G4VPX9_SCHMA Loading...

Putative syntrophin

AlphaFold DB , UniProt , Accession G4VPX9, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 554 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	31.9	Very low	59	Low	253 Å²	253	112.4 Å²	112.4	100%	1.246	64%	0.638	S	S	*	*				0	105	0	-70.7	170.5	130.9	0	0	105.8
2	S	33	Very low	61.9	Low	94 Å²	94	109.8 Å²	109.8	66%	0.657	62%	0.617	S	S	*	*			cis	-120.3	144.8	10.9	39.1	0	0	0	0	110.1	Q4	S2-Q4 PolarHBondContact O-N 3.3Å; S2-Q4 VanDerWaalsContact O-N 3.12Å
3	T	32.4	Very low	64.4	Low	147 Å²	147	101.7 Å²	101.7	90%	0.902	57%	0.571	S	S	*	*			trans	-65.6	99	163.1	41.3	0	0	0	0	107.9
4	Q	42.5	Very low	66.3	Low	173 Å²	173	98 Å²	98	81%	0.808	55%	0.547	S	S	*	.			trans	-101	119.7	170.9	-118.1	172.9	-13.8	0	0	107.9	S2 S6	S2-Q4 PolarHBondContact O-N 3.3Å; S2-Q4 VanDerWaalsContact O-N 3.12Å; Q4-S6 PolarHBondContact O-N 2.85Å; Q4-S6 VanDerWaalsContact O-N 3.17Å
5	D	44.8	Very low	67.7	Low	148 Å²	148	91.5 Å²	91.5	79%	0.791	51%	0.511	S	S	*	.			trans	-38.6	115.1	-174.1	-69.9	-49	0	0	0	112.3	L7	D5-L7 PolarHBondContact O-N 3.32Å
6	S	53.5	Low	68.7	Low	87 Å²	87	87.3 Å²	87.3	61%	0.608	49%	0.485	S	S	*	.			trans	-66.5	86.1	163.2	59.2	0	0	0	0	106.9	Q4 V8	Q4-S6 PolarHBondContact O-N 2.85Å; Q4-S6 VanDerWaalsContact O-N 3.17Å; S6-V8 VanDerWaalsContact C-N 3.27Å; S6-V8 PolarHBondContact O-N 2.69Å
7	L	56.9	Low	68.9	Low	121 Å²	121	82.7 Å²	82.7	63%	0.634	46%	0.459	S	S	*	.			trans	-61.2	98.7	171.6	-124.5	113.8	0	0	0	106.4	D5 I9 K254	D5-L7 PolarHBondContact O-N 3.32Å; L7-I9 HydrophobicContact CD2-CG1 4.08Å; L7-I9 PolarHBondContact O-N 3.18Å; L7-K254 PolarHBondContact O-NZ 3.42Å
8	V	77	Confident	68.8	Low	86 Å²	86	89.9 Å²	89.9	52%	0.521	48%	0.478	S	S	.	.			trans	-80	104.6	168.7	178.2	0	0	0	0	104.7	S6 T27	S6-V8 VanDerWaalsContact C-N 3.27Å; S6-V8 PolarHBondContact O-N 2.69Å; V8-T27 HydrophobicContact CG1-CG2 3.53Å
9	I	89.7	Confident	68.5	Low	50 Å²	50	87.2 Å²	87.2	26%	0.256	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	126.3	173.4	-59.6	177.5	0	0	0	106.4	L7 T27 L28 W247 A250	L7-I9 HydrophobicContact CD2-CG1 4.08Å; L7-I9 PolarHBondContact O-N 3.18Å; I9-T27 CarbonylContact O-C 3.51Å; I9-T27 WeakPolarHBondContact O-CA 3.45Å; I9-L28 HydrophobicContact CB-CB 4.22Å; I9-L28 HydrophobicContact CD1-CD2 4.38Å; I9-L28 PolarHBondContact O-N 3.22Å; I9-W247 HydrophobicContact CG2-CE3 4.5Å; I9-W247 HydrophobicContact CG2-CH2 3.88Å; I9-W247 HydrophobicContact CG2-CZ2 4Å; I9-W247 HydrophobicContact CG2-CZ3 4.15Å; I9-A250 HydrophobicContact CD1-CB 3.33Å
10	S	93.5	Very high	68.7	Low	60 Å²	60	86.1 Å²	86.1	42%	0.42	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	139.2	173	-168.6	0	0	0	0	108.6	K25 A26 T27	S10-K25 VanDerWaalsContact OG-CE 3.3Å; S10-K25 WeakPolarHBondContact OG-CE 3.5Å; S10-A26 VanDerWaalsContact CA-O 3.23Å; S10-A26 WeakPolarHBondContact CA-O 3.24Å; S10-A26 PolarHBondContact OG-O 3.49Å; S10-T27 PolarHBondContact OG-OG1 2.89Å
11	G	93.4	Very high	69.4	Low	17 Å²	17	84.8 Å²	84.8	18%	0.175	45%	0.449	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-171.6	175.7	-175.8	0	0	0	0	0	112.3	A26	G11-A26 PolarHBondContact N-O 2.95Å; G11-A26 PolarHBondContact O-N 3.12Å
12	Q	94.3	Very high	71.8	Confident	81 Å²	81	75 Å²	75	38%	0.379	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	128.1	-178.4	-67.9	-63	-22.1	0	0	109.7	I24 E38	Q12-I24 PolarHBondContact OE1-O 3.49Å; Q12-E38 VanDerWaalsContact CD-OE1 3.28Å; Q12-E38 PolarHBondContact NE2-OE1 2.82Å; Q12-E38 VanDerWaalsContact OE1-CD 3.28Å; Q12-E38 PolarHBondContact OE1-OE1 2.93Å; Q12-E38 VanDerWaalsContact OE1-OE1 3.13Å
13	L	94.5	Very high	74.6	Confident	5 Å²	5	73.4 Å²	73.4	3%	0.026	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	174.8	173	-66.8	-179.7	0	0	0	108.4	I24 A26 F223 L236 R237 A238 W247	L13-I24 HydrophobicContact CB-CD1 4Å; L13-I24 HydrophobicContact CB-CG1 3.89Å; L13-I24 PolarHBondContact N-O 3.15Å; L13-I24 VanDerWaalsContact O-CG1 3.29Å; L13-I24 WeakPolarHBondContact O-CG1 3.34Å; L13-I24 PolarHBondContact O-N 3.13Å; L13-A26 HydrophobicContact CD1-CB 3.63Å; L13-A26 HydrophobicContact CG-CB 4.15Å; L13-F223 HydrophobicContact CD1-CZ 3.77Å; L13-L236 HydrophobicContact CD1-CD1 4.41Å; L13-R237 CarbonylContact C-O 3.51Å; L13-R237 WeakPolarHBondContact CA-O 3.3Å; L13-A238 HydrophobicContact CD2-CB 3.71Å; L13-W247 HydrophobicContact CD1-CD2 3.99Å; L13-W247 HydrophobicContact CD1-CE3 4.33Å; L13-W247 HydrophobicContact CD1-CG 4.32Å; L13-W247 HydrophobicContact CD1-CZ2 4.32Å; L13-W247 HydrophobicContact CD2-CD2 4.49Å; L13-W247 HydrophobicContact CD2-CG 4.23Å; L13-W247 HydrophobicContact CG-CZ2 4.38Å
14	E	90.8	Very high	77.4	Confident	50 Å²	50	66.4 Å²	66.4	23%	0.234	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	140.9	164.9	-65.8	168.8	103.9	0	0	109.6	W21 I22 L236 R237	E14-W21 HydrophobicContact CB-CB 4.15Å; E14-W21 HydrophobicContact CB-CE3 3.84Å; E14-I22 CarbonylContact C-O 3.54Å; E14-I22 VanDerWaalsContact CA-O 3.27Å; E14-I22 WeakPolarHBondContact CA-O 3.49Å; E14-L236 CarbonylContact O-C 3.59Å; E14-L236 VanDerWaalsContact O-CA 3.31Å; E14-L236 WeakPolarHBondContact O-CA 3.39Å; E14-R237 HydrophobicContact CB-CB 4.43Å; E14-R237 PolarHBondContact N-O 3.36Å; E14-R237 PolarHBondContact O-N 2.76Å; E14-R237 IonicContact OE1-CZ 3.9Å; E14-R237 IonicContact OE1-NH2 2.85Å; E14-R237 PolarHBondContact OE1-NH2 3.45Å; E14-R237 IonicContact OE2-CZ 3.08Å; E14-R237 IonicContact OE2-NE 2.73Å; E14-R237 PolarHBondContact OE2-NE 2.95Å; E14-R237 IonicContact OE2-NH2 2.67Å; E14-R237 PolarHBondContact OE2-NH2 3.48Å
15	I	87.8	Confident	79.8	Confident	0 Å²	0	62 Å²	62	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	139	172.3	-169.2	170.1	0	0	0	109.7	L17 W21 I22 I24 I35 L37 L161 C234 L235 L236	I15-L17 HydrophobicContact CB-CG 4.49Å; I15-L17 HydrophobicContact CD1-CD1 4.19Å; I15-L17 HydrophobicContact CD1-CD2 4.22Å; I15-L17 HydrophobicContact CD1-CG 4.14Å; I15-L17 HydrophobicContact CG1-CD1 4.41Å; I15-L17 HydrophobicContact CG1-CD2 4.37Å; I15-L17 HydrophobicContact CG1-CG 4Å; I15-L17 HydrophobicContact CG2-CD1 3.62Å; I15-L17 HydrophobicContact CG2-CG 3.82Å; I15-L17 PolarHBondContact O-N 3.36Å; I15-W21 WeakPolarHBondContact O-CA 3.23Å; I15-I22 HydrophobicContact CG2-CB 4.23Å; I15-I22 PolarHBondContact N-O 3.17Å; I15-I22 PolarHBondContact O-N 3.17Å; I15-I24 HydrophobicContact CB-CD1 4.09Å; I15-I24 HydrophobicContact CB-CG1 4.32Å; I15-I24 HydrophobicContact CB-CG2 4.15Å; I15-I24 HydrophobicContact CG2-CG1 4.46Å; I15-I24 HydrophobicContact CG2-CG2 3.43Å; I15-I24 VanDerWaalsContact CG2-CG2 3.43Å; I15-I35 HydrophobicContact CD1-CD1 4.26Å; I15-L37 HydrophobicContact CG2-CD2 4.4Å; I15-L161 HydrophobicContact CD1-CD2 3.72Å; I15-C234 HydrophobicContact CD1-CB 3.84Å; I15-C234 HydrophobicContact CG1-CB 4.3Å; I15-L235 WeakPolarHBondContact CA-O 3.4Å; I15-L236 HydrophobicContact CB-CD2 3.83Å; I15-L236 HydrophobicContact CD1-CD2 4.2Å; I15-L236 HydrophobicContact CG1-CD2 3.82Å
16	Y	82.8	Confident	82.2	Confident	24 Å²	24	55 Å²	55	9%	0.094	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	105.6	173.4	-167.5	-102.6	0	0	0	110.3	N19 T20 W21 H140 C157 L235	Y16-N19 WeakPolarHBondContact OH-CA 3.25Å; Y16-N19 PolarHBondContact OH-OD1 3.25Å; Y16-T20 WeakPolarHBondContact CA-O 3.36Å; Y16-W21 AromaticContact CD2-CD2 3.99Å; Y16-W21 HydrophobicContact CD2-CD2 3.99Å; Y16-W21 AromaticContact CD2-CE2 3.79Å; Y16-W21 HydrophobicContact CD2-CE3 4.49Å; Y16-W21 HydrophobicContact CD2-CG 4.3Å; Y16-W21 HydrophobicContact CD2-CZ2 4.2Å; Y16-W21 AromaticContact CD2-NE1 3.91Å; Y16-H140 PolarHBondContact OH-O 2.98Å; Y16-C157 PolarHBondContact O-SG 3.04Å; Y16-L235 HydrophobicContact CG-CD2 4.16Å; Y16-L235 PolarHBondContact N-O 2.92Å
17	L	72.7	Confident	84.1	Confident	10 Å²	10	51.7 Å²	51.7	5%	0.052	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	139.4	178.4	-67.8	176.4	0	0	0	109.8	I15 N19 T20 I22 L37 C157	I15-L17 HydrophobicContact CB-CG 4.49Å; I15-L17 HydrophobicContact CD1-CD1 4.19Å; I15-L17 HydrophobicContact CD1-CD2 4.22Å; I15-L17 HydrophobicContact CD1-CG 4.14Å; I15-L17 HydrophobicContact CG1-CD1 4.41Å; I15-L17 HydrophobicContact CG1-CD2 4.37Å; I15-L17 HydrophobicContact CG1-CG 4Å; I15-L17 HydrophobicContact CG2-CD1 3.62Å; I15-L17 HydrophobicContact CG2-CG 3.82Å; I15-L17 PolarHBondContact O-N 3.36Å; L17-N19 PolarHBondContact O-N 2.93Å; L17-N19 VanDerWaalsContact O-N 3.1Å; L17-T20 PolarHBondContact N-O 3.23Å; L17-T20 VanDerWaalsContact O-CG2 3.26Å; L17-T20 WeakPolarHBondContact O-CG2 3.3Å; L17-T20 PolarHBondContact O-N 2.85Å; L17-I22 HydrophobicContact CB-CD1 3.79Å; L17-I22 HydrophobicContact CB-CG1 4.49Å; L17-I22 HydrophobicContact CD1-CD1 4.33Å; L17-L37 HydrophobicContact CD1-CD2 4.13Å; L17-C157 HydrophobicContact CD2-CB 3.55Å
18	R	67.2	Low	86	Confident	212 Å²	212	45.9 Å²	45.9	80%	0.8	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.4	39.3	176.6	-56.9	178.8	-179.3	169.6	0.7	113.1	T20	R18-T20 PolarHBondContact O-N 3.45Å
19	N	63.5	Low	86.7	Confident	38 Å²	38	45.9 Å²	45.9	20%	0.203	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	62.6	21.9	-178	-53.4	-48.4	0	0	0	115.8	Y16 L17 H140 E141	Y16-N19 WeakPolarHBondContact OH-CA 3.25Å; Y16-N19 PolarHBondContact OH-OD1 3.25Å; L17-N19 PolarHBondContact O-N 2.93Å; L17-N19 VanDerWaalsContact O-N 3.1Å; N19-H140 HydrophobicContact CB-CB 4.12Å; N19-H140 VanDerWaalsContact O-CB 3.32Å; N19-H140 WeakPolarHBondContact O-CB 3.36Å; N19-E141 HydrophobicContact CB-CG 4.28Å; N19-E141 WeakPolarHBondContact ND2-CG 3.34Å; N19-E141 PolarHBondContact ND2-OE1 2.88Å; N19-E141 VanDerWaalsContact ND2-OE1 3.15Å
20	T	72.8	Confident	86.6	Confident	65 Å²	65	50 Å²	50	40%	0.399	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	151.3	171.4	-177	0	0	0	0	110.1	Y16 L17 R18 I22	Y16-T20 WeakPolarHBondContact CA-O 3.36Å; L17-T20 PolarHBondContact N-O 3.23Å; L17-T20 VanDerWaalsContact O-CG2 3.26Å; L17-T20 WeakPolarHBondContact O-CG2 3.3Å; L17-T20 PolarHBondContact O-N 2.85Å; R18-T20 PolarHBondContact O-N 3.45Å; T20-I22 HydrophobicContact CG2-CD1 4.14Å; T20-I22 HydrophobicContact CG2-CG1 3.79Å
21	W	81.9	Confident	86.4	Confident	60 Å²	60	51.6 Å²	51.6	23%	0.227	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76	128.7	164	-67.3	101	0	0	0	107.9	E14 I15 Y16 L235 R237	E14-W21 HydrophobicContact CB-CB 4.15Å; E14-W21 HydrophobicContact CB-CE3 3.84Å; I15-W21 WeakPolarHBondContact O-CA 3.23Å; Y16-W21 AromaticContact CD2-CD2 3.99Å; Y16-W21 HydrophobicContact CD2-CD2 3.99Å; Y16-W21 AromaticContact CD2-CE2 3.79Å; Y16-W21 HydrophobicContact CD2-CE3 4.49Å; Y16-W21 HydrophobicContact CD2-CG 4.3Å; Y16-W21 HydrophobicContact CD2-CZ2 4.2Å; Y16-W21 AromaticContact CD2-NE1 3.91Å; W21-L235 HydrophobicContact CH2-CD2 3.54Å; W21-L235 HydrophobicContact CH2-CG 3.62Å; W21-L235 HydrophobicContact CZ2-CD2 3.91Å; W21-L235 HydrophobicContact CZ2-CG 4.47Å; W21-L235 HydrophobicContact CZ3-CD2 4.4Å; W21-L235 HydrophobicContact CZ3-CG 4.23Å; W21-R237 HydrophobicContact CD2-CB 4.39Å; W21-R237 HydrophobicContact CE3-CB 3.75Å; W21-R237 HydrophobicContact CH2-CB 3.52Å; W21-R237 HydrophobicContact CH2-CG 4.49Å; W21-R237 HydrophobicContact CZ2-CB 4.22Å; W21-R237 HydrophobicContact CZ3-CB 3.27Å; W21-R237 HydrophobicContact CZ3-CG 4.49Å
22	I	83.7	Confident	86.4	Confident	47 Å²	47	51 Å²	51	24%	0.241	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	126.1	179	-55	-178.9	0	0	0	107.5	E14 I15 L17 T20 I24 L37	E14-I22 CarbonylContact C-O 3.54Å; E14-I22 VanDerWaalsContact CA-O 3.27Å; E14-I22 WeakPolarHBondContact CA-O 3.49Å; I15-I22 HydrophobicContact CG2-CB 4.23Å; I15-I22 PolarHBondContact N-O 3.17Å; I15-I22 PolarHBondContact O-N 3.17Å; L17-I22 HydrophobicContact CB-CD1 3.79Å; L17-I22 HydrophobicContact CB-CG1 4.49Å; L17-I22 HydrophobicContact CD1-CD1 4.33Å; T20-I22 HydrophobicContact CG2-CD1 4.14Å; T20-I22 HydrophobicContact CG2-CG1 3.79Å; I22-I24 PolarHBondContact O-N 2.79Å; I22-L37 HydrophobicContact CG2-CD2 3.88Å
23	P	91.4	Very high	86.3	Confident	60 Å²	60	47.2 Å²	47.2	39%	0.39	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.3	132.4	172.3	-24.6	34.3	0	0	0	111.4	E38	P23-E38 HydrophobicContact CB-CB 4.37Å; P23-E38 HydrophobicContact CB-CG 4.49Å; P23-E38 PolarHBondContact O-N 3.36Å
24	I	91.4	Very high	86.2	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	148.9	175.7	54	153.9	0	0	0	109.9	Q12 L13 I15 I22 A26 I35 E36 L37 L236	Q12-I24 PolarHBondContact OE1-O 3.49Å; L13-I24 HydrophobicContact CB-CD1 4Å; L13-I24 HydrophobicContact CB-CG1 3.89Å; L13-I24 PolarHBondContact N-O 3.15Å; L13-I24 VanDerWaalsContact O-CG1 3.29Å; L13-I24 WeakPolarHBondContact O-CG1 3.34Å; L13-I24 PolarHBondContact O-N 3.13Å; I15-I24 HydrophobicContact CB-CD1 4.09Å; I15-I24 HydrophobicContact CB-CG1 4.32Å; I15-I24 HydrophobicContact CB-CG2 4.15Å; I15-I24 HydrophobicContact CG2-CG1 4.46Å; I15-I24 HydrophobicContact CG2-CG2 3.43Å; I15-I24 VanDerWaalsContact CG2-CG2 3.43Å; I22-I24 PolarHBondContact O-N 2.79Å; I24-A26 HydrophobicContact CD1-CB 4.35Å; I24-I35 HydrophobicContact CB-CG2 4.02Å; I24-I35 HydrophobicContact CD1-CG1 4.28Å; I24-I35 HydrophobicContact CD1-CG2 3.65Å; I24-I35 HydrophobicContact CG1-CG2 4.44Å; I24-I35 HydrophobicContact CG2-CG2 3.75Å; I24-E36 CarbonylContact C-O 3.54Å; I24-E36 VanDerWaalsContact CA-O 3.24Å; I24-E36 WeakPolarHBondContact CA-O 3.35Å; I24-E36 WeakPolarHBondContact CB-O 3.4Å; I24-L37 HydrophobicContact CG2-CD2 3.81Å; I24-L236 HydrophobicContact CD1-CD2 3.69Å
25	K	93	Very high	86.1	Confident	81 Å²	81	45.1 Å²	45.1	35%	0.352	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	117.6	159.7	-176.3	-178	176.5	-167.7	0	108.7	S10 E36	S10-K25 VanDerWaalsContact OG-CE 3.3Å; S10-K25 WeakPolarHBondContact OG-CE 3.5Å; K25-E36 HydrophobicContact CB-CB 4.25Å; K25-E36 PolarHBondContact N-O 2.8Å; K25-E36 PolarHBondContact O-N 2.9Å
26	A	94.2	Very high	86.1	Confident	0 Å²	0	49 Å²	49	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	140.9	174.7	0	0	0	0	0	110.1	S10 G11 L13 I24 L33 V34 W247	S10-A26 VanDerWaalsContact CA-O 3.23Å; S10-A26 WeakPolarHBondContact CA-O 3.24Å; S10-A26 PolarHBondContact OG-O 3.49Å; G11-A26 PolarHBondContact N-O 2.95Å; G11-A26 PolarHBondContact O-N 3.12Å; L13-A26 HydrophobicContact CD1-CB 3.63Å; L13-A26 HydrophobicContact CG-CB 4.15Å; I24-A26 HydrophobicContact CD1-CB 4.35Å; A26-L33 HydrophobicContact CB-CD1 4.23Å; A26-V34 CarbonylContact C-O 3.43Å; A26-V34 WeakPolarHBondContact CA-O 3.3Å; A26-W247 HydrophobicContact CB-CH2 3.69Å; A26-W247 HydrophobicContact CB-CZ2 4.16Å; A26-W247 HydrophobicContact CB-CZ3 4.11Å; A26-W247 WeakPolarHBondContact O-CH2 3.44Å
27	T	94.8	Very high	86.1	Confident	18 Å²	18	51.6 Å²	51.6	11%	0.11	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	112.2	176.4	-56.9	0	0	0	0	110.2	V8 I9 S10 Q29 V34	V8-T27 HydrophobicContact CG1-CG2 3.53Å; I9-T27 CarbonylContact O-C 3.51Å; I9-T27 WeakPolarHBondContact O-CA 3.45Å; S10-T27 PolarHBondContact OG-OG1 2.89Å; T27-Q29 HydrophobicContact CG2-CG 4.36Å; T27-Q29 PolarHBondContact O-N 3.49Å; T27-V34 PolarHBondContact N-O 3.09Å; T27-V34 PolarHBondContact O-N 3.03Å
28	L	95.7	Very high	86.3	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	99.9	178.1	-176.3	60.8	0	0	0	110.6	I9 L33 L204 W247 A250 I251 K254	I9-L28 HydrophobicContact CB-CB 4.22Å; I9-L28 HydrophobicContact CD1-CD2 4.38Å; I9-L28 PolarHBondContact O-N 3.22Å; L28-L33 HydrophobicContact CB-CD1 4.28Å; L28-L33 HydrophobicContact CD1-CD1 4.36Å; L28-L204 HydrophobicContact CD1-CD1 3.65Å; L28-W247 HydrophobicContact CB-CZ3 4.1Å; L28-A250 HydrophobicContact CD2-CB 3.86Å; L28-I251 HydrophobicContact CD1-CG1 3.98Å; L28-I251 HydrophobicContact CD2-CG1 4.11Å; L28-K254 HydrophobicContact CD1-CD 4.04Å; L28-K254 HydrophobicContact CD2-CD 3.8Å; L28-K254 HydrophobicContact CD2-CG 4.27Å; L28-K254 HydrophobicContact CG-CD 3.71Å; L28-K254 PolarHBondContact O-NZ 3.4Å
29	Q	91.5	Very high	86	Confident	86 Å²	86	53.4 Å²	53.4	40%	0.402	27%	0.265	S	S	.	.			trans	-82.6	-165.3	176	-61.5	-169.6	-10.6	0	0	111.3	T27 A32 V34 K254	T27-Q29 HydrophobicContact CG2-CG 4.36Å; T27-Q29 PolarHBondContact O-N 3.49Å; Q29-A32 WeakPolarHBondContact CA-O 3.42Å; Q29-A32 WeakPolarHBondContact CB-O 3.41Å; Q29-A32 PolarHBondContact N-O 3.24Å; Q29-V34 VanDerWaalsContact CD-CG2 3.46Å; Q29-V34 HydrophobicContact CG-CG2 3.91Å; Q29-K254 VanDerWaalsContact O-CD 3.28Å; Q29-K254 WeakPolarHBondContact O-CD 3.35Å; Q29-K254 PolarHBondContact O-NZ 2.96Å
30	H	88.1	Confident	85.1	Confident	135 Å²	135	57.8 Å²	57.8	63%	0.625	29%	0.293	S	S	*	.	S	Bend	trans	-69.3	-45.4	-178.2	179.9	64.7	0	0	0	112.2	I258	H30-I258 WeakPolarHBondContact O-CD1 3.25Å
31	D	89.8	Confident	83.4	Confident	95 Å²	95	60 Å²	60	51%	0.508	31%	0.309	S	S	.	.	S	Bend	trans	-124.4	-0.3	-172.2	63.9	-22.1	0	0	0	114.2	L204	D31-L204 WeakPolarHBondContact O-CB 3.46Å; D31-L204 PolarHBondContact O-N 2.67Å
32	A	92.3	Very high	80.8	Confident	5 Å²	5	63 Å²	63	4%	0.041	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	154.5	-176.9	0	0	0	0	0	113	Q29 V201 V202	Q29-A32 WeakPolarHBondContact CA-O 3.42Å; Q29-A32 WeakPolarHBondContact CB-O 3.41Å; Q29-A32 PolarHBondContact N-O 3.24Å; A32-V201 HydrophobicContact CB-CG1 3.68Å; A32-V202 CarbonylContact C-O 3.6Å; A32-V202 VanDerWaalsContact CA-O 3.23Å; A32-V202 WeakPolarHBondContact CA-O 3.31Å
33	L	93.5	Very high	78.4	Confident	0 Å²	0	67 Å²	67	0%	0	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	116	162.3	179.6	71.5	0	0	0	108.5	A26 L28 I35 V202 L204 L225 L236 W247 I251	A26-L33 HydrophobicContact CB-CD1 4.23Å; L28-L33 HydrophobicContact CB-CD1 4.28Å; L28-L33 HydrophobicContact CD1-CD1 4.36Å; L33-I35 HydrophobicContact CD2-CD1 4.42Å; L33-I35 HydrophobicContact CD2-CG1 4.48Å; L33-I35 HydrophobicContact CG-CG1 4.35Å; L33-V202 HydrophobicContact CB-CB 4.22Å; L33-V202 PolarHBondContact N-O 3.16Å; L33-V202 PolarHBondContact O-N 3.36Å; L33-L204 HydrophobicContact CB-CD2 4.33Å; L33-L225 HydrophobicContact CD2-CD1 3.6Å; L33-L236 HydrophobicContact CD2-CD1 3.76Å; L33-W247 HydrophobicContact CD1-CZ3 3.9Å; L33-I251 HydrophobicContact CD2-CD1 4.28Å
34	V	91.2	Very high	75.6	Confident	10 Å²	10	68.6 Å²	68.6	6%	0.061	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	129.9	178.8	-178.7	0	0	0	0	109.2	A26 T27 Q29 P199 G200	A26-V34 CarbonylContact C-O 3.43Å; A26-V34 WeakPolarHBondContact CA-O 3.3Å; T27-V34 PolarHBondContact N-O 3.09Å; T27-V34 PolarHBondContact O-N 3.03Å; Q29-V34 VanDerWaalsContact CD-CG2 3.46Å; Q29-V34 HydrophobicContact CG-CG2 3.91Å; V34-P199 HydrophobicContact CG1-CB 3.62Å; V34-P199 HydrophobicContact CG1-CG 4.11Å; V34-G200 CarbonylContact C-O 3.58Å; V34-G200 WeakPolarHBondContact CA-O 3.43Å
35	I	89.6	Confident	72.5	Confident	1 Å²	1	73.4 Å²	73.4	1%	0.005	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	115.2	-174.9	-63.4	175	0	0	0	108.8	I15 I24 L33 L161 P199 G200 V202 L236	I15-I35 HydrophobicContact CD1-CD1 4.26Å; I24-I35 HydrophobicContact CB-CG2 4.02Å; I24-I35 HydrophobicContact CD1-CG1 4.28Å; I24-I35 HydrophobicContact CD1-CG2 3.65Å; I24-I35 HydrophobicContact CG1-CG2 4.44Å; I24-I35 HydrophobicContact CG2-CG2 3.75Å; L33-I35 HydrophobicContact CD2-CD1 4.42Å; L33-I35 HydrophobicContact CD2-CG1 4.48Å; L33-I35 HydrophobicContact CG-CG1 4.35Å; I35-L161 HydrophobicContact CB-CD1 4.24Å; I35-L161 HydrophobicContact CG2-CD1 3.87Å; I35-P199 CarbonylContact O-C 3.57Å; I35-P199 VanDerWaalsContact O-CA 3.31Å; I35-P199 WeakPolarHBondContact O-CA 3.48Å; I35-G200 PolarHBondContact N-O 3.1Å; I35-G200 PolarHBondContact O-N 3.1Å; I35-V202 HydrophobicContact CD1-CG2 3.96Å; I35-L236 HydrophobicContact CD1-CD2 4.49Å
36	E	86.6	Confident	69.4	Low	83 Å²	83	76.7 Å²	76.7	39%	0.388	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	121.8	174.9	-72.9	168.9	-164.6	0	0	109	I24 K25 E38 P199	I24-E36 CarbonylContact C-O 3.54Å; I24-E36 VanDerWaalsContact CA-O 3.24Å; I24-E36 WeakPolarHBondContact CA-O 3.35Å; I24-E36 WeakPolarHBondContact CB-O 3.4Å; K25-E36 HydrophobicContact CB-CB 4.25Å; K25-E36 PolarHBondContact N-O 2.8Å; K25-E36 PolarHBondContact O-N 2.9Å; E36-E38 PolarHBondContact O-N 3.45Å; E36-P199 HydrophobicContact CG-CB 3.76Å
37	L	83.3	Confident	66.4	Low	78 Å²	78	85.3 Å²	85.3	41%	0.408	47%	0.473	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	127.2	172.6	-68.6	166	0	0	0	109.1	I15 L17 I22 I24 H39	I15-L37 HydrophobicContact CG2-CD2 4.4Å; L17-L37 HydrophobicContact CD1-CD2 4.13Å; I22-L37 HydrophobicContact CG2-CD2 3.88Å; I24-L37 HydrophobicContact CG2-CD2 3.81Å; L37-H39 PolarHBondContact O-N 2.99Å
38	E	76.2	Confident	63.5	Low	92 Å²	92	92.5 Å²	92.5	43%	0.43	51%	0.505	S	S	.	.			trans	-73.4	111.3	172.8	-63.2	-153.8	136.8	0	0	109.3	Q12 P23 E36 T40	Q12-E38 VanDerWaalsContact CD-OE1 3.28Å; Q12-E38 PolarHBondContact NE2-OE1 2.82Å; Q12-E38 VanDerWaalsContact OE1-CD 3.28Å; Q12-E38 PolarHBondContact OE1-OE1 2.93Å; Q12-E38 VanDerWaalsContact OE1-OE1 3.13Å; P23-E38 HydrophobicContact CB-CB 4.37Å; P23-E38 HydrophobicContact CB-CG 4.49Å; P23-E38 PolarHBondContact O-N 3.36Å; E36-E38 PolarHBondContact O-N 3.45Å; E38-T40 PolarHBondContact O-N 3.43Å
39	H	60.7	Low	60.3	Low	168 Å²	168	101.1 Å²	101.1	78%	0.778	55%	0.545	S	S	*	.			trans	-69.1	111.1	169.2	-70.3	-57.6	0	0	0	108.4	L37 P41	L37-H39 PolarHBondContact O-N 2.99Å; H39-P41 WeakPolarHBondContact O-CD 3.4Å
40	T	45.7	Very low	57.6	Low	129 Å²	129	102.9 Å²	102.9	79%	0.791	56%	0.557	S	S	*	*			trans	-55.7	124.2	167.9	45.6	0	0	0	0	108.4	E38 S42	E38-T40 PolarHBondContact O-N 3.43Å; T40-S42 PolarHBondContact O-N 3.26Å
41	P	36.3	Very low	55.4	Low	111 Å²	111	102.3 Å²	102.3	72%	0.721	56%	0.558	S	S	*	*			trans	-61.9	128	179.1	22.3	-29.6	0	0	0	108.7	H39 V43	H39-P41 WeakPolarHBondContact O-CD 3.4Å; P41-V43 PolarHBondContact O-N 2.95Å
42	S	28.3	Very low	53.6	Low	125 Å²	125	100.8 Å²	100.8	87%	0.874	55%	0.554	S	S	*	*			trans	-60.5	92.6	176.5	42.7	0	0	0	0	110.4	T40 S44	T40-S42 PolarHBondContact O-N 3.26Å; S42-S44 PolarHBondContact O-N 3.25Å
43	V	33.5	Very low	51.7	Low	129 Å²	129	104 Å²	104	78%	0.782	57%	0.574	S	S	*	*			trans	-75.9	111.1	166.7	-177.1	0	0	0	0	107.6	P41 S45	P41-V43 PolarHBondContact O-N 2.95Å; V43-S45 PolarHBondContact O-N 3.2Å
44	S	31.6	Very low	50.6	Low	95 Å²	95	106.2 Å²	106.2	66%	0.664	59%	0.592	S	S	*	*			trans	-40.9	120.8	165.5	44.5	0	0	0	0	112.8	S42	S42-S44 PolarHBondContact O-N 3.25Å
45	S	26.4	Very low	50.4	Low	101 Å²	101	111.1 Å²	111.1	71%	0.706	61%	0.612	S	S	*	*	S	Bend	trans	41.5	92.2	152	60.3	0	0	0	0	117.6	V43	V43-S45 PolarHBondContact O-N 3.2Å
46	N	27.7	Very low	50.5	Low	149 Å²	149	114.8 Å²	114.8	80%	0.797	63%	0.626	S	S	*	*			trans	-174.6	114.3	132.8	-93	-22.3	0	0	0	110.5	H48	N46-H48 PolarHBondContact O-N 3.38Å
47	H	31.9	Very low	50.8	Low	182 Å²	182	116.5 Å²	116.5	84%	0.843	64%	0.637	S	S	*	*			trans	20.7	87.9	161	-67.4	-70.8	0	0	0	118.6
48	H	32.9	Very low	51.3	Low	168 Å²	168	112.8 Å²	112.8	78%	0.778	62%	0.618	S	S	*	*			trans	-157	56	154.7	-104.2	-76.8	0	0	0	110.1	N46 I51	N46-H48 PolarHBondContact O-N 3.38Å; H48-I51 VanDerWaalsContact CE1-CD1 3.45Å; H48-I51 WeakPolarHBondContact CE1-CD1 3.47Å; H48-I51 WeakPolarHBondContact ND1-CD1 3.29Å
49	E	28.4	Very low	52.1	Low	182 Å²	182	115.6 Å²	115.6	85%	0.85	62%	0.624	S	S	*	*			trans	-86.3	140.3	159.9	-74.7	-173.8	145.4	0	0	108.6
50	D	35.6	Very low	53.7	Low	122 Å²	122	107.6 Å²	107.6	65%	0.652	59%	0.587	S	S	*	*			trans	75.3	58.2	160.8	-68.1	-22.1	0	0	0	121.8
51	I	42.9	Very low	55.7	Low	124 Å²	124	104.8 Å²	104.8	64%	0.636	57%	0.57	S	S	*	*	S	Bend	trans	-98.7	-14.9	169.7	-64.9	178.4	0	0	0	114.9	H48	H48-I51 VanDerWaalsContact CE1-CD1 3.45Å; H48-I51 WeakPolarHBondContact CE1-CD1 3.47Å; H48-I51 WeakPolarHBondContact ND1-CD1 3.29Å
52	S	50.4	Low	58.2	Low	62 Å²	62	100.7 Å²	100.7	43%	0.434	54%	0.541	S	S	.	.	S	Bend	trans	-101.1	-13.1	-174.7	111.5	0	0	0	0	116	H140	S52-H140 PolarHBondContact O-NE2 3.07Å; S52-H140 PolarHBondContact OG-NE2 2.91Å
53	T	53.9	Low	60.7	Low	74 Å²	74	99.1 Å²	99.1	45%	0.454	52%	0.52	S	S	.	.	S	Bend	trans	-110.4	-6.4	177.8	39.9	0	0	0	0	113.7	K137	T53-K137 VanDerWaalsContact O-CE 3.24Å; T53-K137 WeakPolarHBondContact O-CE 3.27Å
54	A	70.3	Confident	62.4	Low	45 Å²	45	101.5 Å²	101.5	37%	0.372	52%	0.522	S	S	.	.	S	Bend	trans	-67	141	-178.9	0	0	0	0	0	111.5
55	K	86.2	Confident	64.4	Low	114 Å²	114	104.9 Å²	104.9	50%	0.496	53%	0.532	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	135.9	169.2	-58	-171.9	179.6	-178.3	0	109	L106 E135 V136	K55-L106 HydrophobicContact CD-CD1 3.62Å; K55-L106 HydrophobicContact CG-CD1 3.9Å; K55-E135 HydrophobicContact CB-CG 4.48Å; K55-E135 HydrophobicContact CD-CG 4.3Å; K55-E135 WeakPolarHBondContact CD-OE1 3.46Å; K55-E135 WeakPolarHBondContact CE-OE1 3.35Å; K55-E135 IonicContact NZ-OE1 3.55Å; K55-E135 PolarHBondContact NZ-OE1 3.44Å; K55-V136 CarbonylContact C-O 3.47Å; K55-V136 WeakPolarHBondContact CA-O 3.4Å
56	R	92.2	Very high	66.7	Low	78 Å²	78	103.4 Å²	103.4	29%	0.294	52%	0.517	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	131.3	176.2	-59	-173.7	-67.1	-117.2	0.8	108.9	V58 N100 D103 E135 V136	R56-V58 HydrophobicContact CB-CG2 4.26Å; R56-N100 PolarHBondContact NH2-ND2 2.87Å; R56-D103 IonicContact NH2-OD1 2.79Å; R56-D103 PolarHBondContact NH2-OD1 2.95Å; R56-D103 IonicContact NH2-OD2 3.74Å; R56-D103 PolarHBondContact NH2-OD2 2.74Å; R56-E135 WeakPolarHBondContact O-CA 3.31Å; R56-V136 HydrophobicContact CB-CG2 3.97Å; R56-V136 PolarHBondContact N-O 2.93Å; R56-V136 PolarHBondContact O-N 2.86Å
57	L	92.3	Very high	69.4	Low	118 Å²	118	98.3 Å²	98.3	62%	0.618	50%	0.499	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.8	114.2	168.2	-174.6	67.7	0	0	0	108.2	E133 L134 E135	L57-E133 HydrophobicContact CD1-CB 4.37Å; L57-L134 CarbonylContact C-O 3.58Å; L57-L134 WeakPolarHBondContact CA-O 3.46Å; L57-E135 HydrophobicContact CD1-CB 4.42Å
58	V	93.8	Very high	72.2	Confident	1 Å²	1	90.4 Å²	90.4	1%	0.006	46%	0.463	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	117.2	-176	-175.3	0	0	0	0	108.9	R56 I60 Q98 L99 E133 L134 V136	R56-V58 HydrophobicContact CB-CG2 4.26Å; V58-I60 HydrophobicContact CG1-CD1 4.05Å; V58-I60 HydrophobicContact CG1-CG1 3.83Å; V58-Q98 HydrophobicContact CB-CB 4.43Å; V58-Q98 HydrophobicContact CG1-CB 3.58Å; V58-Q98 HydrophobicContact CG2-CB 3.96Å; V58-L99 HydrophobicContact CB-CD2 4.15Å; V58-L99 HydrophobicContact CG1-CD2 4.14Å; V58-L99 HydrophobicContact CG1-CG 4.26Å; V58-L99 HydrophobicContact CG2-CD2 4.07Å; V58-E133 WeakPolarHBondContact O-CA 3.21Å; V58-L134 PolarHBondContact N-O 2.9Å; V58-L134 PolarHBondContact O-N 2.83Å; V58-V136 HydrophobicContact CG2-CG2 3.96Å
59	R	93.1	Very high	75	Confident	150 Å²	150	82.7 Å²	82.7	57%	0.566	43%	0.429	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99	121.6	176.1	-179.8	173.9	148.1	169.6	-6.5	110.3	I131 V132 E133	R59-I131 HydrophobicContact CG-CG2 3.88Å; R59-V132 CarbonylContact C-O 3.52Å; R59-V132 WeakPolarHBondContact CA-O 3.3Å; R59-E133 HydrophobicContact CB-CG 4.25Å; R59-E133 HydrophobicContact CG-CG 4.09Å
60	I	93.6	Very high	78	Confident	0 Å²	0	75.3 Å²	75.3	0%	0	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	132.4	-173	-50.8	177.4	0	0	0	108.7	V58 L68 A92 T96 L99 V132 L134	V58-I60 HydrophobicContact CG1-CD1 4.05Å; V58-I60 HydrophobicContact CG1-CG1 3.83Å; I60-L68 HydrophobicContact CB-CD1 4.08Å; I60-L68 HydrophobicContact CD1-CD1 3.77Å; I60-L68 HydrophobicContact CG2-CD1 3.69Å; I60-A92 HydrophobicContact CG2-CB 3.82Å; I60-T96 HydrophobicContact CB-CG2 3.98Å; I60-T96 HydrophobicContact CD1-CG2 4.28Å; I60-T96 HydrophobicContact CG1-CG2 3.62Å; I60-T96 HydrophobicContact CG2-CG2 3.65Å; I60-L99 HydrophobicContact CD1-CD1 3.41Å; I60-L99 VanDerWaalsContact CD1-CD1 3.41Å; I60-L99 HydrophobicContact CD1-CG 4.04Å; I60-V132 PolarHBondContact N-O 3.08Å; I60-V132 PolarHBondContact O-N 2.67Å; I60-L134 HydrophobicContact CD1-CD1 3.98Å
61	T	89.5	Confident	80.7	Confident	71 Å²	71	71.4 Å²	71.4	44%	0.436	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	114.1	174.7	-54.1	0	0	0	0	108.4	R130	T61-R130 CarbonylContact C-O 3.42Å; T61-R130 WeakPolarHBondContact CA-O 3.29Å; T61-R130 HydrophobicContact CG2-CG 4.21Å
62	K	88.1	Confident	82.9	Confident	25 Å²	25	66.7 Å²	66.7	11%	0.109	35%	0.353	C	S	.	.			trans	-73.5	148.6	174.9	-62.3	173.4	-179.1	160.6	0	110.4	L125 A128 G129 R130 V132	K62-L125 PolarHBondContact NZ-O 3.29Å; K62-A128 PolarHBondContact NZ-O 2.8Å; K62-G129 WeakPolarHBondContact CD-O 3.38Å; K62-G129 PolarHBondContact NZ-O 3.05Å; K62-R130 PolarHBondContact N-O 2.85Å; K62-R130 WeakPolarHBondContact O-CG 3.48Å; K62-V132 HydrophobicContact CD-CG2 4.11Å; K62-V132 HydrophobicContact CG-CG2 4.41Å
63	E	79.7	Confident	84.6	Confident	91 Å²	91	65.7 Å²	65.7	43%	0.425	34%	0.341	S	S	.	.			trans	-77.2	154.4	165.3	-63.1	174.6	175.4	0	0	109.5	L65 N66	E63-L65 PolarHBondContact O-N 3.23Å; E63-L65 VanDerWaalsContact O-N 3.15Å; E63-N66 HydrophobicContact CB-CB 4.22Å; E63-N66 PolarHBondContact O-N 3.06Å; E63-N66 VanDerWaalsContact O-O 3.05Å; E63-N66 PolarHBondContact OE2-ND2 2.73Å
64	E	70.2	Confident	86.2	Confident	179 Å²	179	62.6 Å²	62.6	84%	0.836	32%	0.323	S	S	*	.	S	Bend	trans	-60.9	-28	-173.4	-71.4	-178.1	170.5	0	0	113.9
65	L	72.9	Confident	86.8	Confident	167 Å²	167	60.4 Å²	60.4	87%	0.874	31%	0.306	S	S	*	.	S	Bend	trans	-103.1	-15.9	-177.5	-64.9	169.6	0	0	0	113.4	E63	E63-L65 PolarHBondContact O-N 3.23Å; E63-L65 VanDerWaalsContact O-N 3.15Å
66	N	75.8	Confident	86.6	Confident	70 Å²	70	63.6 Å²	63.6	37%	0.374	32%	0.315	S	S	.	.			trans	-115.2	136.6	-170.9	-65.9	-29.5	0	0	0	111.7	E63 M91	E63-N66 HydrophobicContact CB-CB 4.22Å; E63-N66 PolarHBondContact O-N 3.06Å; E63-N66 VanDerWaalsContact O-O 3.05Å; E63-N66 PolarHBondContact OE2-ND2 2.73Å; N66-M91 HydrophobicContact CB-SD 4.36Å
67	G	83.9	Confident	86.1	Confident	41 Å²	41	64.5 Å²	64.5	42%	0.423	32%	0.322	S	S	.	.			trans	-70.2	-174.4	177	0	0	0	0	0	113.4	G69	G67-G69 VanDerWaalsContact C-N 3.25Å; G67-G69 PolarHBondContact O-N 3.4Å
68	L	89.8	Confident	85.2	Confident	16 Å²	16	63.1 Å²	63.1	8%	0.084	32%	0.315	C	S	.	.			trans	-60.2	-33.3	179.9	-173.9	59.2	0	0	0	113.2	I60 I70 A93 L125 L134	I60-L68 HydrophobicContact CB-CD1 4.08Å; I60-L68 HydrophobicContact CD1-CD1 3.77Å; I60-L68 HydrophobicContact CG2-CD1 3.69Å; L68-I70 HydrophobicContact CD2-CD1 3.5Å; L68-I70 HydrophobicContact CD2-CG1 3.76Å; L68-I70 HydrophobicContact CG-CD1 4.26Å; L68-I70 HydrophobicContact CG-CG1 4.08Å; L68-A93 WeakPolarHBondContact O-CB 3.28Å; L68-A93 PolarHBondContact O-N 2.91Å; L68-L125 HydrophobicContact CD2-CD2 4.11Å; L68-L134 HydrophobicContact CD2-CD1 4.24Å
69	G	91.6	Very high	84.4	Confident	6 Å²	6	72 Å²	72	6%	0.062	35%	0.354	C	S	.	.			trans	84.2	32.5	179.4	0	0	0	0	0	115.1	G67 F88	G67-G69 VanDerWaalsContact C-N 3.25Å; G67-G69 PolarHBondContact O-N 3.4Å; G69-F88 PolarHBondContact O-N 3.13Å
70	I	92.7	Very high	83.5	Confident	28 Å²	28	66 Å²	66	14%	0.144	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	151.6	172.6	61.8	174.8	0	0	0	111.7	L68 I72 I84 K86 I87 A93 L99 I105	L68-I70 HydrophobicContact CD2-CD1 3.5Å; L68-I70 HydrophobicContact CD2-CG1 3.76Å; L68-I70 HydrophobicContact CG-CD1 4.26Å; L68-I70 HydrophobicContact CG-CG1 4.08Å; I70-I72 HydrophobicContact CD1-CG2 4.02Å; I70-I72 HydrophobicContact CG1-CG2 4.46Å; I70-I84 HydrophobicContact CB-CG2 4.4Å; I70-I84 HydrophobicContact CD1-CD1 4.43Å; I70-I84 HydrophobicContact CD1-CG1 4.39Å; I70-I84 HydrophobicContact CG2-CG2 4.36Å; I70-K86 CarbonylContact C-O 3.56Å; I70-K86 VanDerWaalsContact CA-O 3.31Å; I70-K86 WeakPolarHBondContact CA-O 3.48Å; I70-I87 HydrophobicContact CG2-CG1 4.28Å; I70-A93 HydrophobicContact CG2-CB 3.4Å; I70-A93 VanDerWaalsContact CG2-CB 3.4Å; I70-L99 HydrophobicContact CG2-CD1 4.25Å; I70-I105 HydrophobicContact CD1-CD1 3.99Å
71	S	91	Very high	83.1	Confident	39 Å²	39	67.7 Å²	67.7	27%	0.273	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	141.2	159.1	-62.9	0	0	0	0	109	S85 K86 F88	S71-S85 VanDerWaalsContact C-OG 3.3Å; S71-S85 VanDerWaalsContact CB-OG 3.25Å; S71-S85 WeakPolarHBondContact CB-OG 3.23Å; S71-S85 PolarHBondContact O-N 3.02Å; S71-S85 PolarHBondContact O-OG 3.03Å; S71-S85 VanDerWaalsContact O-OG 3.13Å; S71-K86 PolarHBondContact N-O 2.82Å; S71-K86 PolarHBondContact O-N 3.01Å; S71-F88 VanDerWaalsContact OG-CE2 3.25Å; S71-F88 WeakPolarHBondContact OG-CE2 3.47Å; S71-F88 WeakPolarHBondContact OG-CZ 3.37Å
72	I	91.1	Very high	83.2	Confident	25 Å²	25	64.4 Å²	64.4	13%	0.128	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	156.1	174.5	59.3	162.7	0	0	0	110.9	I70 I82 L83 I105 H118 A121 V122 L125	I70-I72 HydrophobicContact CD1-CG2 4.02Å; I70-I72 HydrophobicContact CG1-CG2 4.46Å; I72-I82 HydrophobicContact CB-CG2 4.23Å; I72-I82 HydrophobicContact CD1-CG2 3.81Å; I72-I82 HydrophobicContact CG2-CG2 4.35Å; I72-L83 CarbonylContact C-O 3.57Å; I72-L83 WeakPolarHBondContact CA-O 3.45Å; I72-I105 HydrophobicContact CG2-CD1 3.75Å; I72-H118 PolarHBondContact O-CE1 2.94Å; I72-A121 HydrophobicContact CD1-CB 4.07Å; I72-V122 HydrophobicContact CD1-CG2 3.84Å; I72-V122 HydrophobicContact CG1-CG2 4.33Å; I72-L125 HydrophobicContact CD1-CD1 3.84Å; I72-L125 HydrophobicContact CG2-CD1 4.12Å
73	K	85.9	Confident	83.3	Confident	41 Å²	41	63.2 Å²	63.2	18%	0.178	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	170.9	169.3	67.3	175.1	-175.8	161.9	0	109.7	L83 F146	K73-L83 HydrophobicContact CG-CB 4Å; K73-L83 PolarHBondContact N-O 2.8Å; K73-L83 PolarHBondContact O-N 3.39Å; K73-F146 HydrophobicContact CD-CE1 4.14Å; K73-F146 HydrophobicContact CD-CZ 4.25Å; K73-F146 VanDerWaalsContact CE-CZ 3.42Å; K73-F146 VanDerWaalsContact NZ-CG 3.29Å
74	G	87	Confident	83.8	Confident	9 Å²	9	58.9 Å²	58.9	9%	0.093	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	85.9	-163.5	178.6	0	0	0	0	0	113	T80 H118	G74-T80 WeakPolarHBondContact CA-OG1 3.44Å; G74-H118 VanDerWaalsContact O-CB 3.31Å; G74-H118 WeakPolarHBondContact O-CB 3.33Å; G74-H118 PolarHBondContact O-ND1 2.91Å
75	G	82.2	Confident	84.4	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	135.8	155.5	-165.5	0	0	0	0	0	111.5	E77 N78 K79 T80	G75-E77 PolarHBondContact O-N 2.85Å; G75-N78 PolarHBondContact O-N 3.29Å; G75-K79 PolarHBondContact O-N 2.8Å; G75-T80 CarbonylContact C-O 3.56Å; G75-T80 VanDerWaalsContact C-O 3.23Å; G75-T80 WeakPolarHBondContact CA-O 3.31Å; G75-T80 PolarHBondContact N-O 2.88Å; G75-T80 PolarHBondContact N-OG1 2.77Å; G75-T80 PolarHBondContact O-N 2.85Å; G75-T80 PolarHBondContact O-OG1 2.81Å
76	R	82.2	Confident	85.1	Confident	181 Å²	181	49.8 Å²	49.8	68%	0.683	26%	0.255	S	S	*	.	G	3₁₀ helix	trans	-53.3	-39.1	178.3	179	177.5	170.6	-157.2	-1.6	112.7	N78 K79 N115 S116	R76-N78 PolarHBondContact O-N 2.86Å; R76-K79 PolarHBondContact O-N 2.79Å; R76-K79 VanDerWaalsContact O-N 3.08Å; R76-N115 VanDerWaalsContact CD-O 3.29Å; R76-N115 WeakPolarHBondContact CD-O 3.47Å; R76-S116 PolarHBondContact N-O 3.23Å
77	E	81.4	Confident	85.7	Confident	96 Å²	96	48.1 Å²	48.1	45%	0.449	25%	0.245	S	C	.	.	G	3₁₀ helix	trans	-60.7	-29	177.2	68.2	-77.1	-176.3	0	0	113	G75 T117 H118	G75-E77 PolarHBondContact O-N 2.85Å; E77-T117 WeakPolarHBondContact OE2-CA 3.5Å; E77-T117 WeakPolarHBondContact OE2-CB 3.22Å; E77-H118 WeakPolarHBondContact OE1-CB 3.47Å; E77-H118 PolarHBondContact OE1-N 2.94Å; E77-H118 PolarHBondContact OE2-N 3.49Å
78	N	74	Confident	85.9	Confident	90 Å²	90	50 Å²	50	48%	0.481	24%	0.242	S	C	.	.	G	3₁₀ helix	trans	-94.7	0.4	179	-67.3	-47.5	0	0	0	112.8	G75 R76 T80	G75-N78 PolarHBondContact O-N 3.29Å; R76-N78 PolarHBondContact O-N 2.86Å; N78-T80 HydrophobicContact CB-CG2 4.31Å; N78-T80 WeakPolarHBondContact CB-OG1 3.49Å; N78-T80 VanDerWaalsContact O-CG2 3.31Å; N78-T80 WeakPolarHBondContact O-CG2 3.45Å; N78-T80 PolarHBondContact O-N 2.79Å
79	K	76.8	Confident	85.7	Confident	188 Å²	188	58 Å²	58	82%	0.817	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.3	36.3	-172.2	-55.9	-179.2	-178.6	179.1	0	112.6	G75 R76	G75-K79 PolarHBondContact O-N 2.8Å; R76-K79 PolarHBondContact O-N 2.79Å; R76-K79 VanDerWaalsContact O-N 3.08Å
80	T	73.7	Confident	85.5	Confident	24 Å²	24	60 Å²	60	15%	0.147	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	140	-176.5	55.9	0	0	0	0	109.3	G74 G75 N78 Y145	G74-T80 WeakPolarHBondContact CA-OG1 3.44Å; G75-T80 CarbonylContact C-O 3.56Å; G75-T80 VanDerWaalsContact C-O 3.23Å; G75-T80 WeakPolarHBondContact CA-O 3.31Å; G75-T80 PolarHBondContact N-O 2.88Å; G75-T80 PolarHBondContact N-OG1 2.77Å; G75-T80 PolarHBondContact O-N 2.85Å; G75-T80 PolarHBondContact O-OG1 2.81Å; N78-T80 HydrophobicContact CB-CG2 4.31Å; N78-T80 WeakPolarHBondContact CB-OG1 3.49Å; N78-T80 VanDerWaalsContact O-CG2 3.31Å; N78-T80 WeakPolarHBondContact O-CG2 3.45Å; N78-T80 PolarHBondContact O-N 2.79Å; T80-Y145 HydrophobicContact CG2-CD1 3.21Å; T80-Y145 HydrophobicContact CG2-CE1 3.36Å; T80-Y145 HydrophobicContact CG2-CG 4.01Å
81	P	85.4	Confident	85.4	Confident	34 Å²	34	61.1 Å²	61.1	22%	0.221	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.6	165.5	173.3	25	-31.3	0	0	0	111.7	L83 A104 M139	P81-L83 HydrophobicContact CB-CG 4.48Å; P81-L83 HydrophobicContact CG-CD1 4.02Å; P81-L83 HydrophobicContact CG-CD2 4.03Å; P81-L83 HydrophobicContact CG-CG 4.05Å; P81-L83 WeakPolarHBondContact O-CD1 3.07Å; P81-L83 WeakPolarHBondContact O-CG 3.43Å; P81-L83 PolarHBondContact O-N 3.46Å; P81-A104 HydrophobicContact CB-CB 4.36Å; P81-M139 HydrophobicContact CB-SD 4.42Å; P81-M139 HydrophobicContact CG-SD 3.83Å
82	I	92.6	Very high	85.4	Confident	2 Å²	2	59.5 Å²	59.5	1%	0.01	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	118.1	173.1	-56.2	-60.9	0	0	0	108.8	I72 A104 I105 A121	I72-I82 HydrophobicContact CB-CG2 4.23Å; I72-I82 HydrophobicContact CD1-CG2 3.81Å; I72-I82 HydrophobicContact CG2-CG2 4.35Å; I82-A104 CarbonylContact O-C 3.48Å; I82-A104 VanDerWaalsContact O-CA 3.31Å; I82-A104 WeakPolarHBondContact O-CA 3.24Å; I82-I105 HydrophobicContact CG2-CB 4.25Å; I82-I105 HydrophobicContact CG2-CD1 4.24Å; I82-I105 HydrophobicContact CG2-CG1 4.49Å; I82-I105 PolarHBondContact O-N 2.88Å; I82-A121 HydrophobicContact CB-CB 4.42Å; I82-A121 HydrophobicContact CD1-CB 3.51Å; I82-A121 HydrophobicContact CG1-CB 3.66Å; I82-A121 HydrophobicContact CG2-CB 3.93Å
83	L	89	Confident	85.5	Confident	1 Å²	1	58.4 Å²	58.4	1%	0.005	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	139.2	-166.4	-67.1	157.9	0	0	0	112	I72 K73 P81 S85 D103 A104 V142 Y145	I72-L83 CarbonylContact C-O 3.57Å; I72-L83 WeakPolarHBondContact CA-O 3.45Å; K73-L83 HydrophobicContact CG-CB 4Å; K73-L83 PolarHBondContact N-O 2.8Å; K73-L83 PolarHBondContact O-N 3.39Å; P81-L83 HydrophobicContact CB-CG 4.48Å; P81-L83 HydrophobicContact CG-CD1 4.02Å; P81-L83 HydrophobicContact CG-CD2 4.03Å; P81-L83 HydrophobicContact CG-CG 4.05Å; P81-L83 WeakPolarHBondContact O-CD1 3.07Å; P81-L83 WeakPolarHBondContact O-CG 3.43Å; P81-L83 PolarHBondContact O-N 3.46Å; L83-S85 PolarHBondContact O-N 2.73Å; L83-D103 WeakPolarHBondContact CA-O 3.35Å; L83-A104 HydrophobicContact CD2-CB 3.68Å; L83-V142 HydrophobicContact CB-CG1 4.31Å; L83-V142 HydrophobicContact CD1-CB 4.16Å; L83-V142 HydrophobicContact CD1-CG1 3.17Å; L83-V142 HydrophobicContact CD1-CG2 3.85Å; L83-V142 HydrophobicContact CD2-CB 4Å; L83-V142 HydrophobicContact CD2-CG1 3.66Å; L83-V142 HydrophobicContact CD2-CG2 3.37Å; L83-V142 HydrophobicContact CG-CG1 3.83Å; L83-V142 HydrophobicContact CG-CG2 4.19Å; L83-Y145 HydrophobicContact CD1-CD2 4.26Å
84	I	89.8	Confident	85.7	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	113.6	172.2	-57.5	-175.7	0	0	0	109.1	I70 I87 L99 G102 D103 I105	I70-I84 HydrophobicContact CB-CG2 4.4Å; I70-I84 HydrophobicContact CD1-CD1 4.43Å; I70-I84 HydrophobicContact CD1-CG1 4.39Å; I70-I84 HydrophobicContact CG2-CG2 4.36Å; I84-I87 HydrophobicContact CG2-CD1 4.36Å; I84-I87 HydrophobicContact CG2-CG1 3.77Å; I84-L99 HydrophobicContact CD1-CB 4.19Å; I84-L99 HydrophobicContact CD1-CD1 4.09Å; I84-L99 HydrophobicContact CD1-CD2 4.13Å; I84-L99 HydrophobicContact CD1-CG 4.38Å; I84-G102 PolarHBondContact O-N 3.37Å; I84-D103 HydrophobicContact CD1-CB 4.02Å; I84-D103 HydrophobicContact CG1-CB 4.36Å; I84-D103 PolarHBondContact N-O 3.22Å; I84-I105 HydrophobicContact CG1-CD1 4.13Å; I84-I105 HydrophobicContact CG1-CG1 4.15Å
85	S	84.4	Confident	85.8	Confident	39 Å²	39	65.7 Å²	65.7	27%	0.273	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	-25.1	178	58.5	0	0	0	0	113.2	S71 L83	S71-S85 VanDerWaalsContact C-OG 3.3Å; S71-S85 VanDerWaalsContact CB-OG 3.25Å; S71-S85 WeakPolarHBondContact CB-OG 3.23Å; S71-S85 PolarHBondContact O-N 3.02Å; S71-S85 PolarHBondContact O-OG 3.03Å; S71-S85 VanDerWaalsContact O-OG 3.13Å; L83-S85 PolarHBondContact O-N 2.73Å
86	K	87.8	Confident	86.1	Confident	115 Å²	115	67.2 Å²	67.2	50%	0.5	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.1	146.1	178.4	-170.4	172.4	-179.2	172.1	0	110.5	I70 S71 F88	I70-K86 CarbonylContact C-O 3.56Å; I70-K86 VanDerWaalsContact CA-O 3.31Å; I70-K86 WeakPolarHBondContact CA-O 3.48Å; S71-K86 PolarHBondContact N-O 2.82Å; S71-K86 PolarHBondContact O-N 3.01Å; K86-F88 HydrophobicContact CD-CE1 4.15Å; K86-F88 HydrophobicContact CD-CZ 4.2Å
87	I	87.3	Confident	86.4	Confident	35 Å²	35	61.7 Å²	61.7	18%	0.179	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	128.9	167.8	-57.9	177.4	0	0	0	106.9	I70 I84 A93 E94 L99 V101	I70-I87 HydrophobicContact CG2-CG1 4.28Å; I84-I87 HydrophobicContact CG2-CD1 4.36Å; I84-I87 HydrophobicContact CG2-CG1 3.77Å; I87-A93 HydrophobicContact CG2-CB 4.17Å; I87-E94 HydrophobicContact CG2-CB 3.85Å; I87-L99 HydrophobicContact CD1-CB 4.03Å; I87-L99 VanDerWaalsContact CD1-O 3.23Å; I87-L99 WeakPolarHBondContact CD1-O 3.39Å; I87-V101 HydrophobicContact CD1-CG2 4.43Å; I87-V101 HydrophobicContact CG1-CG2 4.15Å
88	F	88.5	Confident	86.7	Confident	81 Å²	81	61.9 Å²	61.9	36%	0.355	33%	0.327	S	S	.	.			trans	-88.7	133.5	-176.6	-70.1	-87.3	0	0	0	110.9	G69 S71 K86 M91	G69-F88 PolarHBondContact O-N 3.13Å; S71-F88 VanDerWaalsContact OG-CE2 3.25Å; S71-F88 WeakPolarHBondContact OG-CE2 3.47Å; S71-F88 WeakPolarHBondContact OG-CZ 3.37Å; K86-F88 HydrophobicContact CD-CE1 4.15Å; K86-F88 HydrophobicContact CD-CZ 4.2Å; F88-M91 HydrophobicContact CB-CB 4.44Å; F88-M91 HydrophobicContact CB-CG 3.79Å; F88-M91 WeakPolarHBondContact O-CB 3.48Å; F88-M91 PolarHBondContact O-N 3.49Å
89	K	86.1	Confident	87.5	Confident	184 Å²	184	58 Å²	58	80%	0.8	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	140.4	-179	-63.1	-166.9	172.3	-176.2	0	112.2	M91 E94	K89-M91 VanDerWaalsContact C-N 3.26Å; K89-M91 PolarHBondContact O-N 2.76Å; K89-E94 WeakPolarHBondContact CA-OE2 3.29Å; K89-E94 WeakPolarHBondContact CG-OE1 3.39Å
90	G	87	Confident	88	Confident	48 Å²	48	52.5 Å²	52.5	50%	0.495	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.5	0.2	178.1	0	0	0	0	0	115.2	E94 Q95	G90-E94 PolarHBondContact N-OE2 2.83Å; G90-Q95 PolarHBondContact O-NE2 2.87Å
91	M	91.2	Very high	88.4	Confident	52 Å²	52	55 Å²	55	26%	0.256	30%	0.301	S	S	.	.	S	Bend	trans	-99.3	165.4	-173.7	-57.7	-80.5	-93.3	0	0	112.2	N66 F88 K89 A93 E94 Q95	N66-M91 HydrophobicContact CB-SD 4.36Å; F88-M91 HydrophobicContact CB-CB 4.44Å; F88-M91 HydrophobicContact CB-CG 3.79Å; F88-M91 WeakPolarHBondContact O-CB 3.48Å; F88-M91 PolarHBondContact O-N 3.49Å; K89-M91 VanDerWaalsContact C-N 3.26Å; K89-M91 PolarHBondContact O-N 2.76Å; M91-A93 VanDerWaalsContact C-N 3.28Å; M91-A93 PolarHBondContact O-N 3.38Å; M91-A93 VanDerWaalsContact O-N 3.13Å; M91-E94 PolarHBondContact O-N 2.79Å; M91-Q95 WeakPolarHBondContact O-CG 3.06Å; M91-Q95 PolarHBondContact O-N 2.8Å
92	A	90.8	Very high	88.2	Confident	5 Å²	5	53.8 Å²	53.8	4%	0.041	30%	0.295	C	S	.	.	H	α-helix	trans	-51.9	-40.4	-174.5	0	0	0	0	0	114.2	I60 Q95 T96	I60-A92 HydrophobicContact CG2-CB 3.82Å; A92-Q95 PolarHBondContact O-N 3.17Å; A92-T96 WeakPolarHBondContact O-CG2 3.47Å; A92-T96 PolarHBondContact O-N 3.1Å
93	A	91.7	Very high	88.1	Confident	1 Å²	1	53.7 Å²	53.7	1%	0.008	30%	0.295	C	S	.	.	H	α-helix	trans	-62.9	-43.6	177	0	0	0	0	0	113.5	L68 I70 I87 M91 T96 L99	L68-A93 WeakPolarHBondContact O-CB 3.28Å; L68-A93 PolarHBondContact O-N 2.91Å; I70-A93 HydrophobicContact CG2-CB 3.4Å; I70-A93 VanDerWaalsContact CG2-CB 3.4Å; I87-A93 HydrophobicContact CG2-CB 4.17Å; M91-A93 VanDerWaalsContact C-N 3.28Å; M91-A93 PolarHBondContact O-N 3.38Å; M91-A93 VanDerWaalsContact O-N 3.13Å; A93-T96 PolarHBondContact O-N 2.74Å; A93-T96 PolarHBondContact O-OG1 2.83Å; A93-L99 HydrophobicContact CB-CD1 3.89Å
94	E	90.4	Very high	88.2	Confident	85 Å²	85	53.7 Å²	53.7	40%	0.397	29%	0.294	S	S	.	.	H	α-helix	trans	-68	-44.1	177	-171.1	-175.6	-120.9	0	0	110.9	I87 K89 G90 M91 T96 G97	I87-E94 HydrophobicContact CG2-CB 3.85Å; K89-E94 WeakPolarHBondContact CA-OE2 3.29Å; K89-E94 WeakPolarHBondContact CG-OE1 3.39Å; G90-E94 PolarHBondContact N-OE2 2.83Å; M91-E94 PolarHBondContact O-N 2.79Å; E94-T96 PolarHBondContact O-N 2.89Å; E94-T96 VanDerWaalsContact O-N 3.09Å; E94-G97 PolarHBondContact O-N 2.86Å
95	Q	89.2	Confident	88.4	Confident	119 Å²	119	53.8 Å²	53.8	56%	0.556	30%	0.295	S	S	*	.	H	α-helix	trans	-58.1	-26.9	-179.9	-68	177.1	15.5	0	0	112.8	G90 M91 A92 G97	G90-Q95 PolarHBondContact O-NE2 2.87Å; M91-Q95 WeakPolarHBondContact O-CG 3.06Å; M91-Q95 PolarHBondContact O-N 2.8Å; A92-Q95 PolarHBondContact O-N 3.17Å; Q95-G97 VanDerWaalsContact C-N 3.31Å; Q95-G97 PolarHBondContact O-N 2.77Å
96	T	89.2	Confident	88.9	Confident	31 Å²	31	53 Å²	53	19%	0.19	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-25.7	176.8	70.4	0	0	0	0	113.8	I60 A92 A93 E94 Q98	I60-T96 HydrophobicContact CB-CG2 3.98Å; I60-T96 HydrophobicContact CD1-CG2 4.28Å; I60-T96 HydrophobicContact CG1-CG2 3.62Å; I60-T96 HydrophobicContact CG2-CG2 3.65Å; A92-T96 WeakPolarHBondContact O-CG2 3.47Å; A92-T96 PolarHBondContact O-N 3.1Å; A93-T96 PolarHBondContact O-N 2.74Å; A93-T96 PolarHBondContact O-OG1 2.83Å; E94-T96 PolarHBondContact O-N 2.89Å; E94-T96 VanDerWaalsContact O-N 3.09Å; T96-Q98 WeakPolarHBondContact O-CG 3.48Å; T96-Q98 PolarHBondContact O-N 3.43Å; T96-Q98 PolarHBondContact O-NE2 2.81Å; T96-Q98 PolarHBondContact OG1-N 2.94Å
97	G	87.4	Confident	89.2	Confident	65 Å²	65	48 Å²	48	67%	0.67	27%	0.268	S	S	*	.	S	Bend	trans	61.3	5.1	-174.1	0	0	0	0	0	115.6	E94 Q95	E94-G97 PolarHBondContact O-N 2.86Å; Q95-G97 VanDerWaalsContact C-N 3.31Å; Q95-G97 PolarHBondContact O-N 2.77Å
98	Q	88.7	Confident	89.7	Confident	100 Å²	100	46.5 Å²	46.5	47%	0.467	26%	0.26	S	S	.	.			trans	-107.9	-8.2	-169.1	-76.5	171.5	77.4	0	0	113.9	V58 T96	V58-Q98 HydrophobicContact CB-CB 4.43Å; V58-Q98 HydrophobicContact CG1-CB 3.58Å; V58-Q98 HydrophobicContact CG2-CB 3.96Å; T96-Q98 WeakPolarHBondContact O-CG 3.48Å; T96-Q98 PolarHBondContact O-N 3.43Å; T96-Q98 PolarHBondContact O-NE2 2.81Å; T96-Q98 PolarHBondContact OG1-N 2.94Å
99	L	90.5	Very high	89.9	Confident	9 Å²	9	46.3 Å²	46.3	5%	0.047	26%	0.263	C	S	.	.			trans	-104.7	141.3	175.7	-65.8	-177.4	0	0	0	110.8	V58 I60 I70 I84 I87 A93 L134 V136	V58-L99 HydrophobicContact CB-CD2 4.15Å; V58-L99 HydrophobicContact CG1-CD2 4.14Å; V58-L99 HydrophobicContact CG1-CG 4.26Å; V58-L99 HydrophobicContact CG2-CD2 4.07Å; I60-L99 HydrophobicContact CD1-CD1 3.41Å; I60-L99 VanDerWaalsContact CD1-CD1 3.41Å; I60-L99 HydrophobicContact CD1-CG 4.04Å; I70-L99 HydrophobicContact CG2-CD1 4.25Å; I84-L99 HydrophobicContact CD1-CB 4.19Å; I84-L99 HydrophobicContact CD1-CD1 4.09Å; I84-L99 HydrophobicContact CD1-CD2 4.13Å; I84-L99 HydrophobicContact CD1-CG 4.38Å; I87-L99 HydrophobicContact CD1-CB 4.03Å; I87-L99 VanDerWaalsContact CD1-O 3.23Å; I87-L99 WeakPolarHBondContact CD1-O 3.39Å; A93-L99 HydrophobicContact CB-CD1 3.89Å; L99-L134 HydrophobicContact CD1-CD1 4.15Å; L99-L134 HydrophobicContact CD2-CD1 4.33Å; L99-V136 HydrophobicContact CD2-CG1 3.92Å; L99-V136 HydrophobicContact CD2-CG2 4.23Å
100	N	86.3	Confident	90.1	Very high	73 Å²	73	40.8 Å²	40.8	39%	0.39	26%	0.258	S	S	.	.			trans	-124	149.7	175.6	-63.6	-69.1	0	0	0	111.5	R56 G102 D103	R56-N100 PolarHBondContact NH2-ND2 2.87Å; N100-G102 PolarHBondContact O-N 2.89Å; N100-D103 PolarHBondContact N-OD2 3.17Å; N100-D103 VanDerWaalsContact O-CB 3.3Å; N100-D103 WeakPolarHBondContact O-CB 3.32Å; N100-D103 PolarHBondContact O-N 3.28Å; N100-D103 VanDerWaalsContact O-N 3.08Å
101	V	83.9	Confident	90.4	Very high	75 Å²	75	42.6 Å²	42.6	46%	0.455	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	131.6	167	176.7	0	0	0	0	108.4	I87	I87-V101 HydrophobicContact CD1-CG2 4.43Å; I87-V101 HydrophobicContact CG1-CG2 4.15Å
102	G	81.1	Confident	90.5	Very high	10 Å²	10	43.3 Å²	43.3	10%	0.103	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	94.3	-6.4	-172.6	0	0	0	0	0	115.2	I84 N100 A104 M139	I84-G102 PolarHBondContact O-N 3.37Å; N100-G102 PolarHBondContact O-N 2.89Å; G102-A104 PolarHBondContact O-N 3.33Å; G102-M139 PolarHBondContact O-N 3.39Å
103	D	90	Very high	90.7	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	132	170.3	-76.7	-7.5	0	0	0	110.9	R56 L83 I84 N100 V136 H138	R56-D103 IonicContact NH2-OD1 2.79Å; R56-D103 PolarHBondContact NH2-OD1 2.95Å; R56-D103 IonicContact NH2-OD2 3.74Å; R56-D103 PolarHBondContact NH2-OD2 2.74Å; L83-D103 WeakPolarHBondContact CA-O 3.35Å; I84-D103 HydrophobicContact CD1-CB 4.02Å; I84-D103 HydrophobicContact CG1-CB 4.36Å; I84-D103 PolarHBondContact N-O 3.22Å; N100-D103 PolarHBondContact N-OD2 3.17Å; N100-D103 VanDerWaalsContact O-CB 3.3Å; N100-D103 WeakPolarHBondContact O-CB 3.32Å; N100-D103 PolarHBondContact O-N 3.28Å; N100-D103 VanDerWaalsContact O-N 3.08Å; D103-V136 HydrophobicContact CB-CB 4.23Å; D103-H138 VanDerWaalsContact OD1-CA 3.29Å; D103-H138 WeakPolarHBondContact OD1-CA 3.2Å; D103-H138 WeakPolarHBondContact OD1-CB 3.32Å; D103-H138 IonicContact OD1-CE1 3.17Å; D103-H138 IonicContact OD1-CG 2.78Å; D103-H138 IonicContact OD1-ND1 2.7Å; D103-H138 PolarHBondContact OD1-ND1 2.67Å
104	A	91	Very high	90.5	Very high	0 Å²	0	50 Å²	50	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	126.2	169	0	0	0	0	0	110.5	P81 I82 L83 G102 L106 V136 K137 M139	P81-A104 HydrophobicContact CB-CB 4.36Å; I82-A104 CarbonylContact O-C 3.48Å; I82-A104 VanDerWaalsContact O-CA 3.31Å; I82-A104 WeakPolarHBondContact O-CA 3.24Å; L83-A104 HydrophobicContact CD2-CB 3.68Å; G102-A104 PolarHBondContact O-N 3.33Å; A104-L106 HydrophobicContact CB-CD2 4.48Å; A104-L106 PolarHBondContact O-N 3.49Å; A104-V136 CarbonylContact O-C 3.6Å; A104-V136 WeakPolarHBondContact O-CA 3.28Å; A104-K137 PolarHBondContact N-O 3.14Å; A104-K137 PolarHBondContact O-N 3.34Å; A104-M139 HydrophobicContact CB-CB 4.37Å; A104-M139 HydrophobicContact CB-CG 3.53Å; A104-M139 HydrophobicContact CB-SD 3.49Å; A104-M139 WeakPolarHBondContact CB-SD 2.8Å
105	I	94.8	Very high	90.4	Very high	3 Å²	3	51.8 Å²	51.8	2%	0.015	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	110	176.2	-50	178.5	0	0	0	107.5	I70 I72 I82 I84 L113 L125 L134 V136	I70-I105 HydrophobicContact CD1-CD1 3.99Å; I72-I105 HydrophobicContact CG2-CD1 3.75Å; I82-I105 HydrophobicContact CG2-CB 4.25Å; I82-I105 HydrophobicContact CG2-CD1 4.24Å; I82-I105 HydrophobicContact CG2-CG1 4.49Å; I82-I105 PolarHBondContact O-N 2.88Å; I84-I105 HydrophobicContact CG1-CD1 4.13Å; I84-I105 HydrophobicContact CG1-CG1 4.15Å; I105-L113 HydrophobicContact CG2-CD1 3.87Å; I105-L125 HydrophobicContact CD1-CD1 4.18Å; I105-L125 HydrophobicContact CD1-CD2 4.47Å; I105-L134 HydrophobicContact CG2-CD2 4.1Å; I105-V136 HydrophobicContact CG1-CG1 4.46Å
106	L	93.4	Very high	90.3	Very high	21 Å²	21	46.9 Å²	46.9	11%	0.11	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	-39.3	-178.8	-54.8	-178.7	0	0	0	111.4	K55 A104 L113 R114 E135 K137	K55-L106 HydrophobicContact CD-CD1 3.62Å; K55-L106 HydrophobicContact CG-CD1 3.9Å; A104-L106 HydrophobicContact CB-CD2 4.48Å; A104-L106 PolarHBondContact O-N 3.49Å; L106-L113 PolarHBondContact O-N 3.33Å; L106-R114 HydrophobicContact CB-CG 4.36Å; L106-R114 HydrophobicContact CD2-CG 4.1Å; L106-E135 WeakPolarHBondContact CA-O 3.48Å; L106-E135 HydrophobicContact CB-CB 4.35Å; L106-E135 HydrophobicContact CB-CG 4.32Å; L106-E135 WeakPolarHBondContact CB-O 2.99Å; L106-E135 HydrophobicContact CD1-CG 4.33Å; L106-E135 PolarHBondContact N-O 3.41Å; L106-K137 HydrophobicContact CD1-CB 3.87Å; L106-K137 HydrophobicContact CG-CB 4.34Å
107	S	95.5	Very high	90.4	Very high	12 Å²	12	47.4 Å²	47.4	8%	0.084	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152	158.4	175.5	67.9	0	0	0	0	111.8	E111 L134 E135	S107-E111 CarbonylContact C-O 3.54Å; S107-E111 WeakPolarHBondContact CA-O 3.24Å; S107-E111 VanDerWaalsContact CB-O 3.23Å; S107-E111 WeakPolarHBondContact CB-O 3.49Å; S107-L134 WeakPolarHBondContact O-CA 3.34Å; S107-E135 PolarHBondContact N-O 2.87Å; S107-E135 PolarHBondContact O-N 2.95Å; S107-E135 WeakPolarHBondContact OG-CB 3.5Å; S107-E135 PolarHBondContact OG-OE2 3.32Å
108	V	96.3	Very high	90.5	Very high	3 Å²	3	46.8 Å²	46.8	2%	0.018	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	120.5	172.8	57.9	0	0	0	0	109.7	G110 E111 L113 A124 L125 A128 V132 E133 L134	V108-G110 PolarHBondContact O-N 3.48Å; V108-G110 VanDerWaalsContact O-N 3.14Å; V108-E111 HydrophobicContact CG1-CB 4.4Å; V108-E111 PolarHBondContact N-O 3.34Å; V108-E111 VanDerWaalsContact O-CB 3.31Å; V108-E111 WeakPolarHBondContact O-CB 3.15Å; V108-E111 PolarHBondContact O-N 2.92Å; V108-L113 HydrophobicContact CB-CD1 4.3Å; V108-L113 HydrophobicContact CG1-CD1 3.78Å; V108-L113 HydrophobicContact CG1-CD2 4.17Å; V108-L113 HydrophobicContact CG1-CG 4.06Å; V108-A124 HydrophobicContact CG1-CB 3.57Å; V108-L125 HydrophobicContact CB-CD2 4.38Å; V108-L125 HydrophobicContact CG2-CD2 4.13Å; V108-A128 HydrophobicContact CG2-CB 3.94Å; V108-V132 HydrophobicContact CG2-CG1 3.77Å; V108-E133 CarbonylContact C-O 3.58Å; V108-E133 WeakPolarHBondContact CA-O 3.43Å; V108-L134 HydrophobicContact CB-CD2 3.84Å; V108-L134 HydrophobicContact CG2-CD2 3.75Å
109	N	94.4	Very high	90.6	Very high	77 Å²	77	47.2 Å²	47.2	41%	0.412	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.7	36.1	-177	-65.1	-10.1	0	0	0	113.4	E111 V132 E133	N109-E111 VanDerWaalsContact C-N 3.29Å; N109-E111 PolarHBondContact O-N 2.93Å; N109-V132 WeakPolarHBondContact OD1-CA 3.09Å; N109-E133 PolarHBondContact N-O 3.45Å; N109-E133 PolarHBondContact OD1-N 3.37Å
110	G	89.3	Confident	90.8	Very high	68 Å²	68	50.6 Å²	50.6	70%	0.701	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.8	-6.7	-176.2	0	0	0	0	0	115.5	V108 D112	V108-G110 PolarHBondContact O-N 3.48Å; V108-G110 VanDerWaalsContact O-N 3.14Å; G110-D112 PolarHBondContact O-N 2.72Å
111	E	94.1	Very high	91.2	Very high	86 Å²	86	47.1 Å²	47.1	40%	0.402	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	114.2	171.1	-171.8	175	168.4	0	0	109.6	S107 V108 N109 R127	S107-E111 CarbonylContact C-O 3.54Å; S107-E111 WeakPolarHBondContact CA-O 3.24Å; S107-E111 VanDerWaalsContact CB-O 3.23Å; S107-E111 WeakPolarHBondContact CB-O 3.49Å; V108-E111 HydrophobicContact CG1-CB 4.4Å; V108-E111 PolarHBondContact N-O 3.34Å; V108-E111 VanDerWaalsContact O-CB 3.31Å; V108-E111 WeakPolarHBondContact O-CB 3.15Å; V108-E111 PolarHBondContact O-N 2.92Å; N109-E111 VanDerWaalsContact C-N 3.29Å; N109-E111 PolarHBondContact O-N 2.93Å; E111-R127 IonicContact OE2-NH1 2.98Å
112	D	93.5	Very high	91.6	Very high	66 Å²	66	45.3 Å²	45.3	35%	0.353	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	127.1	-179.3	-177.4	14.5	0	0	0	111.9	G110 R114	G110-D112 PolarHBondContact O-N 2.72Å; D112-R114 VanDerWaalsContact CG-NE 3.3Å; D112-R114 WeakPolarHBondContact OD1-CB 3.48Å; D112-R114 WeakPolarHBondContact OD1-CG 3.26Å; D112-R114 IonicContact OD1-CZ 2.86Å; D112-R114 PolarHBondContact OD1-N 3.36Å; D112-R114 IonicContact OD1-NE 3.75Å; D112-R114 PolarHBondContact OD1-NE 3.39Å; D112-R114 IonicContact OD1-NH2 3.52Å; D112-R114 IonicContact OD2-CZ 3.23Å; D112-R114 VanDerWaalsContact OD2-CZ 3.27Å; D112-R114 IonicContact OD2-NE 3.06Å; D112-R114 PolarHBondContact OD2-NE 2.95Å; D112-R114 IonicContact OD2-NH2 2.72Å; D112-R114 PolarHBondContact OD2-NH2 2.86Å
113	L	93.7	Very high	92.2	Very high	1 Å²	1	51.1 Å²	51.1	1%	0.005	27%	0.266	C	S	.	.			trans	-107.6	-1	-178.6	-61.8	-173	0	0	0	114	I105 L106 V108 N115 S116 A121 A124	I105-L113 HydrophobicContact CG2-CD1 3.87Å; L106-L113 PolarHBondContact O-N 3.33Å; V108-L113 HydrophobicContact CB-CD1 4.3Å; V108-L113 HydrophobicContact CG1-CD1 3.78Å; V108-L113 HydrophobicContact CG1-CD2 4.17Å; V108-L113 HydrophobicContact CG1-CG 4.06Å; L113-N115 PolarHBondContact O-N 2.98Å; L113-N115 VanDerWaalsContact O-N 3.08Å; L113-S116 WeakPolarHBondContact CA-OG 3.47Å; L113-S116 PolarHBondContact O-N 2.86Å; L113-S116 VanDerWaalsContact O-N 3.09Å; L113-A121 HydrophobicContact CD1-CB 4.23Å; L113-A124 HydrophobicContact CD2-CB 3.86Å
114	R	87.6	Confident	92.4	Very high	147 Å²	147	51.2 Å²	51.2	56%	0.555	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-29.5	-173.3	-71.2	174.8	-67.5	176.4	-1.3	114.2	L106 D112	L106-R114 HydrophobicContact CB-CG 4.36Å; L106-R114 HydrophobicContact CD2-CG 4.1Å; D112-R114 VanDerWaalsContact CG-NE 3.3Å; D112-R114 WeakPolarHBondContact OD1-CB 3.48Å; D112-R114 WeakPolarHBondContact OD1-CG 3.26Å; D112-R114 IonicContact OD1-CZ 2.86Å; D112-R114 PolarHBondContact OD1-N 3.36Å; D112-R114 IonicContact OD1-NE 3.75Å; D112-R114 PolarHBondContact OD1-NE 3.39Å; D112-R114 IonicContact OD1-NH2 3.52Å; D112-R114 IonicContact OD2-CZ 3.23Å; D112-R114 VanDerWaalsContact OD2-CZ 3.27Å; D112-R114 IonicContact OD2-NE 3.06Å; D112-R114 PolarHBondContact OD2-NE 2.95Å; D112-R114 IonicContact OD2-NH2 2.72Å; D112-R114 PolarHBondContact OD2-NH2 2.86Å
115	N	87.6	Confident	92.5	Very high	121 Å²	121	52 Å²	52	65%	0.647	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117	12.6	-179.8	-66.4	-48.3	0	0	0	113.3	R76 L113	R76-N115 VanDerWaalsContact CD-O 3.29Å; R76-N115 WeakPolarHBondContact CD-O 3.47Å; L113-N115 PolarHBondContact O-N 2.98Å; L113-N115 VanDerWaalsContact O-N 3.08Å
116	S	87.5	Confident	92.3	Very high	17 Å²	17	59.9 Å²	59.9	12%	0.119	31%	0.305	C	S	.	.			trans	-77	149.8	-179.2	-63.5	0	0	0	0	112	R76 L113 E120	R76-S116 PolarHBondContact N-O 3.23Å; L113-S116 WeakPolarHBondContact CA-OG 3.47Å; L113-S116 PolarHBondContact O-N 2.86Å; L113-S116 VanDerWaalsContact O-N 3.09Å; S116-E120 WeakPolarHBondContact CA-OE2 3.47Å
117	T	91.9	Very high	92.1	Very high	41 Å²	41	67 Å²	67	25%	0.252	33%	0.331	S	S	.	.			trans	-68.8	162.8	164.6	57.9	0	0	0	0	111.3	E77 D119 E120 A121	E77-T117 WeakPolarHBondContact OE2-CA 3.5Å; E77-T117 WeakPolarHBondContact OE2-CB 3.22Å; T117-D119 VanDerWaalsContact C-N 3.27Å; T117-D119 PolarHBondContact O-N 3.32Å; T117-E120 PolarHBondContact N-OE2 2.9Å; T117-E120 PolarHBondContact O-N 3.1Å; T117-E120 WeakPolarHBondContact OG1-CB 3.41Å; T117-E120 WeakPolarHBondContact OG1-CG 3.29Å; T117-E120 PolarHBondContact OG1-N 3.27Å; T117-E120 PolarHBondContact OG1-OE2 3.15Å; T117-A121 PolarHBondContact O-N 3.39Å
118	H	88.5	Confident	91.6	Very high	53 Å²	53	66.9 Å²	66.9	25%	0.245	33%	0.33	C	S	.	.	H	α-helix	trans	-52.5	-47.7	173.8	-171.6	84.3	0	0	0	111.8	I72 G74 E77 E120 A121 V122	I72-H118 PolarHBondContact O-CE1 2.94Å; G74-H118 VanDerWaalsContact O-CB 3.31Å; G74-H118 WeakPolarHBondContact O-CB 3.33Å; G74-H118 PolarHBondContact O-ND1 2.91Å; E77-H118 WeakPolarHBondContact OE1-CB 3.47Å; E77-H118 PolarHBondContact OE1-N 2.94Å; E77-H118 PolarHBondContact OE2-N 3.49Å; H118-E120 PolarHBondContact O-N 3.33Å; H118-A121 PolarHBondContact O-N 3.15Å; H118-V122 WeakPolarHBondContact O-CG2 3.23Å; H118-V122 PolarHBondContact O-N 3.43Å
119	D	92.8	Very high	91.1	Very high	109 Å²	109	68.8 Å²	68.8	58%	0.583	35%	0.351	S	S	*	.	H	α-helix	trans	-67.8	-33	-177.6	-72.4	-26.6	0	0	0	113.3	T117 R123	T117-D119 VanDerWaalsContact C-N 3.27Å; T117-D119 PolarHBondContact O-N 3.32Å; D119-R123 WeakPolarHBondContact O-CB 3.46Å; D119-R123 VanDerWaalsContact O-CG 3.26Å; D119-R123 WeakPolarHBondContact O-CG 3.47Å; D119-R123 PolarHBondContact O-N 3.15Å; D119-R123 PolarHBondContact O-NE 2.97Å
120	E	93.3	Very high	90.9	Very high	80 Å²	80	73 Å²	73	37%	0.374	36%	0.361	S	S	.	.	H	α-helix	trans	-66.2	-45.8	172	-75.7	166	163.8	0	0	111.2	S116 T117 H118 V122 R123 A124	S116-E120 WeakPolarHBondContact CA-OE2 3.47Å; T117-E120 PolarHBondContact N-OE2 2.9Å; T117-E120 PolarHBondContact O-N 3.1Å; T117-E120 WeakPolarHBondContact OG1-CB 3.41Å; T117-E120 WeakPolarHBondContact OG1-CG 3.29Å; T117-E120 PolarHBondContact OG1-N 3.27Å; T117-E120 PolarHBondContact OG1-OE2 3.15Å; H118-E120 PolarHBondContact O-N 3.33Å; E120-V122 PolarHBondContact O-N 3.4Å; E120-R123 PolarHBondContact O-N 2.82Å; E120-A124 WeakPolarHBondContact O-CB 3.08Å; E120-A124 PolarHBondContact O-N 2.78Å
121	A	94.2	Very high	91	Very high	0 Å²	0	73.3 Å²	73.3	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-62.8	-42.9	177.3	0	0	0	0	0	112.1	I72 I82 L113 T117 H118 R123 A124 L125	I72-A121 HydrophobicContact CD1-CB 4.07Å; I82-A121 HydrophobicContact CB-CB 4.42Å; I82-A121 HydrophobicContact CD1-CB 3.51Å; I82-A121 HydrophobicContact CG1-CB 3.66Å; I82-A121 HydrophobicContact CG2-CB 3.93Å; L113-A121 HydrophobicContact CD1-CB 4.23Å; T117-A121 PolarHBondContact O-N 3.39Å; H118-A121 PolarHBondContact O-N 3.15Å; A121-R123 VanDerWaalsContact C-N 3.34Å; A121-R123 PolarHBondContact O-N 2.88Å; A121-A124 PolarHBondContact O-N 3.1Å; A121-L125 WeakPolarHBondContact O-CB 3.5Å; A121-L125 WeakPolarHBondContact O-CG 3.48Å; A121-L125 PolarHBondContact O-N 3.15Å
122	V	93.7	Very high	91	Very high	36 Å²	36	69.2 Å²	69.2	22%	0.218	33%	0.327	C	S	.	.	H	α-helix	trans	-59.4	-45.5	173	171.7	0	0	0	0	110.7	I72 H118 E120 L125 K126	I72-V122 HydrophobicContact CD1-CG2 3.84Å; I72-V122 HydrophobicContact CG1-CG2 4.33Å; H118-V122 WeakPolarHBondContact O-CG2 3.23Å; H118-V122 PolarHBondContact O-N 3.43Å; E120-V122 PolarHBondContact O-N 3.4Å; V122-L125 PolarHBondContact O-N 3Å; V122-K126 HydrophobicContact CG1-CD 3.97Å; V122-K126 HydrophobicContact CG1-CG 4.41Å; V122-K126 WeakPolarHBondContact O-CB 3.45Å; V122-K126 VanDerWaalsContact O-CG 3.32Å; V122-K126 WeakPolarHBondContact O-CG 3.45Å; V122-K126 PolarHBondContact O-N 3.26Å
123	R	93.6	Very high	91.1	Very high	132 Å²	132	69.7 Å²	69.7	50%	0.498	33%	0.327	S	S	.	.	H	α-helix	trans	-62.9	-42.4	177.9	-80.3	-178.5	-71.3	156.2	-5.6	112.1	D119 E120 A121 K126 R127	D119-R123 WeakPolarHBondContact O-CB 3.46Å; D119-R123 VanDerWaalsContact O-CG 3.26Å; D119-R123 WeakPolarHBondContact O-CG 3.47Å; D119-R123 PolarHBondContact O-N 3.15Å; D119-R123 PolarHBondContact O-NE 2.97Å; E120-R123 PolarHBondContact O-N 2.82Å; A121-R123 VanDerWaalsContact C-N 3.34Å; A121-R123 PolarHBondContact O-N 2.88Å; R123-K126 PolarHBondContact O-N 2.87Å; R123-R127 VanDerWaalsContact O-CB 3.3Å; R123-R127 WeakPolarHBondContact O-CB 3.38Å; R123-R127 PolarHBondContact O-N 3.44Å
124	A	93.7	Very high	91.2	Very high	3 Å²	3	69.6 Å²	69.6	3%	0.025	33%	0.327	C	S	.	.	H	α-helix	trans	-64.6	-46.3	178.3	0	0	0	0	0	111.6	V108 L113 E120 A121 K126 R127 A128	V108-A124 HydrophobicContact CG1-CB 3.57Å; L113-A124 HydrophobicContact CD2-CB 3.86Å; E120-A124 WeakPolarHBondContact O-CB 3.08Å; E120-A124 PolarHBondContact O-N 2.78Å; A121-A124 PolarHBondContact O-N 3.1Å; A124-K126 VanDerWaalsContact C-N 3.34Å; A124-K126 PolarHBondContact O-N 3.35Å; A124-R127 PolarHBondContact O-N 2.89Å; A124-A128 PolarHBondContact O-N 2.79Å
125	L	92.6	Very high	91.6	Very high	17 Å²	17	65.2 Å²	65.2	9%	0.089	31%	0.312	C	S	.	.	H	α-helix	trans	-64.1	-35	176.4	-71.2	167.8	0	0	0	113.3	K62 L68 I72 I105 V108 A121 V122 L134	K62-L125 PolarHBondContact NZ-O 3.29Å; L68-L125 HydrophobicContact CD2-CD2 4.11Å; I72-L125 HydrophobicContact CD1-CD1 3.84Å; I72-L125 HydrophobicContact CG2-CD1 4.12Å; I105-L125 HydrophobicContact CD1-CD1 4.18Å; I105-L125 HydrophobicContact CD1-CD2 4.47Å; V108-L125 HydrophobicContact CB-CD2 4.38Å; V108-L125 HydrophobicContact CG2-CD2 4.13Å; A121-L125 WeakPolarHBondContact O-CB 3.5Å; A121-L125 WeakPolarHBondContact O-CG 3.48Å; A121-L125 PolarHBondContact O-N 3.15Å; V122-L125 PolarHBondContact O-N 3Å; L125-L134 HydrophobicContact CD2-CD2 3.74Å
126	K	90.3	Very high	91.9	Very high	167 Å²	167	59.4 Å²	59.4	73%	0.726	28%	0.281	S	S	*	.	H	α-helix	trans	-72.9	-36.7	174.7	-77.7	-177.9	177.2	-179.9	0	112.7	V122 R123 A124 A128	V122-K126 HydrophobicContact CG1-CD 3.97Å; V122-K126 HydrophobicContact CG1-CG 4.41Å; V122-K126 WeakPolarHBondContact O-CB 3.45Å; V122-K126 VanDerWaalsContact O-CG 3.32Å; V122-K126 WeakPolarHBondContact O-CG 3.45Å; V122-K126 PolarHBondContact O-N 3.26Å; R123-K126 PolarHBondContact O-N 2.87Å; A124-K126 VanDerWaalsContact C-N 3.34Å; A124-K126 PolarHBondContact O-N 3.35Å; K126-A128 VanDerWaalsContact C-N 3.3Å
127	R	89.1	Confident	91.9	Very high	172 Å²	172	62.2 Å²	62.2	65%	0.649	29%	0.291	S	S	*	.	H	α-helix	trans	-72.6	-24.6	177.3	-166.3	-172	-56.8	152	4.5	112.2	E111 R123 A124 G129	E111-R127 IonicContact OE2-NH1 2.98Å; R123-R127 VanDerWaalsContact O-CB 3.3Å; R123-R127 WeakPolarHBondContact O-CB 3.38Å; R123-R127 PolarHBondContact O-N 3.44Å; A124-R127 PolarHBondContact O-N 2.89Å; R127-G129 PolarHBondContact O-N 3.43Å
128	A	85.3	Confident	91.4	Very high	8 Å²	8	62.3 Å²	62.3	7%	0.066	29%	0.289	C	S	.	.			trans	-57.6	122.5	174.4	0	0	0	0	0	109.8	K62 V108 A124 K126 V132	K62-A128 PolarHBondContact NZ-O 2.8Å; V108-A128 HydrophobicContact CG2-CB 3.94Å; A124-A128 PolarHBondContact O-N 2.79Å; K126-A128 VanDerWaalsContact C-N 3.3Å; A128-V132 HydrophobicContact CB-CB 4.36Å; A128-V132 HydrophobicContact CB-CG1 3.96Å; A128-V132 HydrophobicContact CB-CG2 3.64Å
129	G	86.5	Confident	90.4	Very high	44 Å²	44	62 Å²	62	45%	0.454	29%	0.288	S	S	.	.			trans	-69.4	-151.2	-176.3	0	0	0	0	0	113.3	K62 R127 I131	K62-G129 WeakPolarHBondContact CD-O 3.38Å; K62-G129 PolarHBondContact NZ-O 3.05Å; R127-G129 PolarHBondContact O-N 3.43Å; G129-I131 VanDerWaalsContact C-N 3.28Å; G129-I131 PolarHBondContact O-N 2.94Å
130	R	90.6	Very high	88.5	Confident	164 Å²	164	59.6 Å²	59.6	62%	0.619	27%	0.273	S	S	*	.	S	Bend	trans	-60.1	-37.5	-179.7	-173.8	178.1	175.9	-165.9	-1	112.8	T61 K62	T61-R130 CarbonylContact C-O 3.42Å; T61-R130 WeakPolarHBondContact CA-O 3.29Å; T61-R130 HydrophobicContact CG2-CG 4.21Å; K62-R130 PolarHBondContact N-O 2.85Å; K62-R130 WeakPolarHBondContact O-CG 3.48Å
131	I	91.1	Very high	86.3	Confident	75 Å²	75	61 Å²	61	39%	0.385	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	124.3	177	-56.8	174.5	0	0	0	107.9	R59 G129	R59-I131 HydrophobicContact CG-CG2 3.88Å; G129-I131 VanDerWaalsContact C-N 3.28Å; G129-I131 PolarHBondContact O-N 2.94Å
132	V	94.3	Very high	83.9	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	122.4	178.4	-172.9	0	0	0	0	109.1	R59 I60 K62 V108 N109 A128 L134	R59-V132 CarbonylContact C-O 3.52Å; R59-V132 WeakPolarHBondContact CA-O 3.3Å; I60-V132 PolarHBondContact N-O 3.08Å; I60-V132 PolarHBondContact O-N 2.67Å; K62-V132 HydrophobicContact CD-CG2 4.11Å; K62-V132 HydrophobicContact CG-CG2 4.41Å; V108-V132 HydrophobicContact CG2-CG1 3.77Å; N109-V132 WeakPolarHBondContact OD1-CA 3.09Å; A128-V132 HydrophobicContact CB-CB 4.36Å; A128-V132 HydrophobicContact CB-CG1 3.96Å; A128-V132 HydrophobicContact CB-CG2 3.64Å; V132-L134 HydrophobicContact CG1-CD2 3.7Å; V132-L134 HydrophobicContact CG1-CG 3.96Å
133	E	95	Very high	81.4	Confident	76 Å²	76	62 Å²	62	36%	0.355	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	112.4	173.6	-64.9	-175.5	159.7	0	0	108.3	L57 V58 R59 V108 N109	L57-E133 HydrophobicContact CD1-CB 4.37Å; V58-E133 WeakPolarHBondContact O-CA 3.21Å; R59-E133 HydrophobicContact CB-CG 4.25Å; R59-E133 HydrophobicContact CG-CG 4.09Å; V108-E133 CarbonylContact C-O 3.58Å; V108-E133 WeakPolarHBondContact CA-O 3.43Å; N109-E133 PolarHBondContact N-O 3.45Å; N109-E133 PolarHBondContact OD1-N 3.37Å
134	L	96.5	Very high	78.7	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	123.4	177.5	-60.5	-179.6	0	0	0	109.6	L57 V58 I60 L68 L99 I105 S107 V108 L125 V132 V136	L57-L134 CarbonylContact C-O 3.58Å; L57-L134 WeakPolarHBondContact CA-O 3.46Å; V58-L134 PolarHBondContact N-O 2.9Å; V58-L134 PolarHBondContact O-N 2.83Å; I60-L134 HydrophobicContact CD1-CD1 3.98Å; L68-L134 HydrophobicContact CD2-CD1 4.24Å; L99-L134 HydrophobicContact CD1-CD1 4.15Å; L99-L134 HydrophobicContact CD2-CD1 4.33Å; I105-L134 HydrophobicContact CG2-CD2 4.1Å; S107-L134 WeakPolarHBondContact O-CA 3.34Å; V108-L134 HydrophobicContact CB-CD2 3.84Å; V108-L134 HydrophobicContact CG2-CD2 3.75Å; L125-L134 HydrophobicContact CD2-CD2 3.74Å; V132-L134 HydrophobicContact CG1-CD2 3.7Å; V132-L134 HydrophobicContact CG1-CG 3.96Å; L134-V136 HydrophobicContact CB-CG1 3.94Å
135	E	95	Very high	75.8	Confident	54 Å²	54	62.2 Å²	62.2	25%	0.252	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	111.7	162.6	-168.5	-173.2	176	0	0	107.1	K55 R56 L57 L106 S107	K55-E135 HydrophobicContact CB-CG 4.48Å; K55-E135 HydrophobicContact CD-CG 4.3Å; K55-E135 WeakPolarHBondContact CD-OE1 3.46Å; K55-E135 WeakPolarHBondContact CE-OE1 3.35Å; K55-E135 IonicContact NZ-OE1 3.55Å; K55-E135 PolarHBondContact NZ-OE1 3.44Å; R56-E135 WeakPolarHBondContact O-CA 3.31Å; L57-E135 HydrophobicContact CD1-CB 4.42Å; L106-E135 WeakPolarHBondContact CA-O 3.48Å; L106-E135 HydrophobicContact CB-CB 4.35Å; L106-E135 HydrophobicContact CB-CG 4.32Å; L106-E135 WeakPolarHBondContact CB-O 2.99Å; L106-E135 HydrophobicContact CD1-CG 4.33Å; L106-E135 PolarHBondContact N-O 3.41Å; S107-E135 PolarHBondContact N-O 2.87Å; S107-E135 PolarHBondContact O-N 2.95Å; S107-E135 WeakPolarHBondContact OG-CB 3.5Å; S107-E135 PolarHBondContact OG-OE2 3.32Å
136	V	93.7	Very high	73.3	Confident	0 Å²	0	66.2 Å²	66.2	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	150	179.8	-59.3	0	0	0	0	110.8	K55 R56 V58 L99 D103 A104 I105 L134	K55-V136 CarbonylContact C-O 3.47Å; K55-V136 WeakPolarHBondContact CA-O 3.4Å; R56-V136 HydrophobicContact CB-CG2 3.97Å; R56-V136 PolarHBondContact N-O 2.93Å; R56-V136 PolarHBondContact O-N 2.86Å; V58-V136 HydrophobicContact CG2-CG2 3.96Å; L99-V136 HydrophobicContact CD2-CG1 3.92Å; L99-V136 HydrophobicContact CD2-CG2 4.23Å; D103-V136 HydrophobicContact CB-CB 4.23Å; A104-V136 CarbonylContact O-C 3.6Å; A104-V136 WeakPolarHBondContact O-CA 3.28Å; I105-V136 HydrophobicContact CG1-CG1 4.46Å; L134-V136 HydrophobicContact CB-CG1 3.94Å
137	K	87.6	Confident	70.9	Confident	75 Å²	75	63.3 Å²	63.3	33%	0.326	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	127.3	166.2	178.9	175.9	175.9	176.6	0	107.3	T53 A104 L106 M139	T53-K137 VanDerWaalsContact O-CE 3.24Å; T53-K137 WeakPolarHBondContact O-CE 3.27Å; A104-K137 PolarHBondContact N-O 3.14Å; A104-K137 PolarHBondContact O-N 3.34Å; L106-K137 HydrophobicContact CD1-CB 3.87Å; L106-K137 HydrophobicContact CG-CB 4.34Å; K137-M139 PolarHBondContact O-N 3.32Å
138	H	81.8	Confident	68.4	Low	43 Å²	43	66.5 Å²	66.5	20%	0.199	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	111.7	173.7	-166	48.8	0	0	0	108.2	D103 H140	D103-H138 VanDerWaalsContact OD1-CA 3.29Å; D103-H138 WeakPolarHBondContact OD1-CA 3.2Å; D103-H138 WeakPolarHBondContact OD1-CB 3.32Å; D103-H138 IonicContact OD1-CE1 3.17Å; D103-H138 IonicContact OD1-CG 2.78Å; D103-H138 IonicContact OD1-ND1 2.7Å; D103-H138 PolarHBondContact OD1-ND1 2.67Å; H138-H140 AromaticContact CD2-CD2 3.8Å; H138-H140 AromaticContact CD2-CE1 3.14Å; H138-H140 PolarHBondContact CD2-CE1 2.98Å; H138-H140 AromaticContact CD2-CG 3.92Å; H138-H140 AromaticContact CD2-ND1 3.49Å; H138-H140 PolarHBondContact CD2-ND1 2.78Å; H138-H140 AromaticContact CD2-NE2 3.33Å; H138-H140 PolarHBondContact CD2-NE2 2.7Å; H138-H140 VanDerWaalsContact CD2-NE2 3.33Å; H138-H140 AromaticContact NE2-CE1 3.53Å; H138-H140 AromaticContact NE2-ND1 3.57Å; H138-H140 PolarHBondContact O-N 2.77Å
139	M	67.3	Low	66	Low	47 Å²	47	67.5 Å²	67.5	23%	0.232	31%	0.312	C	S	.	.			trans	-97.6	91.5	179	-71.3	-158.3	83.9	0	0	108	P81 G102 A104 K137 E141 V142	P81-M139 HydrophobicContact CB-SD 4.42Å; P81-M139 HydrophobicContact CG-SD 3.83Å; G102-M139 PolarHBondContact O-N 3.39Å; A104-M139 HydrophobicContact CB-CB 4.37Å; A104-M139 HydrophobicContact CB-CG 3.53Å; A104-M139 HydrophobicContact CB-SD 3.49Å; A104-M139 WeakPolarHBondContact CB-SD 2.8Å; K137-M139 PolarHBondContact O-N 3.32Å; M139-E141 PolarHBondContact O-N 2.75Å; M139-E141 VanDerWaalsContact O-N 3.07Å; M139-V142 HydrophobicContact CB-CB 4.25Å; M139-V142 HydrophobicContact CB-CG2 3.34Å; M139-V142 HydrophobicContact CG-CG2 4.29Å; M139-V142 WeakPolarHBondContact O-CB 2.98Å; M139-V142 PolarHBondContact O-N 3.25Å; M139-V142 HydrophobicContact SD-CG2 4.16Å
140	H	54.1	Low	63.7	Low	59 Å²	59	66.8 Å²	66.8	27%	0.273	30%	0.299	S	S	.	.	G	3₁₀ helix	trans	-56.8	-19.2	168.4	-63.4	-79.8	0	0	0	112.2	Y16 N19 S52 H138 V142	Y16-H140 PolarHBondContact OH-O 2.98Å; N19-H140 HydrophobicContact CB-CB 4.12Å; N19-H140 VanDerWaalsContact O-CB 3.32Å; N19-H140 WeakPolarHBondContact O-CB 3.36Å; S52-H140 PolarHBondContact O-NE2 3.07Å; S52-H140 PolarHBondContact OG-NE2 2.91Å; H138-H140 AromaticContact CD2-CD2 3.8Å; H138-H140 AromaticContact CD2-CE1 3.14Å; H138-H140 PolarHBondContact CD2-CE1 2.98Å; H138-H140 AromaticContact CD2-CG 3.92Å; H138-H140 AromaticContact CD2-ND1 3.49Å; H138-H140 PolarHBondContact CD2-ND1 2.78Å; H138-H140 AromaticContact CD2-NE2 3.33Å; H138-H140 PolarHBondContact CD2-NE2 2.7Å; H138-H140 VanDerWaalsContact CD2-NE2 3.33Å; H138-H140 AromaticContact NE2-CE1 3.53Å; H138-H140 AromaticContact NE2-ND1 3.57Å; H138-H140 PolarHBondContact O-N 2.77Å; H140-V142 VanDerWaalsContact C-N 3.29Å; H140-V142 PolarHBondContact O-N 3Å
141	E	47.1	Very low	60.9	Low	110 Å²	110	60.7 Å²	60.7	51%	0.514	29%	0.288	S	S	.	.	G	3₁₀ helix	trans	-81.7	14.9	172.2	-82.7	176	-179	0	0	115.2	N19 M139 P144	N19-E141 HydrophobicContact CB-CG 4.28Å; N19-E141 WeakPolarHBondContact ND2-CG 3.34Å; N19-E141 PolarHBondContact ND2-OE1 2.88Å; N19-E141 VanDerWaalsContact ND2-OE1 3.15Å; M139-E141 PolarHBondContact O-N 2.75Å; M139-E141 VanDerWaalsContact O-N 3.07Å; E141-P144 VanDerWaalsContact O-CD 3.29Å; E141-P144 WeakPolarHBondContact O-CD 3.42Å; E141-P144 WeakPolarHBondContact O-CG 3.41Å
142	V	43.5	Very low	58.6	Low	1 Å²	1	58.9 Å²	58.9	1%	0.006	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-108.5	-11.9	179.5	176.9	0	0	0	0	114.8	L83 M139 H140 P144 Y145 F146	L83-V142 HydrophobicContact CB-CG1 4.31Å; L83-V142 HydrophobicContact CD1-CB 4.16Å; L83-V142 HydrophobicContact CD1-CG1 3.17Å; L83-V142 HydrophobicContact CD1-CG2 3.85Å; L83-V142 HydrophobicContact CD2-CB 4Å; L83-V142 HydrophobicContact CD2-CG1 3.66Å; L83-V142 HydrophobicContact CD2-CG2 3.37Å; L83-V142 HydrophobicContact CG-CG1 3.83Å; L83-V142 HydrophobicContact CG-CG2 4.19Å; M139-V142 HydrophobicContact CB-CB 4.25Å; M139-V142 HydrophobicContact CB-CG2 3.34Å; M139-V142 HydrophobicContact CG-CG2 4.29Å; M139-V142 WeakPolarHBondContact O-CB 2.98Å; M139-V142 PolarHBondContact O-N 3.25Å; M139-V142 HydrophobicContact SD-CG2 4.16Å; H140-V142 VanDerWaalsContact C-N 3.29Å; H140-V142 PolarHBondContact O-N 3Å; V142-P144 VanDerWaalsContact C-CD 3.47Å; V142-Y145 HydrophobicContact CB-CD2 4.1Å; V142-Y145 HydrophobicContact CG1-CD2 4Å; V142-Y145 HydrophobicContact CG2-CD2 3.82Å; V142-Y145 HydrophobicContact CG2-CE2 4.17Å; V142-Y145 PolarHBondContact O-N 3.47Å; V142-F146 WeakPolarHBondContact O-CD2 2.84Å
143	T	40.6	Very low	55.9	Low	54 Å²	54	67.3 Å²	67.3	33%	0.331	32%	0.318	S	S	.	.	G	3₁₀ helix	trans	-50.7	-33	157.6	-32.7	0	0	0	0	111.3	Y145 L215	T143-Y145 PolarHBondContact O-N 3.02Å; T143-L215 HydrophobicContact CG2-CD1 3.83Å; T143-L215 HydrophobicContact CG2-CD2 3.76Å; T143-L215 HydrophobicContact CG2-CG 4.44Å
144	P	36.9	Very low	53.1	Low	32 Å²	32	68.1 Å²	68.1	21%	0.208	33%	0.328	C	S	.	.	G	3₁₀ helix	trans	-55.5	-34.6	161.8	-21.6	17.8	0	0	0	119.6	E141 V142 F146 R147	E141-P144 VanDerWaalsContact O-CD 3.29Å; E141-P144 WeakPolarHBondContact O-CD 3.42Å; E141-P144 WeakPolarHBondContact O-CG 3.41Å; V142-P144 VanDerWaalsContact C-CD 3.47Å; P144-F146 PolarHBondContact O-N 3.42Å; P144-R147 VanDerWaalsContact CA-CZ 3.42Å; P144-R147 VanDerWaalsContact CA-NE 3.32Å; P144-R147 VanDerWaalsContact CB-CZ 3.43Å; P144-R147 VanDerWaalsContact CD-NH2 3.32Å; P144-R147 VanDerWaalsContact CG-CZ 3.41Å; P144-R147 WeakPolarHBondContact O-CB 3.3Å; P144-R147 VanDerWaalsContact O-CG 3.32Å; P144-R147 WeakPolarHBondContact O-CG 3.43Å; P144-R147 PolarHBondContact O-N 3.32Å
145	Y	33.7	Very low	50.5	Low	108 Å²	108	69.9 Å²	69.9	42%	0.424	34%	0.337	S	S	.	.	G	3₁₀ helix	trans	-81.9	1.3	-174.8	-69.7	-71.9	0	0	0	113.4	T80 L83 V142 T143	T80-Y145 HydrophobicContact CG2-CD1 3.21Å; T80-Y145 HydrophobicContact CG2-CE1 3.36Å; T80-Y145 HydrophobicContact CG2-CG 4.01Å; L83-Y145 HydrophobicContact CD1-CD2 4.26Å; V142-Y145 HydrophobicContact CB-CD2 4.1Å; V142-Y145 HydrophobicContact CG1-CD2 4Å; V142-Y145 HydrophobicContact CG2-CD2 3.82Å; V142-Y145 HydrophobicContact CG2-CE2 4.17Å; V142-Y145 PolarHBondContact O-N 3.47Å; T143-Y145 PolarHBondContact O-N 3.02Å
146	F	39.1	Very low	47.9	Very low	102 Å²	102	70.6 Å²	70.6	45%	0.447	35%	0.352	S	S	.	.	G	3₁₀ helix	trans	-92.2	-8.3	164.9	-63.7	-84.1	0	0	0	112.3	K73 V142 P144 R148	K73-F146 HydrophobicContact CD-CE1 4.14Å; K73-F146 HydrophobicContact CD-CZ 4.25Å; K73-F146 VanDerWaalsContact CE-CZ 3.42Å; K73-F146 VanDerWaalsContact NZ-CG 3.29Å; V142-F146 WeakPolarHBondContact O-CD2 2.84Å; P144-F146 PolarHBondContact O-N 3.42Å; F146-R148 VanDerWaalsContact C-N 3.35Å; F146-R148 PolarHBondContact O-N 3.42Å
147	R	40.6	Very low	45.6	Very low	105 Å²	105	72.1 Å²	72.1	40%	0.396	36%	0.363	S	S	.	.			trans	-77.5	5.2	-167.4	-67.2	-178	-163.9	149.2	6.4	117.2	P144 A149	P144-R147 VanDerWaalsContact CA-CZ 3.42Å; P144-R147 VanDerWaalsContact CA-NE 3.32Å; P144-R147 VanDerWaalsContact CB-CZ 3.43Å; P144-R147 VanDerWaalsContact CD-NH2 3.32Å; P144-R147 VanDerWaalsContact CG-CZ 3.41Å; P144-R147 WeakPolarHBondContact O-CB 3.3Å; P144-R147 VanDerWaalsContact O-CG 3.32Å; P144-R147 WeakPolarHBondContact O-CG 3.43Å; P144-R147 PolarHBondContact O-N 3.32Å; R147-A149 PolarHBondContact O-N 3.3Å
148	R	35.8	Very low	43.7	Very low	239 Å²	239	69.7 Å²	69.7	90%	0.902	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.3	24.9	-171.4	-142.1	177.9	-160.7	148.2	3.9	114.9	F146	F146-R148 VanDerWaalsContact C-N 3.35Å; F146-R148 PolarHBondContact O-N 3.42Å
149	A	35.1	Very low	42	Very low	29 Å²	29	70.5 Å²	70.5	24%	0.24	37%	0.369	C	S	.	.	T	Hydrogen-bonded Turn	trans	-127.5	1.5	-176.3	0	0	0	0	0	115.1	R147 T330	R147-A149 PolarHBondContact O-N 3.3Å; A149-T330 HydrophobicContact CB-CG2 4.31Å; A149-T330 WeakPolarHBondContact O-CB 3.25Å; A149-T330 WeakPolarHBondContact O-CG2 3.42Å
150	V	37.7	Very low	41.3	Very low	29 Å²	29	72.8 Å²	72.8	18%	0.176	38%	0.382	C	S	.	.	S	Bend	trans	-130.2	115.3	170.8	-163.4	0	0	0	0	107.4	M152 L213	V150-M152 PolarHBondContact O-N 3.17Å; V150-L213 WeakPolarHBondContact CG2-O 3.25Å
151	G	33.6	Very low	41.6	Very low	37 Å²	37	70.6 Å²	70.6	38%	0.381	37%	0.372	S	S	.	.			trans	-71.9	58.1	-179.3	0	0	0	0	0	112.9
152	M	41.4	Very low	42.2	Very low	37 Å²	37	67.6 Å²	67.6	18%	0.182	36%	0.363	C	S	.	.			trans	-114.9	84	163.4	-73.3	179.1	77.3	0	0	106.8	V150 T154 I155 G230 P333	V150-M152 PolarHBondContact O-N 3.17Å; M152-T154 PolarHBondContact O-N 2.62Å; M152-I155 HydrophobicContact CB-CD1 4.02Å; M152-I155 HydrophobicContact CB-CG1 4.06Å; M152-I155 HydrophobicContact CE-CD1 3.66Å; M152-I155 HydrophobicContact CE-CG1 3.84Å; M152-I155 HydrophobicContact SD-CD1 3.86Å; M152-G230 WeakPolarHBondContact CE-O 3.45Å; M152-P333 HydrophobicContact SD-CG 3.79Å
153	E	37	Very low	43.2	Very low	177 Å²	177	68.5 Å²	68.5	83%	0.827	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	3	-174.8	-19	-79.5	169.3	0	0	114.2
154	T	36.7	Very low	44.2	Very low	92 Å²	92	67.9 Å²	67.9	56%	0.564	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-145.2	20	-161.5	35.8	0	0	0	0	115.9	M152 A156	M152-T154 PolarHBondContact O-N 2.62Å; T154-A156 PolarHBondContact O-N 3.43Å
155	I	43.3	Very low	45.2	Very low	37 Å²	37	70.8 Å²	70.8	19%	0.19	38%	0.381	C	S	.	.			trans	-76.2	80	170.6	-55.1	177.7	0	0	0	110.1	M152 T214 H226 S233	M152-I155 HydrophobicContact CB-CD1 4.02Å; M152-I155 HydrophobicContact CB-CG1 4.06Å; M152-I155 HydrophobicContact CE-CD1 3.66Å; M152-I155 HydrophobicContact CE-CG1 3.84Å; M152-I155 HydrophobicContact SD-CD1 3.86Å; I155-T214 HydrophobicContact CD1-CG2 4.42Å; I155-H226 VanDerWaalsContact CD1-CE1 3.41Å; I155-H226 WeakPolarHBondContact CD1-CE1 3.1Å; I155-H226 WeakPolarHBondContact CD1-ND1 3.13Å; I155-S233 WeakPolarHBondContact CG2-OG 3.29Å
156	A	38.7	Very low	46.3	Very low	70 Å²	70	66.2 Å²	66.2	58%	0.579	37%	0.365	S	S	*	.			trans	-84.7	115.3	153.1	0	0	0	0	0	106.3	T154 S158	T154-A156 PolarHBondContact O-N 3.43Å; A156-S158 VanDerWaalsContact C-N 3.32Å; A156-S158 PolarHBondContact O-N 3.16Å
157	C	46.1	Very low	47.2	Very low	32 Å²	32	68.1 Å²	68.1	22%	0.216	38%	0.375	C	S	.	.			trans	-56.9	105.4	163	-60.1	0	0	0	0	106.3	Y16 L17 A159 S233	Y16-C157 PolarHBondContact O-SG 3.04Å; L17-C157 HydrophobicContact CD2-CB 3.55Å; C157-A159 PolarHBondContact O-N 3.38Å; C157-S233 WeakPolarHBondContact CA-O 3.4Å; C157-S233 PolarHBondContact SG-O 3.12Å
158	S	47.4	Very low	47.9	Very low	23 Å²	23	63.7 Å²	63.7	16%	0.161	36%	0.359	C	S	.	.			trans	-69.2	123.4	-170.6	79.1	0	0	0	0	107	A156 D160 L161	A156-S158 VanDerWaalsContact C-N 3.32Å; A156-S158 PolarHBondContact O-N 3.16Å; S158-D160 WeakPolarHBondContact CB-OD1 3.05Å; S158-D160 PolarHBondContact O-N 3.39Å; S158-D160 PolarHBondContact OG-OD1 2.83Å; S158-L161 PolarHBondContact O-N 3.26Å
159	A	45.7	Very low	48.5	Very low	60 Å²	60	55.8 Å²	55.8	50%	0.496	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-15.7	-175.9	0	0	0	0	0	112.4	C157	C157-A159 PolarHBondContact O-N 3.38Å
160	D	52.5	Low	49	Very low	96 Å²	96	61.5 Å²	61.5	51%	0.513	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.9	-7.6	177.5	68.1	-24.7	0	0	0	113.7	S158 S162	S158-D160 WeakPolarHBondContact CB-OD1 3.05Å; S158-D160 PolarHBondContact O-N 3.39Å; S158-D160 PolarHBondContact OG-OD1 2.83Å; D160-S162 PolarHBondContact O-N 2.71Å; D160-S162 PolarHBondContact OD2-OG 2.95Å
161	L	61.2	Low	49.5	Very low	13 Å²	13	61.1 Å²	61.1	7%	0.068	38%	0.376	C	S	.	.			trans	45.3	18.5	-178.1	-66.4	171.9	0	0	0	114.6	I15 I35 S158	I15-L161 HydrophobicContact CD1-CD2 3.72Å; I35-L161 HydrophobicContact CB-CD1 4.24Å; I35-L161 HydrophobicContact CG2-CD1 3.87Å; S158-L161 PolarHBondContact O-N 3.26Å
162	S	60	Low	49.9	Very low	46 Å²	46	64 Å²	64	32%	0.322	39%	0.386	S	S	.	.			trans	-72.8	132.9	175.2	72.3	0	0	0	0	105.9	D160 R232	D160-S162 PolarHBondContact O-N 2.71Å; D160-S162 PolarHBondContact OD2-OG 2.95Å; S162-R232 WeakPolarHBondContact O-CD 3.44Å; S162-R232 PolarHBondContact O-NE 3.13Å; S162-R232 VanDerWaalsContact O-NE 3.15Å; S162-R232 PolarHBondContact O-NH1 3.36Å; S162-R232 VanDerWaalsContact OG-CZ 3.28Å; S162-R232 PolarHBondContact OG-NH1 2.82Å; S162-R232 VanDerWaalsContact OG-NH1 3.16Å; S162-R232 PolarHBondContact OG-NH2 2.95Å; S162-R232 VanDerWaalsContact OG-NH2 3.1Å
163	W	65	Low	50.1	Low	21 Å²	21	66.2 Å²	66.2	8%	0.08	40%	0.402	C	S	.	.			trans	-121.2	144.9	175.3	-85.5	48.3	0	0	0	109.2	T165 V202 P203 T207 L225 S227 R232	W163-T165 PolarHBondContact O-N 3.15Å; W163-V202 HydrophobicContact CD2-CB 4.46Å; W163-V202 HydrophobicContact CD2-CG1 4.01Å; W163-V202 HydrophobicContact CD2-CG2 4.32Å; W163-V202 HydrophobicContact CE3-CG1 3.76Å; W163-V202 HydrophobicContact CH2-CG1 3.65Å; W163-V202 HydrophobicContact CZ2-CG1 3.92Å; W163-V202 HydrophobicContact CZ2-CG2 4.17Å; W163-V202 HydrophobicContact CZ3-CG1 3.55Å; W163-P203 VanDerWaalsContact CB-CD 3.4Å; W163-P203 HydrophobicContact CB-CG 4.03Å; W163-P203 HydrophobicContact CE3-CG 4.31Å; W163-T207 HydrophobicContact CH2-CG2 4.2Å; W163-T207 HydrophobicContact CZ3-CG2 3.78Å; W163-L225 HydrophobicContact CH2-CB 3.79Å; W163-L225 WeakPolarHBondContact CH2-O 3.35Å; W163-L225 HydrophobicContact CZ2-CB 4.37Å; W163-S227 VanDerWaalsContact CH2-N 3.35Å; W163-R232 VanDerWaalsContact CA-NH1 3.33Å
164	P	60.4	Low	50.4	Low	40 Å²	40	61.2 Å²	61.2	26%	0.26	38%	0.378	S	S	.	.			trans	-61.5	134.5	172.6	27.2	-32.9	0	0	0	109
165	T	58.8	Low	50.6	Low	93 Å²	93	60.5 Å²	60.5	57%	0.571	39%	0.389	S	S	*	.			trans	-95.7	121.2	173.1	-55.7	0	0	0	0	108.6	W163 Q167	W163-T165 PolarHBondContact O-N 3.15Å; T165-Q167 VanDerWaalsContact C-N 3.32Å; T165-Q167 HydrophobicContact CG2-CG 3.85Å; T165-Q167 PolarHBondContact O-N 3.01Å
166	S	56.9	Low	50.5	Low	13 Å²	13	61.9 Å²	61.9	9%	0.091	41%	0.406	C	S	.	.			trans	-73.5	85.8	172.4	47.7	0	0	0	0	109.9	R205	S166-R205 PolarHBondContact O-NH1 2.97Å; S166-R205 VanDerWaalsContact OG-CD 3.26Å; S166-R205 WeakPolarHBondContact OG-CD 3.42Å; S166-R205 WeakPolarHBondContact OG-CG 2.98Å
167	Q	56.7	Low	50.5	Low	141 Å²	141	65.9 Å²	65.9	66%	0.659	42%	0.418	S	S	*	.			trans	-88.5	119.6	171.4	-65.1	-165.4	-7.4	0	0	109.8	T165 G169	T165-Q167 VanDerWaalsContact C-N 3.32Å; T165-Q167 HydrophobicContact CG2-CG 3.85Å; T165-Q167 PolarHBondContact O-N 3.01Å; Q167-G169 PolarHBondContact O-N 3.39Å
168	L	57	Low	50	Low	12 Å²	12	71.2 Å²	71.2	6%	0.063	44%	0.444	C	S	.	.	G	3₁₀ helix	trans	-66.3	-13.1	175.6	-152.8	74.1	0	0	0	112.6	N170 L171 Y262 E265 L266 L269	L168-N170 PolarHBondContact O-N 2.89Å; L168-L171 HydrophobicContact CD1-CD1 3.31Å; L168-L171 HydrophobicContact CD1-CG 4.28Å; L168-L171 HydrophobicContact CG-CD1 3.76Å; L168-L171 HydrophobicContact CG-CG 4.41Å; L168-L171 WeakPolarHBondContact O-CB 3.38Å; L168-L171 PolarHBondContact O-N 3.44Å; L168-Y262 HydrophobicContact CD1-CE2 3.63Å; L168-E265 HydrophobicContact CD2-CB 3.96Å; L168-E265 VanDerWaalsContact CD2-CD 3.41Å; L168-E265 HydrophobicContact CD2-CG 3.43Å; L168-E265 VanDerWaalsContact CD2-CG 3.43Å; L168-E265 WeakPolarHBondContact CD2-OE1 3.42Å; L168-L266 HydrophobicContact CD1-CD1 4.19Å; L168-L269 HydrophobicContact CD1-CD1 4.39Å; L168-L269 HydrophobicContact CD2-CD1 3.34Å; L168-L269 HydrophobicContact CD2-CG 4.28Å; L168-L269 HydrophobicContact CG-CD1 3.55Å
169	G	46.9	Very low	49.4	Very low	73 Å²	73	75.4 Å²	75.4	75%	0.753	47%	0.473	S	S	*	.	G	3₁₀ helix	trans	-59.8	-12.3	-175.3	0	0	0	0	0	115.9	Q167	Q167-G169 PolarHBondContact O-N 3.39Å
170	N	45.4	Very low	48.9	Very low	150 Å²	150	77.7 Å²	77.7	80%	0.802	48%	0.481	S	S	*	.	G	3₁₀ helix	trans	-88	-7.3	173	-73.3	-5.5	0	0	0	113.8	L168 V172	L168-N170 PolarHBondContact O-N 2.89Å; N170-V172 PolarHBondContact O-N 3.2Å
171	L	49.3	Very low	47.8	Very low	21 Å²	21	76.9 Å²	76.9	11%	0.11	50%	0.496	C	S	.	.			trans	-82.1	99.2	176.2	-65.1	-177.3	0	0	0	110.1	L168 L266 L269 K353	L168-L171 HydrophobicContact CD1-CD1 3.31Å; L168-L171 HydrophobicContact CD1-CG 4.28Å; L168-L171 HydrophobicContact CG-CD1 3.76Å; L168-L171 HydrophobicContact CG-CG 4.41Å; L168-L171 WeakPolarHBondContact O-CB 3.38Å; L168-L171 PolarHBondContact O-N 3.44Å; L171-L266 HydrophobicContact CD1-CD1 3.97Å; L171-L269 HydrophobicContact CB-CD1 3.73Å; L171-L269 HydrophobicContact CD1-CD1 3.93Å; L171-L269 HydrophobicContact CG-CD1 4.45Å; L171-K353 HydrophobicContact CD2-CB 3.81Å
172	V	40.8	Very low	46.3	Very low	98 Å²	98	85.1 Å²	85.1	59%	0.594	53%	0.531	S	S	*	.	P	Polyproline II helix	trans	-63.6	134.8	172.1	-166.2	0	0	0	0	109.2	N170 F174	N170-V172 PolarHBondContact O-N 3.2Å; V172-F174 PolarHBondContact O-N 3.47Å
173	P	45.3	Very low	44.7	Very low	82 Å²	82	90.5 Å²	90.5	53%	0.532	56%	0.556	S	S	.	*	P	Polyproline II helix	trans	-53.2	137.4	178.4	-25.6	33.1	0	0	0	112.2	G175	P173-G175 PolarHBondContact O-N 3.01Å; P173-G175 VanDerWaalsContact O-N 3.13Å
174	F	43.5	Very low	43	Very low	72 Å²	72	96 Å²	96	32%	0.316	59%	0.592	S	S	.	*	T	Hydrogen-bonded Turn	trans	-62.3	117.4	177.3	-77.6	-113.1	0	0	0	110	V172 L269 L270 P271 K353	V172-F174 PolarHBondContact O-N 3.47Å; F174-L269 WeakPolarHBondContact CD2-O 3.37Å; F174-L269 WeakPolarHBondContact CE2-O 3.31Å; F174-L270 HydrophobicContact CE2-CD2 4.1Å; F174-L270 HydrophobicContact CZ-CD2 4.02Å; F174-P271 HydrophobicContact CD1-CG 3.26Å; F174-P271 HydrophobicContact CE1-CG 3.33Å; F174-P271 HydrophobicContact CG-CG 3.88Å; F174-P271 HydrophobicContact CZ-CG 4Å; F174-K353 HydrophobicContact CD1-CD 4.37Å; F174-K353 HydrophobicContact CD2-CD 4.16Å; F174-K353 HydrophobicContact CE1-CD 3.8Å; F174-K353 HydrophobicContact CE1-CG 4.2Å; F174-K353 HydrophobicContact CE2-CD 3.6Å; F174-K353 HydrophobicContact CE2-CG 4.04Å; F174-K353 VanDerWaalsContact CG-NZ 3.29Å; F174-K353 HydrophobicContact CZ-CD 3.39Å; F174-K353 HydrophobicContact CZ-CG 3.56Å
175	G	42.2	Very low	41.4	Very low	77 Å²	77	98.9 Å²	98.9	79%	0.794	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	110.1	1.5	174.1	0	0	0	0	0	116.7	P173 N177	P173-G175 PolarHBondContact O-N 3.01Å; P173-G175 VanDerWaalsContact O-N 3.13Å; G175-N177 PolarHBondContact O-N 3.47Å
176	A	41	Very low	39.8	Very low	66 Å²	66	100.2 Å²	100.2	55%	0.545	62%	0.622	S	S	.	*			trans	-78.4	109.9	170	0	0	0	0	0	110.4	D178	A176-D178 PolarHBondContact O-N 3.35Å
177	N	37.4	Very low	38.4	Very low	155 Å²	155	104.8 Å²	104.8	83%	0.829	65%	0.649	S	S	*	*			trans	-63.2	117.3	167.7	-82.5	-15.2	0	0	0	109.2	G175 S179	G175-N177 PolarHBondContact O-N 3.47Å; N177-S179 PolarHBondContact O-N 3.08Å
178	D	35.7	Very low	37.1	Very low	143 Å²	143	102.5 Å²	102.5	77%	0.765	65%	0.649	S	S	*	*			trans	-76.4	89.9	174.5	-163.7	9.9	0	0	0	109.8	A176	A176-D178 PolarHBondContact O-N 3.35Å
179	S	36	Very low	35.6	Very low	111 Å²	111	105.3 Å²	105.3	78%	0.776	68%	0.681	S	S	*	*			trans	-105.8	13.2	173	59.6	0	0	0	0	113	N177	N177-S179 PolarHBondContact O-N 3.08Å
180	T	34.6	Very low	34.6	Very low	109 Å²	109	107.5 Å²	107.5	67%	0.669	67%	0.674	S	S	*	*			trans	-129.9	80.6	174	53.7	0	0	0	0	110.4	K182	T180-K182 VanDerWaalsContact C-N 3.3Å; T180-K182 PolarHBondContact O-N 2.81Å
181	G	28.6	Very low	33.7	Very low	79 Å²	79	108.6 Å²	108.6	81%	0.814	67%	0.674	S	S	*	*			trans	-56.4	91.2	166.8	0	0	0	0	0	111.2
182	K	31.2	Very low	32.7	Very low	185 Å²	185	115.2 Å²	115.2	80%	0.804	70%	0.704	S	S	*	*			trans	-112.2	105.5	157.5	-85	-175.7	175.7	176.7	0	106.8	T180 V184	T180-K182 VanDerWaalsContact C-N 3.3Å; T180-K182 PolarHBondContact O-N 2.81Å; K182-V184 PolarHBondContact O-N 3.23Å
183	N	25.9	Very low	31.9	Very low	160 Å²	160	116.5 Å²	116.5	86%	0.856	72%	0.715	S	S	*	*			trans	-30.3	100.9	167.9	-69.8	-25.7	0	0	0	112.3
184	V	29.4	Very low	31.1	Very low	137 Å²	137	115.6 Å²	115.6	83%	0.83	72%	0.721	S	S	*	*			trans	-94.3	90.8	152.8	-177.1	0	0	0	0	104.5	K182 S186	K182-V184 PolarHBondContact O-N 3.23Å; V184-S186 PolarHBondContact O-N 3.24Å; V184-S186 VanDerWaalsContact O-N 3.1Å
185	T	26.4	Very low	30.5	Very low	100 Å²	100	123.8 Å²	123.8	61%	0.613	75%	0.749	S	S	*	*			trans	-46.8	120.2	164.5	35.4	0	0	0	0	108.1	T187	T185-T187 PolarHBondContact O-N 3.28Å
186	S	26.4	Very low	30.3	Very low	120 Å²	120	126.5 Å²	126.5	84%	0.839	76%	0.756	S	S	*	*			trans	-46.4	87.1	155.7	20	0	0	0	0	108.3	V184 S188	V184-S186 PolarHBondContact O-N 3.24Å; V184-S186 VanDerWaalsContact O-N 3.1Å; S186-S188 PolarHBondContact O-N 2.86Å
187	T	26.5	Very low	30.5	Very low	109 Å²	109	126.6 Å²	126.6	67%	0.669	76%	0.764	S	S	*	*			trans	-77.8	87.2	164.8	28.9	0	0	0	0	104.3	T185 G189	T185-T187 PolarHBondContact O-N 3.28Å; T187-G189 PolarHBondContact O-N 2.57Å
188	S	28.6	Very low	31.4	Very low	94 Å²	94	121.8 Å²	121.8	66%	0.657	75%	0.751	S	S	*	*			trans	-17.4	124.8	141.8	50.2	0	0	0	0	109.8	S186 I190	S186-S188 PolarHBondContact O-N 2.86Å; S188-I190 PolarHBondContact O-N 2.58Å
189	G	25.8	Very low	33	Very low	71 Å²	71	118.2 Å²	118.2	73%	0.732	74%	0.736	S	S	*	*			trans	-39.7	109.1	174	0	0	0	0	0	109.3	T187 E191	T187-G189 PolarHBondContact O-N 2.57Å; G189-E191 PolarHBondContact O-N 3.02Å
190	I	26.1	Very low	35	Very low	118 Å²	118	113.2 Å²	113.2	61%	0.605	70%	0.701	S	S	*	*			trans	-66.7	93	161.5	-64.1	176.2	0	0	0	102.3	S188 H192	S188-I190 PolarHBondContact O-N 2.58Å; I190-H192 PolarHBondContact O-N 3.22Å
191	E	26.4	Very low	37.5	Very low	173 Å²	173	111.3 Å²	111.3	81%	0.808	69%	0.689	S	S	*	*			trans	-44.5	101.2	147.4	-67.7	-177.8	161.7	0	0	104.7	G189 P193	G189-E191 PolarHBondContact O-N 3.02Å; E191-P193 WeakPolarHBondContact O-CD 3.44Å
192	H	28.2	Very low	40.4	Very low	161 Å²	161	107.6 Å²	107.6	75%	0.745	65%	0.651	S	S	*	*			trans	-74.8	101.4	163.1	-86.6	-53	0	0	0	105.1	I190 G194	I190-H192 PolarHBondContact O-N 3.22Å; H192-G194 PolarHBondContact O-N 2.85Å; H192-G194 VanDerWaalsContact O-N 3.1Å
193	P	25.5	Very low	43.2	Very low	124 Å²	124	99.6 Å²	99.6	81%	0.805	62%	0.618	S	S	*	*			trans	-79.6	100.9	172.5	13.1	9.3	0	0	0	104.6	E191	E191-P193 WeakPolarHBondContact O-CD 3.44Å
194	G	27.3	Very low	46.5	Very low	64 Å²	64	92 Å²	92	66%	0.66	58%	0.577	S	S	*	*			trans	112.7	90.3	165	0	0	0	0	0	116.7	H192	H192-G194 PolarHBondContact O-N 2.85Å; H192-G194 VanDerWaalsContact O-N 3.1Å
195	R	31.6	Very low	49.5	Very low	243 Å²	243	88.9 Å²	88.9	92%	0.917	55%	0.551	S	S	*	*				-130.5	88.5	125.5	-104.6	-174.6	172.5	-171.3	-1.5	107.3	G197	R195-G197 PolarHBondContact O-N 3.4Å
196	S	38.4	Very low	52.7	Low	134 Å²	134	84.2 Å²	84.2	94%	0.937	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.4	54.3	-178.1	60.9	0	0	0	0	112.8
197	G	45.3	Very low	55.9	Low	69 Å²	69	78.5 Å²	78.5	71%	0.711	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	179.9	9.2	-179.7	0	0	0	0	0	117.3	R195	R195-G197 PolarHBondContact O-N 3.4Å
198	G	56	Low	59.1	Low	54 Å²	54	73.7 Å²	73.7	56%	0.557	45%	0.452	S	S	*	.	S	Bend	trans	-85.1	156.5	168.4	0	0	0	0	0	111.1
199	P	68.1	Low	62.3	Low	68 Å²	68	69.5 Å²	69.5	44%	0.442	42%	0.422	S	S	.	.	P	Polyproline II helix	trans	-60.6	141.1	170	27.8	-34	0	0	0	110	V34 I35 E36	V34-P199 HydrophobicContact CG1-CB 3.62Å; V34-P199 HydrophobicContact CG1-CG 4.11Å; I35-P199 CarbonylContact O-C 3.57Å; I35-P199 VanDerWaalsContact O-CA 3.31Å; I35-P199 WeakPolarHBondContact O-CA 3.48Å; E36-P199 HydrophobicContact CG-CB 3.76Å
200	G	79.1	Confident	65.4	Low	5 Å²	5	66.1 Å²	66.1	5%	0.052	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	141.8	168.1	0	0	0	0	0	110.1	V34 I35	V34-G200 CarbonylContact C-O 3.58Å; V34-G200 WeakPolarHBondContact CA-O 3.43Å; I35-G200 PolarHBondContact N-O 3.1Å; I35-G200 PolarHBondContact O-N 3.1Å
201	V	86	Confident	68.4	Low	70 Å²	70	61.7 Å²	61.7	42%	0.424	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	113.6	-179.9	-177.1	0	0	0	0	108.5	A32 P203	A32-V201 HydrophobicContact CB-CG1 3.68Å; V201-P203 WeakPolarHBondContact O-CD 3.29Å
202	V	89.6	Confident	71	Confident	0 Å²	0	56 Å²	56	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	106.9	174.6	176.9	0	0	0	0	107.9	A32 L33 I35 W163 L225	A32-V202 CarbonylContact C-O 3.6Å; A32-V202 VanDerWaalsContact CA-O 3.23Å; A32-V202 WeakPolarHBondContact CA-O 3.31Å; L33-V202 HydrophobicContact CB-CB 4.22Å; L33-V202 PolarHBondContact N-O 3.16Å; L33-V202 PolarHBondContact O-N 3.36Å; I35-V202 HydrophobicContact CD1-CG2 3.96Å; W163-V202 HydrophobicContact CD2-CB 4.46Å; W163-V202 HydrophobicContact CD2-CG1 4.01Å; W163-V202 HydrophobicContact CD2-CG2 4.32Å; W163-V202 HydrophobicContact CE3-CG1 3.76Å; W163-V202 HydrophobicContact CH2-CG1 3.65Å; W163-V202 HydrophobicContact CZ2-CG1 3.92Å; W163-V202 HydrophobicContact CZ2-CG2 4.17Å; W163-V202 HydrophobicContact CZ3-CG1 3.55Å; V202-L225 HydrophobicContact CG1-CB 4.48Å; V202-L225 HydrophobicContact CG1-CD1 4.29Å
203	P	91.1	Very high	73.5	Confident	18 Å²	18	48.9 Å²	48.9	12%	0.117	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.4	143.5	173.7	27.6	-32.7	0	0	0	109.3	W163 V201 T207	W163-P203 VanDerWaalsContact CB-CD 3.4Å; W163-P203 HydrophobicContact CB-CG 4.03Å; W163-P203 HydrophobicContact CE3-CG 4.31Å; V201-P203 WeakPolarHBondContact O-CD 3.29Å; P203-T207 WeakPolarHBondContact O-CB 3.25Å; P203-T207 PolarHBondContact O-OG1 3.2Å
204	L	93.5	Very high	75.7	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	28%	0.276	C	S	.	.			trans	-92.2	-22.2	179.4	-64.1	-178.8	0	0	0	112.8	L28 D31 L33 L206 T207 I251 K254 M255 I258	L28-L204 HydrophobicContact CD1-CD1 3.65Å; D31-L204 WeakPolarHBondContact O-CB 3.46Å; D31-L204 PolarHBondContact O-N 2.67Å; L33-L204 HydrophobicContact CB-CD2 4.33Å; L204-L206 PolarHBondContact O-N 2.62Å; L204-T207 PolarHBondContact O-N 3.15Å; L204-I251 HydrophobicContact CD2-CG2 3.86Å; L204-K254 HydrophobicContact CD1-CB 4.06Å; L204-M255 HydrophobicContact CB-CG 3.93Å; L204-M255 HydrophobicContact CD2-CG 4.29Å; L204-I258 HydrophobicContact CB-CD1 3.55Å; L204-I258 HydrophobicContact CD1-CD1 3.95Å; L204-I258 HydrophobicContact CG-CD1 4.37Å
205	R	93.1	Very high	77.6	Confident	72 Å²	72	42.9 Å²	42.9	27%	0.272	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	120.5	178.3	176.9	-176.5	-70.1	179.1	-6.1	110.6	S166 T207 I258 Y262	S166-R205 PolarHBondContact O-NH1 2.97Å; S166-R205 VanDerWaalsContact OG-CD 3.26Å; S166-R205 WeakPolarHBondContact OG-CD 3.42Å; S166-R205 WeakPolarHBondContact OG-CG 2.98Å; R205-T207 PolarHBondContact O-N 2.85Å; R205-T207 VanDerWaalsContact O-N 3.08Å; R205-I258 HydrophobicContact CB-CG2 3.75Å; R205-I258 HydrophobicContact CG-CG2 4.3Å; R205-Y262 HydrophobicContact CG-CD2 4.11Å; R205-Y262 HydrophobicContact CG-CG 4.36Å
206	L	93.3	Very high	79.4	Confident	1 Å²	1	36 Å²	36	1%	0.005	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.2	17	180	-53.4	177.3	0	0	0	114.8	L204 S228 N259 Y262 L279 W281 F335 A349	L204-L206 PolarHBondContact O-N 2.62Å; L206-S228 WeakPolarHBondContact O-CA 3.03Å; L206-S228 WeakPolarHBondContact O-CB 3.44Å; L206-N259 PolarHBondContact N-OD1 3.47Å; L206-Y262 HydrophobicContact CD1-CD1 4.38Å; L206-Y262 HydrophobicContact CD1-CE1 3.76Å; L206-Y262 HydrophobicContact CD1-CE2 4.31Å; L206-Y262 HydrophobicContact CD2-CD1 3.93Å; L206-Y262 HydrophobicContact CD2-CE1 3.94Å; L206-Y262 HydrophobicContact CG-CD1 4.34Å; L206-Y262 HydrophobicContact CG-CE1 4.2Å; L206-L279 HydrophobicContact CD2-CD1 3.75Å; L206-W281 PolarHBondContact O-NE1 3.38Å; L206-F335 HydrophobicContact CD2-CE2 3.91Å; L206-F335 HydrophobicContact CD2-CZ 3.83Å; L206-A349 HydrophobicContact CB-CB 4.11Å; L206-A349 HydrophobicContact CD1-CB 4.19Å
207	T	93.6	Very high	81.2	Confident	1 Å²	1	30.9 Å²	30.9	1%	0.006	20%	0.201	C	C	.	.	P	Polyproline II helix	trans	-71.9	149.5	171	-75.5	0	0	0	0	109.1	W163 P203 L204 R205 L225 H226 M255	W163-T207 HydrophobicContact CH2-CG2 4.2Å; W163-T207 HydrophobicContact CZ3-CG2 3.78Å; P203-T207 WeakPolarHBondContact O-CB 3.25Å; P203-T207 PolarHBondContact O-OG1 3.2Å; L204-T207 PolarHBondContact O-N 3.15Å; R205-T207 PolarHBondContact O-N 2.85Å; R205-T207 VanDerWaalsContact O-N 3.08Å; T207-L225 HydrophobicContact CG2-CB 4.15Å; T207-L225 HydrophobicContact CG2-CD2 3.53Å; T207-L225 HydrophobicContact CG2-CG 4.47Å; T207-H226 WeakPolarHBondContact CA-O 3.24Å; T207-H226 WeakPolarHBondContact CG2-O 3.31Å; T207-M255 WeakPolarHBondContact O-CE 3.34Å
208	H	94.2	Very high	82.6	Confident	8 Å²	8	34.6 Å²	34.6	4%	0.037	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	116.8	174.7	-178.7	-150.5	0	0	0	109.3	L225 H226 W281	H208-L225 CarbonylContact O-C 3.23Å; H208-L225 VanDerWaalsContact O-CA 3.3Å; H208-L225 WeakPolarHBondContact O-CA 3.39Å; H208-H226 HydrophobicContact CB-CB 4.15Å; H208-H226 PolarHBondContact N-O 2.81Å; H208-H226 PolarHBondContact O-N 3.07Å; H208-W281 HydrophobicContact CB-CB 4.1Å; H208-W281 HydrophobicContact CB-CD2 3.74Å; H208-W281 HydrophobicContact CB-CE3 4.45Å; H208-W281 HydrophobicContact CB-CG 3.55Å; H208-W281 WeakPolarHBondContact CD2-CB 3.32Å; H208-W281 AromaticContact CD2-CG 3.78Å; H208-W281 AromaticContact CG-CD2 3.97Å; H208-W281 AromaticContact CG-CG 3.72Å
209	L	95	Very high	83.7	Confident	6 Å²	6	36.3 Å²	36.3	3%	0.031	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	123.5	175.2	174	71.7	0	0	0	109.5	F223 E224 L225 F248 I251 H252 M255	L209-F223 HydrophobicContact CD1-CD2 4.06Å; L209-E224 WeakPolarHBondContact CA-O 3.45Å; L209-L225 HydrophobicContact CB-CD2 4.02Å; L209-L225 HydrophobicContact CD1-CD2 3.69Å; L209-L225 HydrophobicContact CD1-CG 4.04Å; L209-L225 HydrophobicContact CG-CD2 4.42Å; L209-F248 HydrophobicContact CD1-CD2 3.92Å; L209-F248 HydrophobicContact CD1-CE2 3.99Å; L209-F248 HydrophobicContact CD2-CD1 4.37Å; L209-F248 HydrophobicContact CD2-CD2 3.86Å; L209-F248 HydrophobicContact CD2-CE1 4.3Å; L209-F248 HydrophobicContact CD2-CE2 3.8Å; L209-F248 HydrophobicContact CD2-CG 4.15Å; L209-F248 HydrophobicContact CD2-CZ 4.02Å; L209-F248 WeakPolarHBondContact CD2-O 2.94Å; L209-F248 HydrophobicContact CG-CD2 3.82Å; L209-F248 HydrophobicContact CG-CE2 3.5Å; L209-F248 VanDerWaalsContact CG-CE2 3.5Å; L209-F248 HydrophobicContact CG-CZ 4.02Å; L209-I251 HydrophobicContact CD1-CG2 4.43Å; L209-I251 HydrophobicContact CD2-CB 4.03Å; L209-I251 HydrophobicContact CD2-CG2 3.93Å; L209-H252 HydrophobicContact CD2-CB 3.78Å; L209-M255 HydrophobicContact CB-CE 3.88Å; L209-M255 HydrophobicContact CB-SD 3.71Å; L209-M255 HydrophobicContact CD2-SD 4.3Å
210	V	92.1	Very high	84.6	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	161.3	-175.8	70.8	0	0	0	0	112	L213 E224 V283 M398	V210-L213 HydrophobicContact CB-CB 4.32Å; V210-L213 HydrophobicContact CB-CD2 4.44Å; V210-L213 HydrophobicContact CG1-CB 3.7Å; V210-L213 HydrophobicContact CG1-CD2 3.81Å; V210-L213 HydrophobicContact CG1-CG 4.4Å; V210-L213 HydrophobicContact CG2-CB 3.66Å; V210-L213 HydrophobicContact CG2-CD2 4.13Å; V210-L213 HydrophobicContact CG2-CG 4.41Å; V210-E224 HydrophobicContact CG1-CB 3.85Å; V210-E224 PolarHBondContact N-O 3.41Å; V210-E224 PolarHBondContact O-N 2.85Å; V210-V283 HydrophobicContact CG2-CG2 4.35Å; V210-M398 HydrophobicContact CG2-SD 4.04Å
211	R	88.6	Confident	85.2	Confident	24 Å²	24	35.3 Å²	35.3	9%	0.091	21%	0.209	C	C	.	.	S	Bend	trans	-122	148.7	169.6	-65.6	-173.4	-69.9	-129.8	-6.8	109.2	L213 F223 F248 D397	R211-L213 PolarHBondContact O-N 2.73Å; R211-F223 HydrophobicContact CG-CB 4.11Å; R211-F248 HydrophobicContact CG-CD2 3.66Å; R211-F248 HydrophobicContact CG-CE2 3.62Å; R211-D397 IonicContact CZ-OD1 3.15Å; R211-D397 IonicContact CZ-OD2 2.69Å; R211-D397 IonicContact NE-OD1 3.8Å; R211-D397 PolarHBondContact NE-OD1 2.72Å; R211-D397 IonicContact NH2-OD1 2.77Å; R211-D397 PolarHBondContact NH2-OD1 3.31Å; R211-D397 IonicContact NH2-OD2 3.4Å; R211-D397 PolarHBondContact NH2-OD2 3.47Å
212	D	82.2	Confident	85.5	Confident	54 Å²	54	32.7 Å²	32.7	29%	0.289	19%	0.193	S	C	.	.	S	Bend	trans	60.6	16.8	168.8	-155.5	44.6	0	0	0	114.7	L215 P216 D217 P395 G396	D212-L215 WeakPolarHBondContact CA-O 3.31Å; D212-P216 WeakPolarHBondContact OD1-CA 3.13Å; D212-D217 PolarHBondContact OD1-N 3.34Å; D212-P395 HydrophobicContact CB-CB 4.36Å; D212-G396 VanDerWaalsContact OD2-CA 3.24Å; D212-G396 WeakPolarHBondContact OD2-CA 3.5Å; D212-G396 PolarHBondContact OD2-N 3.24Å
213	L	80.3	Confident	85.6	Confident	12 Å²	12	32.8 Å²	32.8	6%	0.063	19%	0.194	C	C	.	.	S	Bend	trans	-85.5	-58.4	-176.5	-179.9	68.7	0	0	0	111.3	V150 V210 R211 V283 W331 P395	V150-L213 WeakPolarHBondContact CG2-O 3.25Å; V210-L213 HydrophobicContact CB-CB 4.32Å; V210-L213 HydrophobicContact CB-CD2 4.44Å; V210-L213 HydrophobicContact CG1-CB 3.7Å; V210-L213 HydrophobicContact CG1-CD2 3.81Å; V210-L213 HydrophobicContact CG1-CG 4.4Å; V210-L213 HydrophobicContact CG2-CB 3.66Å; V210-L213 HydrophobicContact CG2-CD2 4.13Å; V210-L213 HydrophobicContact CG2-CG 4.41Å; R211-L213 PolarHBondContact O-N 2.73Å; L213-V283 HydrophobicContact CD1-CG1 3.69Å; L213-V283 HydrophobicContact CD1-CG2 4.38Å; L213-V283 HydrophobicContact CD2-CG2 4.47Å; L213-W331 HydrophobicContact CD1-CB 4.24Å; L213-P395 HydrophobicContact CD1-CG 3.77Å
214	T	71.4	Confident	85.6	Confident	32 Å²	32	32.1 Å²	32.1	20%	0.196	19%	0.189	C	C	.	.	S	Bend	trans	-83.7	-37.6	-177.5	-52.8	0	0	0	0	110.4	I155 E224	I155-T214 HydrophobicContact CD1-CG2 4.42Å; T214-E224 WeakPolarHBondContact CB-OE1 3.22Å; T214-E224 WeakPolarHBondContact CB-OE2 3.35Å; T214-E224 PolarHBondContact N-OE1 2.9Å; T214-E224 PolarHBondContact N-OE2 3.01Å; T214-E224 PolarHBondContact OG1-OE2 2.68Å
215	L	66.8	Low	85.5	Confident	29 Å²	29	32.1 Å²	32.1	15%	0.152	19%	0.189	C	C	.	.	S	Bend	trans	-132.4	133.5	-178.1	-67.9	178.2	0	0	0	111.8	T143 D212 D217 E224 L235	T143-L215 HydrophobicContact CG2-CD1 3.83Å; T143-L215 HydrophobicContact CG2-CD2 3.76Å; T143-L215 HydrophobicContact CG2-CG 4.44Å; D212-L215 WeakPolarHBondContact CA-O 3.31Å; L215-D217 PolarHBondContact O-N 2.86Å; L215-E224 PolarHBondContact N-OE1 2.81Å; L215-L235 HydrophobicContact CD1-CD2 3.66Å
216	P	68.8	Low	85.4	Confident	99 Å²	99	28.9 Å²	28.9	64%	0.643	18%	0.177	S	C	*	.			trans	-57	122.2	171.5	-26.6	35.4	0	0	0	112.2	D212	D212-P216 WeakPolarHBondContact OD1-CA 3.13Å
217	D	78	Confident	85	Confident	27 Å²	27	28.8 Å²	28.8	14%	0.144	18%	0.177	C	C	.	.			trans	-106.9	82	176.5	179.5	20.6	0	0	0	111.2	D212 L215 T219 G220 C221 C222	D212-D217 PolarHBondContact OD1-N 3.34Å; L215-D217 PolarHBondContact O-N 2.86Å; D217-T219 PolarHBondContact O-N 3.14Å; D217-T219 PolarHBondContact OD1-N 3.42Å; D217-T219 VanDerWaalsContact OD1-N 3.1Å; D217-T219 PolarHBondContact OD1-OG1 3.13Å; D217-G220 VanDerWaalsContact CG-N 3.25Å; D217-G220 PolarHBondContact O-N 2.83Å; D217-G220 PolarHBondContact OD1-N 3.25Å; D217-G220 WeakPolarHBondContact OD2-CA 3.12Å; D217-G220 PolarHBondContact OD2-N 3.48Å; D217-C221 PolarHBondContact OD1-N 2.88Å; D217-C221 PolarHBondContact OD2-N 3.19Å; D217-C222 HydrophobicContact CB-CB 4.13Å; D217-C222 WeakPolarHBondContact OD2-CA 3.23Å; D217-C222 PolarHBondContact OD2-N 2.88Å
218	V	73.4	Confident	84.6	Confident	146 Å²	146	29 Å²	29	89%	0.885	18%	0.178	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-22.4	177.5	-172.4	0	0	0	0	111.9
219	T	80.2	Confident	83.8	Confident	91 Å²	91	30.5 Å²	30.5	56%	0.558	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88	-19.8	-177.5	52	0	0	0	0	113.7	D217 C221	D217-T219 PolarHBondContact O-N 3.14Å; D217-T219 PolarHBondContact OD1-N 3.42Å; D217-T219 VanDerWaalsContact OD1-N 3.1Å; D217-T219 PolarHBondContact OD1-OG1 3.13Å; T219-C221 PolarHBondContact O-N 3.12Å
220	G	86.2	Confident	83	Confident	34 Å²	34	30.9 Å²	30.9	35%	0.351	19%	0.192	S	C	.	.	S	Bend	trans	67.1	15.4	-171.2	0	0	0	0	0	113.6	D217 A241 A244	D217-G220 VanDerWaalsContact CG-N 3.25Å; D217-G220 PolarHBondContact O-N 2.83Å; D217-G220 PolarHBondContact OD1-N 3.25Å; D217-G220 WeakPolarHBondContact OD2-CA 3.12Å; D217-G220 PolarHBondContact OD2-N 3.48Å; G220-A241 WeakPolarHBondContact O-CA 3.45Å; G220-A241 WeakPolarHBondContact O-CB 3.5Å; G220-A244 WeakPolarHBondContact O-CB 3.32Å
221	C	92.3	Very high	82.1	Confident	17 Å²	17	39.4 Å²	39.4	12%	0.115	22%	0.224	C	C	.	.			trans	-96.7	-8.4	-175.5	-63.1	0	0	0	0	113.4	D217 T219 R237 A238 D240 A241 A244	D217-C221 PolarHBondContact OD1-N 2.88Å; D217-C221 PolarHBondContact OD2-N 3.19Å; T219-C221 PolarHBondContact O-N 3.12Å; C221-R237 HydrophobicContact CB-CG 4.1Å; C221-R237 CarbonylContact O-C 3.56Å; C221-R237 WeakPolarHBondContact O-CA 3.48Å; C221-A238 PolarHBondContact O-N 3.19Å; C221-D240 VanDerWaalsContact SG-C 3.51Å; C221-A241 PolarHBondContact SG-N 3.37Å; C221-A241 VanDerWaalsContact SG-N 3.45Å; C221-A244 WeakPolarHBondContact O-CB 3.39Å
222	C	90.7	Very high	81.5	Confident	16 Å²	16	41.7 Å²	41.7	11%	0.108	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	149.5	-169.7	-56.4	0	0	0	0	112.6	D217 L235 L236	D217-C222 HydrophobicContact CB-CB 4.13Å; D217-C222 WeakPolarHBondContact OD2-CA 3.23Å; D217-C222 PolarHBondContact OD2-N 2.88Å; C222-L235 HydrophobicContact CB-CD1 4.16Å; C222-L236 CarbonylContact C-O 3.52Å; C222-L236 WeakPolarHBondContact CA-O 3.31Å
223	F	92.6	Very high	81.6	Confident	1 Å²	1	39.4 Å²	39.4	0%	0.004	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	155.1	170.5	55.1	-83.7	0	0	0	110.2	L13 L209 R211 L236 W247 F248 I251	L13-F223 HydrophobicContact CD1-CZ 3.77Å; L209-F223 HydrophobicContact CD1-CD2 4.06Å; R211-F223 HydrophobicContact CG-CB 4.11Å; F223-L236 HydrophobicContact CD1-CB 4.46Å; F223-L236 HydrophobicContact CD2-CB 4.05Å; F223-L236 HydrophobicContact CD2-CD1 4.21Å; F223-L236 HydrophobicContact CE1-CB 4.09Å; F223-L236 HydrophobicContact CE2-CB 3.67Å; F223-L236 HydrophobicContact CE2-CD1 3.44Å; F223-L236 VanDerWaalsContact CE2-CD1 3.44Å; F223-L236 HydrophobicContact CE2-CG 4.14Å; F223-L236 HydrophobicContact CG-CB 4.44Å; F223-L236 HydrophobicContact CZ-CB 3.69Å; F223-L236 HydrophobicContact CZ-CD1 3.95Å; F223-L236 HydrophobicContact CZ-CG 4.47Å; F223-L236 PolarHBondContact N-O 3.31Å; F223-L236 PolarHBondContact O-N 3.02Å; F223-W247 HydrophobicContact CE1-CB 3.88Å; F223-W247 HydrophobicContact CZ-CB 3.72Å; F223-W247 HydrophobicContact CZ-CG 4.25Å; F223-F248 HydrophobicContact CB-CD2 4.02Å; F223-I251 HydrophobicContact CD2-CD1 4.48Å; F223-I251 HydrophobicContact CE2-CD1 3.78Å; F223-I251 HydrophobicContact CZ-CD1 4.46Å
224	E	91.1	Very high	81.8	Confident	5 Å²	5	38.9 Å²	38.9	2%	0.023	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	138.1	-172.8	-61.5	173.9	-146.2	0	0	110.1	L209 V210 T214 L215 H226 C234 L235	L209-E224 WeakPolarHBondContact CA-O 3.45Å; V210-E224 HydrophobicContact CG1-CB 3.85Å; V210-E224 PolarHBondContact N-O 3.41Å; V210-E224 PolarHBondContact O-N 2.85Å; T214-E224 WeakPolarHBondContact CB-OE1 3.22Å; T214-E224 WeakPolarHBondContact CB-OE2 3.35Å; T214-E224 PolarHBondContact N-OE1 2.9Å; T214-E224 PolarHBondContact N-OE2 3.01Å; T214-E224 PolarHBondContact OG1-OE2 2.68Å; L215-E224 PolarHBondContact N-OE1 2.81Å; E224-H226 IonicContact OE2-CE1 3.73Å; E224-H226 PolarHBondContact OE2-CE1 3.04Å; E224-H226 IonicContact OE2-NE2 2.78Å; E224-H226 PolarHBondContact OE2-NE2 2.95Å; E224-C234 WeakPolarHBondContact CA-O 3.07Å; E224-L235 HydrophobicContact CG-CD1 3.49Å; E224-L235 VanDerWaalsContact CG-CD1 3.49Å
225	L	92.2	Very high	82.6	Confident	0 Å²	0	38 Å²	38	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	131.2	169.1	-69.9	154.8	0	0	0	108	L33 W163 V202 T207 H208 L209 S233 C234 L236 I251	L33-L225 HydrophobicContact CD2-CD1 3.6Å; W163-L225 HydrophobicContact CH2-CB 3.79Å; W163-L225 WeakPolarHBondContact CH2-O 3.35Å; W163-L225 HydrophobicContact CZ2-CB 4.37Å; V202-L225 HydrophobicContact CG1-CB 4.48Å; V202-L225 HydrophobicContact CG1-CD1 4.29Å; T207-L225 HydrophobicContact CG2-CB 4.15Å; T207-L225 HydrophobicContact CG2-CD2 3.53Å; T207-L225 HydrophobicContact CG2-CG 4.47Å; H208-L225 CarbonylContact O-C 3.23Å; H208-L225 VanDerWaalsContact O-CA 3.3Å; H208-L225 WeakPolarHBondContact O-CA 3.39Å; L209-L225 HydrophobicContact CB-CD2 4.02Å; L209-L225 HydrophobicContact CD1-CD2 3.69Å; L209-L225 HydrophobicContact CD1-CG 4.04Å; L209-L225 HydrophobicContact CG-CD2 4.42Å; L225-S233 CarbonylContact O-C 3.55Å; L225-S233 WeakPolarHBondContact O-CA 3.12Å; L225-S233 WeakPolarHBondContact O-CB 3.24Å; L225-C234 PolarHBondContact N-O 3.49Å; L225-C234 PolarHBondContact O-N 3.17Å; L225-L236 HydrophobicContact CD1-CD1 3.93Å; L225-I251 HydrophobicContact CD2-CG2 4.19Å
226	H	89.4	Confident	83.8	Confident	3 Å²	3	36.6 Å²	36.6	1%	0.014	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	140.9	174.1	-50.8	-107.3	0	0	0	110.8	I155 T207 H208 E224 R232 S233	I155-H226 VanDerWaalsContact CD1-CE1 3.41Å; I155-H226 WeakPolarHBondContact CD1-CE1 3.1Å; I155-H226 WeakPolarHBondContact CD1-ND1 3.13Å; T207-H226 WeakPolarHBondContact CA-O 3.24Å; T207-H226 WeakPolarHBondContact CG2-O 3.31Å; H208-H226 HydrophobicContact CB-CB 4.15Å; H208-H226 PolarHBondContact N-O 2.81Å; H208-H226 PolarHBondContact O-N 3.07Å; E224-H226 IonicContact OE2-CE1 3.73Å; E224-H226 PolarHBondContact OE2-CE1 3.04Å; E224-H226 IonicContact OE2-NE2 2.78Å; E224-H226 PolarHBondContact OE2-NE2 2.95Å; H226-R232 CarbonylContact C-O 3.59Å; H226-R232 WeakPolarHBondContact CA-O 3.33Å; H226-S233 VanDerWaalsContact ND1-CB 3.33Å; H226-S233 WeakPolarHBondContact ND1-CB 3.46Å
227	S	85.6	Confident	85	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.187	C	C	.	.			trans	-64	158.2	179.7	56.5	0	0	0	0	111.8	W163 D229 G230 R231 R232	W163-S227 VanDerWaalsContact CH2-N 3.35Å; S227-D229 WeakPolarHBondContact CB-OD1 3.46Å; S227-D229 PolarHBondContact O-N 3.17Å; S227-D229 VanDerWaalsContact O-N 3.12Å; S227-D229 PolarHBondContact OG-OD1 2.81Å; S227-G230 WeakPolarHBondContact O-CA 3.49Å; S227-G230 PolarHBondContact O-N 3.37Å; S227-R231 PolarHBondContact OG-N 3.29Å; S227-R232 PolarHBondContact N-O 3.03Å; S227-R232 PolarHBondContact OG-N 3.34Å; S227-R232 PolarHBondContact OG-O 3.38Å
228	S	86.1	Confident	85.8	Confident	6 Å²	6	34.1 Å²	34.1	4%	0.042	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-27.2	-179.3	62.3	0	0	0	0	113.5	L206 W281 A349	L206-S228 WeakPolarHBondContact O-CA 3.03Å; L206-S228 WeakPolarHBondContact O-CB 3.44Å; S228-W281 WeakPolarHBondContact O-CZ2 3.31Å; S228-A349 WeakPolarHBondContact O-CB 3.43Å; S228-A349 PolarHBondContact O-N 3Å
229	D	77.1	Confident	86.7	Confident	38 Å²	38	31.2 Å²	31.2	20%	0.203	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.1	1.4	175	69.8	-9.8	0	0	0	113.7	S227 R231 T348	S227-D229 WeakPolarHBondContact CB-OD1 3.46Å; S227-D229 PolarHBondContact O-N 3.17Å; S227-D229 VanDerWaalsContact O-N 3.12Å; S227-D229 PolarHBondContact OG-OD1 2.81Å; D229-R231 HydrophobicContact CB-CG 4.36Å; D229-R231 PolarHBondContact O-N 2.83Å; D229-R231 VanDerWaalsContact O-N 3.14Å; D229-R231 PolarHBondContact OD1-N 3.48Å; D229-R231 WeakPolarHBondContact OD2-CD 3.46Å; D229-T348 VanDerWaalsContact O-CG2 3.29Å; D229-T348 WeakPolarHBondContact O-CG2 3.31Å
230	G	77.2	Confident	87.4	Confident	14 Å²	14	30.5 Å²	30.5	14%	0.144	16%	0.158	C	C	.	.	S	Bend	trans	66.5	6.7	-178.4	0	0	0	0	0	115.5	M152 S227	M152-G230 WeakPolarHBondContact CE-O 3.45Å; S227-G230 WeakPolarHBondContact O-CA 3.49Å; S227-G230 PolarHBondContact O-N 3.37Å
231	R	73.7	Confident	87.6	Confident	180 Å²	180	31 Å²	31	68%	0.679	16%	0.158	S	C	*	.	S	Bend	trans	-89.7	-21.6	-173.3	-63	-175.1	-176.7	173.1	0.5	114.3	S227 D229	S227-R231 PolarHBondContact OG-N 3.29Å; D229-R231 HydrophobicContact CB-CG 4.36Å; D229-R231 PolarHBondContact O-N 2.83Å; D229-R231 VanDerWaalsContact O-N 3.14Å; D229-R231 PolarHBondContact OD1-N 3.48Å; D229-R231 WeakPolarHBondContact OD2-CD 3.46Å
232	R	76	Confident	87.7	Confident	71 Å²	71	37.2 Å²	37.2	27%	0.268	19%	0.186	S	C	.	.			trans	-124.3	146.4	-178.9	-62.2	-176.8	173.2	159.3	-8.6	108.8	S162 W163 H226 S227	S162-R232 WeakPolarHBondContact O-CD 3.44Å; S162-R232 PolarHBondContact O-NE 3.13Å; S162-R232 VanDerWaalsContact O-NE 3.15Å; S162-R232 PolarHBondContact O-NH1 3.36Å; S162-R232 VanDerWaalsContact OG-CZ 3.28Å; S162-R232 PolarHBondContact OG-NH1 2.82Å; S162-R232 VanDerWaalsContact OG-NH1 3.16Å; S162-R232 PolarHBondContact OG-NH2 2.95Å; S162-R232 VanDerWaalsContact OG-NH2 3.1Å; W163-R232 VanDerWaalsContact CA-NH1 3.33Å; H226-R232 CarbonylContact C-O 3.59Å; H226-R232 WeakPolarHBondContact CA-O 3.33Å; S227-R232 PolarHBondContact N-O 3.03Å; S227-R232 PolarHBondContact OG-N 3.34Å; S227-R232 PolarHBondContact OG-O 3.38Å
233	S	83.4	Confident	87.9	Confident	7 Å²	7	39.1 Å²	39.1	5%	0.049	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	159.9	169.6	106.6	0	0	0	0	111.2	I155 C157 L225 H226	I155-S233 WeakPolarHBondContact CG2-OG 3.29Å; C157-S233 WeakPolarHBondContact CA-O 3.4Å; C157-S233 PolarHBondContact SG-O 3.12Å; L225-S233 CarbonylContact O-C 3.55Å; L225-S233 WeakPolarHBondContact O-CA 3.12Å; L225-S233 WeakPolarHBondContact O-CB 3.24Å; H226-S233 VanDerWaalsContact ND1-CB 3.33Å; H226-S233 WeakPolarHBondContact ND1-CB 3.46Å
234	C	85.2	Confident	88	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	139.2	163.9	59.8	0	0	0	0	110.1	I15 E224 L225	I15-C234 HydrophobicContact CD1-CB 3.84Å; I15-C234 HydrophobicContact CG1-CB 4.3Å; E224-C234 WeakPolarHBondContact CA-O 3.07Å; L225-C234 PolarHBondContact N-O 3.49Å; L225-C234 PolarHBondContact O-N 3.17Å
235	L	88.9	Confident	88.1	Confident	14 Å²	14	44.5 Å²	44.5	7%	0.073	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	122.9	170.4	174.8	73.6	0	0	0	107.7	I15 Y16 W21 L215 C222 E224	I15-L235 WeakPolarHBondContact CA-O 3.4Å; Y16-L235 HydrophobicContact CG-CD2 4.16Å; Y16-L235 PolarHBondContact N-O 2.92Å; W21-L235 HydrophobicContact CH2-CD2 3.54Å; W21-L235 HydrophobicContact CH2-CG 3.62Å; W21-L235 HydrophobicContact CZ2-CD2 3.91Å; W21-L235 HydrophobicContact CZ2-CG 4.47Å; W21-L235 HydrophobicContact CZ3-CD2 4.4Å; W21-L235 HydrophobicContact CZ3-CG 4.23Å; L215-L235 HydrophobicContact CD1-CD2 3.66Å; C222-L235 HydrophobicContact CB-CD1 4.16Å; E224-L235 HydrophobicContact CG-CD1 3.49Å; E224-L235 VanDerWaalsContact CG-CD1 3.49Å
236	L	92.1	Very high	88.3	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	145.3	-177.3	-62.2	176.8	0	0	0	109.7	L13 E14 I15 I24 L33 I35 C222 F223 L225	L13-L236 HydrophobicContact CD1-CD1 4.41Å; E14-L236 CarbonylContact O-C 3.59Å; E14-L236 VanDerWaalsContact O-CA 3.31Å; E14-L236 WeakPolarHBondContact O-CA 3.39Å; I15-L236 HydrophobicContact CB-CD2 3.83Å; I15-L236 HydrophobicContact CD1-CD2 4.2Å; I15-L236 HydrophobicContact CG1-CD2 3.82Å; I24-L236 HydrophobicContact CD1-CD2 3.69Å; L33-L236 HydrophobicContact CD2-CD1 3.76Å; I35-L236 HydrophobicContact CD1-CD2 4.49Å; C222-L236 CarbonylContact C-O 3.52Å; C222-L236 WeakPolarHBondContact CA-O 3.31Å; F223-L236 HydrophobicContact CD1-CB 4.46Å; F223-L236 HydrophobicContact CD2-CB 4.05Å; F223-L236 HydrophobicContact CD2-CD1 4.21Å; F223-L236 HydrophobicContact CE1-CB 4.09Å; F223-L236 HydrophobicContact CE2-CB 3.67Å; F223-L236 HydrophobicContact CE2-CD1 3.44Å; F223-L236 VanDerWaalsContact CE2-CD1 3.44Å; F223-L236 HydrophobicContact CE2-CG 4.14Å; F223-L236 HydrophobicContact CG-CB 4.44Å; F223-L236 HydrophobicContact CZ-CB 3.69Å; F223-L236 HydrophobicContact CZ-CD1 3.95Å; F223-L236 HydrophobicContact CZ-CG 4.47Å; F223-L236 PolarHBondContact N-O 3.31Å; F223-L236 PolarHBondContact O-N 3.02Å; L225-L236 HydrophobicContact CD1-CD1 3.93Å
237	R	92.7	Very high	88.6	Confident	72 Å²	72	50.5 Å²	50.5	27%	0.272	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	131.3	176.3	177.4	174.3	77.2	-178	3.5	109.9	L13 E14 W21 C221	L13-R237 CarbonylContact C-O 3.51Å; L13-R237 WeakPolarHBondContact CA-O 3.3Å; E14-R237 HydrophobicContact CB-CB 4.43Å; E14-R237 PolarHBondContact N-O 3.36Å; E14-R237 PolarHBondContact O-N 2.76Å; E14-R237 IonicContact OE1-CZ 3.9Å; E14-R237 IonicContact OE1-NH2 2.85Å; E14-R237 PolarHBondContact OE1-NH2 3.45Å; E14-R237 IonicContact OE2-CZ 3.08Å; E14-R237 IonicContact OE2-NE 2.73Å; E14-R237 PolarHBondContact OE2-NE 2.95Å; E14-R237 IonicContact OE2-NH2 2.67Å; E14-R237 PolarHBondContact OE2-NH2 3.48Å; W21-R237 HydrophobicContact CD2-CB 4.39Å; W21-R237 HydrophobicContact CE3-CB 3.75Å; W21-R237 HydrophobicContact CH2-CB 3.52Å; W21-R237 HydrophobicContact CH2-CG 4.49Å; W21-R237 HydrophobicContact CZ2-CB 4.22Å; W21-R237 HydrophobicContact CZ3-CB 3.27Å; W21-R237 HydrophobicContact CZ3-CG 4.49Å; C221-R237 HydrophobicContact CB-CG 4.1Å; C221-R237 CarbonylContact O-C 3.56Å; C221-R237 WeakPolarHBondContact O-CA 3.48Å
238	A	94.8	Very high	89	Confident	2 Å²	2	50.6 Å²	50.6	2%	0.017	24%	0.243	C	C	.	.			trans	-91.6	161.7	170.3	0	0	0	0	0	111.3	L13 C221 D240 E243 A244	L13-A238 HydrophobicContact CD2-CB 3.71Å; C221-A238 PolarHBondContact O-N 3.19Å; A238-D240 PolarHBondContact O-N 2.74Å; A238-E243 HydrophobicContact CB-CB 4.06Å; A238-E243 HydrophobicContact CB-CG 4.07Å; A238-A244 HydrophobicContact CB-CB 3.76Å; A238-A244 VanDerWaalsContact CB-N 3.31Å
239	P	93.2	Very high	89.5	Confident	85 Å²	85	53.4 Å²	53.4	55%	0.552	26%	0.258	S	S	*	.	S	Bend	trans	-55.2	-35.6	176.1	-27.8	36.4	0	0	0	114	E243	P239-E243 VanDerWaalsContact CD-OE2 3.25Å; P239-E243 WeakPolarHBondContact CD-OE2 3.38Å; P239-E243 VanDerWaalsContact CG-OE2 3.3Å; P239-E243 WeakPolarHBondContact CG-OE2 3.33Å
240	D	93.8	Very high	90.4	Very high	75 Å²	75	52.5 Å²	52.5	40%	0.401	26%	0.256	S	S	.	.	S	Bend	trans	-146.7	170.3	177	66	56.5	0	0	0	112.4	C221 A238 Q242 E243 A244	C221-D240 VanDerWaalsContact SG-C 3.51Å; A238-D240 PolarHBondContact O-N 2.74Å; D240-Q242 VanDerWaalsContact C-N 3.27Å; D240-Q242 PolarHBondContact O-N 2.82Å; D240-Q242 WeakPolarHBondContact OD1-CA 3.41Å; D240-Q242 WeakPolarHBondContact OD1-CB 3.1Å; D240-Q242 PolarHBondContact OD1-N 2.86Å; D240-E243 PolarHBondContact O-N 3.23Å; D240-E243 PolarHBondContact OD1-N 2.96Å; D240-A244 PolarHBondContact O-N 2.87Å
241	A	91.8	Very high	91.3	Very high	44 Å²	44	51.9 Å²	51.9	36%	0.364	25%	0.249	S	C	.	.	H	α-helix	trans	-67.3	-25.3	-176.7	0	0	0	0	0	113.7	G220 C221 R245	G220-A241 WeakPolarHBondContact O-CA 3.45Å; G220-A241 WeakPolarHBondContact O-CB 3.5Å; C221-A241 PolarHBondContact SG-N 3.37Å; C221-A241 VanDerWaalsContact SG-N 3.45Å; A241-R245 WeakPolarHBondContact O-CB 2.86Å; A241-R245 PolarHBondContact O-N 2.56Å; A241-R245 VanDerWaalsContact O-N 3.1Å
242	Q	94.7	Very high	92.3	Very high	149 Å²	149	44.2 Å²	44.2	70%	0.696	22%	0.221	S	C	*	.	H	α-helix	trans	-74.5	-45.7	178.1	-179.3	172.4	5.5	0	0	110.1	D240 A244 R245 M246	D240-Q242 VanDerWaalsContact C-N 3.27Å; D240-Q242 PolarHBondContact O-N 2.82Å; D240-Q242 WeakPolarHBondContact OD1-CA 3.41Å; D240-Q242 WeakPolarHBondContact OD1-CB 3.1Å; D240-Q242 PolarHBondContact OD1-N 2.86Å; Q242-A244 VanDerWaalsContact C-N 3.34Å; Q242-R245 PolarHBondContact O-N 2.84Å; Q242-M246 WeakPolarHBondContact O-CG 3.45Å; Q242-M246 PolarHBondContact O-N 2.83Å
243	E	95.2	Very high	93.2	Very high	55 Å²	55	44 Å²	44	26%	0.257	23%	0.23	S	C	.	.	H	α-helix	trans	-64.2	-40.1	174.8	-174.1	166.1	-175.4	0	0	111.1	A238 P239 D240 R245 M246 W247	A238-E243 HydrophobicContact CB-CB 4.06Å; A238-E243 HydrophobicContact CB-CG 4.07Å; P239-E243 VanDerWaalsContact CD-OE2 3.25Å; P239-E243 WeakPolarHBondContact CD-OE2 3.38Å; P239-E243 VanDerWaalsContact CG-OE2 3.3Å; P239-E243 WeakPolarHBondContact CG-OE2 3.33Å; D240-E243 PolarHBondContact O-N 3.23Å; D240-E243 PolarHBondContact OD1-N 2.96Å; E243-R245 VanDerWaalsContact C-N 3.31Å; E243-R245 PolarHBondContact O-N 2.8Å; E243-M246 PolarHBondContact O-N 2.91Å; E243-W247 VanDerWaalsContact O-CD1 3.27Å; E243-W247 PolarHBondContact O-N 2.88Å; E243-W247 PolarHBondContact OE1-NE1 2.84Å
244	A	94	Very high	93.7	Very high	2 Å²	2	45.2 Å²	45.2	2%	0.017	24%	0.235	C	C	.	.	H	α-helix	trans	-57.6	-43.7	173.2	0	0	0	0	0	112.3	G220 C221 A238 D240 Q242 W247 F248	G220-A244 WeakPolarHBondContact O-CB 3.32Å; C221-A244 WeakPolarHBondContact O-CB 3.39Å; A238-A244 HydrophobicContact CB-CB 3.76Å; A238-A244 VanDerWaalsContact CB-N 3.31Å; D240-A244 PolarHBondContact O-N 2.87Å; Q242-A244 VanDerWaalsContact C-N 3.34Å; A244-W247 PolarHBondContact O-N 3.17Å; A244-F248 WeakPolarHBondContact O-CB 3.44Å; A244-F248 PolarHBondContact O-N 2.82Å
245	R	93.5	Very high	94.2	Very high	118 Å²	118	45.5 Å²	45.5	45%	0.445	24%	0.236	S	C	.	.	H	α-helix	trans	-64.3	-43.5	176.2	-174.1	169.8	-65.6	-88.1	-4.4	111.7	A241 Q242 E243 W247 F248 D249 D397	A241-R245 WeakPolarHBondContact O-CB 2.86Å; A241-R245 PolarHBondContact O-N 2.56Å; A241-R245 VanDerWaalsContact O-N 3.1Å; Q242-R245 PolarHBondContact O-N 2.84Å; E243-R245 VanDerWaalsContact C-N 3.31Å; E243-R245 PolarHBondContact O-N 2.8Å; R245-W247 PolarHBondContact O-N 2.85Å; R245-F248 PolarHBondContact O-N 3.3Å; R245-D249 WeakPolarHBondContact O-CB 3.4Å; R245-D249 PolarHBondContact O-N 2.95Å; R245-D397 IonicContact CZ-OD2 2.74Å; R245-D397 IonicContact NH1-OD2 3.87Å; R245-D397 PolarHBondContact NH1-OD2 3.08Å; R245-D397 IonicContact NH2-OD2 3.36Å; R245-D397 PolarHBondContact NH2-OD2 3.12Å
246	M	95.4	Very high	94.4	Very high	121 Å²	121	47 Å²	47	60%	0.596	24%	0.242	S	C	*	.	H	α-helix	trans	-59.6	-45.4	175.8	-72.8	176.4	53.8	0	0	112.4	Q242 E243 A250	Q242-M246 WeakPolarHBondContact O-CG 3.45Å; Q242-M246 PolarHBondContact O-N 2.83Å; E243-M246 PolarHBondContact O-N 2.91Å; M246-A250 VanDerWaalsContact O-CB 3.29Å; M246-A250 WeakPolarHBondContact O-CB 3.43Å; M246-A250 PolarHBondContact O-N 3.28Å
247	W	96.4	Very high	94.6	Very high	8 Å²	8	52.5 Å²	52.5	3%	0.03	27%	0.27	C	S	.	.	H	α-helix	trans	-62.7	-47.4	175.6	-85.5	102.5	0	0	0	111.9	I9 L13 A26 L28 L33 F223 E243 A244 R245 A250 I251	I9-W247 HydrophobicContact CG2-CE3 4.5Å; I9-W247 HydrophobicContact CG2-CH2 3.88Å; I9-W247 HydrophobicContact CG2-CZ2 4Å; I9-W247 HydrophobicContact CG2-CZ3 4.15Å; L13-W247 HydrophobicContact CD1-CD2 3.99Å; L13-W247 HydrophobicContact CD1-CE3 4.33Å; L13-W247 HydrophobicContact CD1-CG 4.32Å; L13-W247 HydrophobicContact CD1-CZ2 4.32Å; L13-W247 HydrophobicContact CD2-CD2 4.49Å; L13-W247 HydrophobicContact CD2-CG 4.23Å; L13-W247 HydrophobicContact CG-CZ2 4.38Å; A26-W247 HydrophobicContact CB-CH2 3.69Å; A26-W247 HydrophobicContact CB-CZ2 4.16Å; A26-W247 HydrophobicContact CB-CZ3 4.11Å; A26-W247 WeakPolarHBondContact O-CH2 3.44Å; L28-W247 HydrophobicContact CB-CZ3 4.1Å; L33-W247 HydrophobicContact CD1-CZ3 3.9Å; F223-W247 HydrophobicContact CE1-CB 3.88Å; F223-W247 HydrophobicContact CZ-CB 3.72Å; F223-W247 HydrophobicContact CZ-CG 4.25Å; E243-W247 VanDerWaalsContact O-CD1 3.27Å; E243-W247 PolarHBondContact O-N 2.88Å; E243-W247 PolarHBondContact OE1-NE1 2.84Å; A244-W247 PolarHBondContact O-N 3.17Å; R245-W247 PolarHBondContact O-N 2.85Å; W247-A250 PolarHBondContact O-N 2.81Å; W247-I251 HydrophobicContact CE3-CD1 4.27Å; W247-I251 VanDerWaalsContact O-CG1 3.24Å; W247-I251 WeakPolarHBondContact O-CG1 3.33Å; W247-I251 PolarHBondContact O-N 2.53Å
248	F	94.9	Very high	94.6	Very high	1 Å²	1	49.9 Å²	49.9	0%	0.004	26%	0.262	C	S	.	.	H	α-helix	trans	-57	-52.7	178	-173.6	-83.7	0	0	0	111.2	L209 R211 F223 A244 R245 A250 I251 H252	L209-F248 HydrophobicContact CD1-CD2 3.92Å; L209-F248 HydrophobicContact CD1-CE2 3.99Å; L209-F248 HydrophobicContact CD2-CD1 4.37Å; L209-F248 HydrophobicContact CD2-CD2 3.86Å; L209-F248 HydrophobicContact CD2-CE1 4.3Å; L209-F248 HydrophobicContact CD2-CE2 3.8Å; L209-F248 HydrophobicContact CD2-CG 4.15Å; L209-F248 HydrophobicContact CD2-CZ 4.02Å; L209-F248 WeakPolarHBondContact CD2-O 2.94Å; L209-F248 HydrophobicContact CG-CD2 3.82Å; L209-F248 HydrophobicContact CG-CE2 3.5Å; L209-F248 VanDerWaalsContact CG-CE2 3.5Å; L209-F248 HydrophobicContact CG-CZ 4.02Å; R211-F248 HydrophobicContact CG-CD2 3.66Å; R211-F248 HydrophobicContact CG-CE2 3.62Å; F223-F248 HydrophobicContact CB-CD2 4.02Å; A244-F248 WeakPolarHBondContact O-CB 3.44Å; A244-F248 PolarHBondContact O-N 2.82Å; R245-F248 PolarHBondContact O-N 3.3Å; F248-A250 VanDerWaalsContact C-N 3.31Å; F248-A250 PolarHBondContact O-N 3.02Å; F248-I251 PolarHBondContact O-N 3.35Å; F248-H252 HydrophobicContact CE1-CB 4.41Å; F248-H252 WeakPolarHBondContact O-CB 3.37Å; F248-H252 PolarHBondContact O-N 3.38Å
249	D	94.8	Very high	94.6	Very high	66 Å²	66	50 Å²	50	35%	0.353	26%	0.262	S	S	.	.	H	α-helix	trans	-63.8	-37.3	-176.6	-66.3	-15.3	0	0	0	111.6	R245 S253	R245-D249 WeakPolarHBondContact O-CB 3.4Å; R245-D249 PolarHBondContact O-N 2.95Å; D249-S253 VanDerWaalsContact O-CB 3.28Å; D249-S253 WeakPolarHBondContact O-CB 3.47Å; D249-S253 PolarHBondContact O-N 3.25Å; D249-S253 PolarHBondContact O-OG 2.95Å
250	A	95.8	Very high	94.7	Very high	19 Å²	19	53.8 Å²	53.8	16%	0.157	27%	0.27	C	S	.	.	H	α-helix	trans	-68.7	-46.1	177.2	0	0	0	0	0	112.9	I9 L28 M246 W247 F248 K254	I9-A250 HydrophobicContact CD1-CB 3.33Å; L28-A250 HydrophobicContact CD2-CB 3.86Å; M246-A250 VanDerWaalsContact O-CB 3.29Å; M246-A250 WeakPolarHBondContact O-CB 3.43Å; M246-A250 PolarHBondContact O-N 3.28Å; W247-A250 PolarHBondContact O-N 2.81Å; F248-A250 VanDerWaalsContact C-N 3.31Å; F248-A250 PolarHBondContact O-N 3.02Å; A250-K254 WeakPolarHBondContact O-CG 3.26Å; A250-K254 PolarHBondContact O-N 2.84Å; A250-K254 VanDerWaalsContact O-N 3.15Å
251	I	96.2	Very high	94.8	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-63.5	-47.6	177	-64.6	166.6	0	0	0	109.5	L28 L33 L204 L209 F223 L225 W247 F248 S253 K254 M255	L28-I251 HydrophobicContact CD1-CG1 3.98Å; L28-I251 HydrophobicContact CD2-CG1 4.11Å; L33-I251 HydrophobicContact CD2-CD1 4.28Å; L204-I251 HydrophobicContact CD2-CG2 3.86Å; L209-I251 HydrophobicContact CD1-CG2 4.43Å; L209-I251 HydrophobicContact CD2-CB 4.03Å; L209-I251 HydrophobicContact CD2-CG2 3.93Å; F223-I251 HydrophobicContact CD2-CD1 4.48Å; F223-I251 HydrophobicContact CE2-CD1 3.78Å; F223-I251 HydrophobicContact CZ-CD1 4.46Å; L225-I251 HydrophobicContact CD2-CG2 4.19Å; W247-I251 HydrophobicContact CE3-CD1 4.27Å; W247-I251 VanDerWaalsContact O-CG1 3.24Å; W247-I251 WeakPolarHBondContact O-CG1 3.33Å; W247-I251 PolarHBondContact O-N 2.53Å; F248-I251 PolarHBondContact O-N 3.35Å; I251-S253 PolarHBondContact O-N 3.48Å; I251-K254 PolarHBondContact O-N 2.83Å; I251-K254 VanDerWaalsContact O-N 3.15Å; I251-M255 HydrophobicContact CG2-CG 4.25Å; I251-M255 HydrophobicContact CG2-SD 3.65Å; I251-M255 WeakPolarHBondContact O-CG 3.47Å; I251-M255 PolarHBondContact O-N 3.49Å
252	H	95.4	Very high	94.8	Very high	19 Å²	19	52.1 Å²	52.1	9%	0.088	26%	0.26	C	S	.	.	H	α-helix	trans	-55.9	-47.7	178.4	-173.2	-114.4	0	0	0	112.1	L209 F248 K254 M255 K256 D423	L209-H252 HydrophobicContact CD2-CB 3.78Å; F248-H252 HydrophobicContact CE1-CB 4.41Å; F248-H252 WeakPolarHBondContact O-CB 3.37Å; F248-H252 PolarHBondContact O-N 3.38Å; H252-K254 VanDerWaalsContact C-N 3.33Å; H252-K254 PolarHBondContact O-N 2.9Å; H252-M255 PolarHBondContact O-N 2.89Å; H252-K256 WeakPolarHBondContact CE1-CE 3.3Å; H252-K256 PolarHBondContact O-N 3.49Å; H252-D423 IonicContact CE1-OD1 2.87Å; H252-D423 PolarHBondContact CE1-OD1 3.12Å; H252-D423 IonicContact CE1-OD2 3.5Å; H252-D423 PolarHBondContact CE1-OD2 2.92Å; H252-D423 IonicContact NE2-OD1 3.17Å; H252-D423 IonicContact NE2-OD2 2.86Å; H252-D423 PolarHBondContact NE2-OD2 3.14Å
253	S	94.4	Very high	94.8	Very high	66 Å²	66	45.9 Å²	45.9	46%	0.462	23%	0.232	S	C	.	.	H	α-helix	trans	-61.7	-39.3	178.1	-61	0	0	0	0	112.4	D249 I251 I257	D249-S253 VanDerWaalsContact O-CB 3.28Å; D249-S253 WeakPolarHBondContact O-CB 3.47Å; D249-S253 PolarHBondContact O-N 3.25Å; D249-S253 PolarHBondContact O-OG 2.95Å; I251-S253 PolarHBondContact O-N 3.48Å; S253-I257 WeakPolarHBondContact O-CG1 3.4Å; S253-I257 PolarHBondContact O-N 3.18Å
254	K	94.4	Very high	94.8	Very high	33 Å²	33	45.7 Å²	45.7	14%	0.143	24%	0.239	C	C	.	.	H	α-helix	trans	-68.6	-43.7	175.5	-70.3	-157.9	-172.3	-165.1	0	112.1	L7 L28 Q29 L204 A250 I251 H252 K256 I257 I258	L7-K254 PolarHBondContact O-NZ 3.42Å; L28-K254 HydrophobicContact CD1-CD 4.04Å; L28-K254 HydrophobicContact CD2-CD 3.8Å; L28-K254 HydrophobicContact CD2-CG 4.27Å; L28-K254 HydrophobicContact CG-CD 3.71Å; L28-K254 PolarHBondContact O-NZ 3.4Å; Q29-K254 VanDerWaalsContact O-CD 3.28Å; Q29-K254 WeakPolarHBondContact O-CD 3.35Å; Q29-K254 PolarHBondContact O-NZ 2.96Å; L204-K254 HydrophobicContact CD1-CB 4.06Å; A250-K254 WeakPolarHBondContact O-CG 3.26Å; A250-K254 PolarHBondContact O-N 2.84Å; A250-K254 VanDerWaalsContact O-N 3.15Å; I251-K254 PolarHBondContact O-N 2.83Å; I251-K254 VanDerWaalsContact O-N 3.15Å; H252-K254 VanDerWaalsContact C-N 3.33Å; H252-K254 PolarHBondContact O-N 2.9Å; K254-K256 VanDerWaalsContact C-N 3.31Å; K254-K256 PolarHBondContact O-N 2.96Å; K254-I257 PolarHBondContact O-N 3.26Å; K254-I257 VanDerWaalsContact O-N 3.15Å; K254-I258 WeakPolarHBondContact O-CD1 3.46Å; K254-I258 VanDerWaalsContact O-CG1 3.29Å; K254-I258 WeakPolarHBondContact O-CG1 3.2Å; K254-I258 PolarHBondContact O-N 3.42Å
255	M	95.4	Very high	94.7	Very high	7 Å²	7	48.7 Å²	48.7	3%	0.034	25%	0.253	C	S	.	.	H	α-helix	trans	-57.5	-43.9	177.4	-73.3	171.4	54.5	0	0	111.8	L204 T207 L209 I251 H252 I257 I258 N259	L204-M255 HydrophobicContact CB-CG 3.93Å; L204-M255 HydrophobicContact CD2-CG 4.29Å; T207-M255 WeakPolarHBondContact O-CE 3.34Å; L209-M255 HydrophobicContact CB-CE 3.88Å; L209-M255 HydrophobicContact CB-SD 3.71Å; L209-M255 HydrophobicContact CD2-SD 4.3Å; I251-M255 HydrophobicContact CG2-CG 4.25Å; I251-M255 HydrophobicContact CG2-SD 3.65Å; I251-M255 WeakPolarHBondContact O-CG 3.47Å; I251-M255 PolarHBondContact O-N 3.49Å; H252-M255 PolarHBondContact O-N 2.89Å; M255-I257 VanDerWaalsContact C-N 3.33Å; M255-I257 PolarHBondContact O-N 2.86Å; M255-I258 PolarHBondContact O-N 3.19Å; M255-N259 VanDerWaalsContact O-CB 3.31Å; M255-N259 WeakPolarHBondContact O-CB 3.32Å; M255-N259 PolarHBondContact O-N 2.75Å
256	K	94.3	Very high	94.5	Very high	44 Å²	44	43 Å²	43	19%	0.191	23%	0.232	C	C	.	.	H	α-helix	trans	-53.7	-47.1	173.9	-78.2	-178	165.3	-177.6	0	112.9	H252 K254 K260 E422 D423	H252-K256 WeakPolarHBondContact CE1-CE 3.3Å; H252-K256 PolarHBondContact O-N 3.49Å; K254-K256 VanDerWaalsContact C-N 3.31Å; K254-K256 PolarHBondContact O-N 2.96Å; K256-K260 VanDerWaalsContact O-CB 3.29Å; K256-K260 WeakPolarHBondContact O-CB 3.1Å; K256-K260 PolarHBondContact O-N 2.83Å; K256-E422 IonicContact NZ-OE1 3.21Å; K256-E422 PolarHBondContact NZ-OE1 3.11Å; K256-E422 IonicContact NZ-OE2 3.39Å; K256-E422 PolarHBondContact NZ-OE2 2.84Å; K256-D423 WeakPolarHBondContact CE-OD1 3.34Å; K256-D423 IonicContact NZ-OD1 2.89Å; K256-D423 PolarHBondContact NZ-OD1 3.34Å
257	I	94.6	Very high	94.4	Very high	116 Å²	116	39.1 Å²	39.1	60%	0.595	21%	0.213	S	C	*	.	H	α-helix	trans	-64.8	-46	180	-64.6	166.7	0	0	0	110.6	S253 K254 M255 K260 S261	S253-I257 WeakPolarHBondContact O-CG1 3.4Å; S253-I257 PolarHBondContact O-N 3.18Å; K254-I257 PolarHBondContact O-N 3.26Å; K254-I257 VanDerWaalsContact O-N 3.15Å; M255-I257 VanDerWaalsContact C-N 3.33Å; M255-I257 PolarHBondContact O-N 2.86Å; I257-K260 PolarHBondContact O-N 3.02Å; I257-S261 PolarHBondContact O-N 3.48Å; I257-S261 VanDerWaalsContact O-N 3.08Å
258	I	94.5	Very high	94.2	Very high	18 Å²	18	47.5 Å²	47.5	9%	0.092	25%	0.245	C	C	.	.	H	α-helix	trans	-64.4	-47.5	-179.1	-64.8	162	0	0	0	110.8	H30 L204 R205 K254 M255 K260 S261 Y262	H30-I258 WeakPolarHBondContact O-CD1 3.25Å; L204-I258 HydrophobicContact CB-CD1 3.55Å; L204-I258 HydrophobicContact CD1-CD1 3.95Å; L204-I258 HydrophobicContact CG-CD1 4.37Å; R205-I258 HydrophobicContact CB-CG2 3.75Å; R205-I258 HydrophobicContact CG-CG2 4.3Å; K254-I258 WeakPolarHBondContact O-CD1 3.46Å; K254-I258 VanDerWaalsContact O-CG1 3.29Å; K254-I258 WeakPolarHBondContact O-CG1 3.2Å; K254-I258 PolarHBondContact O-N 3.42Å; M255-I258 PolarHBondContact O-N 3.19Å; I258-K260 VanDerWaalsContact C-N 3.34Å; I258-K260 PolarHBondContact O-N 3.24Å; I258-S261 PolarHBondContact O-N 3.29Å; I258-Y262 WeakPolarHBondContact O-CB 3.45Å; I258-Y262 PolarHBondContact O-N 2.99Å
259	N	95.1	Very high	93.7	Very high	5 Å²	5	49.5 Å²	49.5	3%	0.027	26%	0.255	C	S	.	.	H	α-helix	trans	-66	-36.8	-179	-72.5	-9	0	0	0	111.3	L206 M255 Y262 L263 L279	L206-N259 PolarHBondContact N-OD1 3.47Å; M255-N259 VanDerWaalsContact O-CB 3.31Å; M255-N259 WeakPolarHBondContact O-CB 3.32Å; M255-N259 PolarHBondContact O-N 2.75Å; N259-Y262 PolarHBondContact O-N 3.48Å; N259-L263 WeakPolarHBondContact O-CB 3.48Å; N259-L263 PolarHBondContact O-N 3.08Å; N259-L279 HydrophobicContact CB-CD1 4.26Å
260	K	95	Very high	93.2	Very high	164 Å²	164	47.1 Å²	47.1	71%	0.713	24%	0.243	S	C	*	.	H	α-helix	trans	-62.5	-42.8	172.2	-174.8	174.5	-177	172.6	0	112.4	K256 I257 I258 A264	K256-K260 VanDerWaalsContact O-CB 3.29Å; K256-K260 WeakPolarHBondContact O-CB 3.1Å; K256-K260 PolarHBondContact O-N 2.83Å; I257-K260 PolarHBondContact O-N 3.02Å; I258-K260 VanDerWaalsContact C-N 3.34Å; I258-K260 PolarHBondContact O-N 3.24Å; K260-A264 PolarHBondContact O-N 3.09Å
261	S	94.3	Very high	92.7	Very high	77 Å²	77	47.5 Å²	47.5	54%	0.538	24%	0.244	S	C	.	.	H	α-helix	trans	-65.6	-40.8	174.8	-174.8	0	0	0	0	111.8	I257 I258 A264 E265	I257-S261 PolarHBondContact O-N 3.48Å; I257-S261 VanDerWaalsContact O-N 3.08Å; I258-S261 PolarHBondContact O-N 3.29Å; S261-A264 PolarHBondContact O-N 3.08Å; S261-E265 PolarHBondContact O-N 3.18Å; S261-E265 VanDerWaalsContact O-N 3.12Å
262	Y	93.5	Very high	92.2	Very high	6 Å²	6	53.4 Å²	53.4	2%	0.024	28%	0.282	C	S	.	.	H	α-helix	trans	-62.3	-45.5	176.7	172.6	-94.7	0	0	0	111.6	L168 R205 L206 I258 N259 A264 E265 L266 L279	L168-Y262 HydrophobicContact CD1-CE2 3.63Å; R205-Y262 HydrophobicContact CG-CD2 4.11Å; R205-Y262 HydrophobicContact CG-CG 4.36Å; L206-Y262 HydrophobicContact CD1-CD1 4.38Å; L206-Y262 HydrophobicContact CD1-CE1 3.76Å; L206-Y262 HydrophobicContact CD1-CE2 4.31Å; L206-Y262 HydrophobicContact CD2-CD1 3.93Å; L206-Y262 HydrophobicContact CD2-CE1 3.94Å; L206-Y262 HydrophobicContact CG-CD1 4.34Å; L206-Y262 HydrophobicContact CG-CE1 4.2Å; I258-Y262 WeakPolarHBondContact O-CB 3.45Å; I258-Y262 PolarHBondContact O-N 2.99Å; N259-Y262 PolarHBondContact O-N 3.48Å; Y262-A264 VanDerWaalsContact C-N 3.3Å; Y262-A264 PolarHBondContact O-N 2.95Å; Y262-E265 CarbonylContact O-C 3.54Å; Y262-E265 WeakPolarHBondContact O-CA 3.42Å; Y262-E265 WeakPolarHBondContact O-CB 2.87Å; Y262-E265 PolarHBondContact O-N 3.28Å; Y262-L266 HydrophobicContact CE1-CB 4.4Å; Y262-L266 HydrophobicContact CE1-CD2 4.01Å; Y262-L266 WeakPolarHBondContact O-CB 2.94Å; Y262-L266 PolarHBondContact O-N 3.2Å; Y262-L279 HydrophobicContact CD1-CD1 4.47Å; Y262-L279 HydrophobicContact CD1-CD2 4.19Å; Y262-L279 HydrophobicContact CE1-CD2 4.15Å
263	L	94.6	Very high	91.7	Very high	18 Å²	18	56.8 Å²	56.8	9%	0.094	30%	0.304	C	S	.	.	H	α-helix	trans	-56.2	-44.1	175.9	175.9	61.7	0	0	0	111.8	N259 E265 L266 N267 L276 L279	N259-L263 WeakPolarHBondContact O-CB 3.48Å; N259-L263 PolarHBondContact O-N 3.08Å; L263-E265 VanDerWaalsContact C-N 3.29Å; L263-E265 PolarHBondContact O-N 3.06Å; L263-L266 PolarHBondContact O-N 2.92Å; L263-N267 PolarHBondContact O-N 3.32Å; L263-L276 HydrophobicContact CD1-CB 3.55Å; L263-L279 HydrophobicContact CB-CD2 4.24Å; L263-L279 HydrophobicContact CB-CG 4.37Å; L263-L279 HydrophobicContact CD1-CD2 3.73Å; L263-L279 HydrophobicContact CD1-CG 4.13Å
264	A	94.2	Very high	91.2	Very high	51 Å²	51	57.4 Å²	57.4	42%	0.421	30%	0.3	S	S	.	.	H	α-helix	trans	-67.6	-26.5	176.7	0	0	0	0	0	113.6	K260 S261 Y262 R268	K260-A264 PolarHBondContact O-N 3.09Å; S261-A264 PolarHBondContact O-N 3.08Å; Y262-A264 VanDerWaalsContact C-N 3.3Å; Y262-A264 PolarHBondContact O-N 2.95Å; A264-R268 PolarHBondContact O-NE 2.7Å
265	E	91.7	Very high	91	Very high	65 Å²	65	59.7 Å²	59.7	30%	0.304	31%	0.311	S	S	.	.	H	α-helix	trans	-76.1	-45	172.1	-161	-171.9	161.6	0	0	111	L168 S261 Y262 L263 N267 R268	L168-E265 HydrophobicContact CD2-CB 3.96Å; L168-E265 VanDerWaalsContact CD2-CD 3.41Å; L168-E265 HydrophobicContact CD2-CG 3.43Å; L168-E265 VanDerWaalsContact CD2-CG 3.43Å; L168-E265 WeakPolarHBondContact CD2-OE1 3.42Å; S261-E265 PolarHBondContact O-N 3.18Å; S261-E265 VanDerWaalsContact O-N 3.12Å; Y262-E265 CarbonylContact O-C 3.54Å; Y262-E265 WeakPolarHBondContact O-CA 3.42Å; Y262-E265 WeakPolarHBondContact O-CB 2.87Å; Y262-E265 PolarHBondContact O-N 3.28Å; L263-E265 VanDerWaalsContact C-N 3.29Å; L263-E265 PolarHBondContact O-N 3.06Å; E265-N267 PolarHBondContact O-N 2.76Å; E265-R268 WeakPolarHBondContact O-CB 3.44Å; E265-R268 PolarHBondContact O-N 3.2Å; E265-R268 VanDerWaalsContact O-N 3.14Å
266	L	90.6	Very high	91	Very high	0 Å²	0	59.7 Å²	59.7	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-60.1	-45.8	178.4	178.9	62.6	0	0	0	111.9	L168 L171 Y262 L263 R268 L269 L270 L276 L279 W356	L168-L266 HydrophobicContact CD1-CD1 4.19Å; L171-L266 HydrophobicContact CD1-CD1 3.97Å; Y262-L266 HydrophobicContact CE1-CB 4.4Å; Y262-L266 HydrophobicContact CE1-CD2 4.01Å; Y262-L266 WeakPolarHBondContact O-CB 2.94Å; Y262-L266 PolarHBondContact O-N 3.2Å; L263-L266 PolarHBondContact O-N 2.92Å; L266-R268 PolarHBondContact O-N 3.17Å; L266-L269 WeakPolarHBondContact O-CA 3.38Å; L266-L269 WeakPolarHBondContact O-CB 3.13Å; L266-L269 PolarHBondContact O-N 3.27Å; L266-L270 HydrophobicContact CD1-CD1 4.21Å; L266-L270 HydrophobicContact CD1-CD2 4.42Å; L266-L270 HydrophobicContact CD1-CG 4.1Å; L266-L270 HydrophobicContact CD2-CD1 4.26Å; L266-L270 HydrophobicContact CG-CD1 3.79Å; L266-L270 HydrophobicContact CG-CG 4.12Å; L266-L270 PolarHBondContact O-N 3.48Å; L266-L276 HydrophobicContact CD2-CD1 3.77Å; L266-L279 HydrophobicContact CD2-CD2 4.12Å; L266-W356 HydrophobicContact CD2-CD2 4.35Å; L266-W356 HydrophobicContact CD2-CH2 3.84Å; L266-W356 HydrophobicContact CD2-CZ2 3.32Å
267	N	92.4	Very high	91	Very high	38 Å²	38	62.2 Å²	62.2	20%	0.203	32%	0.322	C	S	.	.	H	α-helix	trans	-63.7	-21	177.3	-77.4	-21.1	0	0	0	114	L263 E265 E275 L276	L263-N267 PolarHBondContact O-N 3.32Å; E265-N267 PolarHBondContact O-N 2.76Å; N267-E275 HydrophobicContact CB-CG 4.39Å; N267-L276 PolarHBondContact ND2-O 2.98Å; N267-L276 PolarHBondContact OD1-N 3.35Å
268	R	91.2	Very high	91.1	Very high	184 Å²	184	58.6 Å²	58.6	69%	0.694	30%	0.302	S	S	*	.	H	α-helix	trans	-74.4	-20	171.8	-76.6	177.7	-96	155.2	-8.9	112.5	A264 E265 L266	A264-R268 PolarHBondContact O-NE 2.7Å; E265-R268 WeakPolarHBondContact O-CB 3.44Å; E265-R268 PolarHBondContact O-N 3.2Å; E265-R268 VanDerWaalsContact O-N 3.14Å; L266-R268 PolarHBondContact O-N 3.17Å
269	L	86	Confident	91.2	Very high	43 Å²	43	57.9 Å²	57.9	23%	0.225	30%	0.299	C	S	.	.	H	α-helix	trans	-96.9	-37.7	178.6	-58.6	-177.5	0	0	0	111.6	L168 L171 F174 L266	L168-L269 HydrophobicContact CD1-CD1 4.39Å; L168-L269 HydrophobicContact CD2-CD1 3.34Å; L168-L269 HydrophobicContact CD2-CG 4.28Å; L168-L269 HydrophobicContact CG-CD1 3.55Å; L171-L269 HydrophobicContact CB-CD1 3.73Å; L171-L269 HydrophobicContact CD1-CD1 3.93Å; L171-L269 HydrophobicContact CG-CD1 4.45Å; F174-L269 WeakPolarHBondContact CD2-O 3.37Å; F174-L269 WeakPolarHBondContact CE2-O 3.31Å; L266-L269 WeakPolarHBondContact O-CA 3.38Å; L266-L269 WeakPolarHBondContact O-CB 3.13Å; L266-L269 PolarHBondContact O-N 3.27Å
270	L	84.4	Confident	91.3	Very high	17 Å²	17	59 Å²	59	9%	0.089	31%	0.305	C	S	.	.	S	Bend	trans	-65.4	151.8	178.6	-66.6	175.8	0	0	0	112.2	F174 L266 Q274 L276	F174-L270 HydrophobicContact CE2-CD2 4.1Å; F174-L270 HydrophobicContact CZ-CD2 4.02Å; L266-L270 HydrophobicContact CD1-CD1 4.21Å; L266-L270 HydrophobicContact CD1-CD2 4.42Å; L266-L270 HydrophobicContact CD1-CG 4.1Å; L266-L270 HydrophobicContact CD2-CD1 4.26Å; L266-L270 HydrophobicContact CG-CD1 3.79Å; L266-L270 HydrophobicContact CG-CG 4.12Å; L266-L270 PolarHBondContact O-N 3.48Å; L270-Q274 WeakPolarHBondContact CD1-O 3.19Å; L270-L276 HydrophobicContact CD1-CD1 3.86Å; L270-L276 HydrophobicContact CD1-CG 3.88Å
271	P	85.2	Confident	91.4	Very high	27 Å²	27	52.2 Å²	52.2	18%	0.175	27%	0.274	C	S	.	.			trans	-57	147.8	169.2	-23	34	0	0	0	110.1	F174 T273 Q274	F174-P271 HydrophobicContact CD1-CG 3.26Å; F174-P271 HydrophobicContact CE1-CG 3.33Å; F174-P271 HydrophobicContact CG-CG 3.88Å; F174-P271 HydrophobicContact CZ-CG 4Å; P271-T273 PolarHBondContact O-N 2.92Å; P271-Q274 PolarHBondContact O-N 2.86Å
272	P	84.9	Confident	91.5	Very high	124 Å²	124	48.6 Å²	48.6	81%	0.805	25%	0.249	S	C	*	.	G	3₁₀ helix	trans	-54.5	-25	174.1	-26.8	34.9	0	0	0	113.9	Q274	P272-Q274 VanDerWaalsContact C-N 3.26Å; P272-Q274 PolarHBondContact O-N 2.71Å
273	T	84	Confident	91.5	Very high	89 Å²	89	48.3 Å²	48.3	55%	0.546	25%	0.248	S	C	.	.	G	3₁₀ helix	trans	-78.5	-2.4	177.2	58.1	0	0	0	0	114.4	P271	P271-T273 PolarHBondContact O-N 2.92Å
274	Q	84.2	Confident	91.4	Very high	80 Å²	80	47.5 Å²	47.5	37%	0.374	24%	0.244	S	C	.	.	G	3₁₀ helix	trans	-130.2	27.9	-179.5	-66.5	-173.7	-44.3	0	0	111.1	L270 P271 P272 L276	L270-Q274 WeakPolarHBondContact CD1-O 3.19Å; P271-Q274 PolarHBondContact O-N 2.86Å; P272-Q274 VanDerWaalsContact C-N 3.26Å; P272-Q274 PolarHBondContact O-N 2.71Å; Q274-L276 PolarHBondContact O-N 3.08Å
275	E	90.7	Very high	91.2	Very high	81 Å²	81	45.9 Å²	45.9	38%	0.379	23%	0.228	S	C	.	.			trans	-61.7	127.4	178.1	-166.2	-163.8	162.1	0	0	110.5	N267 K277 S339	N267-E275 HydrophobicContact CB-CG 4.39Å; E275-K277 IonicContact OE1-NZ 3.9Å; E275-K277 PolarHBondContact OE1-NZ 2.95Å; E275-K277 IonicContact OE2-NZ 2.7Å; E275-K277 PolarHBondContact OE2-NZ 2.84Å; E275-S339 WeakPolarHBondContact O-CA 3.15Å
276	L	95.1	Very high	90.8	Very high	6 Å²	6	45.3 Å²	45.3	3%	0.031	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	139.6	177.5	-60	179.3	0	0	0	110.7	L263 L266 N267 L270 Q274 A337 L338 L344 W356	L263-L276 HydrophobicContact CD1-CB 3.55Å; L266-L276 HydrophobicContact CD2-CD1 3.77Å; N267-L276 PolarHBondContact ND2-O 2.98Å; N267-L276 PolarHBondContact OD1-N 3.35Å; L270-L276 HydrophobicContact CD1-CD1 3.86Å; L270-L276 HydrophobicContact CD1-CG 3.88Å; Q274-L276 PolarHBondContact O-N 3.08Å; L276-A337 HydrophobicContact CD1-CB 4.37Å; L276-A337 HydrophobicContact CD2-CB 4.33Å; L276-L338 CarbonylContact C-O 3.55Å; L276-L338 WeakPolarHBondContact CA-O 3.48Å; L276-L344 HydrophobicContact CD2-CD1 4.27Å; L276-W356 HydrophobicContact CD1-CE3 3.85Å; L276-W356 HydrophobicContact CD1-CH2 3.69Å; L276-W356 HydrophobicContact CD1-CZ2 4.45Å; L276-W356 HydrophobicContact CD1-CZ3 3.35Å
277	K	95.3	Very high	89.8	Confident	98 Å²	98	46.7 Å²	46.7	43%	0.426	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	-29	-177.4	-57.5	-60.1	175.9	-179.3	0	112.9	E275 L338	E275-K277 IonicContact OE1-NZ 3.9Å; E275-K277 PolarHBondContact OE1-NZ 2.95Å; E275-K277 IonicContact OE2-NZ 2.7Å; E275-K277 PolarHBondContact OE2-NZ 2.84Å; K277-L338 HydrophobicContact CB-CD2 4.41Å; K277-L338 PolarHBondContact N-O 3.06Å
278	Q	96.9	Very high	88	Confident	39 Å²	39	47.9 Å²	47.9	18%	0.182	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	146	179.5	178.5	66.3	-32.4	0	0	109.5	A337 L338 T426 W427 A430	Q278-A337 CarbonylContact O-C 3.56Å; Q278-A337 WeakPolarHBondContact O-CA 3.3Å; Q278-L338 HydrophobicContact CB-CB 4.03Å; Q278-L338 HydrophobicContact CB-CD2 4.48Å; Q278-L338 PolarHBondContact O-N 3.3Å; Q278-T426 VanDerWaalsContact NE2-CG2 3.28Å; Q278-W427 HydrophobicContact CB-CZ3 4.46Å; Q278-W427 HydrophobicContact CG-CD2 4.05Å; Q278-W427 HydrophobicContact CG-CE3 3.99Å; Q278-W427 HydrophobicContact CG-CH2 3.76Å; Q278-W427 HydrophobicContact CG-CZ2 3.82Å; Q278-W427 HydrophobicContact CG-CZ3 3.84Å; Q278-A430 HydrophobicContact CB-CB 4.43Å
279	L	96.9	Very high	85.8	Confident	4 Å²	4	42 Å²	42	2%	0.021	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	141.5	168.5	58.1	76.8	0	0	0	110.2	L206 N259 Y262 L263 L266 F335 A336 A337 W356	L206-L279 HydrophobicContact CD2-CD1 3.75Å; N259-L279 HydrophobicContact CB-CD1 4.26Å; Y262-L279 HydrophobicContact CD1-CD1 4.47Å; Y262-L279 HydrophobicContact CD1-CD2 4.19Å; Y262-L279 HydrophobicContact CE1-CD2 4.15Å; L263-L279 HydrophobicContact CB-CD2 4.24Å; L263-L279 HydrophobicContact CB-CG 4.37Å; L263-L279 HydrophobicContact CD1-CD2 3.73Å; L263-L279 HydrophobicContact CD1-CG 4.13Å; L266-L279 HydrophobicContact CD2-CD2 4.12Å; L279-F335 HydrophobicContact CB-CE1 4.34Å; L279-F335 HydrophobicContact CB-CZ 4.04Å; L279-F335 HydrophobicContact CD1-CZ 4.12Å; L279-F335 HydrophobicContact CG-CZ 4.47Å; L279-A336 VanDerWaalsContact CA-O 3.29Å; L279-A336 WeakPolarHBondContact CA-O 3.35Å; L279-A337 HydrophobicContact CB-CB 4.25Å; L279-W356 HydrophobicContact CD2-CH2 3.92Å; L279-W356 HydrophobicContact CD2-CZ2 4.34Å
280	D	96.6	Very high	83.3	Confident	29 Å²	29	42.9 Å²	42.9	16%	0.155	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-173.4	172.4	167.9	-138.1	-33.6	0	0	0	111.1	A336 W427	D280-A336 PolarHBondContact N-O 2.98Å; D280-A336 PolarHBondContact O-N 3.42Å; D280-W427 HydrophobicContact CB-CZ2 3.87Å
281	W	96.3	Very high	80.8	Confident	20 Å²	20	49.1 Å²	49.1	8%	0.076	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	136	164.8	-70.6	96.7	0	0	0	111.6	L206 H208 S228 P333 F335 A349	L206-W281 PolarHBondContact O-NE1 3.38Å; H208-W281 HydrophobicContact CB-CB 4.1Å; H208-W281 HydrophobicContact CB-CD2 3.74Å; H208-W281 HydrophobicContact CB-CE3 4.45Å; H208-W281 HydrophobicContact CB-CG 3.55Å; H208-W281 WeakPolarHBondContact CD2-CB 3.32Å; H208-W281 AromaticContact CD2-CG 3.78Å; H208-W281 AromaticContact CG-CD2 3.97Å; H208-W281 AromaticContact CG-CG 3.72Å; S228-W281 WeakPolarHBondContact O-CZ2 3.31Å; W281-P333 HydrophobicContact CE3-CB 4Å; W281-P333 HydrophobicContact CZ3-CB 3.94Å; W281-F335 AromaticContact CD1-CD2 3.94Å; W281-F335 HydrophobicContact CD2-CB 4.26Å; W281-F335 AromaticContact CD2-CD2 3.92Å; W281-F335 HydrophobicContact CD2-CD2 3.92Å; W281-F335 AromaticContact CE2-CD2 3.84Å; W281-F335 HydrophobicContact CE3-CB 4.05Å; W281-F335 HydrophobicContact CG-CD2 4.03Å; W281-F335 HydrophobicContact CH2-CB 4.41Å; W281-F335 HydrophobicContact CZ2-CD2 4.46Å; W281-F335 HydrophobicContact CZ3-CB 4.12Å; W281-F335 AromaticContact NE1-CD2 3.81Å; W281-A349 HydrophobicContact CZ2-CB 4.18Å
282	L	96.2	Very high	78.2	Confident	2 Å²	2	53.8 Å²	53.8	1%	0.01	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	167.8	167.3	-57.2	-179.5	0	0	0	108.7	P333 V334 A336 F401 F416 V418 W427	L282-P333 WeakPolarHBondContact O-CA 3.31Å; L282-V334 HydrophobicContact CB-CG1 3.85Å; L282-V334 PolarHBondContact N-O 2.99Å; L282-V334 PolarHBondContact O-N 3.5Å; L282-V334 VanDerWaalsContact O-O 3.1Å; L282-A336 HydrophobicContact CD1-CB 3.54Å; L282-A336 HydrophobicContact CG-CB 3.92Å; L282-F401 HydrophobicContact CD1-CZ 4.04Å; L282-F401 HydrophobicContact CD2-CE1 4.45Å; L282-F416 HydrophobicContact CB-CD1 4.13Å; L282-F416 HydrophobicContact CD1-CB 4.26Å; L282-F416 HydrophobicContact CD1-CD1 3.84Å; L282-F416 HydrophobicContact CD1-CD2 4.37Å; L282-F416 HydrophobicContact CD1-CE1 4.26Å; L282-F416 HydrophobicContact CD1-CG 3.9Å; L282-V418 HydrophobicContact CD2-CG1 3.34Å; L282-W427 HydrophobicContact CD1-CZ2 4.48Å; L282-W427 HydrophobicContact CD2-CD2 4.18Å; L282-W427 HydrophobicContact CD2-CG 4.3Å; L282-W427 HydrophobicContact CD2-CZ2 4.12Å; L282-W427 HydrophobicContact CG-CZ2 4.3Å
283	V	93.4	Very high	75.4	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	119.9	168.7	-177.8	0	0	0	0	108.5	V210 L213 W331 K332 P395 M398 F416 A417	V210-V283 HydrophobicContact CG2-CG2 4.35Å; L213-V283 HydrophobicContact CD1-CG1 3.69Å; L213-V283 HydrophobicContact CD1-CG2 4.38Å; L213-V283 HydrophobicContact CD2-CG2 4.47Å; V283-W331 HydrophobicContact CB-CE3 4.48Å; V283-W331 HydrophobicContact CG1-CB 3.63Å; V283-W331 HydrophobicContact CG1-CD2 4.29Å; V283-W331 HydrophobicContact CG1-CE3 3.84Å; V283-W331 HydrophobicContact CG1-CG 4.27Å; V283-W331 VanDerWaalsContact O-CZ3 3.31Å; V283-W331 WeakPolarHBondContact O-CZ3 3.32Å; V283-K332 CarbonylContact C-O 3.53Å; V283-K332 WeakPolarHBondContact CA-O 3.42Å; V283-P395 HydrophobicContact CG1-CG 4.22Å; V283-M398 HydrophobicContact CB-CE 4.09Å; V283-M398 HydrophobicContact CG2-CE 3.76Å; V283-M398 HydrophobicContact CG2-SD 4.34Å; V283-F416 CarbonylContact O-C 3.55Å; V283-F416 VanDerWaalsContact O-CA 3.31Å; V283-F416 WeakPolarHBondContact O-CA 3.16Å; V283-A417 HydrophobicContact CB-CB 4.28Å; V283-A417 PolarHBondContact N-O 3.15Å; V283-A417 VanDerWaalsContact N-O 3.08Å; V283-A417 PolarHBondContact O-N 2.69Å
284	E	93.2	Very high	72.7	Confident	1 Å²	1	56.9 Å²	56.9	1%	0.005	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	134.3	-174.3	-176.9	-171.4	-161.7	0	0	111.3	R286 W331 K332 V334 H414 T415 F416	E284-R286 HydrophobicContact CG-CG 4.16Å; E284-R286 PolarHBondContact O-N 3Å; E284-R286 IonicContact OE2-CZ 2.78Å; E284-R286 IonicContact OE2-NE 3.64Å; E284-R286 PolarHBondContact OE2-NE 2.88Å; E284-R286 IonicContact OE2-NH2 2.71Å; E284-R286 PolarHBondContact OE2-NH2 2.82Å; E284-R286 VanDerWaalsContact OE2-NH2 3.15Å; E284-W331 VanDerWaalsContact C-CE3 3.45Å; E284-W331 CarbonylContact O-C 3.52Å; E284-W331 WeakPolarHBondContact O-CA 3.26Å; E284-K332 PolarHBondContact N-O 2.93Å; E284-K332 PolarHBondContact O-N 3.09Å; E284-V334 HydrophobicContact CB-CB 4.4Å; E284-V334 HydrophobicContact CB-CG1 3.83Å; E284-H414 IonicContact OE1-CE1 3.27Å; E284-H414 IonicContact OE1-CG 3.36Å; E284-H414 IonicContact OE1-ND1 2.68Å; E284-H414 PolarHBondContact OE1-ND1 2.9Å; E284-T415 WeakPolarHBondContact CA-O 3.28Å; E284-F416 HydrophobicContact CB-CD1 3.93Å; E284-F416 HydrophobicContact CB-CE1 4.02Å; E284-F416 HydrophobicContact CG-CD1 4.13Å; E284-F416 HydrophobicContact CG-CE1 3.91Å
285	L	89.3	Confident	70.1	Confident	16 Å²	16	64 Å²	64	8%	0.084	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	107.5	171.2	-173.4	63.7	0	0	0	109.2	W331 T415	L285-W331 HydrophobicContact CB-CD2 4.1Å; L285-W331 HydrophobicContact CB-CE3 3.84Å; L285-W331 HydrophobicContact CB-CH2 3.91Å; L285-W331 HydrophobicContact CB-CZ2 4.1Å; L285-W331 HydrophobicContact CB-CZ3 3.76Å; L285-W331 HydrophobicContact CD1-CD2 3.97Å; L285-W331 HydrophobicContact CD1-CG 4.2Å; L285-W331 HydrophobicContact CD1-CZ2 4.19Å; L285-W331 HydrophobicContact CD2-CZ2 4.41Å; L285-W331 HydrophobicContact CG-CZ2 4.47Å; L285-W331 VanDerWaalsContact N-CE3 3.26Å; L285-T415 HydrophobicContact CB-CG2 4.41Å; L285-T415 PolarHBondContact N-O 3.33Å
286	R	83.3	Confident	67.1	Low	53 Å²	53	67.1 Å²	67.1	20%	0.2	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	147.5	176.4	-60	-162.5	-175.1	163.3	2.1	111.4	E284 T329 T330 D347	E284-R286 HydrophobicContact CG-CG 4.16Å; E284-R286 PolarHBondContact O-N 3Å; E284-R286 IonicContact OE2-CZ 2.78Å; E284-R286 IonicContact OE2-NE 3.64Å; E284-R286 PolarHBondContact OE2-NE 2.88Å; E284-R286 IonicContact OE2-NH2 2.71Å; E284-R286 PolarHBondContact OE2-NH2 2.82Å; E284-R286 VanDerWaalsContact OE2-NH2 3.15Å; R286-T329 CarbonylContact O-C 3.51Å; R286-T329 WeakPolarHBondContact O-CA 3.41Å; R286-T330 PolarHBondContact N-O 3.28Å; R286-T330 PolarHBondContact O-N 3.42Å; R286-D347 IonicContact CZ-OD1 3.07Å; R286-D347 IonicContact NH1-OD1 3.72Å; R286-D347 PolarHBondContact NH1-OD1 2.91Å; R286-D347 IonicContact NH2-OD1 3.68Å; R286-D347 PolarHBondContact NH2-OD1 3.07Å
287	C	69.6	Low	63.8	Low	29 Å²	29	69.7 Å²	69.7	20%	0.196	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	134.7	175.4	-52.7	0	0	0	0	110.5	I303 N304 I307 I327 H328	C287-I303 HydrophobicContact CB-CG2 4.08Å; C287-N304 WeakPolarHBondContact CB-OD1 3.28Å; C287-N304 PolarHBondContact SG-OD1 2.9Å; C287-I307 HydrophobicContact CB-CD1 4.28Å; C287-I307 WeakPolarHBondContact SG-CD1 3.18Å; C287-I327 HydrophobicContact CB-CG2 3.88Å; C287-H328 CarbonylContact C-O 3.54Å; C287-H328 WeakPolarHBondContact CA-O 3.46Å
288	T	55.9	Low	60.6	Low	63 Å²	63	72.3 Å²	72.3	39%	0.387	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	112.9	168.3	58.3	0	0	0	0	107.8	S290 H328	T288-S290 PolarHBondContact O-N 2.73Å; T288-H328 PolarHBondContact N-O 3.29Å; T288-H328 PolarHBondContact O-N 3.12Å; T288-H328 WeakPolarHBondContact OG1-CB 3.47Å; T288-H328 PolarHBondContact OG1-O 3.18Å
289	S	43.5	Very low	57.5	Low	62 Å²	62	78.4 Å²	78.4	43%	0.434	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	114.9	164.5	54.6	0	0	0	0	108.4	D291	S289-D291 PolarHBondContact O-N 2.82Å
290	S	35.1	Very low	54.4	Low	60 Å²	60	85.7 Å²	85.7	42%	0.42	47%	0.47	S	S	.	.			trans	-72.1	123.9	164.5	48.9	0	0	0	0	108.8	T288	T288-S290 PolarHBondContact O-N 2.73Å
291	D	30.4	Very low	51.7	Low	149 Å²	149	89.9 Å²	89.9	80%	0.797	49%	0.492	S	S	*	.			trans	114.1	92.9	165.7	-58.6	-28.3	0	0	0	116.1	S289	S289-D291 PolarHBondContact O-N 2.82Å
292	V	30.7	Very low	49.1	Very low	124 Å²	124	93.5 Å²	93.5	75%	0.752	51%	0.513	S	S	*	.				161.1	121.5	122.4	167.8	0	0	0	0	108.1
293	P	27.9	Very low	46.6	Very low	116 Å²	116	96.3 Å²	96.3	75%	0.753	53%	0.528	S	S	*	.			trans	-73.5	132.7	175.5	30	-31.1	0	0	0	110.6
294	N	26.8	Very low	44	Very low	162 Å²	162	98.6 Å²	98.6	87%	0.866	54%	0.54	S	S	*	.			trans	44.3	86.8	158.4	-74	-12	0	0	0	117
295	R	28.9	Very low	41.4	Very low	231 Å²	231	99.5 Å²	99.5	87%	0.872	55%	0.549	S	S	*	.			trans	-136.7	102.9	142.3	-74.2	-166.9	179.8	-168.7	0.4	109.7
296	V	27.9	Very low	39.2	Very low	145 Å²	145	103.4 Å²	103.4	88%	0.879	57%	0.57	S	S	*	*			trans	33.8	109.9	140.5	-170.5	0	0	0	0	116.8
297	G	26.3	Very low	37.4	Very low	60 Å²	60	102.1 Å²	102.1	62%	0.619	57%	0.567	S	S	*	*	S	Bend	trans	73.2	118	139.4	0	0	0	0	0	117
298	D	26.9	Very low	36.3	Very low	153 Å²	153	101.1 Å²	101.1	82%	0.818	56%	0.56	S	S	*	*	S	Bend	trans	70.6	131.3	161	-51.1	-26.8	0	0	0	116.1
299	H	31.9	Very low	35.6	Very low	168 Å²	168	100 Å²	100	78%	0.778	56%	0.555	S	S	*	*			trans	103.4	35.1	172.9	-57.4	-68.4	0	0	0	120.4
300	M	33.5	Very low	35.6	Very low	156 Å²	156	102 Å²	102	77%	0.768	56%	0.56	S	S	*	*			trans	-94	-2.5	170.6	-103.2	-163.4	178.8	0	0	116.3
301	D	38.5	Very low	36	Very low	117 Å²	117	101 Å²	101	63%	0.626	55%	0.55	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91	-7.2	-168.5	-61.7	-34.9	0	0	0	115.7
302	D	42.8	Very low	36.4	Very low	96 Å²	96	98.4 Å²	98.4	51%	0.513	54%	0.536	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.8	-10.5	-173.3	-75.6	-30.7	0	0	0	115.2
303	I	42.2	Very low	36.8	Very low	62 Å²	62	96 Å²	96	32%	0.318	52%	0.524	S	S	.	.	H	α-helix	trans	-82.7	-31.5	-171.3	-57.8	178.6	0	0	0	112.5	C287 I327	C287-I303 HydrophobicContact CB-CG2 4.08Å; I303-I327 HydrophobicContact CG2-CG2 4.29Å
304	N	38.8	Very low	37.2	Very low	48 Å²	48	95 Å²	95	26%	0.257	53%	0.526	S	S	.	.	H	α-helix	trans	-75.8	-26.5	178.4	-83.4	1.1	0	0	0	112.7	C287	C287-N304 WeakPolarHBondContact CB-OD1 3.28Å; C287-N304 PolarHBondContact SG-OD1 2.9Å
305	G	39.1	Very low	37.4	Very low	19 Å²	19	90.4 Å²	90.4	20%	0.196	52%	0.517	C	S	.	.	H	α-helix	trans	-68.9	-33.2	178.3	0	0	0	0	0	113.9	S309	G305-S309 PolarHBondContact O-OG 3.14Å
306	N	42.5	Very low	37.4	Very low	98 Å²	98	86.3 Å²	86.3	52%	0.524	51%	0.512	S	S	.	.	H	α-helix	trans	-80.1	-26.4	-173.7	-81.2	-11.9	0	0	0	114.6	S309 D310	N306-S309 VanDerWaalsContact CA-OG 3.31Å; N306-S309 WeakPolarHBondContact CA-OG 3.28Å; N306-S309 PolarHBondContact O-N 3.06Å; N306-S309 PolarHBondContact O-OG 2.96Å; N306-D310 VanDerWaalsContact O-CB 3.31Å; N306-D310 WeakPolarHBondContact O-CB 3.21Å; N306-D310 PolarHBondContact O-N 2.74Å
307	I	45.7	Very low	37.4	Very low	27 Å²	27	88.7 Å²	88.7	14%	0.138	51%	0.513	C	S	.	.	H	α-helix	trans	-71.6	-36.9	-177.6	-72.9	159.1	0	0	0	111.5	C287 D310 I311 I327 T329	C287-I307 HydrophobicContact CB-CD1 4.28Å; C287-I307 WeakPolarHBondContact SG-CD1 3.18Å; I307-D310 PolarHBondContact O-N 2.75Å; I307-I311 HydrophobicContact CG2-CD1 3.56Å; I307-I311 HydrophobicContact CG2-CG1 4.29Å; I307-I311 VanDerWaalsContact O-CB 3.29Å; I307-I311 WeakPolarHBondContact O-CB 3.43Å; I307-I311 VanDerWaalsContact O-CD1 3.32Å; I307-I311 WeakPolarHBondContact O-CD1 3.29Å; I307-I311 WeakPolarHBondContact O-CG1 3.45Å; I307-I311 PolarHBondContact O-N 2.95Å; I307-I327 HydrophobicContact CD1-CG2 4.04Å; I307-T329 HydrophobicContact CD1-CG2 4.21Å
308	V	46.5	Very low	37.7	Very low	8 Å²	8	92 Å²	92	5%	0.048	52%	0.521	C	S	.	.	H	α-helix	trans	-73.7	-36.2	177.1	-175.9	0	0	0	0	110.6	I311 L312 V402	V308-I311 PolarHBondContact O-N 3.33Å; V308-L312 HydrophobicContact CG1-CD1 3.73Å; V308-L312 HydrophobicContact CG1-CG 4.24Å; V308-L312 VanDerWaalsContact O-CB 3.29Å; V308-L312 WeakPolarHBondContact O-CB 3.07Å; V308-L312 WeakPolarHBondContact O-CG 3.35Å; V308-L312 PolarHBondContact O-N 3.47Å; V308-V402 HydrophobicContact CG1-CG1 4.3Å; V308-V402 HydrophobicContact CG2-CG1 4.46Å
309	S	42.2	Very low	37.6	Very low	39 Å²	39	91.9 Å²	91.9	27%	0.273	53%	0.527	S	S	.	.	H	α-helix	trans	-64.2	-43.2	170.1	56.1	0	0	0	0	111	G305 N306 I311 L312 S313	G305-S309 PolarHBondContact O-OG 3.14Å; N306-S309 VanDerWaalsContact CA-OG 3.31Å; N306-S309 WeakPolarHBondContact CA-OG 3.28Å; N306-S309 PolarHBondContact O-N 3.06Å; N306-S309 PolarHBondContact O-OG 2.96Å; S309-I311 VanDerWaalsContact C-N 3.34Å; S309-I311 PolarHBondContact O-N 3.4Å; S309-L312 CarbonylContact O-C 3.6Å; S309-L312 PolarHBondContact O-N 2.74Å; S309-L312 VanDerWaalsContact O-N 3.15Å; S309-S313 WeakPolarHBondContact O-CA 3.37Å; S309-S313 WeakPolarHBondContact O-CB 3.39Å; S309-S313 PolarHBondContact O-N 3.47Å; S309-S313 PolarHBondContact O-OG 3.19Å
310	D	42.4	Very low	37.7	Very low	103 Å²	103	88.2 Å²	88.2	55%	0.551	53%	0.525	S	S	*	.	H	α-helix	trans	-65.9	-37.2	178.6	-68.3	-18.5	0	0	0	111.9	N306 I307 L312 A314	N306-D310 VanDerWaalsContact O-CB 3.31Å; N306-D310 WeakPolarHBondContact O-CB 3.21Å; N306-D310 PolarHBondContact O-N 2.74Å; I307-D310 PolarHBondContact O-N 2.75Å; D310-L312 VanDerWaalsContact C-N 3.33Å; D310-L312 PolarHBondContact O-N 2.86Å; D310-A314 WeakPolarHBondContact O-CB 3.29Å; D310-A314 PolarHBondContact O-N 2.95Å
311	I	44.1	Very low	37.3	Very low	41 Å²	41	88.3 Å²	88.3	21%	0.21	54%	0.535	C	S	.	.	H	α-helix	trans	-65.8	-34.4	173.6	-70.9	164.9	0	0	0	111.9	I307 V308 S309 L375	I307-I311 HydrophobicContact CG2-CD1 3.56Å; I307-I311 HydrophobicContact CG2-CG1 4.29Å; I307-I311 VanDerWaalsContact O-CB 3.29Å; I307-I311 WeakPolarHBondContact O-CB 3.43Å; I307-I311 VanDerWaalsContact O-CD1 3.32Å; I307-I311 WeakPolarHBondContact O-CD1 3.29Å; I307-I311 WeakPolarHBondContact O-CG1 3.45Å; I307-I311 PolarHBondContact O-N 2.95Å; V308-I311 PolarHBondContact O-N 3.33Å; S309-I311 VanDerWaalsContact C-N 3.34Å; S309-I311 PolarHBondContact O-N 3.4Å; I311-L375 HydrophobicContact CD1-CD2 4.32Å
312	L	39.3	Very low	37.2	Very low	93 Å²	93	86.8 Å²	86.8	49%	0.487	54%	0.539	S	S	.	.	H	α-helix	trans	-92	-17.3	-179.3	-65	174.7	0	0	0	113.6	V308 S309 D310	V308-L312 HydrophobicContact CG1-CD1 3.73Å; V308-L312 HydrophobicContact CG1-CG 4.24Å; V308-L312 VanDerWaalsContact O-CB 3.29Å; V308-L312 WeakPolarHBondContact O-CB 3.07Å; V308-L312 WeakPolarHBondContact O-CG 3.35Å; V308-L312 PolarHBondContact O-N 3.47Å; S309-L312 CarbonylContact O-C 3.6Å; S309-L312 PolarHBondContact O-N 2.74Å; S309-L312 VanDerWaalsContact O-N 3.15Å; D310-L312 VanDerWaalsContact C-N 3.33Å; D310-L312 PolarHBondContact O-N 2.86Å
313	S	39.3	Very low	36.6	Very low	74 Å²	74	91.5 Å²	91.5	52%	0.517	56%	0.557	S	S	.	*	H	α-helix	trans	-108.5	-3.4	-173.8	-43.1	0	0	0	0	113.8	S309 G315 D316	S309-S313 WeakPolarHBondContact O-CA 3.37Å; S309-S313 WeakPolarHBondContact O-CB 3.39Å; S309-S313 PolarHBondContact O-N 3.47Å; S309-S313 PolarHBondContact O-OG 3.19Å; S313-G315 PolarHBondContact O-N 2.9Å; S313-D316 PolarHBondContact O-N 3.45Å
314	A	35.8	Very low	36.1	Very low	95 Å²	95	93.8 Å²	93.8	79%	0.785	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.3	13.8	177	0	0	0	0	0	115.1	D310	D310-A314 WeakPolarHBondContact O-CB 3.29Å; D310-A314 PolarHBondContact O-N 2.95Å
315	G	30.7	Very low	36.1	Very low	65 Å²	65	99.5 Å²	99.5	67%	0.67	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.9	-9.1	175.2	0	0	0	0	0	115.6	S313	S313-G315 PolarHBondContact O-N 2.9Å
316	D	29.5	Very low	36.2	Very low	146 Å²	146	103.5 Å²	103.5	78%	0.781	62%	0.62	S	S	*	*	S	Bend	trans	-116.8	117.4	-179.9	-89.3	-27.9	0	0	0	112.8	S313 T318	S313-D316 PolarHBondContact O-N 3.45Å; D316-T318 PolarHBondContact O-N 3.24Å
317	H	27.7	Very low	36.6	Very low	194 Å²	194	102 Å²	102	90%	0.898	61%	0.612	S	S	*	*			trans	-70.5	94.6	177.2	-64.8	-63.2	0	0	0	111.4
318	T	32.2	Very low	37.5	Very low	129 Å²	129	104.1 Å²	104.1	79%	0.791	62%	0.621	S	S	*	*			trans	-132.1	117.4	156.7	53.4	0	0	0	0	111.3	D316 A320	D316-T318 PolarHBondContact O-N 3.24Å; T318-A320 PolarHBondContact O-N 2.91Å
319	T	26	Very low	38.5	Very low	152 Å²	152	104.1 Å²	104.1	93%	0.933	62%	0.621	S	S	*	*			trans	-61.1	109.2	178.6	46.5	0	0	0	0	111.9
320	A	32.8	Very low	40.3	Very low	90 Å²	90	102.9 Å²	102.9	74%	0.744	61%	0.612	S	S	*	*			trans	-130.2	103.4	161.7	0	0	0	0	0	109.3	T318 A322	T318-A320 PolarHBondContact O-N 2.91Å; A320-A322 PolarHBondContact O-N 2.98Å
321	T	26.5	Very low	42.4	Very low	158 Å²	158	98.8 Å²	98.8	97%	0.969	59%	0.588	S	S	*	*			trans	-62.8	96.6	165.8	33.2	0	0	0	0	109.5
322	A	35	Very low	44.5	Very low	86 Å²	86	99.1 Å²	99.1	71%	0.711	59%	0.588	S	S	*	*			trans	-115.4	133.9	168.2	0	0	0	0	0	109.1	A320 S324	A320-A322 PolarHBondContact O-N 2.98Å; A322-S324 PolarHBondContact O-N 3.34Å
323	H	30	Very low	47	Very low	194 Å²	194	95.5 Å²	95.5	90%	0.898	57%	0.571	S	S	*	*			trans	-50.6	113.8	177.1	-73.8	-57	0	0	0	111	Q325	H323-Q325 PolarHBondContact O-N 2.99Å
324	S	32.6	Very low	49.6	Very low	111 Å²	111	92 Å²	92	78%	0.776	55%	0.546	S	S	*	.			trans	-67.7	87.2	-178.9	-175.6	0	0	0	0	110.8	A322 L326	A322-S324 PolarHBondContact O-N 3.34Å; S324-L326 PolarHBondContact O-N 2.73Å
325	Q	37.7	Very low	52.5	Low	168 Å²	168	87.5 Å²	87.5	79%	0.785	51%	0.509	S	S	*	.			trans	-65	118.8	159.6	-72.6	178	-9.9	0	0	107.3	H323 I327	H323-Q325 PolarHBondContact O-N 2.99Å; Q325-I327 PolarHBondContact O-N 3.09Å
326	L	41.6	Very low	55.7	Low	102 Å²	102	84.4 Å²	84.4	53%	0.534	48%	0.477	S	S	.	.			trans	-67.5	104.1	178.1	-78.5	154.8	0	0	0	108.7	S324 H328 E388	S324-L326 PolarHBondContact O-N 2.73Å; L326-H328 PolarHBondContact O-N 2.94Å; L326-E388 WeakPolarHBondContact CD2-OE1 3.35Å
327	I	52.2	Low	58.9	Low	67 Å²	67	77.5 Å²	77.5	34%	0.344	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	112.4	174	-57.1	170.3	0	0	0	107.7	C287 I303 I307 Q325 T329	C287-I327 HydrophobicContact CB-CG2 3.88Å; I303-I327 HydrophobicContact CG2-CG2 4.29Å; I307-I327 HydrophobicContact CD1-CG2 4.04Å; Q325-I327 PolarHBondContact O-N 3.09Å; I327-T329 PolarHBondContact O-N 3.2Å
328	H	62.9	Low	62.3	Low	71 Å²	71	68.3 Å²	68.3	33%	0.329	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	119.1	175.5	-71.9	-56.8	0	0	0	110.1	C287 T288 L326	C287-H328 CarbonylContact C-O 3.54Å; C287-H328 WeakPolarHBondContact CA-O 3.46Å; T288-H328 PolarHBondContact N-O 3.29Å; T288-H328 PolarHBondContact O-N 3.12Å; T288-H328 WeakPolarHBondContact OG1-CB 3.47Å; T288-H328 PolarHBondContact OG1-O 3.18Å; L326-H328 PolarHBondContact O-N 2.94Å
329	T	69	Low	65.2	Low	8 Å²	8	62.5 Å²	62.5	5%	0.049	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	145.2	172.3	53.8	0	0	0	0	111.1	R286 I307 I327	R286-T329 CarbonylContact O-C 3.51Å; R286-T329 WeakPolarHBondContact O-CA 3.41Å; I307-T329 HydrophobicContact CD1-CG2 4.21Å; I327-T329 PolarHBondContact O-N 3.2Å
330	T	78.8	Confident	68.3	Low	13 Å²	13	57.8 Å²	57.8	8%	0.08	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147	135.2	178.4	58.8	0	0	0	0	110.5	A149 R286	A149-T330 HydrophobicContact CB-CG2 4.31Å; A149-T330 WeakPolarHBondContact O-CB 3.25Å; A149-T330 WeakPolarHBondContact O-CG2 3.42Å; R286-T330 PolarHBondContact N-O 3.28Å; R286-T330 PolarHBondContact O-N 3.42Å
331	W	86.7	Confident	71.2	Confident	17 Å²	17	60.6 Å²	60.6	6%	0.064	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	130	170.2	-70.5	101.4	0	0	0	110.5	L213 V283 E284 L285 Y393 P394 P395 T400 T415 A417	L213-W331 HydrophobicContact CD1-CB 4.24Å; V283-W331 HydrophobicContact CB-CE3 4.48Å; V283-W331 HydrophobicContact CG1-CB 3.63Å; V283-W331 HydrophobicContact CG1-CD2 4.29Å; V283-W331 HydrophobicContact CG1-CE3 3.84Å; V283-W331 HydrophobicContact CG1-CG 4.27Å; V283-W331 VanDerWaalsContact O-CZ3 3.31Å; V283-W331 WeakPolarHBondContact O-CZ3 3.32Å; E284-W331 VanDerWaalsContact C-CE3 3.45Å; E284-W331 CarbonylContact O-C 3.52Å; E284-W331 WeakPolarHBondContact O-CA 3.26Å; L285-W331 HydrophobicContact CB-CD2 4.1Å; L285-W331 HydrophobicContact CB-CE3 3.84Å; L285-W331 HydrophobicContact CB-CH2 3.91Å; L285-W331 HydrophobicContact CB-CZ2 4.1Å; L285-W331 HydrophobicContact CB-CZ3 3.76Å; L285-W331 HydrophobicContact CD1-CD2 3.97Å; L285-W331 HydrophobicContact CD1-CG 4.2Å; L285-W331 HydrophobicContact CD1-CZ2 4.19Å; L285-W331 HydrophobicContact CD2-CZ2 4.41Å; L285-W331 HydrophobicContact CG-CZ2 4.47Å; L285-W331 VanDerWaalsContact N-CE3 3.26Å; W331-Y393 PolarHBondContact NE1-O 2.79Å; W331-P394 HydrophobicContact CH2-CB 4.18Å; W331-P394 VanDerWaalsContact CZ2-CA 3.5Å; W331-P394 HydrophobicContact CZ2-CB 3.84Å; W331-P395 HydrophobicContact CB-CG 4.04Å; W331-P395 HydrophobicContact CG-CG 4.09Å; W331-T400 HydrophobicContact CH2-CG2 3.74Å; W331-T400 HydrophobicContact CZ2-CG2 4.32Å; W331-T415 HydrophobicContact CH2-CG2 3.85Å; W331-T415 HydrophobicContact CZ3-CG2 4.44Å; W331-A417 HydrophobicContact CE3-CB 4.09Å; W331-A417 HydrophobicContact CH2-CB 3.91Å; W331-A417 HydrophobicContact CZ3-CB 3.57Å
332	K	87.9	Confident	74.6	Confident	49 Å²	49	55.3 Å²	55.3	21%	0.213	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	142.5	177.9	-65.2	-160.7	-173.9	-179.8	0	110.8	V283 E284	V283-K332 CarbonylContact C-O 3.53Å; V283-K332 WeakPolarHBondContact CA-O 3.42Å; E284-K332 PolarHBondContact N-O 2.93Å; E284-K332 PolarHBondContact O-N 3.09Å
333	P	91.9	Very high	77.6	Confident	17 Å²	17	51.2 Å²	51.2	11%	0.11	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63	142	171.7	28.9	-33.7	0	0	0	110.1	M152 W281 L282	M152-P333 HydrophobicContact SD-CG 3.79Å; W281-P333 HydrophobicContact CE3-CB 4Å; W281-P333 HydrophobicContact CZ3-CB 3.94Å; L282-P333 WeakPolarHBondContact O-CA 3.31Å
334	V	94.3	Very high	80.8	Confident	1 Å²	1	43 Å²	43	1%	0.006	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	135.5	172.1	66.4	0	0	0	0	107.8	L282 E284 L345 Y346 F416	L282-V334 HydrophobicContact CB-CG1 3.85Å; L282-V334 PolarHBondContact N-O 2.99Å; L282-V334 PolarHBondContact O-N 3.5Å; L282-V334 VanDerWaalsContact O-O 3.1Å; E284-V334 HydrophobicContact CB-CB 4.4Å; E284-V334 HydrophobicContact CB-CG1 3.83Å; V334-L345 HydrophobicContact CG2-CB 3.94Å; V334-L345 HydrophobicContact CG2-CD2 4.27Å; V334-Y346 VanDerWaalsContact CG2-O 3.31Å; V334-Y346 WeakPolarHBondContact CG2-O 3.14Å; V334-F416 HydrophobicContact CG1-CD1 4.2Å; V334-F416 HydrophobicContact CG1-CE1 3.99Å
335	F	96.5	Very high	83.8	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	120.1	173.2	-172.1	-94	0	0	0	108.7	L206 L279 W281 Y346 A349 W356	L206-F335 HydrophobicContact CD2-CE2 3.91Å; L206-F335 HydrophobicContact CD2-CZ 3.83Å; L279-F335 HydrophobicContact CB-CE1 4.34Å; L279-F335 HydrophobicContact CB-CZ 4.04Å; L279-F335 HydrophobicContact CD1-CZ 4.12Å; L279-F335 HydrophobicContact CG-CZ 4.47Å; W281-F335 AromaticContact CD1-CD2 3.94Å; W281-F335 HydrophobicContact CD2-CB 4.26Å; W281-F335 AromaticContact CD2-CD2 3.92Å; W281-F335 HydrophobicContact CD2-CD2 3.92Å; W281-F335 AromaticContact CE2-CD2 3.84Å; W281-F335 HydrophobicContact CE3-CB 4.05Å; W281-F335 HydrophobicContact CG-CD2 4.03Å; W281-F335 HydrophobicContact CH2-CB 4.41Å; W281-F335 HydrophobicContact CZ2-CD2 4.46Å; W281-F335 HydrophobicContact CZ3-CB 4.12Å; W281-F335 AromaticContact NE1-CD2 3.81Å; F335-Y346 HydrophobicContact CD1-CD2 4.13Å; F335-Y346 PolarHBondContact N-O 3.08Å; F335-Y346 PolarHBondContact O-N 3.25Å; F335-A349 HydrophobicContact CD1-CB 4.22Å; F335-A349 HydrophobicContact CD2-CB 3.53Å; F335-A349 HydrophobicContact CE1-CB 4.3Å; F335-A349 HydrophobicContact CE2-CB 3.63Å; F335-A349 HydrophobicContact CG-CB 3.83Å; F335-A349 HydrophobicContact CZ-CB 4.01Å; F335-W356 AromaticContact CE1-CH2 3.76Å; F335-W356 HydrophobicContact CE1-CH2 3.76Å; F335-W356 HydrophobicContact CE1-CZ2 4.39Å; F335-W356 HydrophobicContact CE1-CZ3 4.45Å; F335-W356 HydrophobicContact CZ-CH2 4.43Å
336	A	97.9	Very high	86.5	Confident	0 Å²	0	30.2 Å²	30.2	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	142.5	-177.9	0	0	0	0	0	110.6	L279 D280 L282 L344 L345 W427	L279-A336 VanDerWaalsContact CA-O 3.29Å; L279-A336 WeakPolarHBondContact CA-O 3.35Å; D280-A336 PolarHBondContact N-O 2.98Å; D280-A336 PolarHBondContact O-N 3.42Å; L282-A336 HydrophobicContact CD1-CB 3.54Å; L282-A336 HydrophobicContact CG-CB 3.92Å; A336-L344 CarbonylContact C-O 3.5Å; A336-L344 WeakPolarHBondContact CA-O 3.35Å; A336-L345 HydrophobicContact CB-CD2 3.89Å; A336-W427 HydrophobicContact CB-CH2 3.54Å; A336-W427 HydrophobicContact CB-CZ2 4.14Å; A336-W427 HydrophobicContact CB-CZ3 4.1Å
337	A	97.7	Very high	88.8	Confident	0 Å²	0	29.2 Å²	29.2	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	141.1	169.8	0	0	0	0	0	110.1	L276 Q278 L279 L344 Y346 W356	L276-A337 HydrophobicContact CD1-CB 4.37Å; L276-A337 HydrophobicContact CD2-CB 4.33Å; Q278-A337 CarbonylContact O-C 3.56Å; Q278-A337 WeakPolarHBondContact O-CA 3.3Å; L279-A337 HydrophobicContact CB-CB 4.25Å; A337-L344 HydrophobicContact CB-CB 4.4Å; A337-L344 PolarHBondContact N-O 3.26Å; A337-L344 WeakPolarHBondContact O-CA 2.99Å; A337-L344 WeakPolarHBondContact O-CB 3.31Å; A337-L344 PolarHBondContact O-N 2.83Å; A337-Y346 HydrophobicContact CB-CE2 4.24Å; A337-W356 HydrophobicContact CB-CH2 4.23Å; A337-W356 HydrophobicContact CB-CZ3 3.7Å
338	L	97.6	Very high	90.5	Very high	1 Å²	1	28.6 Å²	28.6	1%	0.005	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	123.1	178.6	-170.9	72.7	0	0	0	108.8	L276 K277 Q278 L343 L365 A430 I431	L276-L338 CarbonylContact C-O 3.55Å; L276-L338 WeakPolarHBondContact CA-O 3.48Å; K277-L338 HydrophobicContact CB-CD2 4.41Å; K277-L338 PolarHBondContact N-O 3.06Å; Q278-L338 HydrophobicContact CB-CB 4.03Å; Q278-L338 HydrophobicContact CB-CD2 4.48Å; Q278-L338 PolarHBondContact O-N 3.3Å; L338-L343 HydrophobicContact CD1-CB 4.26Å; L338-L343 HydrophobicContact CD1-CD1 4.3Å; L338-L365 HydrophobicContact CD1-CD1 3.64Å; L338-L365 HydrophobicContact CD1-CD2 3.55Å; L338-L365 HydrophobicContact CD1-CG 4.14Å; L338-L365 HydrophobicContact CG-CD1 4.23Å; L338-A430 VanDerWaalsContact CD2-C 3.49Å; L338-A430 HydrophobicContact CD2-CB 3.67Å; L338-A430 VanDerWaalsContact CD2-O 3.31Å; L338-A430 WeakPolarHBondContact CD2-O 3.3Å; L338-I431 HydrophobicContact CD1-CG1 4.1Å
339	S	94.5	Very high	91.8	Very high	7 Å²	7	25.2 Å²	25.2	5%	0.049	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	-171.6	169.7	74.9	0	0	0	0	111.3	E275 R341 D342 L365	E275-S339 WeakPolarHBondContact O-CA 3.15Å; S339-R341 PolarHBondContact O-N 3.33Å; S339-R341 PolarHBondContact OG-N 3.44Å; S339-R341 VanDerWaalsContact OG-N 3.1Å; S339-D342 PolarHBondContact N-O 3.02Å; S339-D342 PolarHBondContact OG-N 3.27Å; S339-D342 PolarHBondContact OG-O 3.01Å; S339-L365 WeakPolarHBondContact O-CD1 3.46Å
340	D	91	Very high	92.8	Very high	53 Å²	53	25 Å²	25	28%	0.283	12%	0.122	S	C	.	.	S	Bend	trans	-67.6	-17.8	168.4	65.2	-31.7	0	0	0	113.3
341	R	93.4	Very high	92.8	Very high	149 Å²	149	27.5 Å²	27.5	56%	0.562	14%	0.138	S	C	*	.	S	Bend	trans	-123.9	-32.3	-170.3	-68.9	167.2	-167.4	-152.4	-3.7	114.3	S339 P364 L365	S339-R341 PolarHBondContact O-N 3.33Å; S339-R341 PolarHBondContact OG-N 3.44Å; S339-R341 VanDerWaalsContact OG-N 3.1Å; R341-P364 CarbonylContact O-C 3.57Å; R341-L365 WeakPolarHBondContact O-CB 3.19Å; R341-L365 PolarHBondContact O-N 2.96Å
342	D	96.9	Very high	92.4	Very high	47 Å²	47	28 Å²	28	25%	0.251	14%	0.144	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	145.6	-165.2	-57.2	-67.2	0	0	0	111.7	S339 L344 H363 P364	S339-D342 PolarHBondContact N-O 3.02Å; S339-D342 PolarHBondContact OG-N 3.27Å; S339-D342 PolarHBondContact OG-O 3.01Å; D342-L344 HydrophobicContact CB-CD2 3.61Å; D342-L344 HydrophobicContact CB-CG 4.31Å; D342-H363 CarbonylContact C-O 3.55Å; D342-H363 VanDerWaalsContact CA-O 3.3Å; D342-H363 WeakPolarHBondContact CA-O 3.3Å; D342-P364 WeakPolarHBondContact OD1-CA 3.45Å
343	L	97.9	Very high	91.9	Very high	1 Å²	1	28.8 Å²	28.8	1%	0.005	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	114.2	158.2	172	67	0	0	0	108.1	L338 L345 A362 H363 L365 T403 F416 W427	L338-L343 HydrophobicContact CD1-CB 4.26Å; L338-L343 HydrophobicContact CD1-CD1 4.3Å; L343-L345 HydrophobicContact CG-CD2 4.39Å; L343-A362 WeakPolarHBondContact O-CA 3.38Å; L343-H363 HydrophobicContact CB-CB 4.21Å; L343-H363 PolarHBondContact N-O 3.29Å; L343-H363 PolarHBondContact O-N 2.98Å; L343-L365 HydrophobicContact CB-CD2 4.16Å; L343-T403 HydrophobicContact CD2-CG2 3.98Å; L343-F416 HydrophobicContact CD2-CE2 4.44Å; L343-W427 HydrophobicContact CD1-CZ3 4.25Å
344	L	97.5	Very high	91.5	Very high	21 Å²	21	33.9 Å²	33.9	11%	0.11	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	132.3	-175.8	-52	177.4	0	0	0	109.9	L276 A336 A337 D342 Y346 P359 A362	L276-L344 HydrophobicContact CD2-CD1 4.27Å; A336-L344 CarbonylContact C-O 3.5Å; A336-L344 WeakPolarHBondContact CA-O 3.35Å; A337-L344 HydrophobicContact CB-CB 4.4Å; A337-L344 PolarHBondContact N-O 3.26Å; A337-L344 WeakPolarHBondContact O-CA 2.99Å; A337-L344 WeakPolarHBondContact O-CB 3.31Å; A337-L344 PolarHBondContact O-N 2.83Å; D342-L344 HydrophobicContact CB-CD2 3.61Å; D342-L344 HydrophobicContact CB-CG 4.31Å; L344-Y346 HydrophobicContact CB-CE2 3.73Å; L344-P359 HydrophobicContact CB-CB 4.18Å; L344-P359 HydrophobicContact CD2-CB 4.31Å; L344-P359 HydrophobicContact CD2-CG 4.08Å; L344-A362 HydrophobicContact CD2-CB 3.73Å
345	L	96.8	Very high	91.1	Very high	2 Å²	2	37.6 Å²	37.6	1%	0.01	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	135	177.8	-55.5	179.9	0	0	0	110.5	V334 A336 L343 V360 Q361 F416	V334-L345 HydrophobicContact CG2-CB 3.94Å; V334-L345 HydrophobicContact CG2-CD2 4.27Å; A336-L345 HydrophobicContact CB-CD2 3.89Å; L343-L345 HydrophobicContact CG-CD2 4.39Å; L345-V360 WeakPolarHBondContact O-CB 3.21Å; L345-V360 PolarHBondContact O-N 2.89Å; L345-Q361 HydrophobicContact CB-CB 4.22Å; L345-Q361 HydrophobicContact CD1-CB 4.31Å; L345-Q361 PolarHBondContact N-O 2.84Å; L345-Q361 PolarHBondContact O-N 2.83Å; L345-F416 HydrophobicContact CD1-CE1 4.39Å; L345-F416 HydrophobicContact CD1-CZ 4.04Å; L345-F416 HydrophobicContact CD2-CE1 4.21Å; L345-F416 HydrophobicContact CD2-CZ 4Å
346	Y	93.9	Very high	90.7	Very high	8 Å²	8	38.3 Å²	38.3	3%	0.031	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	146.8	178.5	-54	-97.5	0	0	0	109.6	V334 F335 A337 L344 T348 P350 E355 W356 P359	V334-Y346 VanDerWaalsContact CG2-O 3.31Å; V334-Y346 WeakPolarHBondContact CG2-O 3.14Å; F335-Y346 HydrophobicContact CD1-CD2 4.13Å; F335-Y346 PolarHBondContact N-O 3.08Å; F335-Y346 PolarHBondContact O-N 3.25Å; A337-Y346 HydrophobicContact CB-CE2 4.24Å; L344-Y346 HydrophobicContact CB-CE2 3.73Å; Y346-T348 VanDerWaalsContact C-N 3.26Å; Y346-T348 WeakPolarHBondContact CB-O 3.29Å; Y346-T348 PolarHBondContact O-N 3.24Å; Y346-P350 HydrophobicContact CD1-CG 3.47Å; Y346-P350 VanDerWaalsContact CD1-CG 3.47Å; Y346-P350 HydrophobicContact CD2-CG 4.01Å; Y346-P350 HydrophobicContact CE1-CG 3.6Å; Y346-P350 HydrophobicContact CE2-CG 4.13Å; Y346-P350 HydrophobicContact CG-CG 3.69Å; Y346-E355 VanDerWaalsContact CE1-O 3.31Å; Y346-E355 WeakPolarHBondContact CE1-O 3.5Å; Y346-W356 HydrophobicContact CE2-CE3 4.28Å; Y346-W356 HydrophobicContact CE2-CZ3 4.12Å; Y346-W356 AromaticContact CZ-CE3 3.99Å; Y346-W356 PolarHBondContact OH-O 3.04Å; Y346-P359 HydrophobicContact CD1-CB 4.3Å; Y346-P359 HydrophobicContact CE1-CB 3.77Å; Y346-P359 HydrophobicContact CE2-CB 4.32Å
347	D	88.8	Confident	90.2	Very high	81 Å²	81	41 Å²	41	43%	0.433	21%	0.211	S	C	.	.	S	Bend	trans	-69.6	-27.3	173.9	-73.2	-42	0	0	0	112.1	R286	R286-D347 IonicContact CZ-OD1 3.07Å; R286-D347 IonicContact NH1-OD1 3.72Å; R286-D347 PolarHBondContact NH1-OD1 2.91Å; R286-D347 IonicContact NH2-OD1 3.68Å; R286-D347 PolarHBondContact NH2-OD1 3.07Å
348	T	89.4	Confident	89.8	Confident	55 Å²	55	46.5 Å²	46.5	34%	0.337	24%	0.241	S	C	.	.	S	Bend	trans	-139	159.1	176.9	60.1	0	0	0	0	111	D229 Y346 P350	D229-T348 VanDerWaalsContact O-CG2 3.29Å; D229-T348 WeakPolarHBondContact O-CG2 3.31Å; Y346-T348 VanDerWaalsContact C-N 3.26Å; Y346-T348 WeakPolarHBondContact CB-O 3.29Å; Y346-T348 PolarHBondContact O-N 3.24Å; T348-P350 VanDerWaalsContact O-CD 3.31Å; T348-P350 WeakPolarHBondContact O-CD 3.4Å
349	A	90.2	Very high	89.7	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	25%	0.253	C	S	.	.			trans	-64.6	121.9	176.7	0	0	0	0	0	110.5	L206 S228 W281 F335 T351	L206-A349 HydrophobicContact CB-CB 4.11Å; L206-A349 HydrophobicContact CD1-CB 4.19Å; S228-A349 WeakPolarHBondContact O-CB 3.43Å; S228-A349 PolarHBondContact O-N 3Å; W281-A349 HydrophobicContact CZ2-CB 4.18Å; F335-A349 HydrophobicContact CD1-CB 4.22Å; F335-A349 HydrophobicContact CD2-CB 3.53Å; F335-A349 HydrophobicContact CE1-CB 4.3Å; F335-A349 HydrophobicContact CE2-CB 3.63Å; F335-A349 HydrophobicContact CG-CB 3.83Å; F335-A349 HydrophobicContact CZ-CB 4.01Å; A349-T351 PolarHBondContact O-N 2.89Å
350	P	88.8	Confident	89.6	Confident	2 Å²	2	51.8 Å²	51.8	1%	0.013	27%	0.274	C	S	.	.			trans	-63	135.5	-178	-25.4	36	0	0	0	112.5	Y346 T348 E355 W356	Y346-P350 HydrophobicContact CD1-CG 3.47Å; Y346-P350 VanDerWaalsContact CD1-CG 3.47Å; Y346-P350 HydrophobicContact CD2-CG 4.01Å; Y346-P350 HydrophobicContact CE1-CG 3.6Å; Y346-P350 HydrophobicContact CE2-CG 4.13Å; Y346-P350 HydrophobicContact CG-CG 3.69Å; T348-P350 VanDerWaalsContact O-CD 3.31Å; T348-P350 WeakPolarHBondContact O-CD 3.4Å; P350-E355 WeakPolarHBondContact CA-OE2 3.23Å; P350-E355 HydrophobicContact CB-CB 3.78Å; P350-W356 HydrophobicContact CB-CB 4.46Å; P350-W356 HydrophobicContact CB-CD2 3.67Å; P350-W356 HydrophobicContact CB-CE3 4.28Å; P350-W356 HydrophobicContact CB-CG 3.74Å; P350-W356 HydrophobicContact CB-CZ2 4.23Å; P350-W356 HydrophobicContact CG-CD2 3.92Å; P350-W356 HydrophobicContact CG-CE3 4.01Å; P350-W356 HydrophobicContact CG-CG 4.39Å; P350-W356 HydrophobicContact CG-CH2 4.43Å; P350-W356 HydrophobicContact CG-CZ2 4.32Å; P350-W356 HydrophobicContact CG-CZ3 4.27Å; P350-W356 PolarHBondContact O-NE1 3.46Å
351	T	79.6	Confident	89.8	Confident	67 Å²	67	52.2 Å²	52.2	41%	0.411	27%	0.274	S	S	.	.			trans	-111.1	-18.8	-178.6	63.4	0	0	0	0	113	A349 E355	A349-T351 PolarHBondContact O-N 2.89Å; T351-E355 PolarHBondContact N-OE2 2.82Å; T351-E355 PolarHBondContact OG1-OE1 3.32Å; T351-E355 PolarHBondContact OG1-OE2 2.96Å
352	S	78	Confident	89.9	Confident	27 Å²	27	47.7 Å²	47.7	19%	0.189	27%	0.269	C	S	.	.	S	Bend	trans	-122.2	161.9	179.5	66.6	0	0	0	0	111.8	E354 E355 W356	S352-E354 VanDerWaalsContact C-N 3.26Å; S352-E354 PolarHBondContact O-N 3.32Å; S352-E355 PolarHBondContact O-N 3.08Å; S352-E355 WeakPolarHBondContact OG-CB 3.42Å; S352-E355 VanDerWaalsContact OG-CG 3.23Å; S352-E355 WeakPolarHBondContact OG-CG 3.35Å; S352-E355 PolarHBondContact OG-N 3.32Å; S352-E355 VanDerWaalsContact OG-N 3.13Å; S352-E355 PolarHBondContact OG-OE1 3.29Å; S352-W356 PolarHBondContact O-N 3.28Å
353	K	77.4	Confident	89.9	Confident	66 Å²	66	45.6 Å²	45.6	29%	0.287	26%	0.257	S	S	.	.	H	α-helix	trans	-62.1	-39.7	176.1	171.8	172.8	163.1	164.2	0	111	L171 F174 W356 A357	L171-K353 HydrophobicContact CD2-CB 3.81Å; F174-K353 HydrophobicContact CD1-CD 4.37Å; F174-K353 HydrophobicContact CD2-CD 4.16Å; F174-K353 HydrophobicContact CE1-CD 3.8Å; F174-K353 HydrophobicContact CE1-CG 4.2Å; F174-K353 HydrophobicContact CE2-CD 3.6Å; F174-K353 HydrophobicContact CE2-CG 4.04Å; F174-K353 VanDerWaalsContact CG-NZ 3.29Å; F174-K353 HydrophobicContact CZ-CD 3.39Å; F174-K353 HydrophobicContact CZ-CG 3.56Å; K353-W356 PolarHBondContact O-N 3.36Å; K353-A357 PolarHBondContact O-N 3Å
354	E	82.8	Confident	89.9	Confident	123 Å²	123	48 Å²	48	58%	0.575	27%	0.273	S	S	*	.	H	α-helix	trans	-63.3	-41.9	177.5	-65.8	69	-152.6	0	0	110.7	S352 A357 N358	S352-E354 VanDerWaalsContact C-N 3.26Å; S352-E354 PolarHBondContact O-N 3.32Å; E354-A357 PolarHBondContact O-N 3.28Å; E354-N358 PolarHBondContact O-N 3.44Å; E354-N358 PolarHBondContact O-ND2 2.84Å
355	E	86.4	Confident	89.9	Confident	80 Å²	80	47 Å²	47	37%	0.374	27%	0.267	S	S	.	.	H	α-helix	trans	-64.7	-44.9	174.3	-75.4	164.2	-151.8	0	0	111.5	Y346 P350 T351 S352 A357 N358	Y346-E355 VanDerWaalsContact CE1-O 3.31Å; Y346-E355 WeakPolarHBondContact CE1-O 3.5Å; P350-E355 WeakPolarHBondContact CA-OE2 3.23Å; P350-E355 HydrophobicContact CB-CB 3.78Å; T351-E355 PolarHBondContact N-OE2 2.82Å; T351-E355 PolarHBondContact OG1-OE1 3.32Å; T351-E355 PolarHBondContact OG1-OE2 2.96Å; S352-E355 PolarHBondContact O-N 3.08Å; S352-E355 WeakPolarHBondContact OG-CB 3.42Å; S352-E355 VanDerWaalsContact OG-CG 3.23Å; S352-E355 WeakPolarHBondContact OG-CG 3.35Å; S352-E355 PolarHBondContact OG-N 3.32Å; S352-E355 VanDerWaalsContact OG-N 3.13Å; S352-E355 PolarHBondContact OG-OE1 3.29Å; E355-A357 PolarHBondContact O-N 3.2Å; E355-N358 CarbonylContact O-C 3.59Å; E355-N358 PolarHBondContact O-N 2.78Å
356	W	88.7	Confident	90	Very high	15 Å²	15	48.7 Å²	48.7	6%	0.057	28%	0.276	C	S	.	.	H	α-helix	trans	-57.7	-36.4	176	-84.2	109.8	0	0	0	112.7	L266 L276 L279 F335 A337 Y346 P350 S352 K353 N358	L266-W356 HydrophobicContact CD2-CD2 4.35Å; L266-W356 HydrophobicContact CD2-CH2 3.84Å; L266-W356 HydrophobicContact CD2-CZ2 3.32Å; L276-W356 HydrophobicContact CD1-CE3 3.85Å; L276-W356 HydrophobicContact CD1-CH2 3.69Å; L276-W356 HydrophobicContact CD1-CZ2 4.45Å; L276-W356 HydrophobicContact CD1-CZ3 3.35Å; L279-W356 HydrophobicContact CD2-CH2 3.92Å; L279-W356 HydrophobicContact CD2-CZ2 4.34Å; F335-W356 AromaticContact CE1-CH2 3.76Å; F335-W356 HydrophobicContact CE1-CH2 3.76Å; F335-W356 HydrophobicContact CE1-CZ2 4.39Å; F335-W356 HydrophobicContact CE1-CZ3 4.45Å; F335-W356 HydrophobicContact CZ-CH2 4.43Å; A337-W356 HydrophobicContact CB-CH2 4.23Å; A337-W356 HydrophobicContact CB-CZ3 3.7Å; Y346-W356 HydrophobicContact CE2-CE3 4.28Å; Y346-W356 HydrophobicContact CE2-CZ3 4.12Å; Y346-W356 AromaticContact CZ-CE3 3.99Å; Y346-W356 PolarHBondContact OH-O 3.04Å; P350-W356 HydrophobicContact CB-CB 4.46Å; P350-W356 HydrophobicContact CB-CD2 3.67Å; P350-W356 HydrophobicContact CB-CE3 4.28Å; P350-W356 HydrophobicContact CB-CG 3.74Å; P350-W356 HydrophobicContact CB-CZ2 4.23Å; P350-W356 HydrophobicContact CG-CD2 3.92Å; P350-W356 HydrophobicContact CG-CE3 4.01Å; P350-W356 HydrophobicContact CG-CG 4.39Å; P350-W356 HydrophobicContact CG-CH2 4.43Å; P350-W356 HydrophobicContact CG-CZ2 4.32Å; P350-W356 HydrophobicContact CG-CZ3 4.27Å; P350-W356 PolarHBondContact O-NE1 3.46Å; S352-W356 PolarHBondContact O-N 3.28Å; K353-W356 PolarHBondContact O-N 3.36Å; W356-N358 VanDerWaalsContact C-N 3.26Å; W356-N358 PolarHBondContact O-N 3.46Å
357	A	87.3	Confident	90.2	Very high	55 Å²	55	48.5 Å²	48.5	46%	0.455	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-11.3	178.8	0	0	0	0	0	114.3	K353 E354 E355 P359	K353-A357 PolarHBondContact O-N 3Å; E354-A357 PolarHBondContact O-N 3.28Å; E355-A357 PolarHBondContact O-N 3.2Å; A357-P359 VanDerWaalsContact C-CD 3.45Å; A357-P359 WeakPolarHBondContact O-CD 3.14Å
358	N	89.9	Confident	90.6	Very high	116 Å²	116	44.6 Å²	44.6	62%	0.62	26%	0.256	S	S	*	.			trans	-125.3	68.1	-174.3	-66.6	-63.2	0	0	0	111.8	E354 E355 W356	E354-N358 PolarHBondContact O-N 3.44Å; E354-N358 PolarHBondContact O-ND2 2.84Å; E355-N358 CarbonylContact O-C 3.59Å; E355-N358 PolarHBondContact O-N 2.78Å; W356-N358 VanDerWaalsContact C-N 3.26Å; W356-N358 PolarHBondContact O-N 3.46Å
359	P	94.3	Very high	90.9	Very high	41 Å²	41	46.2 Å²	46.2	27%	0.266	26%	0.255	S	S	.	.			trans	-61.2	148.7	170.8	31.3	-38	0	0	0	111.2	L344 Y346 A357 Q361 A362	L344-P359 HydrophobicContact CB-CB 4.18Å; L344-P359 HydrophobicContact CD2-CB 4.31Å; L344-P359 HydrophobicContact CD2-CG 4.08Å; Y346-P359 HydrophobicContact CD1-CB 4.3Å; Y346-P359 HydrophobicContact CE1-CB 3.77Å; Y346-P359 HydrophobicContact CE2-CB 4.32Å; A357-P359 VanDerWaalsContact C-CD 3.45Å; A357-P359 WeakPolarHBondContact O-CD 3.14Å; P359-Q361 VanDerWaalsContact C-N 3.31Å; P359-A362 HydrophobicContact CG-CB 4.26Å
360	V	93.2	Very high	91.1	Very high	79 Å²	79	47.3 Å²	47.3	48%	0.479	26%	0.262	S	S	.	.	S	Bend	trans	-68.1	-37.6	173.8	-179.6	0	0	0	0	109.9	L345	L345-V360 WeakPolarHBondContact O-CB 3.21Å; L345-V360 PolarHBondContact O-N 2.89Å
361	Q	94.6	Very high	91.1	Very high	61 Å²	61	49.4 Å²	49.4	29%	0.285	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	146.6	173.9	-56	173.9	29	0	0	110.3	L345 P359 H363 H414	L345-Q361 HydrophobicContact CB-CB 4.22Å; L345-Q361 HydrophobicContact CD1-CB 4.31Å; L345-Q361 PolarHBondContact N-O 2.84Å; L345-Q361 PolarHBondContact O-N 2.83Å; P359-Q361 VanDerWaalsContact C-N 3.31Å; Q361-H363 PolarHBondContact OE1-NE2 3.22Å; Q361-H363 VanDerWaalsContact OE1-NE2 3.14Å; Q361-H414 PolarHBondContact OE1-CE1 2.79Å; Q361-H414 PolarHBondContact OE1-NE2 3.02Å
362	A	96.4	Very high	91.1	Very high	55 Å²	55	51.4 Å²	51.4	46%	0.455	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	120.7	174.8	0	0	0	0	0	109.3	L343 L344 P359	L343-A362 WeakPolarHBondContact O-CA 3.38Å; L344-A362 HydrophobicContact CD2-CB 3.73Å; P359-A362 HydrophobicContact CG-CB 4.26Å
363	H	97.2	Very high	90.7	Very high	3 Å²	3	51 Å²	51	1%	0.014	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	114.5	-176.1	-69.5	-74.8	0	0	0	110.1	D342 L343 Q361 L365 T405 E412 H414	D342-H363 CarbonylContact C-O 3.55Å; D342-H363 VanDerWaalsContact CA-O 3.3Å; D342-H363 WeakPolarHBondContact CA-O 3.3Å; L343-H363 HydrophobicContact CB-CB 4.21Å; L343-H363 PolarHBondContact N-O 3.29Å; L343-H363 PolarHBondContact O-N 2.98Å; Q361-H363 PolarHBondContact OE1-NE2 3.22Å; Q361-H363 VanDerWaalsContact OE1-NE2 3.14Å; H363-L365 PolarHBondContact O-N 3.24Å; H363-T405 HydrophobicContact CB-CG2 4.25Å; H363-T405 PolarHBondContact ND1-OG1 2.93Å; H363-E412 IonicContact CE1-OE2 2.73Å; H363-E412 IonicContact ND1-OE2 3.86Å; H363-H414 AromaticContact CE1-CD2 3.75Å; H363-H414 AromaticContact CE1-NE2 3.2Å; H363-H414 PolarHBondContact CE1-NE2 2.9Å; H363-H414 AromaticContact NE2-CD2 3.6Å; H363-H414 AromaticContact NE2-CE1 3.73Å; H363-H414 AromaticContact NE2-NE2 3.09Å; H363-H414 PolarHBondContact NE2-NE2 2.89Å
364	P	97.6	Very high	90.3	Very high	50 Å²	50	51.4 Å²	51.4	33%	0.325	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	119.4	-175.4	26.8	-35.4	0	0	0	111.1	R341 D342 I366 A367 T368 T405	R341-P364 CarbonylContact O-C 3.57Å; D342-P364 WeakPolarHBondContact OD1-CA 3.45Å; P364-I366 HydrophobicContact CB-CG2 4.34Å; P364-I366 PolarHBondContact O-N 3.23Å; P364-A367 CarbonylContact O-C 3.55Å; P364-A367 PolarHBondContact O-N 2.98Å; P364-T368 PolarHBondContact O-N 2.87Å; P364-T368 PolarHBondContact O-OG1 2.76Å; P364-T405 HydrophobicContact CG-CG2 4.32Å
365	L	98	Very high	89.5	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	26%	0.255	C	S	.	.	G	3₁₀ helix	trans	-59.3	-32.7	-176.9	-68.2	175.4	0	0	0	112.6	L338 S339 R341 L343 H363 A367 T368 I431 A435 A438 N541	L338-L365 HydrophobicContact CD1-CD1 3.64Å; L338-L365 HydrophobicContact CD1-CD2 3.55Å; L338-L365 HydrophobicContact CD1-CG 4.14Å; L338-L365 HydrophobicContact CG-CD1 4.23Å; S339-L365 WeakPolarHBondContact O-CD1 3.46Å; R341-L365 WeakPolarHBondContact O-CB 3.19Å; R341-L365 PolarHBondContact O-N 2.96Å; L343-L365 HydrophobicContact CB-CD2 4.16Å; H363-L365 PolarHBondContact O-N 3.24Å; L365-A367 PolarHBondContact O-N 3.31Å; L365-A367 VanDerWaalsContact O-N 3.11Å; L365-T368 PolarHBondContact O-N 3.44Å; L365-T368 VanDerWaalsContact O-N 3.1Å; L365-I431 HydrophobicContact CD2-CG2 4.16Å; L365-A435 VanDerWaalsContact O-CB 3.31Å; L365-A435 WeakPolarHBondContact O-CB 3.06Å; L365-A438 HydrophobicContact CB-CB 4.17Å; L365-N541 PolarHBondContact O-ND2 2.76Å
366	I	97.7	Very high	88.4	Confident	38 Å²	38	47.1 Å²	47.1	20%	0.195	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-56	-30.9	176.3	-155.7	-178.8	0	0	0	112.2	P364 A438 V439 A442 V445 I538 N541	P364-I366 HydrophobicContact CB-CG2 4.34Å; P364-I366 PolarHBondContact O-N 3.23Å; I366-A438 HydrophobicContact CB-CB 4.06Å; I366-A438 HydrophobicContact CG1-CB 4.46Å; I366-V439 HydrophobicContact CD1-CG1 4.4Å; I366-V439 HydrophobicContact CG1-CB 4.42Å; I366-V439 HydrophobicContact CG1-CG1 3.53Å; I366-A442 HydrophobicContact CD1-CB 3.71Å; I366-V445 HydrophobicContact CD1-CG2 3.75Å; I366-I538 HydrophobicContact CG1-CG1 4.17Å; I366-I538 HydrophobicContact CG1-CG2 4.46Å; I366-I538 HydrophobicContact CG2-CD1 4.41Å; I366-I538 HydrophobicContact CG2-CG1 4.26Å; I366-I538 WeakPolarHBondContact O-CA 3.36Å; I366-I538 WeakPolarHBondContact O-CG1 3.48Å; I366-N541 PolarHBondContact O-ND2 2.99Å
367	A	97.8	Very high	87	Confident	4 Å²	4	53.1 Å²	53.1	3%	0.033	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-117.1	16	179.5	0	0	0	0	0	113.1	P364 L365 T405 G406 F537 I538	P364-A367 CarbonylContact O-C 3.55Å; P364-A367 PolarHBondContact O-N 2.98Å; L365-A367 PolarHBondContact O-N 3.31Å; L365-A367 VanDerWaalsContact O-N 3.11Å; A367-T405 WeakPolarHBondContact O-CA 3.3Å; A367-G406 PolarHBondContact O-N 3Å; A367-F537 HydrophobicContact CB-CB 4.29Å; A367-F537 WeakPolarHBondContact O-CB 3.42Å; A367-F537 VanDerWaalsContact O-CD1 3.22Å; A367-F537 WeakPolarHBondContact O-CD1 3.45Å; A367-I538 HydrophobicContact CB-CG1 4.06Å
368	T	97.8	Very high	85.3	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	140.6	177.9	-56.3	0	0	0	0	110.2	P364 L365 R404 T405 N541	P364-T368 PolarHBondContact O-N 2.87Å; P364-T368 PolarHBondContact O-OG1 2.76Å; L365-T368 PolarHBondContact O-N 3.44Å; L365-T368 VanDerWaalsContact O-N 3.1Å; T368-R404 CarbonylContact C-O 3.46Å; T368-R404 WeakPolarHBondContact CA-O 3.45Å; T368-T405 PolarHBondContact OG1-OG1 3.42Å; T368-N541 PolarHBondContact O-ND2 3.45Å
369	R	96.4	Very high	83.4	Confident	88 Å²	88	48.6 Å²	48.6	33%	0.332	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	147.5	177.4	-65.3	-172.6	71	-172.3	1.5	111	T403 R404 F537 H540 N541	R369-T403 CarbonylContact O-C 3.44Å; R369-T403 WeakPolarHBondContact O-CA 3.07Å; R369-R404 PolarHBondContact N-O 2.78Å; R369-R404 PolarHBondContact O-N 2.7Å; R369-F537 HydrophobicContact CB-CD1 4.25Å; R369-F537 HydrophobicContact CB-CE1 4.26Å; R369-F537 HydrophobicContact CG-CD1 3.82Å; R369-F537 HydrophobicContact CG-CE1 4.27Å; R369-H540 PolarHBondContact NH1-ND1 2.84Å; R369-N541 WeakPolarHBondContact CG-OD1 3.46Å
370	V	94.4	Very high	81.3	Confident	24 Å²	24	53.3 Å²	53.3	15%	0.145	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	138.6	171.1	-178	0	0	0	0	110	F401 V402 I431 I432	V370-F401 HydrophobicContact CG1-CB 4.46Å; V370-F401 HydrophobicContact CG1-CD2 4.31Å; V370-V402 CarbonylContact C-O 3.52Å; V370-V402 WeakPolarHBondContact CA-O 3.49Å; V370-I431 HydrophobicContact CG2-CB 3.62Å; V370-I431 HydrophobicContact CG2-CD1 4.1Å; V370-I431 HydrophobicContact CG2-CG1 4.48Å; V370-I431 HydrophobicContact CG2-CG2 3.43Å; V370-I431 VanDerWaalsContact CG2-CG2 3.43Å; V370-I432 HydrophobicContact CB-CG1 4.31Å; V370-I432 HydrophobicContact CG2-CG1 4.24Å
371	V	88.6	Confident	79.1	Confident	46 Å²	46	56.6 Å²	56.6	28%	0.279	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	125.3	170	-177.1	0	0	0	0	108.1	V373 V402 R404	V371-V373 HydrophobicContact CG1-CG2 4.02Å; V371-V402 HydrophobicContact CB-CB 4.39Å; V371-V402 PolarHBondContact N-O 2.79Å; V371-V402 PolarHBondContact O-N 2.84Å; V371-R404 HydrophobicContact CG2-CG 4.22Å
372	H	78.3	Confident	76.8	Confident	109 Å²	109	57.8 Å²	57.8	51%	0.505	30%	0.3	S	S	.	.			trans	-81.4	120.3	172.9	-65.2	-75.4	0	0	0	109.4	S428	H372-S428 PolarHBondContact CE1-OG 3.36Å
373	V	69.6	Low	74.3	Confident	19 Å²	19	59.7 Å²	59.7	12%	0.115	31%	0.31	C	S	.	.			trans	-120.8	118.5	177.5	-175.5	0	0	0	0	108.5	V371 L375 T400 V402	V371-V373 HydrophobicContact CG1-CG2 4.02Å; V373-L375 HydrophobicContact CG1-CG 4.11Å; V373-L375 PolarHBondContact O-N 3.17Å; V373-T400 PolarHBondContact O-OG1 2.84Å; V373-V402 HydrophobicContact CB-CG2 4.07Å; V373-V402 HydrophobicContact CG2-CB 4.21Å; V373-V402 HydrophobicContact CG2-CG2 3.55Å
374	D	69.9	Low	71.9	Confident	73 Å²	73	67.9 Å²	67.9	39%	0.39	35%	0.348	S	S	.	.			trans	-87.7	85.4	170.2	-169.6	-14.2	0	0	0	109.1	R376 K377 S378	D374-R376 PolarHBondContact O-N 3.42Å; D374-R376 PolarHBondContact OD1-N 2.87Å; D374-K377 HydrophobicContact CB-CB 4.45Å; D374-K377 HydrophobicContact CB-CD 4.41Å; D374-K377 HydrophobicContact CB-CG 4.49Å; D374-K377 PolarHBondContact O-N 3.43Å; D374-K377 VanDerWaalsContact O-N 3.08Å; D374-K377 VanDerWaalsContact OD2-CD 3.25Å; D374-K377 WeakPolarHBondContact OD2-CD 3.36Å; D374-K377 WeakPolarHBondContact OD2-CE 3.31Å; D374-K377 WeakPolarHBondContact OD2-CG 3.31Å; D374-K377 IonicContact OD2-NZ 3.35Å; D374-K377 PolarHBondContact OD2-NZ 2.73Å; D374-S378 PolarHBondContact O-N 3.3Å
375	L	66.1	Low	69.6	Low	7 Å²	7	66.2 Å²	66.2	4%	0.037	34%	0.339	C	S	.	.	H	α-helix	trans	-59.6	-24.5	-179.8	-84.3	156.6	0	0	0	112.8	I311 V373 K377 T400 T415	I311-L375 HydrophobicContact CD1-CD2 4.32Å; V373-L375 HydrophobicContact CG1-CG 4.11Å; V373-L375 PolarHBondContact O-N 3.17Å; L375-K377 VanDerWaalsContact C-N 3.31Å; L375-K377 PolarHBondContact O-N 2.89Å; L375-T400 HydrophobicContact CD1-CG2 3.9Å; L375-T415 HydrophobicContact CD1-CG2 3.9Å
376	R	62.9	Low	66.8	Low	106 Å²	106	73.2 Å²	73.2	40%	0.4	37%	0.371	S	S	.	.	H	α-helix	trans	-71	-27.9	177.4	-67	-172.2	-179.2	125.7	7	112.3	D374 Y393 G396 D397 M398	D374-R376 PolarHBondContact O-N 3.42Å; D374-R376 PolarHBondContact OD1-N 2.87Å; R376-Y393 HydrophobicContact CG-CD1 4.37Å; R376-G396 PolarHBondContact NH2-O 2.83Å; R376-D397 VanDerWaalsContact NH2-C 3.28Å; R376-D397 VanDerWaalsContact NH2-CA 3.34Å; R376-D397 PolarHBondContact NH2-O 3.46Å; R376-M398 PolarHBondContact NH2-O 2.81Å; R376-M398 VanDerWaalsContact NH2-O 3.12Å
377	K	59.4	Low	64.2	Low	141 Å²	141	79.4 Å²	79.4	61%	0.613	41%	0.405	S	S	*	.	H	α-helix	trans	-85.6	-35.6	176.5	-70.7	-178	-175.7	128.9	0	113	D374 L375 I379	D374-K377 HydrophobicContact CB-CB 4.45Å; D374-K377 HydrophobicContact CB-CD 4.41Å; D374-K377 HydrophobicContact CB-CG 4.49Å; D374-K377 PolarHBondContact O-N 3.43Å; D374-K377 VanDerWaalsContact O-N 3.08Å; D374-K377 VanDerWaalsContact OD2-CD 3.25Å; D374-K377 WeakPolarHBondContact OD2-CD 3.36Å; D374-K377 WeakPolarHBondContact OD2-CE 3.31Å; D374-K377 WeakPolarHBondContact OD2-CG 3.31Å; D374-K377 IonicContact OD2-NZ 3.35Å; D374-K377 PolarHBondContact OD2-NZ 2.73Å; L375-K377 VanDerWaalsContact C-N 3.31Å; L375-K377 PolarHBondContact O-N 2.89Å; K377-I379 PolarHBondContact O-N 3.36Å
378	S	51.9	Low	61.8	Low	49 Å²	49	82 Å²	82	34%	0.343	42%	0.416	S	S	.	.	H	α-helix	trans	-66.3	-35.1	-173.4	-167.9	0	0	0	0	113.2	D374	D374-S378 PolarHBondContact O-N 3.3Å
379	I	49.5	Very low	59.5	Low	28 Å²	28	85.8 Å²	85.8	14%	0.144	44%	0.436	C	S	.	.	G	3₁₀ helix	trans	-86.7	-17.1	-172.9	-56	171.8	0	0	0	113.1	K377 N381 D382 R392 Y393	K377-I379 PolarHBondContact O-N 3.36Å; I379-N381 PolarHBondContact O-N 3.03Å; I379-N381 VanDerWaalsContact O-N 3.09Å; I379-D382 PolarHBondContact O-N 2.95Å; I379-D382 VanDerWaalsContact O-N 3.12Å; I379-R392 HydrophobicContact CD1-CB 4Å; I379-Y393 HydrophobicContact CD1-CE1 4.12Å; I379-Y393 WeakPolarHBondContact CG2-OH 3.31Å
380	L	50	Low	57.2	Low	140 Å²	140	84.9 Å²	84.9	73%	0.733	45%	0.454	S	S	*	.	G	3₁₀ helix	trans	-64	-15.6	176.3	-73.5	169.4	0	0	0	113.3
381	N	46.7	Very low	55.2	Low	147 Å²	147	88.7 Å²	88.7	79%	0.786	47%	0.466	S	S	*	.	G	3₁₀ helix	trans	-91.6	-6.2	178.4	-68.2	-15.1	0	0	0	113.8	I379	I379-N381 PolarHBondContact O-N 3.03Å; I379-N381 VanDerWaalsContact O-N 3.09Å
382	D	47.3	Very low	54.1	Low	86 Å²	86	90.3 Å²	90.3	46%	0.46	47%	0.467	S	S	.	.			trans	-107	95.8	-176.9	-163.9	-6	0	0	0	111.8	I379 H384	I379-D382 PolarHBondContact O-N 2.95Å; I379-D382 VanDerWaalsContact O-N 3.12Å; D382-H384 PolarHBondContact O-N 3.42Å; D382-H384 PolarHBondContact OD1-N 2.87Å
383	S	43.9	Very low	53.9	Low	95 Å²	95	88.2 Å²	88.2	66%	0.664	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-10.6	180	44.7	0	0	0	0	114.3
384	H	46	Very low	54.5	Low	175 Å²	175	87.6 Å²	87.6	81%	0.81	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.2	-9.8	-175.8	-83.2	-67.5	0	0	0	115.1	D382 Q386	D382-H384 PolarHBondContact O-N 3.42Å; D382-H384 PolarHBondContact OD1-N 2.87Å; H384-Q386 VanDerWaalsContact C-N 3.32Å; H384-Q386 PolarHBondContact O-N 3.45Å
385	A	48.9	Very low	55.1	Low	16 Å²	16	84.6 Å²	84.6	13%	0.132	44%	0.436	C	S	.	.			trans	-87.7	17	-173.9	0	0	0	0	0	115.3	N387 E388 I389	A385-N387 PolarHBondContact O-N 2.98Å; A385-E388 PolarHBondContact O-N 3.29Å; A385-E388 VanDerWaalsContact O-N 3.09Å; A385-I389 WeakPolarHBondContact O-CG1 3.41Å
386	Q	39.9	Very low	55.8	Low	146 Å²	146	85.8 Å²	85.8	68%	0.682	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-17.2	-165.7	-75.3	-170.3	-4.7	0	0	116.4	H384 I389	H384-Q386 VanDerWaalsContact C-N 3.32Å; H384-Q386 PolarHBondContact O-N 3.45Å; Q386-I389 HydrophobicContact CB-CD1 4.26Å; Q386-I389 HydrophobicContact CG-CD1 4.39Å; Q386-I389 VanDerWaalsContact O-CD1 3.25Å; Q386-I389 WeakPolarHBondContact O-CD1 3.33Å; Q386-I389 WeakPolarHBondContact O-CG1 3.45Å
387	N	42.3	Very low	56.8	Low	169 Å²	169	83.2 Å²	83.2	90%	0.904	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99	-11.5	179	-76.5	-24.1	0	0	0	114.5	A385	A385-N387 PolarHBondContact O-N 2.98Å
388	E	49.2	Very low	58.3	Low	57 Å²	57	76.9 Å²	76.9	27%	0.266	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.4	-3	178.6	-68.1	-169.6	172.5	0	0	113.6	L326 A385 G390 R391 R392	L326-E388 WeakPolarHBondContact CD2-OE1 3.35Å; A385-E388 PolarHBondContact O-N 3.29Å; A385-E388 VanDerWaalsContact O-N 3.09Å; E388-G390 VanDerWaalsContact C-N 3.29Å; E388-G390 PolarHBondContact O-N 3.13Å; E388-R391 PolarHBondContact O-N 3.44Å; E388-R391 VanDerWaalsContact O-N 3.08Å; E388-R392 IonicContact OE2-CZ 3.32Å; E388-R392 IonicContact OE2-NE 2.83Å; E388-R392 PolarHBondContact OE2-NE 3.13Å; E388-R392 IonicContact OE2-NH2 3.39Å; E388-R392 PolarHBondContact OE2-NH2 3.1Å
389	I	47.5	Very low	60.2	Low	81 Å²	81	76 Å²	76	42%	0.415	41%	0.409	S	S	.	.	H	α-helix	trans	-39.1	-53.9	-173.5	-66.3	-179.8	0	0	0	111.7	A385 Q386 R391 Y393	A385-I389 WeakPolarHBondContact O-CG1 3.41Å; Q386-I389 HydrophobicContact CB-CD1 4.26Å; Q386-I389 HydrophobicContact CG-CD1 4.39Å; Q386-I389 VanDerWaalsContact O-CD1 3.25Å; Q386-I389 WeakPolarHBondContact O-CD1 3.33Å; Q386-I389 WeakPolarHBondContact O-CG1 3.45Å; I389-R391 VanDerWaalsContact C-N 3.33Å; I389-R391 PolarHBondContact O-N 3.42Å; I389-Y393 HydrophobicContact CB-CE2 4.39Å; I389-Y393 HydrophobicContact CG2-CD2 4.23Å; I389-Y393 HydrophobicContact CG2-CE2 3.55Å; I389-Y393 WeakPolarHBondContact O-CD2 3.49Å; I389-Y393 WeakPolarHBondContact O-CE2 3.2Å
390	G	48.5	Very low	62.2	Low	68 Å²	68	75.3 Å²	75.3	70%	0.701	41%	0.406	S	S	*	.	H	α-helix	trans	-68.1	-19.7	-170.9	0	0	0	0	0	116.7	E388	E388-G390 VanDerWaalsContact C-N 3.29Å; E388-G390 PolarHBondContact O-N 3.13Å
391	R	53.5	Low	64.2	Low	105 Å²	105	68.7 Å²	68.7	40%	0.396	37%	0.371	S	S	.	.	H	α-helix	trans	-96.1	-19.4	-171.2	-69.4	-168.8	-179	-150.7	2.7	114.8	E388 I389	E388-R391 PolarHBondContact O-N 3.44Å; E388-R391 VanDerWaalsContact O-N 3.08Å; I389-R391 VanDerWaalsContact C-N 3.33Å; I389-R391 PolarHBondContact O-N 3.42Å
392	R	64.2	Low	66.5	Low	80 Å²	80	61.8 Å²	61.8	30%	0.302	33%	0.334	S	S	.	.	H	α-helix	trans	-89.7	-25.1	179.9	-62.5	-172.6	-174	-163.3	1.5	112.8	I379 E388	I379-R392 HydrophobicContact CD1-CB 4Å; E388-R392 IonicContact OE2-CZ 3.32Å; E388-R392 IonicContact OE2-NE 2.83Å; E388-R392 PolarHBondContact OE2-NE 3.13Å; E388-R392 IonicContact OE2-NH2 3.39Å; E388-R392 PolarHBondContact OE2-NH2 3.1Å
393	Y	74.3	Confident	68.9	Low	64 Å²	64	57.7 Å²	57.7	25%	0.251	31%	0.312	S	S	.	.	S	Bend	trans	-70.8	140.6	174.1	-64.6	-70.6	0	0	0	110.4	W331 R376 I379 I389	W331-Y393 PolarHBondContact NE1-O 2.79Å; R376-Y393 HydrophobicContact CG-CD1 4.37Å; I379-Y393 HydrophobicContact CD1-CE1 4.12Å; I379-Y393 WeakPolarHBondContact CG2-OH 3.31Å; I389-Y393 HydrophobicContact CB-CE2 4.39Å; I389-Y393 HydrophobicContact CG2-CD2 4.23Å; I389-Y393 HydrophobicContact CG2-CE2 3.55Å; I389-Y393 WeakPolarHBondContact O-CD2 3.49Å; I389-Y393 WeakPolarHBondContact O-CE2 3.2Å
394	P	83.1	Confident	71.4	Confident	7 Å²	7	56.7 Å²	56.7	5%	0.045	29%	0.294	C	S	.	.	P	Polyproline II helix	trans	-57.6	150.6	170.1	30	-37.5	0	0	0	110.3	W331 G396 M398 T400 A417	W331-P394 HydrophobicContact CH2-CB 4.18Å; W331-P394 VanDerWaalsContact CZ2-CA 3.5Å; W331-P394 HydrophobicContact CZ2-CB 3.84Å; P394-G396 PolarHBondContact O-N 3.15Å; P394-M398 HydrophobicContact CB-CB 4.13Å; P394-M398 WeakPolarHBondContact CG-O 2.84Å; P394-T400 HydrophobicContact CB-CG2 3.64Å; P394-T400 HydrophobicContact CG-CG2 3.76Å; P394-A417 HydrophobicContact CB-CB 3.82Å
395	P	81.8	Confident	73.8	Confident	10 Å²	10	48.4 Å²	48.4	7%	0.065	26%	0.256	C	S	.	.	S	Bend	trans	-53.2	128.1	177.5	-26.3	35.4	0	0	0	111.8	D212 L213 V283 W331 D397 M398	D212-P395 HydrophobicContact CB-CB 4.36Å; L213-P395 HydrophobicContact CD1-CG 3.77Å; V283-P395 HydrophobicContact CG1-CG 4.22Å; W331-P395 HydrophobicContact CB-CG 4.04Å; W331-P395 HydrophobicContact CG-CG 4.09Å; P395-D397 PolarHBondContact O-N 2.96Å; P395-M398 HydrophobicContact CB-SD 3.86Å; P395-M398 HydrophobicContact CG-SD 4.1Å; P395-M398 VanDerWaalsContact O-CB 3.24Å; P395-M398 WeakPolarHBondContact O-CB 3.45Å; P395-M398 WeakPolarHBondContact O-CG 3.42Å; P395-M398 PolarHBondContact O-N 3.19Å; P395-M398 VanDerWaalsContact O-N 3.17Å
396	G	81.1	Confident	76	Confident	32 Å²	32	47.9 Å²	47.9	33%	0.33	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.8	-128	173.9	0	0	0	0	0	114.2	D212 R376 P394	D212-G396 VanDerWaalsContact OD2-CA 3.24Å; D212-G396 WeakPolarHBondContact OD2-CA 3.5Å; D212-G396 PolarHBondContact OD2-N 3.24Å; R376-G396 PolarHBondContact NH2-O 2.83Å; P394-G396 PolarHBondContact O-N 3.15Å
397	D	85	Confident	78.6	Confident	52 Å²	52	41.7 Å²	41.7	28%	0.278	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.7	7.8	-179.9	63.2	-12.3	0	0	0	114	R211 R245 R376 P395	R211-D397 IonicContact CZ-OD1 3.15Å; R211-D397 IonicContact CZ-OD2 2.69Å; R211-D397 IonicContact NE-OD1 3.8Å; R211-D397 PolarHBondContact NE-OD1 2.72Å; R211-D397 IonicContact NH2-OD1 2.77Å; R211-D397 PolarHBondContact NH2-OD1 3.31Å; R211-D397 IonicContact NH2-OD2 3.4Å; R211-D397 PolarHBondContact NH2-OD2 3.47Å; R245-D397 IonicContact CZ-OD2 2.74Å; R245-D397 IonicContact NH1-OD2 3.87Å; R245-D397 PolarHBondContact NH1-OD2 3.08Å; R245-D397 IonicContact NH2-OD2 3.36Å; R245-D397 PolarHBondContact NH2-OD2 3.12Å; R376-D397 VanDerWaalsContact NH2-C 3.28Å; R376-D397 VanDerWaalsContact NH2-CA 3.34Å; R376-D397 PolarHBondContact NH2-O 3.46Å; P395-D397 PolarHBondContact O-N 2.96Å
398	M	90	Very high	80.9	Confident	7 Å²	7	41.5 Å²	41.5	3%	0.034	22%	0.216	C	C	.	.			trans	-56.3	152.8	179.7	-65.2	179.5	84.1	0	0	112.8	V210 V283 R376 P394 P395 A417 V418	V210-M398 HydrophobicContact CG2-SD 4.04Å; V283-M398 HydrophobicContact CB-CE 4.09Å; V283-M398 HydrophobicContact CG2-CE 3.76Å; V283-M398 HydrophobicContact CG2-SD 4.34Å; R376-M398 PolarHBondContact NH2-O 2.81Å; R376-M398 VanDerWaalsContact NH2-O 3.12Å; P394-M398 HydrophobicContact CB-CB 4.13Å; P394-M398 WeakPolarHBondContact CG-O 2.84Å; P395-M398 HydrophobicContact CB-SD 3.86Å; P395-M398 HydrophobicContact CG-SD 4.1Å; P395-M398 VanDerWaalsContact O-CB 3.24Å; P395-M398 WeakPolarHBondContact O-CB 3.45Å; P395-M398 WeakPolarHBondContact O-CG 3.42Å; P395-M398 PolarHBondContact O-N 3.19Å; P395-M398 VanDerWaalsContact O-N 3.17Å; M398-A417 HydrophobicContact CB-CB 4.16Å; M398-A417 HydrophobicContact CE-CB 3.94Å; M398-A417 WeakPolarHBondContact CE-O 3.33Å; M398-A417 HydrophobicContact SD-CB 4.32Å; M398-V418 WeakPolarHBondContact CA-O 3.23Å; M398-V418 WeakPolarHBondContact CB-O 3.29Å
399	V	90.9	Very high	82.9	Confident	30 Å²	30	44.2 Å²	44.2	18%	0.182	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	149.7	179.5	-65.7	0	0	0	0	110.5	A417 V418 T420 L424	V399-A417 CarbonylContact O-C 3.6Å; V399-A417 VanDerWaalsContact O-CA 3.3Å; V399-A417 WeakPolarHBondContact O-CA 3.34Å; V399-V418 HydrophobicContact CG2-CG2 3.66Å; V399-V418 PolarHBondContact N-O 3.3Å; V399-V418 PolarHBondContact O-N 2.77Å; V399-T420 WeakPolarHBondContact CG2-O 3.41Å; V399-L424 HydrophobicContact CB-CD2 4.19Å; V399-L424 HydrophobicContact CG2-CB 3.75Å; V399-L424 HydrophobicContact CG2-CD2 3.96Å; V399-L424 HydrophobicContact CG2-CG 4.44Å
400	T	91.9	Very high	85	Confident	14 Å²	14	41 Å²	41	9%	0.086	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	148.3	-168.3	51.5	0	0	0	0	113.9	W331 V373 L375 P394 F416 A417	W331-T400 HydrophobicContact CH2-CG2 3.74Å; W331-T400 HydrophobicContact CZ2-CG2 4.32Å; V373-T400 PolarHBondContact O-OG1 2.84Å; L375-T400 HydrophobicContact CD1-CG2 3.9Å; P394-T400 HydrophobicContact CB-CG2 3.64Å; P394-T400 HydrophobicContact CG-CG2 3.76Å; T400-F416 CarbonylContact C-O 3.56Å; T400-F416 WeakPolarHBondContact CA-O 3.19Å; T400-F416 WeakPolarHBondContact CB-O 3.29Å; T400-A417 HydrophobicContact CG2-CB 4Å
401	F	93.5	Very high	87.2	Confident	1 Å²	1	39.2 Å²	39.2	0%	0.004	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	159.1	164.3	67.9	-79.1	0	0	0	110.2	L282 V370 T403 F416 V418 L424 W427 I431	L282-F401 HydrophobicContact CD1-CZ 4.04Å; L282-F401 HydrophobicContact CD2-CE1 4.45Å; V370-F401 HydrophobicContact CG1-CB 4.46Å; V370-F401 HydrophobicContact CG1-CD2 4.31Å; F401-T403 HydrophobicContact CD2-CG2 4.19Å; F401-T403 HydrophobicContact CE2-CG2 3.88Å; F401-F416 HydrophobicContact CD1-CB 4.05Å; F401-F416 HydrophobicContact CD2-CD2 4.21Å; F401-F416 HydrophobicContact CE1-CB 3.59Å; F401-F416 HydrophobicContact CE1-CD2 4.43Å; F401-F416 HydrophobicContact CE1-CG 4.38Å; F401-F416 HydrophobicContact CE2-CB 4.23Å; F401-F416 AromaticContact CE2-CD2 3.56Å; F401-F416 HydrophobicContact CE2-CD2 3.56Å; F401-F416 HydrophobicContact CE2-CE2 4.36Å; F401-F416 HydrophobicContact CE2-CG 4.29Å; F401-F416 HydrophobicContact CZ-CB 3.69Å; F401-F416 AromaticContact CZ-CD2 3.68Å; F401-F416 HydrophobicContact CZ-CD2 3.68Å; F401-F416 AromaticContact CZ-CG 3.98Å; F401-F416 HydrophobicContact CZ-CG 3.98Å; F401-F416 PolarHBondContact N-O 2.87Å; F401-F416 PolarHBondContact O-N 3.02Å; F401-V418 HydrophobicContact CE1-CG1 3.91Å; F401-L424 HydrophobicContact CB-CD1 3.56Å; F401-L424 HydrophobicContact CD1-CD1 3.9Å; F401-L424 HydrophobicContact CG-CD1 4.05Å; F401-W427 HydrophobicContact CE1-CB 4.14Å; F401-W427 HydrophobicContact CZ-CB 3.99Å; F401-W427 HydrophobicContact CZ-CG 4.38Å; F401-I431 HydrophobicContact CE2-CD1 3.83Å
402	V	94.8	Very high	89	Confident	2 Å²	2	36.8 Å²	36.8	1%	0.012	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	133.7	178.2	179.2	0	0	0	0	108.9	V308 V370 V371 V373 R404 H414 T415	V308-V402 HydrophobicContact CG1-CG1 4.3Å; V308-V402 HydrophobicContact CG2-CG1 4.46Å; V370-V402 CarbonylContact C-O 3.52Å; V370-V402 WeakPolarHBondContact CA-O 3.49Å; V371-V402 HydrophobicContact CB-CB 4.39Å; V371-V402 PolarHBondContact N-O 2.79Å; V371-V402 PolarHBondContact O-N 2.84Å; V373-V402 HydrophobicContact CB-CG2 4.07Å; V373-V402 HydrophobicContact CG2-CB 4.21Å; V373-V402 HydrophobicContact CG2-CG2 3.55Å; V402-R404 HydrophobicContact CG1-CG 4.06Å; V402-H414 CarbonylContact C-O 3.57Å; V402-H414 VanDerWaalsContact CA-O 3.23Å; V402-H414 WeakPolarHBondContact CA-O 3.32Å; V402-T415 HydrophobicContact CG2-CG2 4.12Å
403	T	96.2	Very high	90.2	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	143	162.1	63.4	0	0	0	0	109.2	L343 R369 F401 S413 H414 F416 I431	L343-T403 HydrophobicContact CD2-CG2 3.98Å; R369-T403 CarbonylContact O-C 3.44Å; R369-T403 WeakPolarHBondContact O-CA 3.07Å; F401-T403 HydrophobicContact CD2-CG2 4.19Å; F401-T403 HydrophobicContact CE2-CG2 3.88Å; T403-S413 CarbonylContact O-C 3.55Å; T403-S413 VanDerWaalsContact O-CA 3.29Å; T403-S413 WeakPolarHBondContact O-CA 3.37Å; T403-H414 PolarHBondContact N-O 2.77Å; T403-H414 PolarHBondContact O-N 3.32Å; T403-F416 HydrophobicContact CG2-CD2 4.25Å; T403-F416 HydrophobicContact CG2-CE2 3.9Å; T403-F416 WeakPolarHBondContact OG1-CE2 3.27Å; T403-I431 HydrophobicContact CG2-CD1 3.91Å
404	R	96.3	Very high	91.1	Very high	75 Å²	75	30.8 Å²	30.8	28%	0.283	16%	0.162	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	128.3	174.6	-62.1	-177.2	73.1	-175.1	2.4	108.1	T368 R369 V371 V402 V411 E412 F537	T368-R404 CarbonylContact C-O 3.46Å; T368-R404 WeakPolarHBondContact CA-O 3.45Å; R369-R404 PolarHBondContact N-O 2.78Å; R369-R404 PolarHBondContact O-N 2.7Å; V371-R404 HydrophobicContact CG2-CG 4.22Å; V402-R404 HydrophobicContact CG1-CG 4.06Å; R404-V411 HydrophobicContact CB-CG1 3.89Å; R404-V411 HydrophobicContact CG-CG1 4.41Å; R404-E412 CarbonylContact C-O 3.27Å; R404-E412 VanDerWaalsContact CA-O 3.32Å; R404-E412 WeakPolarHBondContact CA-O 3.08Å; R404-F537 HydrophobicContact CB-CE1 3.64Å; R404-F537 HydrophobicContact CB-CZ 4.01Å; R404-F537 VanDerWaalsContact O-CE1 3.22Å; R404-F537 WeakPolarHBondContact O-CE1 3.39Å
405	T	97.3	Very high	91.6	Very high	1 Å²	1	31 Å²	31	1%	0.006	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	124.5	-177.8	-51.9	0	0	0	0	109.1	H363 P364 A367 T368 S407 V411 E412	H363-T405 HydrophobicContact CB-CG2 4.25Å; H363-T405 PolarHBondContact ND1-OG1 2.93Å; P364-T405 HydrophobicContact CG-CG2 4.32Å; A367-T405 WeakPolarHBondContact O-CA 3.3Å; T368-T405 PolarHBondContact OG1-OG1 3.42Å; T405-S407 PolarHBondContact O-N 3Å; T405-V411 WeakPolarHBondContact O-CA 3.4Å; T405-E412 PolarHBondContact N-O 3.25Å; T405-E412 PolarHBondContact O-N 2.83Å
406	G	95.3	Very high	92.2	Very high	4 Å²	4	30.6 Å²	30.6	4%	0.041	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	116.8	170.4	0	0	0	0	0	109.8	A367	A367-G406 PolarHBondContact O-N 3Å
407	S	93.5	Very high	92.8	Very high	16 Å²	16	29.1 Å²	29.1	11%	0.112	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	173.9	180	92.5	0	0	0	0	111.9	T405 H409 G410 E412 P534	T405-S407 PolarHBondContact O-N 3Å; S407-H409 PolarHBondContact O-N 2.88Å; S407-H409 PolarHBondContact OG-N 3.48Å; S407-H409 VanDerWaalsContact OG-N 3.13Å; S407-G410 PolarHBondContact N-O 3.3Å; S407-G410 PolarHBondContact O-N 3.43Å; S407-E412 WeakPolarHBondContact CB-OE1 3.47Å; S407-E412 PolarHBondContact OG-OE1 2.94Å; S407-P534 WeakPolarHBondContact O-CD 3.4Å; S407-P534 WeakPolarHBondContact O-CG 3.46Å
408	K	91.6	Very high	93.2	Very high	166 Å²	166	26.9 Å²	26.9	72%	0.722	13%	0.133	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-17.3	175.5	70.5	-171.7	-176.3	-172	0	113	C531	K408-C531 WeakPolarHBondContact O-CB 3.26Å
409	H	90.1	Very high	93.3	Very high	114 Å²	114	27.5 Å²	27.5	53%	0.528	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.6	-3.4	-180	-61	-62	0	0	0	113.1	S407	S407-H409 PolarHBondContact O-N 2.88Å; S407-H409 PolarHBondContact OG-N 3.48Å; S407-H409 VanDerWaalsContact OG-N 3.13Å
410	G	92.4	Very high	93.4	Very high	13 Å²	13	27.5 Å²	27.5	13%	0.134	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	128.6	-130.7	-177.2	0	0	0	0	0	111.8	S407 K533	S407-G410 PolarHBondContact N-O 3.3Å; S407-G410 PolarHBondContact O-N 3.43Å; G410-K533 WeakPolarHBondContact O-CB 3.43Å
411	V	93.7	Very high	93.4	Very high	30 Å²	30	32 Å²	32	18%	0.182	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	111.3	177.3	-176.5	0	0	0	0	109.3	R404 T405 K533 F537	R404-V411 HydrophobicContact CB-CG1 3.89Å; R404-V411 HydrophobicContact CG-CG1 4.41Å; T405-V411 WeakPolarHBondContact O-CA 3.4Å; V411-K533 HydrophobicContact CG2-CB 4.07Å; V411-K533 HydrophobicContact CG2-CD 3.69Å; V411-K533 HydrophobicContact CG2-CG 3.71Å; V411-F537 HydrophobicContact CG1-CE1 4.45Å; V411-F537 HydrophobicContact CG1-CE2 4.5Å; V411-F537 HydrophobicContact CG1-CZ 3.78Å; V411-F537 HydrophobicContact CG2-CE2 3.96Å; V411-F537 HydrophobicContact CG2-CZ 4.06Å
412	E	91.5	Very high	93.5	Very high	55 Å²	55	37.7 Å²	37.7	26%	0.257	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	130	171.3	-72.7	160.9	-155.4	0	0	108.6	H363 R404 T405 S407	H363-E412 IonicContact CE1-OE2 2.73Å; H363-E412 IonicContact ND1-OE2 3.86Å; R404-E412 CarbonylContact C-O 3.27Å; R404-E412 VanDerWaalsContact CA-O 3.32Å; R404-E412 WeakPolarHBondContact CA-O 3.08Å; T405-E412 PolarHBondContact N-O 3.25Å; T405-E412 PolarHBondContact O-N 2.83Å; S407-E412 WeakPolarHBondContact CB-OE1 3.47Å; S407-E412 PolarHBondContact OG-OE1 2.94Å
413	S	91	Very high	93.5	Very high	7 Å²	7	38.2 Å²	38.2	5%	0.049	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	131.8	-176.5	-57.7	0	0	0	0	111	T403	T403-S413 CarbonylContact O-C 3.55Å; T403-S413 VanDerWaalsContact O-CA 3.29Å; T403-S413 WeakPolarHBondContact O-CA 3.37Å
414	H	92.7	Very high	93.4	Very high	10 Å²	10	38.8 Å²	38.8	5%	0.046	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	125.5	176.8	-63.3	-93.7	0	0	0	109.5	E284 Q361 H363 V402 T403 F416	E284-H414 IonicContact OE1-CE1 3.27Å; E284-H414 IonicContact OE1-CG 3.36Å; E284-H414 IonicContact OE1-ND1 2.68Å; E284-H414 PolarHBondContact OE1-ND1 2.9Å; Q361-H414 PolarHBondContact OE1-CE1 2.79Å; Q361-H414 PolarHBondContact OE1-NE2 3.02Å; H363-H414 AromaticContact CE1-CD2 3.75Å; H363-H414 AromaticContact CE1-NE2 3.2Å; H363-H414 PolarHBondContact CE1-NE2 2.9Å; H363-H414 AromaticContact NE2-CD2 3.6Å; H363-H414 AromaticContact NE2-CE1 3.73Å; H363-H414 AromaticContact NE2-NE2 3.09Å; H363-H414 PolarHBondContact NE2-NE2 2.89Å; V402-H414 CarbonylContact C-O 3.57Å; V402-H414 VanDerWaalsContact CA-O 3.23Å; V402-H414 WeakPolarHBondContact CA-O 3.32Å; T403-H414 PolarHBondContact N-O 2.77Å; T403-H414 PolarHBondContact O-N 3.32Å; H414-F416 HydrophobicContact CB-CD2 4.27Å; H414-F416 HydrophobicContact CB-CE1 4.09Å; H414-F416 HydrophobicContact CB-CE2 3.47Å; H414-F416 VanDerWaalsContact CB-CE2 3.47Å; H414-F416 HydrophobicContact CB-CZ 3.37Å
415	T	92.7	Very high	93.4	Very high	13 Å²	13	39.3 Å²	39.3	8%	0.08	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	116.1	174.4	-57.8	0	0	0	0	108.6	E284 L285 W331 L375 V402	E284-T415 WeakPolarHBondContact CA-O 3.28Å; L285-T415 HydrophobicContact CB-CG2 4.41Å; L285-T415 PolarHBondContact N-O 3.33Å; W331-T415 HydrophobicContact CH2-CG2 3.85Å; W331-T415 HydrophobicContact CZ3-CG2 4.44Å; L375-T415 HydrophobicContact CD1-CG2 3.9Å; V402-T415 HydrophobicContact CG2-CG2 4.12Å
416	F	94.7	Very high	93.3	Very high	1 Å²	1	42 Å²	42	0%	0.004	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	151.5	178.8	-58.1	-69.1	0	0	0	110.9	L282 V283 E284 V334 L343 L345 T400 F401 T403 H414	L282-F416 HydrophobicContact CB-CD1 4.13Å; L282-F416 HydrophobicContact CD1-CB 4.26Å; L282-F416 HydrophobicContact CD1-CD1 3.84Å; L282-F416 HydrophobicContact CD1-CD2 4.37Å; L282-F416 HydrophobicContact CD1-CE1 4.26Å; L282-F416 HydrophobicContact CD1-CG 3.9Å; V283-F416 CarbonylContact O-C 3.55Å; V283-F416 VanDerWaalsContact O-CA 3.31Å; V283-F416 WeakPolarHBondContact O-CA 3.16Å; E284-F416 HydrophobicContact CB-CD1 3.93Å; E284-F416 HydrophobicContact CB-CE1 4.02Å; E284-F416 HydrophobicContact CG-CD1 4.13Å; E284-F416 HydrophobicContact CG-CE1 3.91Å; V334-F416 HydrophobicContact CG1-CD1 4.2Å; V334-F416 HydrophobicContact CG1-CE1 3.99Å; L343-F416 HydrophobicContact CD2-CE2 4.44Å; L345-F416 HydrophobicContact CD1-CE1 4.39Å; L345-F416 HydrophobicContact CD1-CZ 4.04Å; L345-F416 HydrophobicContact CD2-CE1 4.21Å; L345-F416 HydrophobicContact CD2-CZ 4Å; T400-F416 CarbonylContact C-O 3.56Å; T400-F416 WeakPolarHBondContact CA-O 3.19Å; T400-F416 WeakPolarHBondContact CB-O 3.29Å; F401-F416 HydrophobicContact CD1-CB 4.05Å; F401-F416 HydrophobicContact CD2-CD2 4.21Å; F401-F416 HydrophobicContact CE1-CB 3.59Å; F401-F416 HydrophobicContact CE1-CD2 4.43Å; F401-F416 HydrophobicContact CE1-CG 4.38Å; F401-F416 HydrophobicContact CE2-CB 4.23Å; F401-F416 AromaticContact CE2-CD2 3.56Å; F401-F416 HydrophobicContact CE2-CD2 3.56Å; F401-F416 HydrophobicContact CE2-CE2 4.36Å; F401-F416 HydrophobicContact CE2-CG 4.29Å; F401-F416 HydrophobicContact CZ-CB 3.69Å; F401-F416 AromaticContact CZ-CD2 3.68Å; F401-F416 HydrophobicContact CZ-CD2 3.68Å; F401-F416 AromaticContact CZ-CG 3.98Å; F401-F416 HydrophobicContact CZ-CG 3.98Å; F401-F416 PolarHBondContact N-O 2.87Å; F401-F416 PolarHBondContact O-N 3.02Å; T403-F416 HydrophobicContact CG2-CD2 4.25Å; T403-F416 HydrophobicContact CG2-CE2 3.9Å; T403-F416 WeakPolarHBondContact OG1-CE2 3.27Å; H414-F416 HydrophobicContact CB-CD2 4.27Å; H414-F416 HydrophobicContact CB-CE1 4.09Å; H414-F416 HydrophobicContact CB-CE2 3.47Å; H414-F416 VanDerWaalsContact CB-CE2 3.47Å; H414-F416 HydrophobicContact CB-CZ 3.37Å
417	A	93.4	Very high	93.4	Very high	0 Å²	0	42 Å²	42	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	141.5	169.9	0	0	0	0	0	109.5	V283 W331 P394 M398 V399 T400	V283-A417 HydrophobicContact CB-CB 4.28Å; V283-A417 PolarHBondContact N-O 3.15Å; V283-A417 VanDerWaalsContact N-O 3.08Å; V283-A417 PolarHBondContact O-N 2.69Å; W331-A417 HydrophobicContact CE3-CB 4.09Å; W331-A417 HydrophobicContact CH2-CB 3.91Å; W331-A417 HydrophobicContact CZ3-CB 3.57Å; P394-A417 HydrophobicContact CB-CB 3.82Å; M398-A417 HydrophobicContact CB-CB 4.16Å; M398-A417 HydrophobicContact CE-CB 3.94Å; M398-A417 WeakPolarHBondContact CE-O 3.33Å; M398-A417 HydrophobicContact SD-CB 4.32Å; V399-A417 CarbonylContact O-C 3.6Å; V399-A417 VanDerWaalsContact O-CA 3.3Å; V399-A417 WeakPolarHBondContact O-CA 3.34Å; T400-A417 HydrophobicContact CG2-CB 4Å
418	V	94.8	Very high	93.5	Very high	6 Å²	6	41.3 Å²	41.3	4%	0.036	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	155.8	176.6	-67.2	0	0	0	0	111.1	L282 M398 V399 F401 T420 D423 L424	L282-V418 HydrophobicContact CD2-CG1 3.34Å; M398-V418 WeakPolarHBondContact CA-O 3.23Å; M398-V418 WeakPolarHBondContact CB-O 3.29Å; V399-V418 HydrophobicContact CG2-CG2 3.66Å; V399-V418 PolarHBondContact N-O 3.3Å; V399-V418 PolarHBondContact O-N 2.77Å; F401-V418 HydrophobicContact CE1-CG1 3.91Å; V418-T420 PolarHBondContact O-N 3.39Å; V418-D423 HydrophobicContact CB-CB 3.82Å; V418-D423 HydrophobicContact CG1-CB 4.4Å; V418-D423 HydrophobicContact CG2-CB 3.98Å; V418-L424 HydrophobicContact CG2-CB 3.77Å
419	S	91.8	Very high	93.7	Very high	19 Å²	19	37.6 Å²	37.6	13%	0.133	20%	0.196	C	C	.	.	S	Bend	trans	-70.2	-33	-168.9	-63.6	0	0	0	0	114
420	T	92.6	Very high	94.1	Very high	31 Å²	31	33.1 Å²	33.1	19%	0.19	18%	0.178	C	C	.	.	S	Bend	trans	-134	159.8	-177.2	74.3	0	0	0	0	113.1	V399 V418 E422 D423 L424	V399-T420 WeakPolarHBondContact CG2-O 3.41Å; V418-T420 PolarHBondContact O-N 3.39Å; T420-E422 PolarHBondContact O-N 2.84Å; T420-E422 PolarHBondContact OG1-N 3.35Å; T420-D423 WeakPolarHBondContact CB-OD2 3.36Å; T420-D423 PolarHBondContact N-OD2 3.21Å; T420-D423 PolarHBondContact O-N 2.72Å; T420-D423 VanDerWaalsContact O-N 3.17Å; T420-D423 PolarHBondContact OG1-N 3.05Å; T420-D423 PolarHBondContact OG1-OD1 3.34Å; T420-D423 PolarHBondContact OG1-OD2 3.39Å; T420-L424 PolarHBondContact O-N 2.88Å; T420-L424 VanDerWaalsContact O-N 3.12Å
421	Q	92.6	Very high	94.3	Very high	107 Å²	107	32.5 Å²	32.5	50%	0.5	17%	0.172	S	C	.	.	H	α-helix	trans	-59.8	-32.6	171.6	-175.4	62.3	37.1	0	0	112	L424 M425	Q421-L424 WeakPolarHBondContact O-CB 3.31Å; Q421-L424 PolarHBondContact O-N 2.76Å; Q421-M425 VanDerWaalsContact O-CG 3.31Å; Q421-M425 WeakPolarHBondContact O-CG 3.26Å; Q421-M425 PolarHBondContact O-N 3.26Å
422	E	94.3	Very high	94.4	Very high	122 Å²	122	33.9 Å²	33.9	57%	0.57	18%	0.178	S	C	*	.	H	α-helix	trans	-64.9	-40.8	176.4	-168.9	-163.8	135.4	0	0	111.3	K256 T420 L424 M425 T426	K256-E422 IonicContact NZ-OE1 3.21Å; K256-E422 PolarHBondContact NZ-OE1 3.11Å; K256-E422 IonicContact NZ-OE2 3.39Å; K256-E422 PolarHBondContact NZ-OE2 2.84Å; T420-E422 PolarHBondContact O-N 2.84Å; T420-E422 PolarHBondContact OG1-N 3.35Å; E422-L424 VanDerWaalsContact C-N 3.33Å; E422-M425 PolarHBondContact O-N 3.47Å; E422-T426 WeakPolarHBondContact O-CB 3.34Å; E422-T426 PolarHBondContact O-N 2.89Å; E422-T426 PolarHBondContact O-OG1 3.26Å
423	D	95.3	Very high	94.7	Very high	13 Å²	13	37.4 Å²	37.4	7%	0.07	19%	0.194	C	C	.	.	H	α-helix	trans	-65.5	-40.5	176.9	-52.2	-35.3	0	0	0	110.9	H252 K256 V418 T420 M425 T426 W427	H252-D423 IonicContact CE1-OD1 2.87Å; H252-D423 PolarHBondContact CE1-OD1 3.12Å; H252-D423 IonicContact CE1-OD2 3.5Å; H252-D423 PolarHBondContact CE1-OD2 2.92Å; H252-D423 IonicContact NE2-OD1 3.17Å; H252-D423 IonicContact NE2-OD2 2.86Å; H252-D423 PolarHBondContact NE2-OD2 3.14Å; K256-D423 WeakPolarHBondContact CE-OD1 3.34Å; K256-D423 IonicContact NZ-OD1 2.89Å; K256-D423 PolarHBondContact NZ-OD1 3.34Å; V418-D423 HydrophobicContact CB-CB 3.82Å; V418-D423 HydrophobicContact CG1-CB 4.4Å; V418-D423 HydrophobicContact CG2-CB 3.98Å; T420-D423 WeakPolarHBondContact CB-OD2 3.36Å; T420-D423 PolarHBondContact N-OD2 3.21Å; T420-D423 PolarHBondContact O-N 2.72Å; T420-D423 VanDerWaalsContact O-N 3.17Å; T420-D423 PolarHBondContact OG1-N 3.05Å; T420-D423 PolarHBondContact OG1-OD1 3.34Å; T420-D423 PolarHBondContact OG1-OD2 3.39Å; D423-M425 VanDerWaalsContact C-N 3.35Å; D423-M425 PolarHBondContact O-N 2.8Å; D423-T426 PolarHBondContact O-N 3.1Å; D423-W427 WeakPolarHBondContact O-CB 3.34Å; D423-W427 PolarHBondContact O-N 3.21Å
424	L	95.1	Very high	94.9	Very high	11 Å²	11	37.6 Å²	37.6	6%	0.058	20%	0.197	C	C	.	.	H	α-helix	trans	-57.9	-48.9	175.2	169.4	60.6	0	0	0	110.9	V399 F401 V418 T420 Q421 E422 T426 S428	V399-L424 HydrophobicContact CB-CD2 4.19Å; V399-L424 HydrophobicContact CG2-CB 3.75Å; V399-L424 HydrophobicContact CG2-CD2 3.96Å; V399-L424 HydrophobicContact CG2-CG 4.44Å; F401-L424 HydrophobicContact CB-CD1 3.56Å; F401-L424 HydrophobicContact CD1-CD1 3.9Å; F401-L424 HydrophobicContact CG-CD1 4.05Å; V418-L424 HydrophobicContact CG2-CB 3.77Å; T420-L424 PolarHBondContact O-N 2.88Å; T420-L424 VanDerWaalsContact O-N 3.12Å; Q421-L424 WeakPolarHBondContact O-CB 3.31Å; Q421-L424 PolarHBondContact O-N 2.76Å; E422-L424 VanDerWaalsContact C-N 3.33Å; L424-T426 VanDerWaalsContact C-N 3.34Å; L424-S428 WeakPolarHBondContact O-CB 3.49Å; L424-S428 PolarHBondContact O-N 2.86Å; L424-S428 PolarHBondContact O-OG 3.04Å
425	M	95.3	Very high	95.2	Very high	87 Å²	87	37.2 Å²	37.2	43%	0.429	20%	0.196	S	C	.	.	H	α-helix	trans	-64.7	-40.6	177.7	-62.9	-56	-71.5	0	0	111.3	Q421 E422 D423 N429	Q421-M425 VanDerWaalsContact O-CG 3.31Å; Q421-M425 WeakPolarHBondContact O-CG 3.26Å; Q421-M425 PolarHBondContact O-N 3.26Å; E422-M425 PolarHBondContact O-N 3.47Å; D423-M425 VanDerWaalsContact C-N 3.35Å; D423-M425 PolarHBondContact O-N 2.8Å; M425-N429 WeakPolarHBondContact O-CB 3.38Å; M425-N429 PolarHBondContact O-N 3.26Å; M425-N429 PolarHBondContact O-ND2 2.76Å
426	T	96	Very high	95.3	Very high	57 Å²	57	37.6 Å²	37.6	35%	0.35	20%	0.197	S	C	.	.	H	α-helix	trans	-61.5	-51.8	179.4	-56	0	0	0	0	111.1	Q278 E422 D423 L424 A430	Q278-T426 VanDerWaalsContact NE2-CG2 3.28Å; E422-T426 WeakPolarHBondContact O-CB 3.34Å; E422-T426 PolarHBondContact O-N 2.89Å; E422-T426 PolarHBondContact O-OG1 3.26Å; D423-T426 PolarHBondContact O-N 3.1Å; L424-T426 VanDerWaalsContact C-N 3.34Å; T426-A430 WeakPolarHBondContact O-CB 3.13Å; T426-A430 PolarHBondContact O-N 3.34Å
427	W	97.1	Very high	95.4	Very high	4 Å²	4	43.3 Å²	43.3	2%	0.015	23%	0.225	C	C	.	.	H	α-helix	trans	-65.8	-45	178.7	-84.6	104	0	0	0	112.8	Q278 D280 L282 A336 L343 F401 D423 N429 A430 I431	Q278-W427 HydrophobicContact CB-CZ3 4.46Å; Q278-W427 HydrophobicContact CG-CD2 4.05Å; Q278-W427 HydrophobicContact CG-CE3 3.99Å; Q278-W427 HydrophobicContact CG-CH2 3.76Å; Q278-W427 HydrophobicContact CG-CZ2 3.82Å; Q278-W427 HydrophobicContact CG-CZ3 3.84Å; D280-W427 HydrophobicContact CB-CZ2 3.87Å; L282-W427 HydrophobicContact CD1-CZ2 4.48Å; L282-W427 HydrophobicContact CD2-CD2 4.18Å; L282-W427 HydrophobicContact CD2-CG 4.3Å; L282-W427 HydrophobicContact CD2-CZ2 4.12Å; L282-W427 HydrophobicContact CG-CZ2 4.3Å; A336-W427 HydrophobicContact CB-CH2 3.54Å; A336-W427 HydrophobicContact CB-CZ2 4.14Å; A336-W427 HydrophobicContact CB-CZ3 4.1Å; L343-W427 HydrophobicContact CD1-CZ3 4.25Å; F401-W427 HydrophobicContact CE1-CB 4.14Å; F401-W427 HydrophobicContact CZ-CB 3.99Å; F401-W427 HydrophobicContact CZ-CG 4.38Å; D423-W427 WeakPolarHBondContact O-CB 3.34Å; D423-W427 PolarHBondContact O-N 3.21Å; W427-N429 PolarHBondContact O-N 2.75Å; W427-A430 PolarHBondContact O-N 3.26Å; W427-I431 HydrophobicContact CE3-CD1 4.38Å; W427-I431 VanDerWaalsContact O-CG1 3.28Å; W427-I431 WeakPolarHBondContact O-CG1 3.32Å; W427-I431 PolarHBondContact O-N 2.81Å
428	S	95.9	Very high	95.5	Very high	1 Å²	1	44 Å²	44	1%	0.007	23%	0.231	C	C	.	.	H	α-helix	trans	-63.3	-46.2	-178.9	-56.5	0	0	0	0	111.3	H372 L424 I431 I432	H372-S428 PolarHBondContact CE1-OG 3.36Å; L424-S428 WeakPolarHBondContact O-CB 3.49Å; L424-S428 PolarHBondContact O-N 2.86Å; L424-S428 PolarHBondContact O-OG 3.04Å; S428-I431 PolarHBondContact O-N 3.04Å; S428-I432 WeakPolarHBondContact O-CB 3.48Å; S428-I432 WeakPolarHBondContact O-CD1 3.4Å; S428-I432 WeakPolarHBondContact O-CG1 3.31Å; S428-I432 PolarHBondContact O-N 3.17Å
429	N	96.1	Very high	95.6	Very high	88 Å²	88	44 Å²	44	47%	0.471	23%	0.231	S	C	.	.	H	α-helix	trans	-65.4	-43.2	177.9	-69.7	-20.4	0	0	0	111.5	M425 W427 I431 I432 E433	M425-N429 WeakPolarHBondContact O-CB 3.38Å; M425-N429 PolarHBondContact O-N 3.26Å; M425-N429 PolarHBondContact O-ND2 2.76Å; W427-N429 PolarHBondContact O-N 2.75Å; N429-I431 VanDerWaalsContact C-N 3.34Å; N429-I431 PolarHBondContact O-N 3.39Å; N429-I432 PolarHBondContact O-N 3.04Å; N429-E433 VanDerWaalsContact O-CB 3.28Å; N429-E433 WeakPolarHBondContact O-CB 3.37Å; N429-E433 PolarHBondContact O-N 3.4Å
430	A	96.8	Very high	95.8	Very high	20 Å²	20	44.6 Å²	44.6	17%	0.165	24%	0.237	C	C	.	.	H	α-helix	trans	-60.2	-43.2	178.7	0	0	0	0	0	111.8	Q278 L338 T426 W427 G434	Q278-A430 HydrophobicContact CB-CB 4.43Å; L338-A430 VanDerWaalsContact CD2-C 3.49Å; L338-A430 HydrophobicContact CD2-CB 3.67Å; L338-A430 VanDerWaalsContact CD2-O 3.31Å; L338-A430 WeakPolarHBondContact CD2-O 3.3Å; T426-A430 WeakPolarHBondContact O-CB 3.13Å; T426-A430 PolarHBondContact O-N 3.34Å; W427-A430 PolarHBondContact O-N 3.26Å; A430-G434 PolarHBondContact O-N 3.42Å
431	I	97.7	Very high	95.9	Very high	1 Å²	1	46.3 Å²	46.3	1%	0.005	26%	0.261	C	S	.	.	H	α-helix	trans	-68.4	-42.4	177.9	-63.9	164.2	0	0	0	111.1	L338 L365 V370 F401 T403 W427 S428 N429 G434 A435	L338-I431 HydrophobicContact CD1-CG1 4.1Å; L365-I431 HydrophobicContact CD2-CG2 4.16Å; V370-I431 HydrophobicContact CG2-CB 3.62Å; V370-I431 HydrophobicContact CG2-CD1 4.1Å; V370-I431 HydrophobicContact CG2-CG1 4.48Å; V370-I431 HydrophobicContact CG2-CG2 3.43Å; V370-I431 VanDerWaalsContact CG2-CG2 3.43Å; F401-I431 HydrophobicContact CE2-CD1 3.83Å; T403-I431 HydrophobicContact CG2-CD1 3.91Å; W427-I431 HydrophobicContact CE3-CD1 4.38Å; W427-I431 VanDerWaalsContact O-CG1 3.28Å; W427-I431 WeakPolarHBondContact O-CG1 3.32Å; W427-I431 PolarHBondContact O-N 2.81Å; S428-I431 PolarHBondContact O-N 3.04Å; N429-I431 VanDerWaalsContact C-N 3.34Å; N429-I431 PolarHBondContact O-N 3.39Å; I431-G434 PolarHBondContact O-N 3.43Å; I431-A435 WeakPolarHBondContact O-CB 3.48Å; I431-A435 PolarHBondContact O-N 2.8Å
432	I	96.3	Very high	96.1	Very high	59 Å²	59	43.2 Å²	43.2	30%	0.303	25%	0.254	S	S	.	.	H	α-helix	trans	-62.7	-48.6	177.9	-68.9	165	0	0	0	110.6	V370 S428 N429 A435 H436	V370-I432 HydrophobicContact CB-CG1 4.31Å; V370-I432 HydrophobicContact CG2-CG1 4.24Å; S428-I432 WeakPolarHBondContact O-CB 3.48Å; S428-I432 WeakPolarHBondContact O-CD1 3.4Å; S428-I432 WeakPolarHBondContact O-CG1 3.31Å; S428-I432 PolarHBondContact O-N 3.17Å; N429-I432 PolarHBondContact O-N 3.04Å; I432-A435 PolarHBondContact O-N 2.71Å; I432-H436 PolarHBondContact O-CD2 2.55Å; I432-H436 VanDerWaalsContact O-CD2 3.23Å; I432-H436 VanDerWaalsContact O-CG 3.31Å; I432-H436 PolarHBondContact O-N 3.47Å
433	E	96	Very high	96.2	Very high	128 Å²	128	43.3 Å²	43.3	60%	0.598	25%	0.254	S	S	*	.	H	α-helix	trans	-62.7	-44.1	177.1	-175.6	175.2	-171.5	0	0	111	N429 A435 H436 M437	N429-E433 VanDerWaalsContact O-CB 3.28Å; N429-E433 WeakPolarHBondContact O-CB 3.37Å; N429-E433 PolarHBondContact O-N 3.4Å; E433-A435 VanDerWaalsContact C-N 3.34Å; E433-A435 PolarHBondContact O-N 3.42Å; E433-H436 WeakPolarHBondContact O-CB 3.41Å; E433-H436 PolarHBondContact O-N 3.48Å; E433-H436 VanDerWaalsContact O-N 3.17Å; E433-M437 HydrophobicContact CG-CG 4.42Å; E433-M437 WeakPolarHBondContact O-CB 3.37Å; E433-M437 VanDerWaalsContact O-CG 3.3Å; E433-M437 WeakPolarHBondContact O-CG 3.31Å; E433-M437 PolarHBondContact O-N 2.85Å
434	G	96.6	Very high	96.2	Very high	11 Å²	11	47.8 Å²	47.8	11%	0.113	28%	0.275	C	S	.	.	H	α-helix	trans	-57.9	-43.9	174.6	0	0	0	0	0	112.5	A430 I431 M437 A438	A430-G434 PolarHBondContact O-N 3.42Å; I431-G434 PolarHBondContact O-N 3.43Å; G434-M437 PolarHBondContact O-N 3.42Å; G434-A438 WeakPolarHBondContact O-CB 3.36Å; G434-A438 PolarHBondContact O-N 2.88Å
435	A	97.7	Very high	96.3	Very high	2 Å²	2	48.7 Å²	48.7	2%	0.017	28%	0.281	C	S	.	.	H	α-helix	trans	-63.5	-40.7	175	0	0	0	0	0	112.4	L365 I431 I432 E433 A438 V439	L365-A435 VanDerWaalsContact O-CB 3.31Å; L365-A435 WeakPolarHBondContact O-CB 3.06Å; I431-A435 WeakPolarHBondContact O-CB 3.48Å; I431-A435 PolarHBondContact O-N 2.8Å; I432-A435 PolarHBondContact O-N 2.71Å; E433-A435 VanDerWaalsContact C-N 3.34Å; E433-A435 PolarHBondContact O-N 3.42Å; A435-A438 PolarHBondContact O-N 3.05Å; A435-V439 WeakPolarHBondContact O-CG2 3.43Å; A435-V439 PolarHBondContact O-N 2.8Å; A435-V439 VanDerWaalsContact O-N 3.11Å
436	H	96.4	Very high	96.4	Very high	22 Å²	22	47.9 Å²	47.9	10%	0.102	28%	0.281	C	S	.	.	H	α-helix	trans	-65	-41.6	175.8	-68.9	-173.8	0	0	0	111.9	I432 E433 V439 A440 S544 A545 T548	I432-H436 PolarHBondContact O-CD2 2.55Å; I432-H436 VanDerWaalsContact O-CD2 3.23Å; I432-H436 VanDerWaalsContact O-CG 3.31Å; I432-H436 PolarHBondContact O-N 3.47Å; E433-H436 WeakPolarHBondContact O-CB 3.41Å; E433-H436 PolarHBondContact O-N 3.48Å; E433-H436 VanDerWaalsContact O-N 3.17Å; H436-V439 WeakPolarHBondContact O-CG2 3.29Å; H436-A440 WeakPolarHBondContact O-CB 3.41Å; H436-A440 PolarHBondContact O-N 3.33Å; H436-S544 PolarHBondContact NE2-OG 3.39Å; H436-A545 HydrophobicContact CB-CB 3.92Å; H436-T548 PolarHBondContact CE1-OG1 2.82Å
437	M	95.2	Very high	96.4	Very high	120 Å²	120	46.4 Å²	46.4	59%	0.591	27%	0.27	S	S	*	.	H	α-helix	trans	-68.1	-36.9	176	-69.9	-58.8	-65	0	0	111.7	E433 G434 A440 G441	E433-M437 HydrophobicContact CG-CG 4.42Å; E433-M437 WeakPolarHBondContact O-CB 3.37Å; E433-M437 VanDerWaalsContact O-CG 3.3Å; E433-M437 WeakPolarHBondContact O-CG 3.31Å; E433-M437 PolarHBondContact O-N 2.85Å; G434-M437 PolarHBondContact O-N 3.42Å; M437-A440 PolarHBondContact O-N 3.06Å; M437-G441 PolarHBondContact O-N 2.86Å
438	A	96.7	Very high	96.4	Very high	16 Å²	16	50.2 Å²	50.2	13%	0.132	29%	0.294	C	S	.	.	H	α-helix	trans	-64	-45.2	176.7	0	0	0	0	0	112	L365 I366 G434 A435 G441 A442	L365-A438 HydrophobicContact CB-CB 4.17Å; I366-A438 HydrophobicContact CB-CB 4.06Å; I366-A438 HydrophobicContact CG1-CB 4.46Å; G434-A438 WeakPolarHBondContact O-CB 3.36Å; G434-A438 PolarHBondContact O-N 2.88Å; A435-A438 PolarHBondContact O-N 3.05Å; A438-G441 PolarHBondContact O-N 3.48Å; A438-A442 WeakPolarHBondContact O-CB 3.07Å; A438-A442 PolarHBondContact O-N 2.96Å
439	V	97	Very high	96.4	Very high	4 Å²	4	50.2 Å²	50.2	2%	0.024	29%	0.294	C	S	.	.	H	α-helix	trans	-68.1	-34.6	175.1	-64.9	0	0	0	0	112.4	I366 A435 H436 Q443 Y462 N541 I542 A545	I366-V439 HydrophobicContact CD1-CG1 4.4Å; I366-V439 HydrophobicContact CG1-CB 4.42Å; I366-V439 HydrophobicContact CG1-CG1 3.53Å; A435-V439 WeakPolarHBondContact O-CG2 3.43Å; A435-V439 PolarHBondContact O-N 2.8Å; A435-V439 VanDerWaalsContact O-N 3.11Å; H436-V439 WeakPolarHBondContact O-CG2 3.29Å; V439-Q443 PolarHBondContact O-N 3.36Å; V439-Y462 HydrophobicContact CB-CD2 4.35Å; V439-Y462 HydrophobicContact CG2-CD2 3.99Å; V439-Y462 HydrophobicContact CG2-CE2 3.85Å; V439-N541 HydrophobicContact CG1-CB 3.78Å; V439-I542 HydrophobicContact CB-CG1 3.86Å; V439-I542 HydrophobicContact CG1-CG1 3.9Å; V439-I542 HydrophobicContact CG2-CG1 4.28Å; V439-A545 HydrophobicContact CG2-CB 4.21Å
440	A	95.8	Very high	96.5	Very high	32 Å²	32	51.1 Å²	51.1	26%	0.264	29%	0.291	S	S	.	.	H	α-helix	trans	-67.4	-43	175.8	0	0	0	0	0	111.7	H436 M437 Q443 Y462	H436-A440 WeakPolarHBondContact O-CB 3.41Å; H436-A440 PolarHBondContact O-N 3.33Å; M437-A440 PolarHBondContact O-N 3.06Å; A440-Q443 PolarHBondContact O-N 3.26Å; A440-Y462 HydrophobicContact CB-CD2 4.4Å; A440-Y462 HydrophobicContact CB-CE1 3.95Å; A440-Y462 HydrophobicContact CB-CE2 3.86Å
441	G	94.8	Very high	96.4	Very high	68 Å²	68	52.4 Å²	52.4	70%	0.701	29%	0.291	S	S	*	.	H	α-helix	trans	-70	-31.5	178.4	0	0	0	0	0	113.4	M437 A438 Q443	M437-G441 PolarHBondContact O-N 2.86Å; A438-G441 PolarHBondContact O-N 3.48Å; G441-Q443 VanDerWaalsContact C-N 3.29Å
442	A	95.9	Very high	96.1	Very high	42 Å²	42	58.4 Å²	58.4	35%	0.347	32%	0.319	S	S	.	.	H	α-helix	trans	-67.4	-31.1	172	0	0	0	0	0	112.4	I366 A438 E444 V445	I366-A442 HydrophobicContact CD1-CB 3.71Å; A438-A442 WeakPolarHBondContact O-CB 3.07Å; A438-A442 PolarHBondContact O-N 2.96Å; A442-E444 PolarHBondContact O-N 3.41Å; A442-V445 HydrophobicContact CB-CG2 4.31Å
443	Q	96.2	Very high	95.8	Very high	124 Å²	124	62.9 Å²	62.9	58%	0.579	34%	0.344	S	S	*	.			trans	62	-48.8	-176.6	-172.7	177.9	-7.1	0	0	114.7	V439 A440 G441 Y462	V439-Q443 PolarHBondContact O-N 3.36Å; A440-Q443 PolarHBondContact O-N 3.26Å; G441-Q443 VanDerWaalsContact C-N 3.29Å; Q443-Y462 WeakPolarHBondContact O-CB 3.43Å; Q443-Y462 PolarHBondContact O-N 3.1Å
444	E	96.2	Very high	95.6	Very high	106 Å²	106	61 Å²	61	50%	0.495	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	141.4	172.6	61.9	179.8	-159.5	0	0	111.2	A442 T459 L460	A442-E444 PolarHBondContact O-N 3.41Å; E444-T459 HydrophobicContact CB-CG2 4.15Å; E444-L460 WeakPolarHBondContact CA-O 3.4Å
445	V	97.1	Very high	95.5	Very high	30 Å²	30	63.4 Å²	63.4	18%	0.182	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	122.2	171.8	-178.2	0	0	0	0	108.6	I366 A442 I447 T459 L460 I538	I366-V445 HydrophobicContact CD1-CG2 3.75Å; A442-V445 HydrophobicContact CB-CG2 4.31Å; V445-I447 HydrophobicContact CG1-CD1 3.9Å; V445-I447 HydrophobicContact CG1-CG1 4.28Å; V445-T459 CarbonylContact O-C 3.39Å; V445-T459 WeakPolarHBondContact O-CA 3.39Å; V445-L460 HydrophobicContact CB-CB 4.46Å; V445-L460 PolarHBondContact N-O 3.07Å; V445-L460 PolarHBondContact O-N 2.94Å; V445-I538 HydrophobicContact CB-CG2 4.44Å; V445-I538 HydrophobicContact CG1-CD1 4.21Å; V445-I538 HydrophobicContact CG2-CG2 4Å
446	V	97	Very high	95.4	Very high	71 Å²	71	63.3 Å²	63.3	43%	0.43	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	122.9	-179.9	-177	0	0	0	0	109.7	R457 L458 T459	V446-R457 HydrophobicContact CG1-CB 4Å; V446-R457 HydrophobicContact CG1-CG 4Å; V446-L458 WeakPolarHBondContact CA-O 3.45Å; V446-T459 HydrophobicContact CG2-CG2 4.17Å
447	I	96.3	Very high	95.5	Very high	25 Å²	25	68.3 Å²	68.3	13%	0.128	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	127.5	-179.5	-56.7	101.5	0	0	0	109.4	V445 R457 L458 L460 L528 V535	V445-I447 HydrophobicContact CG1-CD1 3.9Å; V445-I447 HydrophobicContact CG1-CG1 4.28Å; I447-R457 CarbonylContact O-C 3.47Å; I447-R457 WeakPolarHBondContact O-CA 3.32Å; I447-L458 HydrophobicContact CB-CB 4.47Å; I447-L458 PolarHBondContact N-O 3.14Å; I447-L458 PolarHBondContact O-N 3.26Å; I447-L460 HydrophobicContact CD1-CD1 3.58Å; I447-L460 HydrophobicContact CD1-CD2 4.43Å; I447-L528 HydrophobicContact CG2-CD2 4.21Å; I447-V535 HydrophobicContact CD1-CG1 4.09Å; I447-V535 HydrophobicContact CD1-CG2 4.27Å; I447-V535 HydrophobicContact CG1-CG2 3.86Å; I447-V535 HydrophobicContact CG2-CG2 4.17Å
448	T	96.1	Very high	95.6	Very high	85 Å²	85	62.7 Å²	62.7	52%	0.521	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	129.9	169.6	-54.6	0	0	0	0	109.2	L529	T448-L529 HydrophobicContact CG2-CD1 4.07Å
449	C	97.1	Very high	95.6	Very high	0 Å²	0	62.6 Å²	62.6	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	177	-179.4	60.5	0	0	0	0	110.8	C456 D527 L528	C449-C456 PolarHBondContact N-O 3.07Å; C449-C456 PolarHBondContact O-N 3.11Å; C449-C456 VanDerWaalsContact O-O 3.05Å; C449-D527 CarbonylContact C-O 3.56Å; C449-D527 WeakPolarHBondContact CA-O 3.42Å; C449-D527 VanDerWaalsContact CB-O 3.3Å; C449-D527 WeakPolarHBondContact CB-O 3.32Å; C449-L528 HydrophobicContact CB-CD2 3.67Å
450	R	97	Very high	95.6	Very high	107 Å²	107	62.5 Å²	62.5	40%	0.404	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	140.1	168.6	-71.8	176	179.1	153.4	-1	110.8	Y454 D455 D527 L529	R450-Y454 VanDerWaalsContact CA-O 3.29Å; R450-Y454 WeakPolarHBondContact CA-O 3.48Å; R450-D455 WeakPolarHBondContact CG-OD1 3.22Å; R450-D455 IonicContact CZ-OD1 2.72Å; R450-D455 IonicContact NE-OD1 3.39Å; R450-D455 PolarHBondContact NE-OD1 3.01Å; R450-D455 IonicContact NH2-OD1 3.31Å; R450-D527 HydrophobicContact CB-CB 4.21Å; R450-D527 PolarHBondContact N-O 3.22Å; R450-D527 PolarHBondContact O-N 3.12Å; R450-L529 HydrophobicContact CG-CD2 4.18Å
451	W	95.4	Very high	95.7	Very high	48 Å²	48	62.6 Å²	62.6	18%	0.182	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	125.8	170.5	176.7	73.1	0	0	0	108.4	N453 Y454 L468 I495 Y524 L526	W451-N453 PolarHBondContact O-N 2.8Å; W451-N453 VanDerWaalsContact O-N 3.15Å; W451-Y454 PolarHBondContact N-O 3.4Å; W451-Y454 PolarHBondContact O-N 3.31Å; W451-L468 HydrophobicContact CB-CD2 3.91Å; W451-L468 HydrophobicContact CD2-CD2 4.2Å; W451-L468 HydrophobicContact CG-CD2 3.9Å; W451-I495 HydrophobicContact CE3-CD1 3.77Å; W451-I495 HydrophobicContact CE3-CG2 4.09Å; W451-I495 HydrophobicContact CH2-CG2 3.9Å; W451-I495 HydrophobicContact CZ2-CG2 4.44Å; W451-I495 HydrophobicContact CZ3-CD1 4.13Å; W451-I495 HydrophobicContact CZ3-CG2 3.71Å; W451-Y524 HydrophobicContact CZ2-CD1 4.39Å; W451-Y524 HydrophobicContact CZ2-CE1 4.46Å; W451-Y524 AromaticContact NE1-CD1 3.74Å; W451-L526 HydrophobicContact CB-CD2 3.81Å; W451-L526 HydrophobicContact CG-CD2 4.06Å
452	Q	92.3	Very high	95.8	Very high	127 Å²	127	60.8 Å²	60.8	59%	0.593	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.8	39	-175.5	-60.7	-176.2	-8	0	0	113.5	Y454	Q452-Y454 HydrophobicContact CB-CD2 4.28Å; Q452-Y454 VanDerWaalsContact O-CD2 3.31Å; Q452-Y454 WeakPolarHBondContact O-CD2 3.22Å; Q452-Y454 WeakPolarHBondContact O-CE2 3.41Å; Q452-Y454 PolarHBondContact O-N 2.8Å
453	N	88.8	Confident	95.7	Very high	153 Å²	153	62.5 Å²	62.5	82%	0.818	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.7	7.4	-175.4	-53.7	-50.8	0	0	0	116.5	W451	W451-N453 PolarHBondContact O-N 2.8Å; W451-N453 VanDerWaalsContact O-N 3.15Å
454	Y	91.8	Very high	95.6	Very high	89 Å²	89	60.2 Å²	60.2	35%	0.349	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	133.3	171.9	-62.5	-74.6	0	0	0	111.2	R450 W451 Q452 C456 I475	R450-Y454 VanDerWaalsContact CA-O 3.29Å; R450-Y454 WeakPolarHBondContact CA-O 3.48Å; W451-Y454 PolarHBondContact N-O 3.4Å; W451-Y454 PolarHBondContact O-N 3.31Å; Q452-Y454 HydrophobicContact CB-CD2 4.28Å; Q452-Y454 VanDerWaalsContact O-CD2 3.31Å; Q452-Y454 WeakPolarHBondContact O-CD2 3.22Å; Q452-Y454 WeakPolarHBondContact O-CE2 3.41Å; Q452-Y454 PolarHBondContact O-N 2.8Å; Y454-C456 PolarHBondContact O-N 2.95Å; Y454-C456 PolarHBondContact O-SG 2.9Å; Y454-I475 HydrophobicContact CD1-CD1 4.43Å; Y454-I475 HydrophobicContact CE1-CD1 3.36Å; Y454-I475 HydrophobicContact CE1-CG1 4.47Å; Y454-I475 HydrophobicContact CE2-CD1 4.45Å; Y454-I475 WeakPolarHBondContact OH-CD1 3.23Å
455	D	94.9	Very high	95.6	Very high	60 Å²	60	55.3 Å²	55.3	32%	0.321	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	124.7	173.5	-65.3	-33	0	0	0	109.8	R450 C471	R450-D455 WeakPolarHBondContact CG-OD1 3.22Å; R450-D455 IonicContact CZ-OD1 2.72Å; R450-D455 IonicContact NE-OD1 3.39Å; R450-D455 PolarHBondContact NE-OD1 3.01Å; R450-D455 IonicContact NH2-OD1 3.31Å; D455-C471 HydrophobicContact CB-CB 4.4Å; D455-C471 VanDerWaalsContact O-CB 3.29Å; D455-C471 WeakPolarHBondContact O-CB 3.31Å; D455-C471 PolarHBondContact O-N 3.03Å
456	C	96.3	Very high	95.6	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	166.1	-174.6	-64.6	0	0	0	0	110.8	C449 Y454 L468 I469 I495	C449-C456 PolarHBondContact N-O 3.07Å; C449-C456 PolarHBondContact O-N 3.11Å; C449-C456 VanDerWaalsContact O-O 3.05Å; Y454-C456 PolarHBondContact O-N 2.95Å; Y454-C456 PolarHBondContact O-SG 2.9Å; C456-L468 HydrophobicContact CB-CD1 3.77Å; C456-L468 HydrophobicContact CB-CG 4.19Å; C456-I469 CarbonylContact C-O 3.59Å; C456-I469 WeakPolarHBondContact CA-O 3.31Å; C456-I469 WeakPolarHBondContact CB-O 3.35Å; C456-I495 VanDerWaalsContact SG-CD1 3.52Å
457	R	96.8	Very high	95.7	Very high	128 Å²	128	53.1 Å²	53.1	48%	0.483	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	117.6	167.6	-79.2	-177.4	-102.5	-172	-4.6	109.3	V446 I447 I469	V446-R457 HydrophobicContact CG1-CB 4Å; V446-R457 HydrophobicContact CG1-CG 4Å; I447-R457 CarbonylContact O-C 3.47Å; I447-R457 WeakPolarHBondContact O-CA 3.32Å; R457-I469 PolarHBondContact N-O 3.14Å; R457-I469 PolarHBondContact O-N 3.38Å
458	L	97.6	Very high	95.7	Very high	1 Å²	1	51.9 Å²	51.9	1%	0.005	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	123.9	168.8	176.2	67.2	0	0	0	108	V446 I447 L460 K467 L468 W496 L514 I516 L526 V535	V446-L458 WeakPolarHBondContact CA-O 3.45Å; I447-L458 HydrophobicContact CB-CB 4.47Å; I447-L458 PolarHBondContact N-O 3.14Å; I447-L458 PolarHBondContact O-N 3.26Å; L458-L460 HydrophobicContact CD1-CD1 4.31Å; L458-L460 HydrophobicContact CD2-CD1 3.78Å; L458-L460 HydrophobicContact CG-CD1 3.63Å; L458-K467 CarbonylContact C-O 3.49Å; L458-K467 WeakPolarHBondContact CA-O 3.45Å; L458-L468 HydrophobicContact CB-CD1 4.15Å; L458-L468 HydrophobicContact CD1-CD1 4.46Å; L458-W496 HydrophobicContact CD1-CH2 3.72Å; L458-W496 HydrophobicContact CD1-CZ2 4.44Å; L458-W496 HydrophobicContact CD1-CZ3 4.47Å; L458-L514 HydrophobicContact CD2-CD2 4.37Å; L458-I516 HydrophobicContact CD2-CD1 4.32Å; L458-L526 HydrophobicContact CD1-CD1 4.14Å; L458-L526 HydrophobicContact CD2-CD1 3.86Å; L458-L526 HydrophobicContact CG-CD1 4.42Å; L458-V535 HydrophobicContact CD2-CG1 4.43Å
459	T	97.5	Very high	95.6	Very high	15 Å²	15	49.7 Å²	49.7	9%	0.092	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	126.7	177.6	-52.1	0	0	0	0	109.2	E444 V445 V446 L466 K467	E444-T459 HydrophobicContact CB-CG2 4.15Å; V445-T459 CarbonylContact O-C 3.39Å; V445-T459 WeakPolarHBondContact O-CA 3.39Å; V446-T459 HydrophobicContact CG2-CG2 4.17Å; T459-L466 WeakPolarHBondContact O-CA 3.4Å; T459-K467 PolarHBondContact N-O 3.09Å; T459-K467 PolarHBondContact O-N 2.71Å
460	L	97.9	Very high	95.4	Very high	1 Å²	1	50.4 Å²	50.4	1%	0.005	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	101.2	171.9	-77.3	58.4	0	0	0	106.9	E444 V445 I447 L458 V535 I538 L539 I542	E444-L460 WeakPolarHBondContact CA-O 3.4Å; V445-L460 HydrophobicContact CB-CB 4.46Å; V445-L460 PolarHBondContact N-O 3.07Å; V445-L460 PolarHBondContact O-N 2.94Å; I447-L460 HydrophobicContact CD1-CD1 3.58Å; I447-L460 HydrophobicContact CD1-CD2 4.43Å; L458-L460 HydrophobicContact CD1-CD1 4.31Å; L458-L460 HydrophobicContact CD2-CD1 3.78Å; L458-L460 HydrophobicContact CG-CD1 3.63Å; L460-V535 HydrophobicContact CD1-CG1 4.44Å; L460-V535 HydrophobicContact CD2-CG1 4.01Å; L460-I538 HydrophobicContact CD2-CG2 4.05Å; L460-L539 HydrophobicContact CD2-CB 4.09Å; L460-I542 HydrophobicContact CB-CD1 3.97Å
461	H	97.6	Very high	94.9	Very high	35 Å²	35	48 Å²	48	16%	0.162	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	131.4	179.6	-176.7	-68	0	0	0	110.2	D463 T464 G465 Y500	H461-D463 PolarHBondContact ND1-N 2.97Å; H461-D463 VanDerWaalsContact ND1-N 3.12Å; H461-D463 PolarHBondContact O-N 2.94Å; H461-T464 VanDerWaalsContact CB-OG1 3.29Å; H461-T464 WeakPolarHBondContact CB-OG1 3.4Å; H461-T464 PolarHBondContact ND1-N 3.11Å; H461-T464 PolarHBondContact ND1-OG1 3.26Å; H461-G465 PolarHBondContact N-O 3.36Å; H461-G465 PolarHBondContact O-N 3.26Å; H461-Y500 VanDerWaalsContact O-CE2 3.22Å; H461-Y500 WeakPolarHBondContact O-CE2 3.4Å; H461-Y500 PolarHBondContact O-OH 2.71Å
462	Y	96.2	Very high	93.9	Very high	30 Å²	30	50.2 Å²	50.2	12%	0.118	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-48.1	-40.1	-173.5	178	-115.5	0	0	0	114.7	V439 A440 Q443 I542 A545 R549	V439-Y462 HydrophobicContact CB-CD2 4.35Å; V439-Y462 HydrophobicContact CG2-CD2 3.99Å; V439-Y462 HydrophobicContact CG2-CE2 3.85Å; A440-Y462 HydrophobicContact CB-CD2 4.4Å; A440-Y462 HydrophobicContact CB-CE1 3.95Å; A440-Y462 HydrophobicContact CB-CE2 3.86Å; Q443-Y462 WeakPolarHBondContact O-CB 3.43Å; Q443-Y462 PolarHBondContact O-N 3.1Å; Y462-I542 HydrophobicContact CD2-CG2 4.43Å; Y462-I542 WeakPolarHBondContact O-CG2 3.45Å; Y462-A545 HydrophobicContact CE2-CB 3.99Å; Y462-R549 VanDerWaalsContact OH-CD 3.26Å; Y462-R549 WeakPolarHBondContact OH-CD 3.29Å; Y462-R549 VanDerWaalsContact OH-CZ 3.23Å; Y462-R549 PolarHBondContact OH-NE 3.32Å
463	D	94.1	Very high	92.3	Very high	78 Å²	78	52.2 Å²	52.2	42%	0.417	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.4	-48	179.8	-67.5	-41.1	0	0	0	116	H461 R549	H461-D463 PolarHBondContact ND1-N 2.97Å; H461-D463 VanDerWaalsContact ND1-N 3.12Å; H461-D463 PolarHBondContact O-N 2.94Å; D463-R549 IonicContact OD1-CZ 2.81Å; D463-R549 VanDerWaalsContact OD1-CZ 3.23Å; D463-R549 IonicContact OD1-NH1 2.96Å; D463-R549 PolarHBondContact OD1-NH1 2.9Å; D463-R549 IonicContact OD1-NH2 3.13Å; D463-R549 PolarHBondContact OD1-NH2 3.33Å
464	T	93.7	Very high	90.7	Very high	75 Å²	75	48.8 Å²	48.8	46%	0.46	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82	-20.8	-164.9	58.1	0	0	0	0	114.5	H461 P499	H461-T464 VanDerWaalsContact CB-OG1 3.29Å; H461-T464 WeakPolarHBondContact CB-OG1 3.4Å; H461-T464 PolarHBondContact ND1-N 3.11Å; H461-T464 PolarHBondContact ND1-OG1 3.26Å; T464-P499 WeakPolarHBondContact O-CA 3.4Å
465	G	96.5	Very high	88.6	Confident	3 Å²	3	50.3 Å²	50.3	3%	0.031	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	119	-146.9	176.7	0	0	0	0	0	114.3	H461 Y498	H461-G465 PolarHBondContact N-O 3.36Å; H461-G465 PolarHBondContact O-N 3.26Å; G465-Y498 WeakPolarHBondContact CA-O 3.33Å
466	L	97.9	Very high	86.1	Confident	1 Å²	1	55 Å²	55	1%	0.005	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	140.8	-177	-58.5	93.9	0	0	0	110.2	T459 W496 E497 Y498 Y500 I516 F518 L539	T459-L466 WeakPolarHBondContact O-CA 3.4Å; L466-W496 HydrophobicContact CB-CH2 4.26Å; L466-W496 HydrophobicContact CB-CZ3 3.76Å; L466-E497 WeakPolarHBondContact O-CA 3.4Å; L466-Y498 PolarHBondContact N-O 2.78Å; L466-Y498 PolarHBondContact O-N 3.41Å; L466-Y500 HydrophobicContact CD1-CD1 3.53Å; L466-Y500 HydrophobicContact CD1-CE1 3.47Å; L466-Y500 VanDerWaalsContact CD1-CE1 3.47Å; L466-Y500 HydrophobicContact CG-CE1 4.03Å; L466-I516 HydrophobicContact CD2-CD1 4Å; L466-F518 HydrophobicContact CB-CZ 4.31Å; L466-F518 HydrophobicContact CD1-CE1 4.22Å; L466-F518 HydrophobicContact CD1-CZ 4.31Å; L466-L539 HydrophobicContact CD1-CD1 4.48Å; L466-L539 HydrophobicContact CD2-CD1 4.33Å
467	K	97.2	Very high	83.4	Confident	54 Å²	54	59.9 Å²	59.9	24%	0.235	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	132.7	179.2	-177.3	176.2	-172.5	145.1	0	111.1	L458 T459 I469 V494 W496 E497	L458-K467 CarbonylContact C-O 3.49Å; L458-K467 WeakPolarHBondContact CA-O 3.45Å; T459-K467 PolarHBondContact N-O 3.09Å; T459-K467 PolarHBondContact O-N 2.71Å; K467-I469 HydrophobicContact CD-CD1 3.99Å; K467-I469 HydrophobicContact CD-CG1 4.14Å; K467-I469 HydrophobicContact CG-CD1 4.29Å; K467-I469 HydrophobicContact CG-CG1 3.92Å; K467-V494 HydrophobicContact CG-CG1 4.18Å; K467-W496 WeakPolarHBondContact CA-O 3.39Å; K467-E497 HydrophobicContact CB-CB 4.39Å; K467-E497 HydrophobicContact CB-CG 4.16Å; K467-E497 HydrophobicContact CD-CG 4.29Å; K467-E497 WeakPolarHBondContact CD-OE2 3.42Å; K467-E497 VanDerWaalsContact CE-OE2 3.29Å; K467-E497 WeakPolarHBondContact CE-OE2 3.15Å; K467-E497 HydrophobicContact CG-CB 4.11Å; K467-E497 HydrophobicContact CG-CG 4.19Å; K467-E497 IonicContact NZ-OE2 3.95Å; K467-E497 PolarHBondContact NZ-OE2 3.06Å
468	L	97.1	Very high	80.4	Confident	0 Å²	0	63.1 Å²	63.1	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	125.9	173.4	-169.8	73.1	0	0	0	110	W451 C456 L458 I495 W496 L526	W451-L468 HydrophobicContact CB-CD2 3.91Å; W451-L468 HydrophobicContact CD2-CD2 4.2Å; W451-L468 HydrophobicContact CG-CD2 3.9Å; C456-L468 HydrophobicContact CB-CD1 3.77Å; C456-L468 HydrophobicContact CB-CG 4.19Å; L458-L468 HydrophobicContact CB-CD1 4.15Å; L458-L468 HydrophobicContact CD1-CD1 4.46Å; L468-I495 HydrophobicContact CB-CB 4.4Å; L468-I495 HydrophobicContact CD2-CB 4.2Å; L468-I495 HydrophobicContact CD2-CD1 3.81Å; L468-I495 HydrophobicContact CD2-CG2 4.23Å; L468-I495 HydrophobicContact CG-CB 4.41Å; L468-I495 HydrophobicContact CG-CD1 4.02Å; L468-I495 PolarHBondContact O-N 3.2Å; L468-W496 HydrophobicContact CB-CD2 3.73Å; L468-W496 HydrophobicContact CB-CE3 4.17Å; L468-W496 HydrophobicContact CB-CG 4.29Å; L468-W496 HydrophobicContact CB-CH2 3.99Å; L468-W496 HydrophobicContact CB-CZ2 3.54Å; L468-W496 HydrophobicContact CB-CZ3 4.28Å; L468-W496 HydrophobicContact CD2-CZ2 4.02Å; L468-W496 HydrophobicContact CG-CZ2 4.25Å; L468-W496 PolarHBondContact N-O 2.85Å; L468-L526 HydrophobicContact CD1-CD2 4.13Å; L468-L526 HydrophobicContact CD2-CD2 3.99Å
469	I	94.9	Very high	77.4	Confident	38 Å²	38	67.5 Å²	67.5	20%	0.195	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	127.5	-177.8	-54.3	178.1	0	0	0	109	C456 R457 K467 G492 H493	C456-I469 CarbonylContact C-O 3.59Å; C456-I469 WeakPolarHBondContact CA-O 3.31Å; C456-I469 WeakPolarHBondContact CB-O 3.35Å; R457-I469 PolarHBondContact N-O 3.14Å; R457-I469 PolarHBondContact O-N 3.38Å; K467-I469 HydrophobicContact CD-CD1 3.99Å; K467-I469 HydrophobicContact CD-CG1 4.14Å; K467-I469 HydrophobicContact CG-CD1 4.29Å; K467-I469 HydrophobicContact CG-CG1 3.92Å; I469-G492 VanDerWaalsContact CG2-C 3.43Å; I469-H493 WeakPolarHBondContact CA-O 3.33Å
470	S	93	Very high	74.5	Confident	16 Å²	16	72.7 Å²	72.7	11%	0.112	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	132.8	169.9	177	0	0	0	0	110.4	Q472 G492 H493	S470-Q472 PolarHBondContact O-N 3.12Å; S470-Q472 PolarHBondContact OG-N 3.28Å; S470-Q472 VanDerWaalsContact OG-N 3.1Å; S470-Q472 PolarHBondContact OG-O 3.19Å; S470-G492 WeakPolarHBondContact O-CA 3.36Å; S470-H493 PolarHBondContact N-O 3.25Å; S470-H493 PolarHBondContact O-N 3.5Å
471	C	86	Confident	71.4	Confident	57 Å²	57	78.5 Å²	78.5	39%	0.385	43%	0.429	S	S	.	.	S	Bend	trans	-76.9	-11.8	171.4	-67.9	0	0	0	0	112.8	D455	D455-C471 HydrophobicContact CB-CB 4.4Å; D455-C471 VanDerWaalsContact O-CB 3.29Å; D455-C471 WeakPolarHBondContact O-CB 3.31Å; D455-C471 PolarHBondContact O-N 3.03Å
472	Q	73.6	Confident	68.5	Low	94 Å²	94	84.3 Å²	84.3	44%	0.439	46%	0.457	S	S	.	.	S	Bend	trans	-109.7	137.9	-179.1	-60.8	178.4	6.2	0	0	109.9	S470	S470-Q472 PolarHBondContact O-N 3.12Å; S470-Q472 PolarHBondContact OG-N 3.28Å; S470-Q472 VanDerWaalsContact OG-N 3.1Å; S470-Q472 PolarHBondContact OG-O 3.19Å
473	F	58.9	Low	65.6	Low	168 Å²	168	88.4 Å²	88.4	74%	0.737	49%	0.49	S	S	*	.			trans	-56.7	154.2	173.1	-80.4	-87.3	0	0	0	110.5	I475	F473-I475 PolarHBondContact O-N 3.26Å
474	P	54.7	Low	62.9	Low	82 Å²	82	94.6 Å²	94.6	53%	0.532	51%	0.509	S	S	.	.			trans	-53	129.2	-174.7	-20.1	29.9	0	0	0	110.5	E476	P474-E476 PolarHBondContact O-N 2.73Å
475	I	49	Very low	60.2	Low	121 Å²	121	96.3 Å²	96.3	62%	0.621	52%	0.521	S	S	*	.			trans	-57	113.8	166.3	-65.8	163.3	0	0	0	106.1	Y454 F473 S477	Y454-I475 HydrophobicContact CD1-CD1 4.43Å; Y454-I475 HydrophobicContact CE1-CD1 3.36Å; Y454-I475 HydrophobicContact CE1-CG1 4.47Å; Y454-I475 HydrophobicContact CE2-CD1 4.45Å; Y454-I475 WeakPolarHBondContact OH-CD1 3.23Å; F473-I475 PolarHBondContact O-N 3.26Å; I475-S477 PolarHBondContact O-N 2.97Å
476	E	42.6	Very low	57.2	Low	159 Å²	159	105.7 Å²	105.7	74%	0.743	56%	0.564	S	S	*	*			trans	-50.2	110.6	-180	-66.3	178.8	167.1	0	0	110	P474 H478	P474-E476 PolarHBondContact O-N 2.73Å; E476-H478 PolarHBondContact O-N 3.26Å
477	S	38.9	Very low	54.2	Low	102 Å²	102	108.9 Å²	108.9	71%	0.713	60%	0.597	S	S	*	*			trans	-60.9	116.8	149.8	54.5	0	0	0	0	106.3	I475 S479	I475-S477 PolarHBondContact O-N 2.97Å; S477-S479 PolarHBondContact O-N 3.06Å
478	H	33.8	Very low	51.2	Low	195 Å²	195	113.6 Å²	113.6	90%	0.903	63%	0.625	S	S	*	*	S	Bend	trans	-33	94	178.1	-66.8	-72.4	0	0	0	114.8	E476	E476-H478 PolarHBondContact O-N 3.26Å
479	S	34.2	Very low	48.3	Very low	93 Å²	93	122.3 Å²	122.3	65%	0.65	67%	0.668	S	S	*	*			trans	-172.2	101.5	157.8	49.9	0	0	0	0	111.7	S477	S477-S479 PolarHBondContact O-N 3.06Å
480	T	36	Very low	46.2	Very low	124 Å²	124	126.6 Å²	126.6	76%	0.761	70%	0.696	S	S	*	*			trans	48.8	119.2	153.8	39.6	0	0	0	0	120.1	Q482	T480-Q482 PolarHBondContact O-N 3.07Å
481	P	33.9	Very low	44.5	Very low	123 Å²	123	130.9 Å²	130.9	80%	0.799	73%	0.726	S	S	*	*			trans	-74.9	111.7	175.6	30.5	-30.2	0	0	0	110.4
482	Q	37	Very low	43.8	Very low	158 Å²	158	129.5 Å²	129.5	74%	0.738	72%	0.721	S	S	*	*			trans	-103.1	121.8	161.1	-81.7	-172	-10.2	0	0	109.4	T480	T480-Q482 PolarHBondContact O-N 3.07Å
483	S	34.8	Very low	44.4	Very low	115 Å²	115	129.8 Å²	129.8	80%	0.804	72%	0.723	S	S	*	*			trans	-55	124	177.5	50.4	0	0	0	0	113.1
484	Y	37.9	Very low	46	Very low	208 Å²	208	124.5 Å²	124.5	82%	0.816	70%	0.704	S	S	*	*			trans	-120.9	122.7	158.4	-71.7	-79.1	0	0	0	109.3
485	P	36.6	Very low	47.8	Very low	112 Å²	112	122.8 Å²	122.8	73%	0.727	69%	0.69	S	S	*	*			trans	-86.2	133.9	178.5	31.8	-28.6	0	0	0	111.6
486	H	33.3	Very low	50	Low	199 Å²	199	117.6 Å²	117.6	92%	0.921	66%	0.662	S	S	*	*			trans	52.2	77.5	154.6	-61.7	-62.7	0	0	0	118.5
487	G	35.2	Very low	52.6	Low	68 Å²	68	114.6 Å²	114.6	70%	0.701	65%	0.648	S	S	*	*			trans	-119.5	135.9	157.4	0	0	0	0	0	110.2	M489	G487-M489 PolarHBondContact O-N 2.87Å
488	N	34.2	Very low	55.4	Low	153 Å²	153	111.4 Å²	111.4	82%	0.818	62%	0.621	S	S	*	*			trans	-35.9	122.6	-175.2	-84.4	-20	0	0	0	114.9	T490	N488-T490 PolarHBondContact O-N 3.35Å
489	M	37	Very low	58.3	Low	184 Å²	184	104.6 Å²	104.6	91%	0.906	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.3	35.4	-177.8	-79.2	175.9	67.9	0	0	115.7	G487	G487-M489 PolarHBondContact O-N 2.87Å
490	T	49.2	Very low	61.2	Low	127 Å²	127	100.6 Å²	100.6	78%	0.779	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.4	-4	-173.1	53	0	0	0	0	115.9	N488	N488-T490 PolarHBondContact O-N 3.35Å
491	S	58.5	Low	63.9	Low	106 Å²	106	99.6 Å²	99.6	74%	0.741	55%	0.551	S	S	*	*			trans	-103.8	97.4	-176.4	-154.4	0	0	0	0	111.8
492	G	70.3	Confident	66.8	Low	29 Å²	29	99.6 Å²	99.6	30%	0.299	54%	0.535	S	S	.	.	P	Polyproline II helix	trans	-69.6	160.6	169.4	0	0	0	0	0	111.9	I469 S470 V494	I469-G492 VanDerWaalsContact CG2-C 3.43Å; S470-G492 WeakPolarHBondContact O-CA 3.36Å; G492-V494 PolarHBondContact O-N 2.98Å
493	H	86.9	Confident	69.6	Low	100 Å²	100	93.5 Å²	93.5	46%	0.463	51%	0.508	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	120.9	179.8	178.4	-79.4	0	0	0	110.8	I469 S470 I495	I469-H493 WeakPolarHBondContact CA-O 3.33Å; S470-H493 PolarHBondContact N-O 3.25Å; S470-H493 PolarHBondContact O-N 3.5Å; H493-I495 PolarHBondContact O-N 3.21Å
494	V	92.3	Very high	72.4	Confident	57 Å²	57	96.9 Å²	96.9	35%	0.345	50%	0.503	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	116.3	176.3	-175.6	0	0	0	0	109.3	K467 G492 E497	K467-V494 HydrophobicContact CG-CG1 4.18Å; G492-V494 PolarHBondContact O-N 2.98Å; V494-E497 HydrophobicContact CG1-CB 4.19Å
495	I	93	Very high	75	Confident	46 Å²	46	89.7 Å²	89.7	24%	0.236	48%	0.483	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	-48.2	177.1	-60.7	170.2	0	0	0	109.1	W451 C456 L468 H493	W451-I495 HydrophobicContact CE3-CD1 3.77Å; W451-I495 HydrophobicContact CE3-CG2 4.09Å; W451-I495 HydrophobicContact CH2-CG2 3.9Å; W451-I495 HydrophobicContact CZ2-CG2 4.44Å; W451-I495 HydrophobicContact CZ3-CD1 4.13Å; W451-I495 HydrophobicContact CZ3-CG2 3.71Å; C456-I495 VanDerWaalsContact SG-CD1 3.52Å; L468-I495 HydrophobicContact CB-CB 4.4Å; L468-I495 HydrophobicContact CD2-CB 4.2Å; L468-I495 HydrophobicContact CD2-CD1 3.81Å; L468-I495 HydrophobicContact CD2-CG2 4.23Å; L468-I495 HydrophobicContact CG-CB 4.41Å; L468-I495 HydrophobicContact CG-CD1 4.02Å; L468-I495 PolarHBondContact O-N 3.2Å; H493-I495 PolarHBondContact O-N 3.21Å
496	W	95.3	Very high	77.8	Confident	11 Å²	11	86.2 Å²	86.2	4%	0.042	46%	0.46	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.7	158.2	171.6	50	-105.7	0	0	0	110.8	L458 L466 K467 L468 Y498 F518 Y524	L458-W496 HydrophobicContact CD1-CH2 3.72Å; L458-W496 HydrophobicContact CD1-CZ2 4.44Å; L458-W496 HydrophobicContact CD1-CZ3 4.47Å; L466-W496 HydrophobicContact CB-CH2 4.26Å; L466-W496 HydrophobicContact CB-CZ3 3.76Å; K467-W496 WeakPolarHBondContact CA-O 3.39Å; L468-W496 HydrophobicContact CB-CD2 3.73Å; L468-W496 HydrophobicContact CB-CE3 4.17Å; L468-W496 HydrophobicContact CB-CG 4.29Å; L468-W496 HydrophobicContact CB-CH2 3.99Å; L468-W496 HydrophobicContact CB-CZ2 3.54Å; L468-W496 HydrophobicContact CB-CZ3 4.28Å; L468-W496 HydrophobicContact CD2-CZ2 4.02Å; L468-W496 HydrophobicContact CG-CZ2 4.25Å; L468-W496 PolarHBondContact N-O 2.85Å; W496-Y498 HydrophobicContact CB-CD2 4.22Å; W496-Y498 HydrophobicContact CB-CE2 3.67Å; W496-Y498 HydrophobicContact CD2-CD2 4.2Å; W496-Y498 HydrophobicContact CD2-CE2 4.23Å; W496-Y498 AromaticContact CE3-CD2 3.8Å; W496-Y498 HydrophobicContact CE3-CD2 3.8Å; W496-Y498 HydrophobicContact CE3-CE2 4.29Å; W496-Y498 HydrophobicContact CG-CD2 4.4Å; W496-Y498 AromaticContact CG-CE2 4Å; W496-Y498 HydrophobicContact CG-CE2 4Å; W496-F518 HydrophobicContact CE3-CE2 4.35Å; W496-F518 HydrophobicContact CE3-CZ 4.47Å; W496-F518 HydrophobicContact CH2-CE2 4.02Å; W496-F518 HydrophobicContact CH2-CZ 4.16Å; W496-F518 HydrophobicContact CZ2-CE2 4.37Å; W496-F518 HydrophobicContact CZ3-CE2 4Å; W496-F518 AromaticContact CZ3-CZ 3.9Å; W496-F518 HydrophobicContact CZ3-CZ 3.9Å; W496-Y524 AromaticContact CD1-CD1 3.74Å; W496-Y524 AromaticContact CD1-CE1 3.3Å; W496-Y524 AromaticContact CD1-CZ 3.59Å; W496-Y524 HydrophobicContact CG-CE1 4.28Å; W496-Y524 HydrophobicContact CZ2-CG 4.4Å; W496-Y524 AromaticContact NE1-CD1 3.27Å; W496-Y524 VanDerWaalsContact NE1-CD1 3.27Å; W496-Y524 AromaticContact NE1-CE1 3.38Å; W496-Y524 AromaticContact NE1-CG 3.68Å; W496-Y524 AromaticContact NE1-CZ 3.86Å
497	E	96.6	Very high	80.8	Confident	96 Å²	96	79.2 Å²	79.2	45%	0.449	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	118.6	175.3	-178.3	169.2	175	0	0	108.1	L466 K467 V494	L466-E497 WeakPolarHBondContact O-CA 3.4Å; K467-E497 HydrophobicContact CB-CB 4.39Å; K467-E497 HydrophobicContact CB-CG 4.16Å; K467-E497 HydrophobicContact CD-CG 4.29Å; K467-E497 WeakPolarHBondContact CD-OE2 3.42Å; K467-E497 VanDerWaalsContact CE-OE2 3.29Å; K467-E497 WeakPolarHBondContact CE-OE2 3.15Å; K467-E497 HydrophobicContact CG-CB 4.11Å; K467-E497 HydrophobicContact CG-CG 4.19Å; K467-E497 IonicContact NZ-OE2 3.95Å; K467-E497 PolarHBondContact NZ-OE2 3.06Å; V494-E497 HydrophobicContact CG1-CB 4.19Å
498	Y	97.2	Very high	83.6	Confident	36 Å²	36	77.9 Å²	77.9	14%	0.141	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	137.1	-176.5	-64.3	-59	0	0	0	111.3	G465 L466 W496 F518 D521 Y524	G465-Y498 WeakPolarHBondContact CA-O 3.33Å; L466-Y498 PolarHBondContact N-O 2.78Å; L466-Y498 PolarHBondContact O-N 3.41Å; W496-Y498 HydrophobicContact CB-CD2 4.22Å; W496-Y498 HydrophobicContact CB-CE2 3.67Å; W496-Y498 HydrophobicContact CD2-CD2 4.2Å; W496-Y498 HydrophobicContact CD2-CE2 4.23Å; W496-Y498 AromaticContact CE3-CD2 3.8Å; W496-Y498 HydrophobicContact CE3-CD2 3.8Å; W496-Y498 HydrophobicContact CE3-CE2 4.29Å; W496-Y498 HydrophobicContact CG-CD2 4.4Å; W496-Y498 AromaticContact CG-CE2 4Å; W496-Y498 HydrophobicContact CG-CE2 4Å; Y498-F518 HydrophobicContact CD2-CB 4.5Å; Y498-F518 AromaticContact CD2-CD1 3.99Å; Y498-F518 HydrophobicContact CD2-CD1 3.99Å; Y498-F518 AromaticContact CD2-CD2 3.71Å; Y498-F518 HydrophobicContact CD2-CD2 3.71Å; Y498-F518 HydrophobicContact CD2-CE1 4.06Å; Y498-F518 AromaticContact CD2-CE2 3.77Å; Y498-F518 HydrophobicContact CD2-CE2 3.77Å; Y498-F518 AromaticContact CD2-CG 3.81Å; Y498-F518 HydrophobicContact CD2-CG 3.81Å; Y498-F518 AromaticContact CD2-CZ 3.94Å; Y498-F518 HydrophobicContact CD2-CZ 3.94Å; Y498-F518 HydrophobicContact CE2-CD2 4.09Å; Y498-F518 HydrophobicContact CE2-CE2 4.41Å; Y498-F518 HydrophobicContact CE2-CG 4.33Å; Y498-F518 HydrophobicContact CG-CD1 4.15Å; Y498-F518 HydrophobicContact CG-CE1 4.26Å; Y498-F518 HydrophobicContact CG-CG 4.34Å; Y498-D521 HydrophobicContact CE1-CB 4.15Å; Y498-D521 HydrophobicContact CE2-CB 4.31Å; Y498-Y524 HydrophobicContact CE2-CE2 4.04Å; Y498-Y524 PolarHBondContact OH-OH 2.92Å
499	P	95.9	Very high	86.5	Confident	51 Å²	51	73.5 Å²	73.5	33%	0.331	39%	0.39	S	S	.	.			trans	-70.4	156	173.4	32.7	-36.1	0	0	0	111.3	T464 E501 R502	T464-P499 WeakPolarHBondContact O-CA 3.4Å; P499-E501 PolarHBondContact O-N 3.48Å; P499-R502 HydrophobicContact CG-CG 4.18Å; P499-R502 PolarHBondContact O-N 3.03Å
500	Y	95	Very high	89	Confident	10 Å²	10	66.4 Å²	66.4	4%	0.039	36%	0.363	C	S	.	.	G	3₁₀ helix	trans	-56.1	-27.3	-179.5	-70.7	-60.2	0	0	0	114.1	H461 L466 R502 L503 L539 I542 L543 K546	H461-Y500 VanDerWaalsContact O-CE2 3.22Å; H461-Y500 WeakPolarHBondContact O-CE2 3.4Å; H461-Y500 PolarHBondContact O-OH 2.71Å; L466-Y500 HydrophobicContact CD1-CD1 3.53Å; L466-Y500 HydrophobicContact CD1-CE1 3.47Å; L466-Y500 VanDerWaalsContact CD1-CE1 3.47Å; L466-Y500 HydrophobicContact CG-CE1 4.03Å; Y500-R502 PolarHBondContact O-N 3.31Å; Y500-L503 VanDerWaalsContact O-CB 3.31Å; Y500-L503 WeakPolarHBondContact O-CB 3.19Å; Y500-L503 PolarHBondContact O-N 3.29Å; Y500-L539 HydrophobicContact CD1-CD1 4.12Å; Y500-L539 HydrophobicContact CE1-CD1 3.49Å; Y500-L539 VanDerWaalsContact CE1-CD1 3.49Å; Y500-I542 HydrophobicContact CD2-CG2 4.33Å; Y500-I542 HydrophobicContact CE1-CG2 4.36Å; Y500-I542 HydrophobicContact CE2-CG2 3.44Å; Y500-I542 VanDerWaalsContact CE2-CG2 3.44Å; Y500-I542 VanDerWaalsContact CZ-CG2 3.48Å; Y500-I542 WeakPolarHBondContact OH-CD1 3.41Å; Y500-I542 WeakPolarHBondContact OH-CG2 3.18Å; Y500-L543 HydrophobicContact CD1-CD2 3.68Å; Y500-L543 HydrophobicContact CE1-CD2 4.44Å; Y500-L543 HydrophobicContact CG-CD2 3.86Å; Y500-K546 HydrophobicContact CD2-CD 4.03Å
501	E	92.1	Very high	91.1	Very high	103 Å²	103	69.7 Å²	69.7	48%	0.481	36%	0.361	S	S	.	.	G	3₁₀ helix	trans	-61.9	-20.9	176.6	-70.7	74	-170.5	0	0	113.7	P499 K546 R550	P499-E501 PolarHBondContact O-N 3.48Å; E501-K546 VanDerWaalsContact CD-NZ 3.34Å; E501-K546 WeakPolarHBondContact OE1-CE 3.22Å; E501-K546 IonicContact OE1-NZ 3.64Å; E501-K546 PolarHBondContact OE1-NZ 3.07Å; E501-K546 IonicContact OE2-NZ 2.69Å; E501-K546 PolarHBondContact OE2-NZ 3.49Å; E501-R550 IonicContact OE1-CZ 2.71Å; E501-R550 IonicContact OE1-NH1 3.74Å; E501-R550 PolarHBondContact OE1-NH1 3Å; E501-R550 IonicContact OE1-NH2 3.26Å; E501-R550 PolarHBondContact OE1-NH2 3.21Å
502	R	94.6	Very high	92.9	Very high	122 Å²	122	66.9 Å²	66.9	46%	0.46	34%	0.34	S	S	.	.	G	3₁₀ helix	trans	-89.5	-12.7	175.1	-66.7	-163.4	-179.6	-166.7	2.7	113.5	P499 Y500 R504 F518 D521	P499-R502 HydrophobicContact CG-CG 4.18Å; P499-R502 PolarHBondContact O-N 3.03Å; Y500-R502 PolarHBondContact O-N 3.31Å; R502-R504 PolarHBondContact O-N 2.96Å; R502-F518 HydrophobicContact CB-CD1 4.08Å; R502-F518 WeakPolarHBondContact O-CA 3.45Å; R502-D521 WeakPolarHBondContact CD-OD2 3.31Å; R502-D521 IonicContact CZ-OD2 2.74Å; R502-D521 IonicContact NE-OD2 3.04Å; R502-D521 IonicContact NH1-OD1 3.94Å; R502-D521 PolarHBondContact NH1-OD1 3.02Å; R502-D521 IonicContact NH1-OD2 3.44Å; R502-D521 PolarHBondContact NH1-OD2 2.92Å
503	L	94.9	Very high	94.2	Very high	31 Å²	31	66.9 Å²	66.9	16%	0.162	33%	0.332	C	S	.	.			trans	-70.1	116.4	-179.9	-178.6	66.1	0	0	0	109.8	Y500 T506 I516 F518 L539 L543	Y500-L503 VanDerWaalsContact O-CB 3.31Å; Y500-L503 WeakPolarHBondContact O-CB 3.19Å; Y500-L503 PolarHBondContact O-N 3.29Å; L503-T506 HydrophobicContact CD1-CG2 3.9Å; L503-T506 HydrophobicContact CD2-CG2 4.31Å; L503-I516 HydrophobicContact CD1-CG2 3.45Å; L503-I516 VanDerWaalsContact CD1-CG2 3.45Å; L503-F518 HydrophobicContact CB-CE1 4.36Å; L503-F518 HydrophobicContact CD1-CE1 4.18Å; L503-L539 HydrophobicContact CD2-CD1 4.25Å; L503-L539 HydrophobicContact CD2-CD2 4.02Å; L503-L539 HydrophobicContact CD2-CG 4.45Å; L503-L543 HydrophobicContact CD2-CD1 4.03Å
504	R	94	Very high	94.7	Very high	186 Å²	186	62.2 Å²	62.2	70%	0.702	31%	0.311	S	S	*	.			trans	-92.4	-47.3	-179.7	178.6	172.2	172.6	-110	-0.6	111.9	R502 D517	R502-R504 PolarHBondContact O-N 2.96Å; R504-D517 WeakPolarHBondContact CB-O 3.47Å; R504-D517 WeakPolarHBondContact CD-OD2 3.33Å; R504-D517 IonicContact CZ-OD2 2.75Å; R504-D517 PolarHBondContact N-O 3.41Å; R504-D517 IonicContact NE-OD2 3.37Å; R504-D517 IonicContact NH1-OD2 2.73Å; R504-D517 PolarHBondContact NH1-OD2 3.35Å
505	S	93.9	Very high	95	Very high	56 Å²	56	62.5 Å²	62.5	39%	0.392	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.6	159.3	178	46.4	0	0	0	0	111.7	D517	S505-D517 PolarHBondContact N-O 2.84Å; S505-D517 PolarHBondContact O-N 2.87Å; S505-D517 PolarHBondContact OG-OD2 2.92Å
506	T	94.5	Very high	95.1	Very high	40 Å²	40	60.4 Å²	60.4	25%	0.245	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	144	166.8	56.5	0	0	0	0	109.7	L503 W515 I516 L539	L503-T506 HydrophobicContact CD1-CG2 3.9Å; L503-T506 HydrophobicContact CD2-CG2 4.31Å; T506-W515 CarbonylContact C-O 3.5Å; T506-W515 VanDerWaalsContact CA-O 3.25Å; T506-W515 WeakPolarHBondContact CA-O 3.37Å; T506-I516 HydrophobicContact CG2-CG2 4.43Å; T506-L539 HydrophobicContact CG2-CD2 3.61Å
507	A	95.8	Very high	95.2	Very high	51 Å²	51	60.4 Å²	60.4	42%	0.421	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	158.9	172.3	0	0	0	0	0	109.7	W515	A507-W515 HydrophobicContact CB-CB 4.33Å; A507-W515 HydrophobicContact CB-CE3 4.14Å; A507-W515 PolarHBondContact N-O 3.25Å; A507-W515 PolarHBondContact O-N 2.93Å
508	D	95.3	Very high	95.2	Very high	40 Å²	40	56 Å²	56	21%	0.214	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	153.8	179.3	79	88.3	0	0	0	111.3	G510 I513 L514 P532 K533 V536	D508-G510 WeakPolarHBondContact OD1-CA 3.29Å; D508-G510 PolarHBondContact OD1-N 3Å; D508-I513 VanDerWaalsContact CA-O 3.31Å; D508-I513 WeakPolarHBondContact CA-O 3.06Å; D508-L514 HydrophobicContact CB-CD1 4.35Å; D508-P532 HydrophobicContact CB-CB 3.9Å; D508-P532 HydrophobicContact CB-CG 3.59Å; D508-K533 VanDerWaalsContact OD1-CE 3.23Å; D508-K533 WeakPolarHBondContact OD1-CE 3.49Å; D508-K533 IonicContact OD1-NZ 2.75Å; D508-K533 PolarHBondContact OD1-NZ 3.49Å; D508-K533 IonicContact OD2-NZ 3.79Å; D508-K533 PolarHBondContact OD2-NZ 3.03Å; D508-V536 HydrophobicContact CB-CG2 4.35Å
509	D	94	Very high	94.9	Very high	62 Å²	62	55.4 Å²	55.4	33%	0.332	28%	0.28	S	S	.	.			trans	-91.9	2.1	-179.2	74.5	-16.8	0	0	0	113.4	R511 T512 I513 W515	D509-R511 PolarHBondContact O-N 3.37Å; D509-R511 WeakPolarHBondContact OD1-CA 3.38Å; D509-R511 PolarHBondContact OD1-N 2.95Å; D509-T512 PolarHBondContact OD1-N 3.45Å; D509-I513 HydrophobicContact CB-CB 4.34Å; D509-I513 PolarHBondContact N-O 2.65Å; D509-I513 PolarHBondContact OD1-N 2.91Å; D509-W515 HydrophobicContact CB-CH2 3.81Å; D509-W515 HydrophobicContact CB-CZ3 3.84Å
510	G	90.5	Very high	94.7	Very high	34 Å²	34	59.5 Å²	59.5	35%	0.351	31%	0.307	S	S	.	.	S	Bend	trans	70.3	-1.6	-173.4	0	0	0	0	0	115.3	D508	D508-G510 WeakPolarHBondContact OD1-CA 3.29Å; D508-G510 PolarHBondContact OD1-N 3Å
511	R	93.1	Very high	94.5	Very high	197 Å²	197	61.9 Å²	61.9	74%	0.743	32%	0.32	S	S	*	.	S	Bend	trans	-115.4	-65.2	-174.1	-64.3	180	176	172.7	0.2	112.3	D509 G530 C531	D509-R511 PolarHBondContact O-N 3.37Å; D509-R511 WeakPolarHBondContact OD1-CA 3.38Å; D509-R511 PolarHBondContact OD1-N 2.95Å; R511-G530 CarbonylContact O-C 3.55Å; R511-G530 VanDerWaalsContact O-C 3.27Å; R511-C531 VanDerWaalsContact O-CA 3.25Å; R511-C531 WeakPolarHBondContact O-CA 3.39Å; R511-C531 PolarHBondContact O-N 2.95Å
512	T	95.9	Very high	94.5	Very high	47 Å²	47	58.3 Å²	58.3	29%	0.288	31%	0.311	S	S	.	.	S	Bend	trans	-148	-20	-179.2	63.1	0	0	0	0	114.2	D509 D527 L528 G530	D509-T512 PolarHBondContact OD1-N 3.45Å; T512-D527 WeakPolarHBondContact CB-OD1 3.48Å; T512-L528 PolarHBondContact O-N 2.94Å; T512-G530 WeakPolarHBondContact CA-O 3.46Å
513	I	97.3	Very high	94.5	Very high	28 Å²	28	58.5 Å²	58.5	14%	0.144	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	131.5	-170.6	-52.9	-57.5	0	0	0	110.6	D508 D509 W515 E525 L526 D527	D508-I513 VanDerWaalsContact CA-O 3.31Å; D508-I513 WeakPolarHBondContact CA-O 3.06Å; D509-I513 HydrophobicContact CB-CB 4.34Å; D509-I513 PolarHBondContact N-O 2.65Å; D509-I513 PolarHBondContact OD1-N 2.91Å; I513-W515 HydrophobicContact CB-CH2 3.99Å; I513-W515 HydrophobicContact CB-CZ2 4.15Å; I513-W515 HydrophobicContact CB-CZ3 4.31Å; I513-W515 HydrophobicContact CG2-CD2 3.89Å; I513-W515 HydrophobicContact CG2-CE3 4.13Å; I513-W515 HydrophobicContact CG2-CH2 3.72Å; I513-W515 HydrophobicContact CG2-CZ2 3.41Å; I513-W515 VanDerWaalsContact CG2-CZ2 3.41Å; I513-W515 HydrophobicContact CG2-CZ3 4.06Å; I513-E525 HydrophobicContact CG2-CG 3.58Å; I513-L526 WeakPolarHBondContact CA-O 3.38Å; I513-D527 HydrophobicContact CD1-CB 3.88Å
514	L	97.5	Very high	94.6	Very high	2 Å²	2	58.6 Å²	58.6	1%	0.01	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	122.4	170.7	178.5	71.4	0	0	0	109.1	L458 D508 I516 L526 L528 P532 V535 V536	L458-L514 HydrophobicContact CD2-CD2 4.37Å; D508-L514 HydrophobicContact CB-CD1 4.35Å; L514-I516 HydrophobicContact CD2-CD1 3.86Å; L514-I516 HydrophobicContact CD2-CG1 3.97Å; L514-I516 HydrophobicContact CG-CD1 4.41Å; L514-I516 HydrophobicContact CG-CG1 3.98Å; L514-L526 PolarHBondContact N-O 3.39Å; L514-L526 PolarHBondContact O-N 3.13Å; L514-L528 HydrophobicContact CB-CD1 3.77Å; L514-L528 HydrophobicContact CB-CG 4.03Å; L514-L528 HydrophobicContact CD2-CD1 3.98Å; L514-L528 HydrophobicContact CG-CD1 4.45Å; L514-P532 HydrophobicContact CB-CB 4.39Å; L514-V535 HydrophobicContact CD2-CG1 4.18Å; L514-V536 HydrophobicContact CD1-CG2 3.67Å
515	W	97.8	Very high	94.7	Very high	64 Å²	64	55.2 Å²	55.2	24%	0.242	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	130.1	169.6	-62.2	-88.2	0	0	0	110	T506 A507 D509 I513 Y524 E525	T506-W515 CarbonylContact C-O 3.5Å; T506-W515 VanDerWaalsContact CA-O 3.25Å; T506-W515 WeakPolarHBondContact CA-O 3.37Å; A507-W515 HydrophobicContact CB-CB 4.33Å; A507-W515 HydrophobicContact CB-CE3 4.14Å; A507-W515 PolarHBondContact N-O 3.25Å; A507-W515 PolarHBondContact O-N 2.93Å; D509-W515 HydrophobicContact CB-CH2 3.81Å; D509-W515 HydrophobicContact CB-CZ3 3.84Å; I513-W515 HydrophobicContact CB-CH2 3.99Å; I513-W515 HydrophobicContact CB-CZ2 4.15Å; I513-W515 HydrophobicContact CB-CZ3 4.31Å; I513-W515 HydrophobicContact CG2-CD2 3.89Å; I513-W515 HydrophobicContact CG2-CE3 4.13Å; I513-W515 HydrophobicContact CG2-CH2 3.72Å; I513-W515 HydrophobicContact CG2-CZ2 3.41Å; I513-W515 VanDerWaalsContact CG2-CZ2 3.41Å; I513-W515 HydrophobicContact CG2-CZ3 4.06Å; W515-Y524 WeakPolarHBondContact CA-O 3.25Å; W515-E525 PolarHBondContact NE1-OE2 3.28Å
516	I	96.9	Very high	94.9	Very high	1 Å²	1	52.5 Å²	52.5	1%	0.005	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	115.9	176.5	-50.8	-178.5	0	0	0	108.4	L458 L466 L503 T506 L514 F518 E523 Y524 L526	L458-I516 HydrophobicContact CD2-CD1 4.32Å; L466-I516 HydrophobicContact CD2-CD1 4Å; L503-I516 HydrophobicContact CD1-CG2 3.45Å; L503-I516 VanDerWaalsContact CD1-CG2 3.45Å; T506-I516 HydrophobicContact CG2-CG2 4.43Å; L514-I516 HydrophobicContact CD2-CD1 3.86Å; L514-I516 HydrophobicContact CD2-CG1 3.97Å; L514-I516 HydrophobicContact CG-CD1 4.41Å; L514-I516 HydrophobicContact CG-CG1 3.98Å; I516-F518 HydrophobicContact CB-CE2 4.24Å; I516-F518 HydrophobicContact CG2-CD2 4.15Å; I516-F518 HydrophobicContact CG2-CE1 4.22Å; I516-F518 HydrophobicContact CG2-CE2 3.45Å; I516-F518 VanDerWaalsContact CG2-CE2 3.45Å; I516-F518 HydrophobicContact CG2-CZ 3.5Å; I516-F518 VanDerWaalsContact CG2-CZ 3.5Å; I516-E523 WeakPolarHBondContact O-CA 3.39Å; I516-Y524 PolarHBondContact N-O 2.82Å; I516-Y524 PolarHBondContact O-N 2.98Å; I516-L526 HydrophobicContact CD1-CD1 3.78Å; I516-L526 HydrophobicContact CG1-CD1 4.48Å
517	D	96.7	Very high	95.1	Very high	11 Å²	11	52.7 Å²	52.7	6%	0.059	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	121.8	-179.8	179.6	20.7	0	0	0	110.9	R504 S505 G519 E523	R504-D517 WeakPolarHBondContact CB-O 3.47Å; R504-D517 WeakPolarHBondContact CD-OD2 3.33Å; R504-D517 IonicContact CZ-OD2 2.75Å; R504-D517 PolarHBondContact N-O 3.41Å; R504-D517 IonicContact NE-OD2 3.37Å; R504-D517 IonicContact NH1-OD2 2.73Å; R504-D517 PolarHBondContact NH1-OD2 3.35Å; S505-D517 PolarHBondContact N-O 2.84Å; S505-D517 PolarHBondContact O-N 2.87Å; S505-D517 PolarHBondContact OG-OD2 2.92Å; D517-G519 WeakPolarHBondContact OD1-CA 3.25Å; D517-G519 PolarHBondContact OD1-N 3.04Å; D517-E523 HydrophobicContact CB-CG 4.33Å
518	F	95.9	Very high	95.1	Very high	4 Å²	4	50.9 Å²	50.9	2%	0.018	27%	0.271	C	S	.	.			trans	-105.3	16.4	173.6	-62.9	-78.7	0	0	0	112.6	L466 W496 Y498 R502 L503 I516 P520 D521 G522 Y524	L466-F518 HydrophobicContact CB-CZ 4.31Å; L466-F518 HydrophobicContact CD1-CE1 4.22Å; L466-F518 HydrophobicContact CD1-CZ 4.31Å; W496-F518 HydrophobicContact CE3-CE2 4.35Å; W496-F518 HydrophobicContact CE3-CZ 4.47Å; W496-F518 HydrophobicContact CH2-CE2 4.02Å; W496-F518 HydrophobicContact CH2-CZ 4.16Å; W496-F518 HydrophobicContact CZ2-CE2 4.37Å; W496-F518 HydrophobicContact CZ3-CE2 4Å; W496-F518 AromaticContact CZ3-CZ 3.9Å; W496-F518 HydrophobicContact CZ3-CZ 3.9Å; Y498-F518 HydrophobicContact CD2-CB 4.5Å; Y498-F518 AromaticContact CD2-CD1 3.99Å; Y498-F518 HydrophobicContact CD2-CD1 3.99Å; Y498-F518 AromaticContact CD2-CD2 3.71Å; Y498-F518 HydrophobicContact CD2-CD2 3.71Å; Y498-F518 HydrophobicContact CD2-CE1 4.06Å; Y498-F518 AromaticContact CD2-CE2 3.77Å; Y498-F518 HydrophobicContact CD2-CE2 3.77Å; Y498-F518 AromaticContact CD2-CG 3.81Å; Y498-F518 HydrophobicContact CD2-CG 3.81Å; Y498-F518 AromaticContact CD2-CZ 3.94Å; Y498-F518 HydrophobicContact CD2-CZ 3.94Å; Y498-F518 HydrophobicContact CE2-CD2 4.09Å; Y498-F518 HydrophobicContact CE2-CE2 4.41Å; Y498-F518 HydrophobicContact CE2-CG 4.33Å; Y498-F518 HydrophobicContact CG-CD1 4.15Å; Y498-F518 HydrophobicContact CG-CE1 4.26Å; Y498-F518 HydrophobicContact CG-CG 4.34Å; R502-F518 HydrophobicContact CB-CD1 4.08Å; R502-F518 WeakPolarHBondContact O-CA 3.45Å; L503-F518 HydrophobicContact CB-CE1 4.36Å; L503-F518 HydrophobicContact CD1-CE1 4.18Å; I516-F518 HydrophobicContact CB-CE2 4.24Å; I516-F518 HydrophobicContact CG2-CD2 4.15Å; I516-F518 HydrophobicContact CG2-CE1 4.22Å; I516-F518 HydrophobicContact CG2-CE2 3.45Å; I516-F518 VanDerWaalsContact CG2-CE2 3.45Å; I516-F518 HydrophobicContact CG2-CZ 3.5Å; I516-F518 VanDerWaalsContact CG2-CZ 3.5Å; F518-P520 WeakPolarHBondContact O-CD 3.35Å; F518-D521 HydrophobicContact CB-CB 3.92Å; F518-G522 PolarHBondContact N-O 2.74Å; F518-Y524 AromaticContact CD2-CD2 3.69Å; F518-Y524 HydrophobicContact CD2-CD2 3.69Å; F518-Y524 AromaticContact CD2-CE2 3.72Å; F518-Y524 HydrophobicContact CD2-CE2 3.72Å; F518-Y524 AromaticContact CE2-CD2 3.98Å; F518-Y524 HydrophobicContact CE2-CD2 3.98Å; F518-Y524 HydrophobicContact CE2-CE2 4.25Å
519	G	91.9	Very high	95.1	Very high	23 Å²	23	53 Å²	53	24%	0.237	28%	0.282	C	S	.	.	G	3₁₀ helix	trans	69.6	-117.7	178.4	0	0	0	0	0	111.7	D517 D521 G522	D517-G519 WeakPolarHBondContact OD1-CA 3.25Å; D517-G519 PolarHBondContact OD1-N 3.04Å; G519-D521 PolarHBondContact O-N 2.69Å; G519-D521 VanDerWaalsContact O-N 3.17Å; G519-G522 PolarHBondContact O-N 2.76Å
520	P	91.8	Very high	95.1	Very high	138 Å²	138	51.6 Å²	51.6	90%	0.896	28%	0.282	S	S	*	.	G	3₁₀ helix	trans	-59.3	-25.4	-179.3	-23	33.7	0	0	0	114.7	F518 G522	F518-P520 WeakPolarHBondContact O-CD 3.35Å; P520-G522 PolarHBondContact O-N 3.49Å
521	D	90.3	Very high	95.3	Very high	59 Å²	59	50.9 Å²	50.9	32%	0.316	27%	0.272	S	S	.	.	G	3₁₀ helix	trans	-78.1	-10.8	178.9	-67.3	-42.9	0	0	0	112.6	Y498 R502 F518 G519 Y524	Y498-D521 HydrophobicContact CE1-CB 4.15Å; Y498-D521 HydrophobicContact CE2-CB 4.31Å; R502-D521 WeakPolarHBondContact CD-OD2 3.31Å; R502-D521 IonicContact CZ-OD2 2.74Å; R502-D521 IonicContact NE-OD2 3.04Å; R502-D521 IonicContact NH1-OD1 3.94Å; R502-D521 PolarHBondContact NH1-OD1 3.02Å; R502-D521 IonicContact NH1-OD2 3.44Å; R502-D521 PolarHBondContact NH1-OD2 2.92Å; F518-D521 HydrophobicContact CB-CB 3.92Å; G519-D521 PolarHBondContact O-N 2.69Å; G519-D521 VanDerWaalsContact O-N 3.17Å; D521-Y524 PolarHBondContact O-OH 2.73Å
522	G	91.3	Very high	95.5	Very high	28 Å²	28	41.5 Å²	41.5	29%	0.289	24%	0.236	S	C	.	.			trans	107.9	168.2	174.9	0	0	0	0	0	114.7	F518 G519 P520	F518-G522 PolarHBondContact N-O 2.74Å; G519-G522 PolarHBondContact O-N 2.76Å; P520-G522 PolarHBondContact O-N 3.49Å
523	E	95	Very high	95.5	Very high	126 Å²	126	41.5 Å²	41.5	59%	0.589	23%	0.232	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-102.1	134.3	172.3	-174.4	179.3	95.6	0	0	109.5	I516 D517	I516-E523 WeakPolarHBondContact O-CA 3.39Å; D517-E523 HydrophobicContact CB-CG 4.33Å
524	Y	96.5	Very high	95.5	Very high	34 Å²	34	41.7 Å²	41.7	13%	0.133	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	121.3	-178.4	-61.3	-90.7	0	0	0	110.3	W451 W496 Y498 W515 I516 F518 D521	W451-Y524 HydrophobicContact CZ2-CD1 4.39Å; W451-Y524 HydrophobicContact CZ2-CE1 4.46Å; W451-Y524 AromaticContact NE1-CD1 3.74Å; W496-Y524 AromaticContact CD1-CD1 3.74Å; W496-Y524 AromaticContact CD1-CE1 3.3Å; W496-Y524 AromaticContact CD1-CZ 3.59Å; W496-Y524 HydrophobicContact CG-CE1 4.28Å; W496-Y524 HydrophobicContact CZ2-CG 4.4Å; W496-Y524 AromaticContact NE1-CD1 3.27Å; W496-Y524 VanDerWaalsContact NE1-CD1 3.27Å; W496-Y524 AromaticContact NE1-CE1 3.38Å; W496-Y524 AromaticContact NE1-CG 3.68Å; W496-Y524 AromaticContact NE1-CZ 3.86Å; Y498-Y524 HydrophobicContact CE2-CE2 4.04Å; Y498-Y524 PolarHBondContact OH-OH 2.92Å; W515-Y524 WeakPolarHBondContact CA-O 3.25Å; I516-Y524 PolarHBondContact N-O 2.82Å; I516-Y524 PolarHBondContact O-N 2.98Å; F518-Y524 AromaticContact CD2-CD2 3.69Å; F518-Y524 HydrophobicContact CD2-CD2 3.69Å; F518-Y524 AromaticContact CD2-CE2 3.72Å; F518-Y524 HydrophobicContact CD2-CE2 3.72Å; F518-Y524 AromaticContact CE2-CD2 3.98Å; F518-Y524 HydrophobicContact CE2-CD2 3.98Å; F518-Y524 HydrophobicContact CE2-CE2 4.25Å; D521-Y524 PolarHBondContact O-OH 2.73Å
525	E	97.3	Very high	95.4	Very high	114 Å²	114	42.2 Å²	42.2	53%	0.533	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	119.1	172	-176.2	176.5	113.4	0	0	110	I513 W515	I513-E525 HydrophobicContact CG2-CG 3.58Å; W515-E525 PolarHBondContact NE1-OE2 3.28Å
526	L	97.8	Very high	95.4	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	128.9	179.8	-55.1	178.8	0	0	0	109.9	W451 L458 L468 I513 L514 I516 L528	W451-L526 HydrophobicContact CB-CD2 3.81Å; W451-L526 HydrophobicContact CG-CD2 4.06Å; L458-L526 HydrophobicContact CD1-CD1 4.14Å; L458-L526 HydrophobicContact CD2-CD1 3.86Å; L458-L526 HydrophobicContact CG-CD1 4.42Å; L468-L526 HydrophobicContact CD1-CD2 4.13Å; L468-L526 HydrophobicContact CD2-CD2 3.99Å; I513-L526 WeakPolarHBondContact CA-O 3.38Å; L514-L526 PolarHBondContact N-O 3.39Å; L514-L526 PolarHBondContact O-N 3.13Å; I516-L526 HydrophobicContact CD1-CD1 3.78Å; I516-L526 HydrophobicContact CG1-CD1 4.48Å; L526-L528 HydrophobicContact CB-CD2 4.23Å
527	D	97.7	Very high	95.4	Very high	44 Å²	44	40.3 Å²	40.3	24%	0.235	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	109.6	168.2	172.6	14.1	0	0	0	109	C449 R450 T512 I513 L529	C449-D527 CarbonylContact C-O 3.56Å; C449-D527 WeakPolarHBondContact CA-O 3.42Å; C449-D527 VanDerWaalsContact CB-O 3.3Å; C449-D527 WeakPolarHBondContact CB-O 3.32Å; R450-D527 HydrophobicContact CB-CB 4.21Å; R450-D527 PolarHBondContact N-O 3.22Å; R450-D527 PolarHBondContact O-N 3.12Å; T512-D527 WeakPolarHBondContact CB-OD1 3.48Å; I513-D527 HydrophobicContact CD1-CB 3.88Å; D527-L529 PolarHBondContact O-N 2.9Å; D527-L529 PolarHBondContact OD1-N 2.91Å
528	L	96.9	Very high	95.4	Very high	12 Å²	12	40.5 Å²	40.5	6%	0.063	23%	0.233	C	C	.	.			trans	-83.1	4.5	-176.9	-59.5	-173.2	0	0	0	113.6	I447 C449 T512 L514 L526 G530 P532 V535	I447-L528 HydrophobicContact CG2-CD2 4.21Å; C449-L528 HydrophobicContact CB-CD2 3.67Å; T512-L528 PolarHBondContact O-N 2.94Å; L514-L528 HydrophobicContact CB-CD1 3.77Å; L514-L528 HydrophobicContact CB-CG 4.03Å; L514-L528 HydrophobicContact CD2-CD1 3.98Å; L514-L528 HydrophobicContact CG-CD1 4.45Å; L526-L528 HydrophobicContact CB-CD2 4.23Å; L528-G530 PolarHBondContact O-N 3.2Å; L528-P532 HydrophobicContact CD1-CB 3.83Å; L528-V535 HydrophobicContact CD1-CB 4.08Å; L528-V535 HydrophobicContact CD1-CG1 4.45Å; L528-V535 HydrophobicContact CD1-CG2 3.86Å
529	L	94.4	Very high	95.5	Very high	86 Å²	86	40.5 Å²	40.5	45%	0.45	23%	0.234	S	C	.	.	S	Bend	trans	61.7	7.4	179.7	-47.8	175.8	0	0	0	114.4	T448 R450 D527	T448-L529 HydrophobicContact CG2-CD1 4.07Å; R450-L529 HydrophobicContact CG-CD2 4.18Å; D527-L529 PolarHBondContact O-N 2.9Å; D527-L529 PolarHBondContact OD1-N 2.91Å
530	G	94.3	Very high	95.6	Very high	32 Å²	32	42.1 Å²	42.1	33%	0.33	24%	0.235	S	C	.	.	S	Bend	trans	-176.5	178.7	-177.7	0	0	0	0	0	110.7	R511 T512 L528	R511-G530 CarbonylContact O-C 3.55Å; R511-G530 VanDerWaalsContact O-C 3.27Å; T512-G530 WeakPolarHBondContact CA-O 3.46Å; L528-G530 PolarHBondContact O-N 3.2Å
531	C	95.5	Very high	95.9	Very high	18 Å²	18	35.9 Å²	35.9	12%	0.122	19%	0.194	C	C	.	.			trans	-53.2	129.3	-173	-170	0	0	0	0	112.1	K408 R511 K533 P534	K408-C531 WeakPolarHBondContact O-CB 3.26Å; R511-C531 VanDerWaalsContact O-CA 3.25Å; R511-C531 WeakPolarHBondContact O-CA 3.39Å; R511-C531 PolarHBondContact O-N 2.95Å; C531-K533 VanDerWaalsContact C-N 3.28Å; C531-K533 PolarHBondContact O-N 2.86Å; C531-K533 VanDerWaalsContact SG-CG 3.59Å; C531-P534 VanDerWaalsContact O-CD 3.26Å; C531-P534 WeakPolarHBondContact O-CD 3.49Å
532	P	96.8	Very high	96.2	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	18%	0.18	C	C	.	.	S	Bend	trans	-75.9	-13.9	-177.3	28.4	-35.5	0	0	0	114	D508 L514 L528 V535 V536	D508-P532 HydrophobicContact CB-CB 3.9Å; D508-P532 HydrophobicContact CB-CG 3.59Å; L514-P532 HydrophobicContact CB-CB 4.39Å; L528-P532 HydrophobicContact CD1-CB 3.83Å; P532-V535 PolarHBondContact O-N 2.74Å; P532-V535 VanDerWaalsContact O-N 3.12Å; P532-V536 WeakPolarHBondContact O-CG2 3.47Å; P532-V536 PolarHBondContact O-N 3.17Å
533	K	95.8	Very high	96.4	Very high	48 Å²	48	34.1 Å²	34.1	21%	0.209	18%	0.178	C	C	.	.	H	α-helix	trans	-57.9	-43.8	-172.1	-62.9	-59.2	-172.3	-162.1	0	114.7	G410 V411 D508 C531 V535 V536 F537	G410-K533 WeakPolarHBondContact O-CB 3.43Å; V411-K533 HydrophobicContact CG2-CB 4.07Å; V411-K533 HydrophobicContact CG2-CD 3.69Å; V411-K533 HydrophobicContact CG2-CG 3.71Å; D508-K533 VanDerWaalsContact OD1-CE 3.23Å; D508-K533 WeakPolarHBondContact OD1-CE 3.49Å; D508-K533 IonicContact OD1-NZ 2.75Å; D508-K533 PolarHBondContact OD1-NZ 3.49Å; D508-K533 IonicContact OD2-NZ 3.79Å; D508-K533 PolarHBondContact OD2-NZ 3.03Å; C531-K533 VanDerWaalsContact C-N 3.28Å; C531-K533 PolarHBondContact O-N 2.86Å; C531-K533 VanDerWaalsContact SG-CG 3.59Å; K533-V535 VanDerWaalsContact C-N 3.3Å; K533-V535 PolarHBondContact O-N 2.78Å; K533-V536 PolarHBondContact O-N 3.44Å; K533-F537 WeakPolarHBondContact O-CD2 3.44Å; K533-F537 PolarHBondContact O-N 2.95Å
534	P	96.5	Very high	96.3	Very high	32 Å²	32	30 Å²	30	21%	0.208	16%	0.163	C	C	.	.	H	α-helix	trans	-55.1	-45.6	174.7	-22.8	32.1	0	0	0	112.3	S407 C531 F537 I538	S407-P534 WeakPolarHBondContact O-CD 3.4Å; S407-P534 WeakPolarHBondContact O-CG 3.46Å; C531-P534 VanDerWaalsContact O-CD 3.26Å; C531-P534 WeakPolarHBondContact O-CD 3.49Å; P534-F537 PolarHBondContact O-N 2.87Å; P534-I538 WeakPolarHBondContact O-CD1 3.29Å; P534-I538 WeakPolarHBondContact O-CG1 3.45Å; P534-I538 PolarHBondContact O-N 2.88Å
535	V	97	Very high	96.3	Very high	12 Å²	12	28.4 Å²	28.4	7%	0.073	16%	0.157	C	C	.	.	H	α-helix	trans	-66	-43.9	-178.9	-176	0	0	0	0	111.3	I447 L458 L460 L514 L528 P532 K533 F537 I538 L539	I447-V535 HydrophobicContact CD1-CG1 4.09Å; I447-V535 HydrophobicContact CD1-CG2 4.27Å; I447-V535 HydrophobicContact CG1-CG2 3.86Å; I447-V535 HydrophobicContact CG2-CG2 4.17Å; L458-V535 HydrophobicContact CD2-CG1 4.43Å; L460-V535 HydrophobicContact CD1-CG1 4.44Å; L460-V535 HydrophobicContact CD2-CG1 4.01Å; L514-V535 HydrophobicContact CD2-CG1 4.18Å; L528-V535 HydrophobicContact CD1-CB 4.08Å; L528-V535 HydrophobicContact CD1-CG1 4.45Å; L528-V535 HydrophobicContact CD1-CG2 3.86Å; P532-V535 PolarHBondContact O-N 2.74Å; P532-V535 VanDerWaalsContact O-N 3.12Å; K533-V535 VanDerWaalsContact C-N 3.3Å; K533-V535 PolarHBondContact O-N 2.78Å; V535-F537 VanDerWaalsContact C-N 3.3Å; V535-F537 PolarHBondContact O-N 2.94Å; V535-I538 PolarHBondContact O-N 3.18Å; V535-L539 WeakPolarHBondContact O-CB 3.3Å; V535-L539 PolarHBondContact O-N 2.86Å
536	V	96.2	Very high	96.1	Very high	10 Å²	10	24 Å²	24	6%	0.061	14%	0.136	C	C	.	.	H	α-helix	trans	-59.2	-42.6	176	171.7	0	0	0	0	111	D508 L514 P532 K533 L539 H540	D508-V536 HydrophobicContact CB-CG2 4.35Å; L514-V536 HydrophobicContact CD1-CG2 3.67Å; P532-V536 WeakPolarHBondContact O-CG2 3.47Å; P532-V536 PolarHBondContact O-N 3.17Å; K533-V536 PolarHBondContact O-N 3.44Å; V536-L539 PolarHBondContact O-N 3.31Å; V536-H540 WeakPolarHBondContact CG1-CE1 3.43Å; V536-H540 WeakPolarHBondContact O-CB 3.38Å; V536-H540 PolarHBondContact O-N 3.22Å; V536-H540 PolarHBondContact O-ND1 3.27Å; V536-H540 VanDerWaalsContact O-ND1 3.11Å
537	F	96.9	Very high	95.8	Very high	15 Å²	15	26.4 Å²	26.4	7%	0.066	15%	0.15	C	C	.	.	H	α-helix	trans	-70.2	-41	-179.8	-84	-121.2	0	0	0	112.2	A367 R369 R404 V411 K533 P534 V535 H540 N541	A367-F537 HydrophobicContact CB-CB 4.29Å; A367-F537 WeakPolarHBondContact O-CB 3.42Å; A367-F537 VanDerWaalsContact O-CD1 3.22Å; A367-F537 WeakPolarHBondContact O-CD1 3.45Å; R369-F537 HydrophobicContact CB-CD1 4.25Å; R369-F537 HydrophobicContact CB-CE1 4.26Å; R369-F537 HydrophobicContact CG-CD1 3.82Å; R369-F537 HydrophobicContact CG-CE1 4.27Å; R404-F537 HydrophobicContact CB-CE1 3.64Å; R404-F537 HydrophobicContact CB-CZ 4.01Å; R404-F537 VanDerWaalsContact O-CE1 3.22Å; R404-F537 WeakPolarHBondContact O-CE1 3.39Å; V411-F537 HydrophobicContact CG1-CE1 4.45Å; V411-F537 HydrophobicContact CG1-CE2 4.5Å; V411-F537 HydrophobicContact CG1-CZ 3.78Å; V411-F537 HydrophobicContact CG2-CE2 3.96Å; V411-F537 HydrophobicContact CG2-CZ 4.06Å; K533-F537 WeakPolarHBondContact O-CD2 3.44Å; K533-F537 PolarHBondContact O-N 2.95Å; P534-F537 PolarHBondContact O-N 2.87Å; V535-F537 VanDerWaalsContact C-N 3.3Å; V535-F537 PolarHBondContact O-N 2.94Å; F537-H540 PolarHBondContact O-N 3.42Å; F537-N541 PolarHBondContact O-N 2.92Å
538	I	97.8	Very high	95.4	Very high	15 Å²	15	27.9 Å²	27.9	8%	0.077	16%	0.161	C	C	.	.	H	α-helix	trans	-59.5	-48	173.4	-67.6	166	0	0	0	110.4	I366 A367 V445 L460 P534 V535 H540 N541 I542	I366-I538 HydrophobicContact CG1-CG1 4.17Å; I366-I538 HydrophobicContact CG1-CG2 4.46Å; I366-I538 HydrophobicContact CG2-CD1 4.41Å; I366-I538 HydrophobicContact CG2-CG1 4.26Å; I366-I538 WeakPolarHBondContact O-CA 3.36Å; I366-I538 WeakPolarHBondContact O-CG1 3.48Å; A367-I538 HydrophobicContact CB-CG1 4.06Å; V445-I538 HydrophobicContact CB-CG2 4.44Å; V445-I538 HydrophobicContact CG1-CD1 4.21Å; V445-I538 HydrophobicContact CG2-CG2 4Å; L460-I538 HydrophobicContact CD2-CG2 4.05Å; P534-I538 WeakPolarHBondContact O-CD1 3.29Å; P534-I538 WeakPolarHBondContact O-CG1 3.45Å; P534-I538 PolarHBondContact O-N 2.88Å; V535-I538 PolarHBondContact O-N 3.18Å; I538-H540 VanDerWaalsContact C-N 3.33Å; I538-H540 PolarHBondContact O-N 2.88Å; I538-N541 PolarHBondContact O-N 2.82Å; I538-N541 VanDerWaalsContact O-N 3.14Å; I538-I542 HydrophobicContact CG2-CD1 4.03Å; I538-I542 WeakPolarHBondContact O-CG1 3.44Å; I538-I542 PolarHBondContact O-N 2.93Å
539	L	97	Very high	95.2	Very high	4 Å²	4	32.8 Å²	32.8	2%	0.021	18%	0.179	C	C	.	.	H	α-helix	trans	-57.6	-46.6	177.3	178.2	60.8	0	0	0	111.4	L460 L466 Y500 L503 T506 V535 V536 N541 I542 L543	L460-L539 HydrophobicContact CD2-CB 4.09Å; L466-L539 HydrophobicContact CD1-CD1 4.48Å; L466-L539 HydrophobicContact CD2-CD1 4.33Å; Y500-L539 HydrophobicContact CD1-CD1 4.12Å; Y500-L539 HydrophobicContact CE1-CD1 3.49Å; Y500-L539 VanDerWaalsContact CE1-CD1 3.49Å; L503-L539 HydrophobicContact CD2-CD1 4.25Å; L503-L539 HydrophobicContact CD2-CD2 4.02Å; L503-L539 HydrophobicContact CD2-CG 4.45Å; T506-L539 HydrophobicContact CG2-CD2 3.61Å; V535-L539 WeakPolarHBondContact O-CB 3.3Å; V535-L539 PolarHBondContact O-N 2.86Å; V536-L539 PolarHBondContact O-N 3.31Å; L539-N541 VanDerWaalsContact C-N 3.32Å; L539-N541 PolarHBondContact O-N 2.86Å; L539-I542 PolarHBondContact O-N 2.8Å; L539-L543 HydrophobicContact CD1-CD1 4.37Å; L539-L543 HydrophobicContact CD1-CG 4.37Å; L539-L543 HydrophobicContact CG-CD1 4.2Å; L539-L543 WeakPolarHBondContact O-CG 3.29Å; L539-L543 PolarHBondContact O-N 2.84Å
540	H	95.2	Very high	94.7	Very high	58 Å²	58	35.5 Å²	35.5	27%	0.269	18%	0.183	S	C	.	.	H	α-helix	trans	-61.4	-38.1	176.4	-71.9	149.3	0	0	0	113.5	R369 V536 F537 I538 L543 S544	R369-H540 PolarHBondContact NH1-ND1 2.84Å; V536-H540 WeakPolarHBondContact CG1-CE1 3.43Å; V536-H540 WeakPolarHBondContact O-CB 3.38Å; V536-H540 PolarHBondContact O-N 3.22Å; V536-H540 PolarHBondContact O-ND1 3.27Å; V536-H540 VanDerWaalsContact O-ND1 3.11Å; F537-H540 PolarHBondContact O-N 3.42Å; I538-H540 VanDerWaalsContact C-N 3.33Å; I538-H540 PolarHBondContact O-N 2.88Å; H540-L543 PolarHBondContact O-N 2.92Å; H540-S544 VanDerWaalsContact O-CB 3.27Å; H540-S544 WeakPolarHBondContact O-CB 3.48Å; H540-S544 PolarHBondContact O-N 3.27Å
541	N	97	Very high	93.8	Very high	6 Å²	6	36.7 Å²	36.7	3%	0.032	20%	0.196	C	C	.	.	H	α-helix	trans	-67.4	-39.6	176.1	-78.3	-16.4	0	0	0	111.7	L365 I366 T368 R369 V439 F537 I538 L539 S544 A545	L365-N541 PolarHBondContact O-ND2 2.76Å; I366-N541 PolarHBondContact O-ND2 2.99Å; T368-N541 PolarHBondContact O-ND2 3.45Å; R369-N541 WeakPolarHBondContact CG-OD1 3.46Å; V439-N541 HydrophobicContact CG1-CB 3.78Å; F537-N541 PolarHBondContact O-N 2.92Å; I538-N541 PolarHBondContact O-N 2.82Å; I538-N541 VanDerWaalsContact O-N 3.14Å; L539-N541 VanDerWaalsContact C-N 3.32Å; L539-N541 PolarHBondContact O-N 2.86Å; N541-S544 PolarHBondContact O-N 3.26Å; N541-A545 WeakPolarHBondContact O-CB 3.44Å; N541-A545 PolarHBondContact O-N 2.8Å
542	I	97.2	Very high	92.2	Very high	3 Å²	3	41.4 Å²	41.4	2%	0.015	22%	0.219	C	C	.	.	H	α-helix	trans	-62.4	-47.6	173.7	-63.7	166.4	0	0	0	110.9	V439 L460 Y462 Y500 I538 L539 S544 A545 K546	V439-I542 HydrophobicContact CB-CG1 3.86Å; V439-I542 HydrophobicContact CG1-CG1 3.9Å; V439-I542 HydrophobicContact CG2-CG1 4.28Å; L460-I542 HydrophobicContact CB-CD1 3.97Å; Y462-I542 HydrophobicContact CD2-CG2 4.43Å; Y462-I542 WeakPolarHBondContact O-CG2 3.45Å; Y500-I542 HydrophobicContact CD2-CG2 4.33Å; Y500-I542 HydrophobicContact CE1-CG2 4.36Å; Y500-I542 HydrophobicContact CE2-CG2 3.44Å; Y500-I542 VanDerWaalsContact CE2-CG2 3.44Å; Y500-I542 VanDerWaalsContact CZ-CG2 3.48Å; Y500-I542 WeakPolarHBondContact OH-CD1 3.41Å; Y500-I542 WeakPolarHBondContact OH-CG2 3.18Å; I538-I542 HydrophobicContact CG2-CD1 4.03Å; I538-I542 WeakPolarHBondContact O-CG1 3.44Å; I538-I542 PolarHBondContact O-N 2.93Å; L539-I542 PolarHBondContact O-N 2.8Å; I542-S544 PolarHBondContact O-N 3.03Å; I542-A545 PolarHBondContact O-N 2.97Å; I542-K546 WeakPolarHBondContact O-CB 3.19Å; I542-K546 PolarHBondContact O-N 3.43Å
543	L	95.2	Very high	90.1	Very high	48 Å²	48	49.4 Å²	49.4	25%	0.251	25%	0.254	S	S	.	.	H	α-helix	trans	-61.6	-44.3	178.2	-67.7	173.7	0	0	0	111.4	Y500 L503 L539 H540 K546 V547	Y500-L543 HydrophobicContact CD1-CD2 3.68Å; Y500-L543 HydrophobicContact CE1-CD2 4.44Å; Y500-L543 HydrophobicContact CG-CD2 3.86Å; L503-L543 HydrophobicContact CD2-CD1 4.03Å; L539-L543 HydrophobicContact CD1-CD1 4.37Å; L539-L543 HydrophobicContact CD1-CG 4.37Å; L539-L543 HydrophobicContact CG-CD1 4.2Å; L539-L543 WeakPolarHBondContact O-CG 3.29Å; L539-L543 PolarHBondContact O-N 2.84Å; H540-L543 PolarHBondContact O-N 2.92Å; L543-K546 PolarHBondContact O-N 2.99Å; L543-V547 VanDerWaalsContact O-CG2 3.28Å; L543-V547 WeakPolarHBondContact O-CG2 3.5Å; L543-V547 PolarHBondContact O-N 3.49Å
544	S	94.4	Very high	87.4	Confident	39 Å²	39	54.5 Å²	54.5	27%	0.273	32%	0.32	S	S	.	.	H	α-helix	trans	-59.8	-47.7	175.8	-179	0	0	0	0	111.6	H436 H540 N541 I542 K546 V547 T548	H436-S544 PolarHBondContact NE2-OG 3.39Å; H540-S544 VanDerWaalsContact O-CB 3.27Å; H540-S544 WeakPolarHBondContact O-CB 3.48Å; H540-S544 PolarHBondContact O-N 3.27Å; N541-S544 PolarHBondContact O-N 3.26Å; I542-S544 PolarHBondContact O-N 3.03Å; S544-K546 VanDerWaalsContact C-N 3.34Å; S544-K546 PolarHBondContact O-N 2.75Å; S544-V547 PolarHBondContact O-N 2.83Å; S544-T548 PolarHBondContact O-N 2.8Å; S544-T548 PolarHBondContact O-OG1 3.35Å
545	A	95.6	Very high	87	Confident	1 Å²	1	55.6 Å²	55.6	1%	0.008	33%	0.326	C	S	.	.	H	α-helix	trans	-61.8	-40	177.2	0	0	0	0	0	112.2	H436 V439 Y462 N541 I542 T548 R549	H436-A545 HydrophobicContact CB-CB 3.92Å; V439-A545 HydrophobicContact CG2-CB 4.21Å; Y462-A545 HydrophobicContact CE2-CB 3.99Å; N541-A545 WeakPolarHBondContact O-CB 3.44Å; N541-A545 PolarHBondContact O-N 2.8Å; I542-A545 PolarHBondContact O-N 2.97Å; A545-T548 PolarHBondContact O-N 2.94Å; A545-R549 WeakPolarHBondContact O-CB 3.31Å; A545-R549 VanDerWaalsContact O-CG 3.3Å; A545-R549 WeakPolarHBondContact O-CG 3.42Å; A545-R549 PolarHBondContact O-N 3.15Å
546	K	93	Very high	86.4	Confident	21 Å²	21	57.9 Å²	57.9	9%	0.091	34%	0.339	C	S	.	.	H	α-helix	trans	-64.2	-40	177.1	-173.5	166.2	178.5	165.9	0	111.9	Y500 E501 I542 L543 S544 R550	Y500-K546 HydrophobicContact CD2-CD 4.03Å; E501-K546 VanDerWaalsContact CD-NZ 3.34Å; E501-K546 WeakPolarHBondContact OE1-CE 3.22Å; E501-K546 IonicContact OE1-NZ 3.64Å; E501-K546 PolarHBondContact OE1-NZ 3.07Å; E501-K546 IonicContact OE2-NZ 2.69Å; E501-K546 PolarHBondContact OE2-NZ 3.49Å; I542-K546 WeakPolarHBondContact O-CB 3.19Å; I542-K546 PolarHBondContact O-N 3.43Å; L543-K546 PolarHBondContact O-N 2.99Å; S544-K546 VanDerWaalsContact C-N 3.34Å; S544-K546 PolarHBondContact O-N 2.75Å; K546-R550 VanDerWaalsContact CE-CZ 3.45Å; K546-R550 WeakPolarHBondContact O-CG 3.03Å; K546-R550 PolarHBondContact O-N 3.04Å
547	V	91	Very high	85.9	Confident	50 Å²	50	60.6 Å²	60.6	30%	0.303	35%	0.354	S	S	.	.	H	α-helix	trans	-67.8	-44	177.3	174.6	0	0	0	0	111.3	L543 S544 R550 L552 F553	L543-V547 VanDerWaalsContact O-CG2 3.28Å; L543-V547 WeakPolarHBondContact O-CG2 3.5Å; L543-V547 PolarHBondContact O-N 3.49Å; S544-V547 PolarHBondContact O-N 2.83Å; V547-R550 PolarHBondContact O-N 3.5Å; V547-L552 HydrophobicContact CG1-CB 3.95Å; V547-L552 PolarHBondContact O-N 3.2Å; V547-F553 HydrophobicContact CG1-CD2 3.44Å; V547-F553 VanDerWaalsContact CG1-CD2 3.44Å; V547-F553 HydrophobicContact CG1-CE2 3.39Å
548	T	90.8	Very high	85.2	Confident	75 Å²	75	63.2 Å²	63.2	46%	0.46	37%	0.371	S	S	.	.	H	α-helix	trans	-60.1	-46.9	174.7	-60.5	0	0	0	0	111.8	H436 S544 A545 R550 G551	H436-T548 PolarHBondContact CE1-OG1 2.82Å; S544-T548 PolarHBondContact O-N 2.8Å; S544-T548 PolarHBondContact O-OG1 3.35Å; A545-T548 PolarHBondContact O-N 2.94Å; T548-R550 PolarHBondContact O-N 2.79Å; T548-G551 PolarHBondContact O-N 3.01Å
549	R	90.8	Very high	84.5	Confident	116 Å²	116	66.3 Å²	66.3	44%	0.438	39%	0.39	S	S	.	.	H	α-helix	trans	-61.7	-28.6	178.5	-75	-173.3	-64.2	160.2	-5	114	Y462 D463 A545 G551	Y462-R549 VanDerWaalsContact OH-CD 3.26Å; Y462-R549 WeakPolarHBondContact OH-CD 3.29Å; Y462-R549 VanDerWaalsContact OH-CZ 3.23Å; Y462-R549 PolarHBondContact OH-NE 3.32Å; D463-R549 IonicContact OD1-CZ 2.81Å; D463-R549 VanDerWaalsContact OD1-CZ 3.23Å; D463-R549 IonicContact OD1-NH1 2.96Å; D463-R549 PolarHBondContact OD1-NH1 2.9Å; D463-R549 IonicContact OD1-NH2 3.13Å; D463-R549 PolarHBondContact OD1-NH2 3.33Å; A545-R549 WeakPolarHBondContact O-CB 3.31Å; A545-R549 VanDerWaalsContact O-CG 3.3Å; A545-R549 WeakPolarHBondContact O-CG 3.42Å; A545-R549 PolarHBondContact O-N 3.15Å; R549-G551 PolarHBondContact O-N 3.22Å
550	R	83.8	Confident	83.6	Confident	142 Å²	142	70.4 Å²	70.4	54%	0.536	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.5	1.4	177.6	-73.3	-177.2	172.4	176	1.2	113.5	E501 K546 V547 T548 L552	E501-R550 IonicContact OE1-CZ 2.71Å; E501-R550 IonicContact OE1-NH1 3.74Å; E501-R550 PolarHBondContact OE1-NH1 3Å; E501-R550 IonicContact OE1-NH2 3.26Å; E501-R550 PolarHBondContact OE1-NH2 3.21Å; K546-R550 VanDerWaalsContact CE-CZ 3.45Å; K546-R550 WeakPolarHBondContact O-CG 3.03Å; K546-R550 PolarHBondContact O-N 3.04Å; V547-R550 PolarHBondContact O-N 3.5Å; T548-R550 PolarHBondContact O-N 2.79Å; R550-L552 HydrophobicContact CB-CD1 3.89Å; R550-L552 HydrophobicContact CB-CG 3.93Å; R550-L552 PolarHBondContact O-N 3.1Å
551	G	76.4	Confident	82.8	Confident	58 Å²	58	71.3 Å²	71.3	60%	0.598	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.6	23.1	-178.8	0	0	0	0	0	113	T548 R549 F553	T548-G551 PolarHBondContact O-N 3.01Å; R549-G551 PolarHBondContact O-N 3.22Å; G551-F553 PolarHBondContact O-N 2.84Å
552	L	62.5	Low	81.7	Confident	117 Å²	117	76.3 Å²	76.3	61%	0.613	46%	0.455	S	S	*	.			trans	-81.3	1.6	-178.4	-67.8	171.6	0	0	0	112.7	V547 R550	V547-L552 HydrophobicContact CG1-CB 3.95Å; V547-L552 PolarHBondContact O-N 3.2Å; R550-L552 HydrophobicContact CB-CD1 3.89Å; R550-L552 HydrophobicContact CB-CG 3.93Å; R550-L552 PolarHBondContact O-N 3.1Å
553	F	52.3	Low	80.4	Confident	167 Å²	167	82.4 Å²	82.4	73%	0.732	49%	0.492	S	S	*	.			trans	-137.3	118	162.1	-69	-69.4	0	0	0	109.1	V547 G551	V547-F553 HydrophobicContact CG1-CD2 3.44Å; V547-F553 VanDerWaalsContact CG1-CD2 3.44Å; V547-F553 HydrophobicContact CG1-CE2 3.39Å; G551-F553 PolarHBondContact O-N 2.84Å
554	G	39.3	Very low	79.1	Confident	155 Å²	155	85.5 Å²	85.5	100%	1.598	51%	0.514	S	S	*	.			trans	-150.2	0	172.5	0	0	0	0	0	109.2

Retrieved 554 of 554 residues in 101.6 ms (Link to these results)

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