A0A077ZDG5_TRITR Loading...

Transducin beta protein 3 like

AlphaFold DB , UniProt , Accession A0A077ZDG5, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 755 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	31.1	Very low	57.6	Low	229 Å²	229	107.5 Å²	107.5	100%	1.128	51%	0.508	S	S	*	.				0	9.7	0	-80.7	-162.7	-156.5	0	0	114.9
2	H	36.6	Very low	60	Low	185 Å²	185	102 Å²	102	86%	0.856	49%	0.487	S	S	*	.			trans	-106.1	19.5	177.7	-76	-3.1	0	0	0	115.1	K4	H2-K4 PolarHBondContact O-N 2.88Å
3	R	43.7	Very low	62	Low	231 Å²	231	98.5 Å²	98.5	87%	0.872	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.1	13.2	173.6	-122.8	-178	-174.8	-174.1	-1.8	113.8
4	K	45	Very low	63.9	Low	199 Å²	199	94.7 Å²	94.7	87%	0.865	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.4	-8	-165.9	-84.3	-168.9	175.3	-176.8	0	116	H2	H2-K4 PolarHBondContact O-N 2.88Å
5	E	46.1	Very low	65.6	Low	180 Å²	180	97.7 Å²	97.7	84%	0.841	46%	0.462	S	S	*	.	S	Bend	trans	-113.6	-1.2	-173.9	-73.4	-178	174.2	0	0	115.2	G7	E5-G7 VanDerWaalsContact C-N 3.32Å; E5-G7 PolarHBondContact O-N 2.96Å; E5-G7 VanDerWaalsContact O-N 3.08Å
6	V	50.3	Low	67.2	Low	49 Å²	49	92.3 Å²	92.3	30%	0.297	44%	0.436	S	S	.	.			trans	-86.2	86.7	170.7	-168.1	0	0	0	0	107.1	A595	V6-A595 HydrophobicContact CG1-CB 4.36Å; V6-A595 HydrophobicContact CG2-CB 3.96Å
7	G	60.5	Low	68.5	Low	13 Å²	13	90.1 Å²	90.1	13%	0.134	43%	0.427	C	S	.	.			trans	-59	153.4	166.4	0	0	0	0	0	110.6	E5 E9	E5-G7 VanDerWaalsContact C-N 3.32Å; E5-G7 PolarHBondContact O-N 2.96Å; E5-G7 VanDerWaalsContact O-N 3.08Å; G7-E9 WeakPolarHBondContact O-CG 3.46Å; G7-E9 PolarHBondContact O-N 2.99Å
8	L	70.7	Confident	69.7	Low	18 Å²	18	86.5 Å²	86.5	9%	0.094	41%	0.413	C	S	.	.			trans	-57.9	137.6	179.3	-68.8	175.4	0	0	0	111	F10 N527 Y532 L544 D589 T591	L8-F10 HydrophobicContact CB-CE2 4.38Å; L8-N527 VanDerWaalsContact CD1-ND2 3.28Å; L8-N527 WeakPolarHBondContact CD1-ND2 3.03Å; L8-Y532 HydrophobicContact CD1-CD1 4.43Å; L8-Y532 HydrophobicContact CD1-CD2 3.13Å; L8-Y532 HydrophobicContact CD1-CE2 3.63Å; L8-Y532 HydrophobicContact CD1-CG 3.6Å; L8-Y532 HydrophobicContact CD2-CE2 4.37Å; L8-Y532 HydrophobicContact CG-CD2 3.6Å; L8-Y532 HydrophobicContact CG-CE2 3.52Å; L8-Y532 HydrophobicContact CG-CG 4.14Å; L8-L544 HydrophobicContact CB-CD1 4.44Å; L8-L544 HydrophobicContact CB-CD2 3.72Å; L8-L544 WeakPolarHBondContact O-CD2 3.49Å; L8-D589 WeakPolarHBondContact CD2-OD2 3.46Å; L8-T591 HydrophobicContact CB-CG2 4.2Å; L8-T591 HydrophobicContact CD2-CG2 3.82Å
9	E	80.2	Confident	70.8	Confident	28 Å²	28	82.4 Å²	82.4	13%	0.131	39%	0.393	C	S	.	.			trans	-134.6	113.8	-177.9	-58.3	-155.1	-177.4	0	0	108.3	G7 K554 Y556 V590 T591 I594 R598	G7-E9 WeakPolarHBondContact O-CG 3.46Å; G7-E9 PolarHBondContact O-N 2.99Å; E9-K554 HydrophobicContact CG-CD 4.35Å; E9-K554 IonicContact OE1-NZ 2.86Å; E9-K554 PolarHBondContact OE1-NZ 3.3Å; E9-K554 IonicContact OE2-NZ 3.97Å; E9-K554 PolarHBondContact OE2-NZ 2.61Å; E9-Y556 WeakPolarHBondContact CA-OH 3.44Å; E9-V590 HydrophobicContact CB-CG2 4.22Å; E9-V590 VanDerWaalsContact O-CG2 3.23Å; E9-V590 WeakPolarHBondContact O-CG2 3.32Å; E9-V590 PolarHBondContact O-N 3.24Å; E9-T591 HydrophobicContact CB-CG2 4.02Å; E9-T591 HydrophobicContact CG-CG2 4.44Å; E9-I594 HydrophobicContact CB-CD1 4.15Å; E9-I594 HydrophobicContact CG-CD1 4.47Å; E9-I594 WeakPolarHBondContact OE2-CD1 3.45Å; E9-R598 IonicContact OE1-NH2 3.34Å; E9-R598 PolarHBondContact OE1-NH2 2.89Å; E9-R598 VanDerWaalsContact OE1-NH2 3.08Å
10	F	83.7	Confident	71.9	Confident	11 Å²	11	78.7 Å²	78.7	5%	0.048	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	141	172.5	-63.3	-75.6	0	0	0	110.9	L8 L534 L544 Y556 F568 L575 W587 K588 D589	L8-F10 HydrophobicContact CB-CE2 4.38Å; F10-L534 HydrophobicContact CE2-CD1 4.2Å; F10-L534 HydrophobicContact CE2-CD2 4.17Å; F10-L534 HydrophobicContact CZ-CD1 4.42Å; F10-L544 HydrophobicContact CE2-CD1 4.46Å; F10-Y556 HydrophobicContact CB-CE1 4.41Å; F10-Y556 HydrophobicContact CB-CE2 4.46Å; F10-Y556 HydrophobicContact CD2-CE2 4.1Å; F10-Y556 PolarHBondContact N-OH 3.42Å; F10-Y556 VanDerWaalsContact O-CE1 3.28Å; F10-Y556 WeakPolarHBondContact O-CE1 3.45Å; F10-F568 HydrophobicContact CE1-CE1 4.19Å; F10-F568 AromaticContact CZ-CE1 3.9Å; F10-F568 HydrophobicContact CZ-CE1 3.9Å; F10-F568 HydrophobicContact CZ-CZ 4.31Å; F10-L575 HydrophobicContact CD1-CB 4.46Å; F10-L575 HydrophobicContact CE1-CB 4.39Å; F10-W587 HydrophobicContact CB-CB 4.14Å; F10-W587 HydrophobicContact CB-CE3 4.25Å; F10-W587 HydrophobicContact CD1-CB 4.49Å; F10-K588 WeakPolarHBondContact CA-O 3.26Å; F10-D589 HydrophobicContact CD1-CB 4.26Å; F10-D589 HydrophobicContact CE1-CB 4.03Å
11	A	85.9	Confident	72.5	Confident	39 Å²	39	77.4 Å²	77.4	32%	0.322	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	142	168.9	0	0	0	0	0	109.6	T13 W587 K588 V590	A11-T13 PolarHBondContact O-N 2.83Å; A11-W587 CarbonylContact O-C 3.56Å; A11-W587 VanDerWaalsContact O-CA 3.26Å; A11-W587 WeakPolarHBondContact O-CA 3.32Å; A11-K588 PolarHBondContact N-O 3.25Å; A11-K588 PolarHBondContact O-N 2.8Å; A11-V590 HydrophobicContact CB-CB 4.4Å; A11-V590 HydrophobicContact CB-CG1 3.76Å; A11-V590 HydrophobicContact CB-CG2 3.73Å
12	V	86.6	Confident	75	Confident	42 Å²	42	68 Å²	68	26%	0.255	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	124.1	176.5	-174.6	0	0	0	0	109.3	R15 L585 W587	V12-R15 HydrophobicContact CG1-CG 3.56Å; V12-L585 HydrophobicContact CG1-CD2 4.3Å; V12-W587 HydrophobicContact CB-CE3 4.43Å; V12-W587 HydrophobicContact CG2-CD2 3.83Å; V12-W587 HydrophobicContact CG2-CE3 3.41Å; V12-W587 VanDerWaalsContact CG2-CE3 3.41Å; V12-W587 HydrophobicContact CG2-CH2 3.44Å; V12-W587 VanDerWaalsContact CG2-CH2 3.44Å; V12-W587 HydrophobicContact CG2-CZ2 3.85Å; V12-W587 HydrophobicContact CG2-CZ3 3.22Å
13	T	85.9	Confident	77.3	Confident	56 Å²	56	61.3 Å²	61.3	34%	0.344	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	-42	172.8	48.2	0	0	0	0	112.8	A11 I586 K588	A11-T13 PolarHBondContact O-N 2.83Å; T13-I586 PolarHBondContact N-O 2.9Å; T13-I586 PolarHBondContact OG1-O 2.82Å; T13-I586 VanDerWaalsContact OG1-O 3.06Å; T13-K588 HydrophobicContact CG2-CB 3.3Å; T13-K588 HydrophobicContact CG2-CD 4.06Å; T13-K588 HydrophobicContact CG2-CG 4.3Å
14	H	88.4	Confident	79.3	Confident	46 Å²	46	50.7 Å²	50.7	21%	0.213	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	141.6	-178.5	-63	-65.2	0	0	0	112.2	F16 E51 I586	H14-F16 HydrophobicContact CB-CE2 4.28Å; H14-F16 HydrophobicContact CB-CZ 4.35Å; H14-E51 WeakPolarHBondContact CA-OE1 3.31Å; H14-E51 WeakPolarHBondContact CB-OE1 3.33Å; H14-E51 IonicContact CE1-OE1 3.23Å; H14-E51 IonicContact CG-OE1 2.84Å; H14-E51 IonicContact ND1-OE1 2.81Å; H14-E51 PolarHBondContact ND1-OE1 3.03Å; H14-I586 HydrophobicContact CB-CB 4.09Å; H14-I586 HydrophobicContact CB-CD1 4.23Å; H14-I586 HydrophobicContact CB-CG1 4.32Å; H14-I586 PolarHBondContact N-O 2.82Å; H14-I586 PolarHBondContact O-N 3.08Å
15	R	89.9	Confident	81.5	Confident	140 Å²	140	41.6 Å²	41.6	53%	0.528	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	103.4	179.7	-57.7	-167.1	176.7	-175.2	-4.5	111.2	V12 L17 E51 L585	V12-R15 HydrophobicContact CG1-CG 3.56Å; R15-L17 HydrophobicContact CB-CG 4.31Å; R15-L17 PolarHBondContact O-N 3.28Å; R15-E51 PolarHBondContact N-OE1 2.92Å; R15-L585 HydrophobicContact CB-CD2 3.96Å; R15-L585 HydrophobicContact CG-CD2 3.65Å
16	F	90.4	Very high	83.4	Confident	11 Å²	11	33.8 Å²	33.8	5%	0.048	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	88.5	170.3	-53.6	-66.8	0	0	0	108.9	H14 F302 G319 A583 L584 I586	H14-F16 HydrophobicContact CB-CE2 4.28Å; H14-F16 HydrophobicContact CB-CZ 4.35Å; F16-F302 HydrophobicContact CD2-CZ 4.31Å; F16-F302 HydrophobicContact CE2-CE1 4.41Å; F16-F302 HydrophobicContact CE2-CZ 4.09Å; F16-G319 VanDerWaalsContact CE1-CA 3.44Å; F16-A583 WeakPolarHBondContact O-CA 3.33Å; F16-L584 HydrophobicContact CB-CB 4.15Å; F16-L584 HydrophobicContact CD2-CB 4.35Å; F16-L584 PolarHBondContact N-O 3.08Å; F16-L584 PolarHBondContact O-N 3.36Å; F16-I586 HydrophobicContact CE2-CD1 3.81Å; F16-I586 HydrophobicContact CE2-CG1 4.43Å
17	L	90.2	Very high	85.2	Confident	55 Å²	55	32.5 Å²	32.5	29%	0.288	20%	0.198	S	C	.	.			trans	-90	153.3	178.2	-58.4	177.6	0	0	0	110.3	R15 F19 V52 A583	R15-L17 HydrophobicContact CB-CG 4.31Å; R15-L17 PolarHBondContact O-N 3.28Å; L17-F19 PolarHBondContact O-N 3.05Å; L17-V52 HydrophobicContact CB-CG2 4.16Å; L17-A583 HydrophobicContact CD2-CB 3.52Å
18	P	89.8	Confident	86.3	Confident	25 Å²	25	32.7 Å²	32.7	16%	0.162	20%	0.197	C	C	.	.			trans	-60.2	128.3	166.7	28.1	-35.7	0	0	0	109.6	K43 G286 D581	P18-K43 PolarHBondContact O-NZ 3.32Å; P18-G286 WeakPolarHBondContact CA-O 3.14Å; P18-D581 WeakPolarHBondContact CG-O 3.35Å
19	F	91.1	Very high	86.5	Confident	8 Å²	8	32.9 Å²	32.9	4%	0.035	20%	0.201	C	C	.	.			trans	-127.5	-8.2	-176.3	66.3	-101.1	0	0	0	114.5	L17 L34 T36 K43 V45 V52 F270 L284 V285 G286	L17-F19 PolarHBondContact O-N 3.05Å; F19-L34 HydrophobicContact CE2-CD2 4.09Å; F19-T36 HydrophobicContact CD2-CG2 3.76Å; F19-T36 WeakPolarHBondContact CD2-OG1 3.48Å; F19-T36 HydrophobicContact CE2-CG2 4Å; F19-T36 VanDerWaalsContact O-CB 3.23Å; F19-T36 WeakPolarHBondContact O-CB 3.49Å; F19-T36 PolarHBondContact O-OG1 2.83Å; F19-K43 HydrophobicContact CB-CB 4.08Å; F19-K43 HydrophobicContact CB-CD 4.29Å; F19-V45 HydrophobicContact CB-CG2 3.68Å; F19-V45 HydrophobicContact CD1-CG2 3.97Å; F19-V45 HydrophobicContact CD2-CG2 3.63Å; F19-V45 HydrophobicContact CE1-CG2 4.49Å; F19-V45 HydrophobicContact CE2-CG2 4.19Å; F19-V45 HydrophobicContact CG-CG2 3.5Å; F19-V45 VanDerWaalsContact CG-CG2 3.5Å; F19-V52 HydrophobicContact CB-CG2 3.88Å; F19-F270 HydrophobicContact CD2-CE2 4.41Å; F19-F270 AromaticContact CE2-CD2 3.87Å; F19-F270 HydrophobicContact CE2-CD2 3.87Å; F19-F270 AromaticContact CE2-CE2 3.51Å; F19-F270 HydrophobicContact CE2-CE2 3.51Å; F19-F270 HydrophobicContact CE2-CZ 4.2Å; F19-F270 HydrophobicContact CZ-CD2 4.06Å; F19-F270 HydrophobicContact CZ-CE2 4.13Å; F19-L284 HydrophobicContact CZ-CB 4.28Å; F19-V285 WeakPolarHBondContact CE1-O 3.47Å; F19-G286 PolarHBondContact N-O 2.78Å
20	F	91.2	Very high	86.3	Confident	8 Å²	8	37.5 Å²	37.5	4%	0.035	23%	0.227	C	C	.	.			trans	-136.3	130.6	178.5	-175.8	-120.3	0	0	0	110.7	G22 V25 T36 T37 V264 E268 F270 G286	F20-G22 VanDerWaalsContact CZ-CA 3.44Å; F20-V25 HydrophobicContact CD2-CG2 3.9Å; F20-V25 HydrophobicContact CE2-CG2 3.41Å; F20-V25 VanDerWaalsContact CE2-CG2 3.41Å; F20-V25 HydrophobicContact CZ-CG2 4.02Å; F20-T36 HydrophobicContact CD2-CG2 4.39Å; F20-T37 WeakPolarHBondContact CA-O 3.43Å; F20-T37 WeakPolarHBondContact CD2-O 3.2Å; F20-V264 HydrophobicContact CD1-CG1 4.35Å; F20-V264 HydrophobicContact CE1-CG1 3.49Å; F20-V264 VanDerWaalsContact CE1-CG1 3.49Å; F20-V264 HydrophobicContact CZ-CG1 3.71Å; F20-E268 HydrophobicContact CD1-CB 3.73Å; F20-E268 HydrophobicContact CD1-CG 4.06Å; F20-E268 HydrophobicContact CE1-CB 4.23Å; F20-E268 HydrophobicContact CE1-CG 4.24Å; F20-F270 HydrophobicContact CB-CE2 3.72Å; F20-F270 HydrophobicContact CB-CZ 3.97Å; F20-F270 AromaticContact CD1-CE2 3.7Å; F20-F270 HydrophobicContact CD1-CE2 3.7Å; F20-F270 AromaticContact CD1-CZ 3.71Å; F20-F270 HydrophobicContact CD1-CZ 3.71Å; F20-F270 AromaticContact CD2-CZ 3.98Å; F20-F270 HydrophobicContact CD2-CZ 3.98Å; F20-F270 HydrophobicContact CE1-CE2 4.46Å; F20-F270 HydrophobicContact CE1-CZ 4.16Å; F20-F270 HydrophobicContact CE2-CZ 4.39Å; F20-F270 AromaticContact CG-CE2 3.75Å; F20-F270 HydrophobicContact CG-CE2 3.75Å; F20-F270 AromaticContact CG-CZ 3.61Å; F20-F270 HydrophobicContact CG-CZ 3.61Å; F20-F270 HydrophobicContact CZ-CZ 4.47Å; F20-G286 PolarHBondContact N-O 3.01Å
21	S	86.1	Confident	86	Confident	52 Å²	52	38.6 Å²	38.6	36%	0.364	23%	0.234	S	C	.	.	S	Bend	trans	-129.1	31.9	177.6	72.9	0	0	0	0	111.6	T37 C38 G39 E268	S21-T37 PolarHBondContact N-O 3.23Å; S21-C38 WeakPolarHBondContact OG-CA 3.32Å; S21-G39 PolarHBondContact OG-N 3.36Å; S21-E268 VanDerWaalsContact CA-OE1 3.26Å; S21-E268 WeakPolarHBondContact CA-OE1 3.27Å
22	G	83.6	Confident	85.8	Confident	31 Å²	31	44.4 Å²	44.4	32%	0.32	25%	0.247	S	C	.	.	S	Bend	trans	83	158.3	-168.8	0	0	0	0	0	113.8	F20 T37	F20-G22 VanDerWaalsContact CZ-CA 3.44Å; G22-T37 PolarHBondContact O-OG1 3.09Å
23	G	85.1	Confident	85.9	Confident	45 Å²	45	44.5 Å²	44.5	46%	0.464	24%	0.244	S	C	.	.	S	Bend	trans	115.2	-160.2	179.2	0	0	0	0	0	113.8	T37	G23-T37 WeakPolarHBondContact CA-OG1 3.46Å
24	S	85.3	Confident	86	Confident	8 Å²	8	41.9 Å²	41.9	6%	0.056	23%	0.228	C	C	.	.			trans	-71.2	144.9	-179.5	-75.3	0	0	0	0	111.8	T37 F68	S24-T37 PolarHBondContact O-OG1 2.99Å; S24-F68 WeakPolarHBondContact O-CE1 3.18Å; S24-F68 WeakPolarHBondContact O-CZ 3.43Å
25	V	89.7	Confident	86.1	Confident	8 Å²	8	39.8 Å²	39.8	5%	0.048	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	143	170.5	175.9	0	0	0	0	109.1	F20 L34 F35 T36 Q251 I253 V264 F270	F20-V25 HydrophobicContact CD2-CG2 3.9Å; F20-V25 HydrophobicContact CE2-CG2 3.41Å; F20-V25 VanDerWaalsContact CE2-CG2 3.41Å; F20-V25 HydrophobicContact CZ-CG2 4.02Å; V25-L34 HydrophobicContact CG1-CD1 3.57Å; V25-L34 HydrophobicContact CG1-CG 4.28Å; V25-F35 WeakPolarHBondContact CA-O 3.1Å; V25-F35 WeakPolarHBondContact CG1-O 3.22Å; V25-T36 HydrophobicContact CG1-CG2 4.14Å; V25-T36 HydrophobicContact CG2-CG2 4.15Å; V25-Q251 PolarHBondContact O-NE2 2.8Å; V25-I253 HydrophobicContact CB-CD1 3.55Å; V25-I253 HydrophobicContact CG1-CD1 3.32Å; V25-I253 WeakPolarHBondContact O-CD1 3.43Å; V25-V264 HydrophobicContact CG2-CG2 4.44Å; V25-F270 HydrophobicContact CB-CE1 4.36Å; V25-F270 HydrophobicContact CG1-CE1 3.82Å; V25-F270 HydrophobicContact CG1-CZ 4.49Å; V25-F270 HydrophobicContact CG2-CE1 3.87Å; V25-F270 HydrophobicContact CG2-CZ 3.94Å
26	A	87.7	Confident	86.2	Confident	17 Å²	17	33.1 Å²	33.1	14%	0.14	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	153.7	171.1	0	0	0	0	0	111.5	F35 F68 L70	A26-F35 PolarHBondContact N-O 2.85Å; A26-F35 PolarHBondContact O-N 3.03Å; A26-F68 HydrophobicContact CB-CE2 3.65Å; A26-F68 HydrophobicContact CB-CZ 4.32Å; A26-L70 HydrophobicContact CB-CB 4.22Å
27	V	86.7	Confident	86.2	Confident	22 Å²	22	32.8 Å²	32.8	13%	0.133	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	141.1	175.8	178.5	0	0	0	0	108.5	L34 L47 I253 F262	V27-L34 HydrophobicContact CG2-CD1 3.59Å; V27-L47 HydrophobicContact CG1-CD1 4.33Å; V27-I253 HydrophobicContact CB-CG2 4.34Å; V27-I253 HydrophobicContact CG2-CG2 3.86Å; V27-F262 HydrophobicContact CG1-CE2 4.49Å; V27-F262 HydrophobicContact CG2-CD2 3.74Å; V27-F262 HydrophobicContact CG2-CE2 3.92Å
28	S	83.4	Confident	86.1	Confident	16 Å²	16	31.2 Å²	31.2	11%	0.112	19%	0.185	C	C	.	.			trans	-61.1	154.4	174.2	-177.2	0	0	0	0	111.7	D30 N31 K33	S28-D30 PolarHBondContact O-N 2.8Å; S28-D30 VanDerWaalsContact O-N 3.11Å; S28-N31 PolarHBondContact O-N 2.94Å; S28-K33 PolarHBondContact N-O 2.82Å
29	A	75.5	Confident	85.9	Confident	22 Å²	22	31.4 Å²	31.4	18%	0.182	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.5	-32.9	177.4	0	0	0	0	0	113.6	N31 K256	A29-N31 VanDerWaalsContact C-N 3.32Å; A29-K256 HydrophobicContact CB-CD 3.99Å; A29-K256 VanDerWaalsContact CB-NZ 3.31Å
30	D	76	Confident	85.8	Confident	126 Å²	126	33.5 Å²	33.5	67%	0.674	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.1	2.8	-178.1	-57.3	-21.1	0	0	0	113.4	S28 R32	S28-D30 PolarHBondContact O-N 2.8Å; S28-D30 VanDerWaalsContact O-N 3.11Å; D30-R32 PolarHBondContact O-N 2.77Å; D30-R32 VanDerWaalsContact O-N 3.09Å
31	N	77.1	Confident	85.8	Confident	34 Å²	34	33.2 Å²	33.2	18%	0.182	20%	0.202	C	C	.	.	S	Bend	trans	54.8	22.2	-175.1	-56.4	-31.9	0	0	0	115.3	S28 A29 L47 C255 K256 T257	S28-N31 PolarHBondContact O-N 2.94Å; A29-N31 VanDerWaalsContact C-N 3.32Å; N31-L47 WeakPolarHBondContact O-CD1 3.32Å; N31-C255 VanDerWaalsContact CG-SG 3.57Å; N31-C255 VanDerWaalsContact OD1-CB 3.23Å; N31-C255 WeakPolarHBondContact OD1-CB 3.24Å; N31-C255 PolarHBondContact OD1-SG 2.59Å; N31-K256 PolarHBondContact OD1-N 3.2Å; N31-T257 WeakPolarHBondContact ND2-CG2 3.4Å; N31-T257 PolarHBondContact ND2-OG1 2.86Å
32	R	82.8	Confident	86	Confident	161 Å²	161	30.8 Å²	30.8	61%	0.608	19%	0.185	S	C	*	.	S	Bend	trans	-97.9	-30.8	177.4	-72.4	-176	172.3	178.7	-2.7	113.8	D30 L47	D30-R32 PolarHBondContact O-N 2.77Å; D30-R32 VanDerWaalsContact O-N 3.09Å; R32-L47 WeakPolarHBondContact O-CB 3.31Å; R32-L47 PolarHBondContact O-N 2.95Å
33	K	87	Confident	86.4	Confident	44 Å²	44	30.1 Å²	30.1	19%	0.191	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	135.3	-175.6	-59.3	175.8	178.3	178.9	0	110.7	S28 F35 V44 V45 D94	S28-K33 PolarHBondContact N-O 2.82Å; K33-F35 HydrophobicContact CB-CE2 4.27Å; K33-V44 HydrophobicContact CB-CG1 3.99Å; K33-V44 HydrophobicContact CD-CG1 4.09Å; K33-V44 HydrophobicContact CG-CG1 4.27Å; K33-V45 CarbonylContact C-O 3.59Å; K33-V45 WeakPolarHBondContact CA-O 3.28Å; K33-D94 VanDerWaalsContact CE-OD1 3.23Å; K33-D94 WeakPolarHBondContact CE-OD1 3.45Å; K33-D94 IonicContact NZ-OD1 3.48Å; K33-D94 PolarHBondContact NZ-OD1 3.4Å
34	L	89.3	Confident	86.7	Confident	0 Å²	0	28 Å²	28	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	127.7	171.9	-177	72.8	0	0	0	108.5	F19 V25 V27 T36 V44 V45 L47 F270	F19-L34 HydrophobicContact CE2-CD2 4.09Å; V25-L34 HydrophobicContact CG1-CD1 3.57Å; V25-L34 HydrophobicContact CG1-CG 4.28Å; V27-L34 HydrophobicContact CG2-CD1 3.59Å; L34-T36 HydrophobicContact CD2-CG2 3.8Å; L34-T36 HydrophobicContact CG-CG2 3.83Å; L34-V44 CarbonylContact O-C 3.57Å; L34-V44 WeakPolarHBondContact O-CA 3.36Å; L34-V45 HydrophobicContact CB-CB 4.3Å; L34-V45 PolarHBondContact N-O 3Å; L34-V45 PolarHBondContact O-N 3.39Å; L34-L47 HydrophobicContact CB-CD2 3.93Å; L34-L47 HydrophobicContact CB-CG 4.17Å; L34-L47 HydrophobicContact CD2-CD2 4.38Å; L34-F270 HydrophobicContact CD2-CD1 4.21Å; L34-F270 HydrophobicContact CD2-CE1 4.2Å
35	F	90.2	Very high	86.9	Confident	3 Å²	3	27.6 Å²	27.6	1%	0.013	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	127.2	173.5	-63.3	-97.6	0	0	0	108	V25 A26 K33 I42 V44 I56 F68 L70 L77 L91	V25-F35 WeakPolarHBondContact CA-O 3.1Å; V25-F35 WeakPolarHBondContact CG1-O 3.22Å; A26-F35 PolarHBondContact N-O 2.85Å; A26-F35 PolarHBondContact O-N 3.03Å; K33-F35 HydrophobicContact CB-CE2 4.27Å; F35-I42 HydrophobicContact CB-CG2 4.21Å; F35-I42 HydrophobicContact CD1-CG2 4.28Å; F35-V44 HydrophobicContact CD1-CG1 4.45Å; F35-V44 HydrophobicContact CD1-CG2 3.53Å; F35-V44 HydrophobicContact CE1-CB 4.49Å; F35-V44 HydrophobicContact CE1-CG1 4.15Å; F35-V44 HydrophobicContact CE1-CG2 3.51Å; F35-V44 HydrophobicContact CG-CG2 4.48Å; F35-V44 HydrophobicContact CZ-CG1 4.33Å; F35-V44 HydrophobicContact CZ-CG2 4.45Å; F35-I56 HydrophobicContact CD1-CD1 4.29Å; F35-I56 HydrophobicContact CE1-CD1 4.16Å; F35-F68 HydrophobicContact CB-CE2 3.82Å; F35-F68 HydrophobicContact CB-CZ 3.77Å; F35-F68 WeakPolarHBondContact O-CZ 3.31Å; F35-L70 HydrophobicContact CD2-CD2 4.21Å; F35-L70 HydrophobicContact CE2-CD1 4.4Å; F35-L70 HydrophobicContact CE2-CD2 3.94Å; F35-L70 HydrophobicContact CZ-CD1 4.4Å; F35-L77 HydrophobicContact CD1-CD2 4.49Å; F35-L91 HydrophobicContact CE1-CD1 3.76Å; F35-L91 HydrophobicContact CE1-CD2 4.41Å; F35-L91 HydrophobicContact CZ-CD1 3.74Å
36	T	91.3	Very high	86.8	Confident	0 Å²	0	28.2 Å²	28.2	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	145.8	-177.4	51.8	0	0	0	0	111	F19 F20 V25 L34 I42 K43 F270	F19-T36 HydrophobicContact CD2-CG2 3.76Å; F19-T36 WeakPolarHBondContact CD2-OG1 3.48Å; F19-T36 HydrophobicContact CE2-CG2 4Å; F19-T36 VanDerWaalsContact O-CB 3.23Å; F19-T36 WeakPolarHBondContact O-CB 3.49Å; F19-T36 PolarHBondContact O-OG1 2.83Å; F20-T36 HydrophobicContact CD2-CG2 4.39Å; V25-T36 HydrophobicContact CG1-CG2 4.14Å; V25-T36 HydrophobicContact CG2-CG2 4.15Å; L34-T36 HydrophobicContact CD2-CG2 3.8Å; L34-T36 HydrophobicContact CG-CG2 3.83Å; T36-I42 CarbonylContact O-C 3.6Å; T36-I42 VanDerWaalsContact O-CA 3.22Å; T36-I42 WeakPolarHBondContact O-CA 3.47Å; T36-I42 WeakPolarHBondContact O-CG2 3.21Å; T36-K43 PolarHBondContact N-O 3.3Å; T36-K43 PolarHBondContact O-N 2.68Å; T36-K43 PolarHBondContact OG1-O 3.5Å; T36-F270 HydrophobicContact CG2-CE1 4.36Å; T36-F270 HydrophobicContact CG2-CE2 4.5Å; T36-F270 HydrophobicContact CG2-CZ 3.81Å
37	T	90.7	Very high	86.6	Confident	3 Å²	3	28.1 Å²	28.1	2%	0.018	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	130	169.9	42.2	0	0	0	0	111	F20 S21 G22 G23 S24 V65 F68	F20-T37 WeakPolarHBondContact CA-O 3.43Å; F20-T37 WeakPolarHBondContact CD2-O 3.2Å; S21-T37 PolarHBondContact N-O 3.23Å; G22-T37 PolarHBondContact O-OG1 3.09Å; G23-T37 WeakPolarHBondContact CA-OG1 3.46Å; S24-T37 PolarHBondContact O-OG1 2.99Å; T37-V65 HydrophobicContact CG2-CB 4.39Å; T37-V65 HydrophobicContact CG2-CG1 3.73Å; T37-F68 HydrophobicContact CG2-CD1 3.54Å; T37-F68 HydrophobicContact CG2-CE1 3.58Å
38	C	88.1	Confident	86.6	Confident	22 Å²	22	32.2 Å²	32.2	15%	0.149	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	97.5	173	-168.7	0	0	0	0	108.4	S21 N40 V41 K43	S21-C38 WeakPolarHBondContact OG-CA 3.32Å; C38-N40 PolarHBondContact O-N 2.73Å; C38-N40 VanDerWaalsContact O-N 3.11Å; C38-V41 PolarHBondContact N-O 2.8Å; C38-V41 VanDerWaalsContact O-CG2 3.24Å; C38-V41 WeakPolarHBondContact O-CG2 3.36Å; C38-V41 PolarHBondContact O-N 3.34Å; C38-V41 VanDerWaalsContact O-N 3.17Å; C38-K43 HydrophobicContact CB-CD 4.25Å; C38-K43 HydrophobicContact CB-CG 4.01Å
39	G	86	Confident	86.5	Confident	30 Å²	30	32.5 Å²	32.5	31%	0.309	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.9	-111	-175.2	0	0	0	0	0	112.5	S21	S21-G39 PolarHBondContact OG-N 3.36Å
40	N	88.6	Confident	86.9	Confident	52 Å²	52	31.8 Å²	31.8	28%	0.278	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.9	-2.4	-175.8	-58.5	-15.1	0	0	0	113.6	C38 E59 D62 Q64 V65	C38-N40 PolarHBondContact O-N 2.73Å; C38-N40 VanDerWaalsContact O-N 3.11Å; N40-E59 PolarHBondContact ND2-O 3.39Å; N40-D62 VanDerWaalsContact CB-O 3.32Å; N40-D62 WeakPolarHBondContact CB-O 3.37Å; N40-D62 VanDerWaalsContact CG-O 3.28Å; N40-D62 PolarHBondContact ND2-O 2.94Å; N40-D62 VanDerWaalsContact ND2-O 3.08Å; N40-Q64 WeakPolarHBondContact OD1-CA 3.48Å; N40-Q64 PolarHBondContact OD1-N 3.27Å; N40-V65 VanDerWaalsContact O-CG2 3.28Å; N40-V65 WeakPolarHBondContact O-CG2 3.34Å
41	V	91.2	Very high	87.4	Confident	1 Å²	1	28 Å²	28	1%	0.006	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	165.6	-173.4	-64.1	0	0	0	0	112.3	C38 K43 T55 E59	C38-V41 PolarHBondContact N-O 2.8Å; C38-V41 VanDerWaalsContact O-CG2 3.24Å; C38-V41 WeakPolarHBondContact O-CG2 3.36Å; C38-V41 PolarHBondContact O-N 3.34Å; C38-V41 VanDerWaalsContact O-N 3.17Å; V41-K43 HydrophobicContact CG2-CG 4.4Å; V41-T55 HydrophobicContact CB-CG2 3.56Å; V41-T55 HydrophobicContact CG1-CG2 4Å; V41-T55 HydrophobicContact CG2-CG2 3.54Å; V41-E59 HydrophobicContact CB-CG 4.15Å; V41-E59 HydrophobicContact CG1-CB 4.23Å; V41-E59 HydrophobicContact CG1-CG 3.51Å; V41-E59 HydrophobicContact CG2-CG 3.54Å
42	I	91.3	Very high	87.9	Confident	1 Å²	1	27.8 Å²	27.8	1%	0.005	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	121.7	171.8	-63	171.7	0	0	0	108.4	F35 T36 I56 F68 L77 V79	F35-I42 HydrophobicContact CB-CG2 4.21Å; F35-I42 HydrophobicContact CD1-CG2 4.28Å; T36-I42 CarbonylContact O-C 3.6Å; T36-I42 VanDerWaalsContact O-CA 3.22Å; T36-I42 WeakPolarHBondContact O-CA 3.47Å; T36-I42 WeakPolarHBondContact O-CG2 3.21Å; I42-I56 HydrophobicContact CB-CB 4.22Å; I42-I56 HydrophobicContact CG2-CD1 4.43Å; I42-I56 PolarHBondContact N-O 2.79Å; I42-I56 PolarHBondContact O-N 2.85Å; I42-F68 HydrophobicContact CD1-CB 3.79Å; I42-F68 HydrophobicContact CD1-CD1 3.58Å; I42-F68 HydrophobicContact CD1-CD2 4.39Å; I42-F68 HydrophobicContact CD1-CE1 4.21Å; I42-F68 HydrophobicContact CD1-CG 3.68Å; I42-F68 HydrophobicContact CG1-CD1 3.99Å; I42-F68 HydrophobicContact CG1-CE1 4.29Å; I42-F68 HydrophobicContact CG2-CE1 4.41Å; I42-L77 HydrophobicContact CD1-CD2 4Å; I42-V79 HydrophobicContact CD1-CB 4.25Å; I42-V79 HydrophobicContact CD1-CG1 3.96Å; I42-V79 HydrophobicContact CD1-CG2 3.32Å
43	K	91.3	Very high	88	Confident	17 Å²	17	24.6 Å²	24.6	7%	0.074	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	138.2	174.8	-59	-155	-168.7	174.5	0	109.7	P18 F19 T36 C38 V41 V52 T55 E59	P18-K43 PolarHBondContact O-NZ 3.32Å; F19-K43 HydrophobicContact CB-CB 4.08Å; F19-K43 HydrophobicContact CB-CD 4.29Å; T36-K43 PolarHBondContact N-O 3.3Å; T36-K43 PolarHBondContact O-N 2.68Å; T36-K43 PolarHBondContact OG1-O 3.5Å; C38-K43 HydrophobicContact CB-CD 4.25Å; C38-K43 HydrophobicContact CB-CG 4.01Å; V41-K43 HydrophobicContact CG2-CG 4.4Å; K43-V52 HydrophobicContact CB-CG1 4.09Å; K43-V52 HydrophobicContact CB-CG2 4.46Å; K43-V52 HydrophobicContact CD-CG1 4.12Å; K43-V52 HydrophobicContact CD-CG2 4.18Å; K43-V52 HydrophobicContact CG-CG1 4.46Å; K43-T55 HydrophobicContact CG-CG2 4.38Å; K43-E59 VanDerWaalsContact CE-OE1 3.25Å; K43-E59 WeakPolarHBondContact CE-OE1 3.39Å; K43-E59 IonicContact NZ-OE1 3.21Å; K43-E59 PolarHBondContact NZ-OE1 3.03Å
44	V	91	Very high	88.1	Confident	0 Å²	0	24 Å²	24	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	111.5	176.5	-174.4	0	0	0	0	108.5	K33 L34 F35 K53 Y54 I56	K33-V44 HydrophobicContact CB-CG1 3.99Å; K33-V44 HydrophobicContact CD-CG1 4.09Å; K33-V44 HydrophobicContact CG-CG1 4.27Å; L34-V44 CarbonylContact O-C 3.57Å; L34-V44 WeakPolarHBondContact O-CA 3.36Å; F35-V44 HydrophobicContact CD1-CG1 4.45Å; F35-V44 HydrophobicContact CD1-CG2 3.53Å; F35-V44 HydrophobicContact CE1-CB 4.49Å; F35-V44 HydrophobicContact CE1-CG1 4.15Å; F35-V44 HydrophobicContact CE1-CG2 3.51Å; F35-V44 HydrophobicContact CG-CG2 4.48Å; F35-V44 HydrophobicContact CZ-CG1 4.33Å; F35-V44 HydrophobicContact CZ-CG2 4.45Å; V44-K53 PolarHBondContact O-N 3.44Å; V44-Y54 HydrophobicContact CB-CD1 4.23Å; V44-Y54 HydrophobicContact CB-CD2 4.32Å; V44-Y54 HydrophobicContact CB-CE1 3.93Å; V44-Y54 HydrophobicContact CB-CE2 4.07Å; V44-Y54 HydrophobicContact CB-CG 4.4Å; V44-Y54 HydrophobicContact CG1-CE1 3.85Å; V44-Y54 HydrophobicContact CG2-CD2 3.97Å; V44-Y54 HydrophobicContact CG2-CE1 4.23Å; V44-Y54 HydrophobicContact CG2-CE2 3.49Å; V44-Y54 VanDerWaalsContact CG2-CE2 3.49Å; V44-Y54 PolarHBondContact N-O 3.19Å; V44-I56 HydrophobicContact CG2-CD1 3.76Å; V44-I56 HydrophobicContact CG2-CG1 4.13Å
45	V	90.3	Very high	88.1	Confident	0 Å²	0	26.8 Å²	26.8	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	135.3	-177.1	-178.3	0	0	0	0	110	F19 K33 L34 E51 V52	F19-V45 HydrophobicContact CB-CG2 3.68Å; F19-V45 HydrophobicContact CD1-CG2 3.97Å; F19-V45 HydrophobicContact CD2-CG2 3.63Å; F19-V45 HydrophobicContact CE1-CG2 4.49Å; F19-V45 HydrophobicContact CE2-CG2 4.19Å; F19-V45 HydrophobicContact CG-CG2 3.5Å; F19-V45 VanDerWaalsContact CG-CG2 3.5Å; K33-V45 CarbonylContact C-O 3.59Å; K33-V45 WeakPolarHBondContact CA-O 3.28Å; L34-V45 HydrophobicContact CB-CB 4.3Å; L34-V45 PolarHBondContact N-O 3Å; L34-V45 PolarHBondContact O-N 3.39Å; V45-E51 CarbonylContact C-O 3.58Å; V45-E51 VanDerWaalsContact CA-O 3.31Å; V45-E51 WeakPolarHBondContact CA-O 3.36Å; V45-V52 HydrophobicContact CG2-CG2 4.13Å
46	D	87.6	Confident	88	Confident	21 Å²	21	26.8 Å²	26.8	11%	0.112	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	126.6	169.9	-156.6	25.8	0	0	0	110.1	D48 S50 E51 K53	D46-D48 VanDerWaalsContact C-N 3.28Å; D46-D48 PolarHBondContact O-N 2.82Å; D46-S50 WeakPolarHBondContact O-CA 3.33Å; D46-S50 PolarHBondContact O-N 3.46Å; D46-E51 PolarHBondContact N-O 2.81Å; D46-K53 HydrophobicContact CB-CD 3.98Å; D46-K53 HydrophobicContact CB-CG 4.12Å; D46-K53 IonicContact OD1-NZ 3.7Å; D46-K53 PolarHBondContact OD1-NZ 2.57Å; D46-K53 WeakPolarHBondContact OD2-CE 3.5Å; D46-K53 IonicContact OD2-NZ 2.65Å; D46-K53 PolarHBondContact OD2-NZ 3.05Å
47	L	83.9	Confident	87.8	Confident	15 Å²	15	28 Å²	28	8%	0.079	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-20.3	-175.1	-75.5	170.3	0	0	0	113.2	V27 N31 R32 L34 F262 K282 L284	V27-L47 HydrophobicContact CG1-CD1 4.33Å; N31-L47 WeakPolarHBondContact O-CD1 3.32Å; R32-L47 WeakPolarHBondContact O-CB 3.31Å; R32-L47 PolarHBondContact O-N 2.95Å; L34-L47 HydrophobicContact CB-CD2 3.93Å; L34-L47 HydrophobicContact CB-CG 4.17Å; L34-L47 HydrophobicContact CD2-CD2 4.38Å; L47-F262 HydrophobicContact CD1-CE2 3.94Å; L47-F262 HydrophobicContact CD1-CZ 3.65Å; L47-F262 HydrophobicContact CD2-CE1 3.78Å; L47-F262 HydrophobicContact CD2-CE2 4.36Å; L47-F262 HydrophobicContact CD2-CZ 3.39Å; L47-F262 HydrophobicContact CG-CZ 4.14Å; L47-K282 PolarHBondContact O-NZ 3.48Å; L47-L284 HydrophobicContact CD2-CD1 4.03Å
48	D	85	Confident	87.4	Confident	108 Å²	108	31 Å²	31	58%	0.578	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.7	-54.6	179.1	-68.2	-30.2	0	0	0	111.5	D46 K282	D46-D48 VanDerWaalsContact C-N 3.28Å; D46-D48 PolarHBondContact O-N 2.82Å; D48-K282 PolarHBondContact O-NZ 3.16Å
49	S	82.1	Confident	87	Confident	22 Å²	22	34.7 Å²	34.7	15%	0.154	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84	-19.7	178.5	63.4	0	0	0	0	114.1	E51	S49-E51 PolarHBondContact O-N 2.88Å; S49-E51 PolarHBondContact OG-N 3.01Å
50	S	84.3	Confident	86.8	Confident	7 Å²	7	41.7 Å²	41.7	5%	0.049	22%	0.217	C	C	.	.			trans	63.4	25.9	-172.6	-41	0	0	0	0	113.8	D46 K282 L284 T318	D46-S50 WeakPolarHBondContact O-CA 3.33Å; D46-S50 PolarHBondContact O-N 3.46Å; S50-K282 WeakPolarHBondContact OG-CE 3.24Å; S50-K282 PolarHBondContact OG-NZ 2.87Å; S50-L284 WeakPolarHBondContact OG-CD2 3.26Å; S50-T318 PolarHBondContact OG-O 3.43Å
51	E	86	Confident	86.6	Confident	47 Å²	47	45 Å²	45	22%	0.22	23%	0.234	C	C	.	.			trans	-100.5	149.5	178.8	-63.4	178.7	159.8	0	0	111.7	H14 R15 V45 D46 S49 K53	H14-E51 WeakPolarHBondContact CA-OE1 3.31Å; H14-E51 WeakPolarHBondContact CB-OE1 3.33Å; H14-E51 IonicContact CE1-OE1 3.23Å; H14-E51 IonicContact CG-OE1 2.84Å; H14-E51 IonicContact ND1-OE1 2.81Å; H14-E51 PolarHBondContact ND1-OE1 3.03Å; R15-E51 PolarHBondContact N-OE1 2.92Å; V45-E51 CarbonylContact C-O 3.58Å; V45-E51 VanDerWaalsContact CA-O 3.31Å; V45-E51 WeakPolarHBondContact CA-O 3.36Å; D46-E51 PolarHBondContact N-O 2.81Å; S49-E51 PolarHBondContact O-N 2.88Å; S49-E51 PolarHBondContact OG-N 3.01Å; E51-K53 PolarHBondContact O-N 3.44Å
52	V	87.7	Confident	86.3	Confident	30 Å²	30	45.7 Å²	45.7	18%	0.182	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	114.4	169.7	-179.5	0	0	0	0	108.9	L17 F19 K43 V45	L17-V52 HydrophobicContact CB-CG2 4.16Å; F19-V52 HydrophobicContact CB-CG2 3.88Å; K43-V52 HydrophobicContact CB-CG1 4.09Å; K43-V52 HydrophobicContact CB-CG2 4.46Å; K43-V52 HydrophobicContact CD-CG1 4.12Å; K43-V52 HydrophobicContact CD-CG2 4.18Å; K43-V52 HydrophobicContact CG-CG1 4.46Å; V45-V52 HydrophobicContact CG2-CG2 4.13Å
53	K	85.9	Confident	86.1	Confident	93 Å²	93	47.3 Å²	47.3	40%	0.404	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	-48.4	176.9	-79.7	-176.9	163.5	161.4	0	112.2	V44 D46 E51	V44-K53 PolarHBondContact O-N 3.44Å; D46-K53 HydrophobicContact CB-CD 3.98Å; D46-K53 HydrophobicContact CB-CG 4.12Å; D46-K53 IonicContact OD1-NZ 3.7Å; D46-K53 PolarHBondContact OD1-NZ 2.57Å; D46-K53 WeakPolarHBondContact OD2-CE 3.5Å; D46-K53 IonicContact OD2-NZ 2.65Å; D46-K53 PolarHBondContact OD2-NZ 3.05Å; E51-K53 PolarHBondContact O-N 3.44Å
54	Y	87.6	Confident	85.9	Confident	31 Å²	31	51.6 Å²	51.6	12%	0.122	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.7	159	178.5	60	-86.4	0	0	0	110.8	V44 I56 D94 A96	V44-Y54 HydrophobicContact CB-CD1 4.23Å; V44-Y54 HydrophobicContact CB-CD2 4.32Å; V44-Y54 HydrophobicContact CB-CE1 3.93Å; V44-Y54 HydrophobicContact CB-CE2 4.07Å; V44-Y54 HydrophobicContact CB-CG 4.4Å; V44-Y54 HydrophobicContact CG1-CE1 3.85Å; V44-Y54 HydrophobicContact CG2-CD2 3.97Å; V44-Y54 HydrophobicContact CG2-CE1 4.23Å; V44-Y54 HydrophobicContact CG2-CE2 3.49Å; V44-Y54 VanDerWaalsContact CG2-CE2 3.49Å; V44-Y54 PolarHBondContact N-O 3.19Å; Y54-I56 HydrophobicContact CD2-CG1 3.91Å; Y54-I56 HydrophobicContact CE2-CD1 3.9Å; Y54-I56 HydrophobicContact CE2-CG1 3.73Å; Y54-D94 HydrophobicContact CD1-CB 3.92Å; Y54-D94 WeakPolarHBondContact CD1-O 3.05Å; Y54-D94 HydrophobicContact CE1-CB 3.79Å; Y54-A96 HydrophobicContact CE2-CB 4.23Å
55	T	89	Confident	85.9	Confident	59 Å²	59	52.1 Å²	52.1	36%	0.362	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	136.4	177.8	-58.5	0	0	0	0	109.1	V41 K43	V41-T55 HydrophobicContact CB-CG2 3.56Å; V41-T55 HydrophobicContact CG1-CG2 4Å; V41-T55 HydrophobicContact CG2-CG2 3.54Å; K43-T55 HydrophobicContact CG-CG2 4.38Å
56	I	89	Confident	85.8	Confident	4 Å²	4	54 Å²	54	2%	0.021	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	119.2	178.4	-53.2	175.2	0	0	0	108.1	F35 I42 V44 Y54 L77 W89 L91 A96	F35-I56 HydrophobicContact CD1-CD1 4.29Å; F35-I56 HydrophobicContact CE1-CD1 4.16Å; I42-I56 HydrophobicContact CB-CB 4.22Å; I42-I56 HydrophobicContact CG2-CD1 4.43Å; I42-I56 PolarHBondContact N-O 2.79Å; I42-I56 PolarHBondContact O-N 2.85Å; V44-I56 HydrophobicContact CG2-CD1 3.76Å; V44-I56 HydrophobicContact CG2-CG1 4.13Å; Y54-I56 HydrophobicContact CD2-CG1 3.91Å; Y54-I56 HydrophobicContact CE2-CD1 3.9Å; Y54-I56 HydrophobicContact CE2-CG1 3.73Å; I56-L77 HydrophobicContact CD1-CD2 3.58Å; I56-L77 HydrophobicContact CG2-CD2 4.47Å; I56-W89 HydrophobicContact CG2-CD2 3.42Å; I56-W89 VanDerWaalsContact CG2-CD2 3.42Å; I56-W89 HydrophobicContact CG2-CE3 3.54Å; I56-W89 HydrophobicContact CG2-CG 3.94Å; I56-W89 HydrophobicContact CG2-CH2 3.94Å; I56-W89 HydrophobicContact CG2-CZ2 3.86Å; I56-W89 HydrophobicContact CG2-CZ3 3.79Å; I56-L91 HydrophobicContact CD1-CD2 3.73Å; I56-A96 HydrophobicContact CB-CB 4.38Å; I56-A96 HydrophobicContact CD1-CB 4.09Å; I56-A96 HydrophobicContact CG1-CB 3.74Å; I56-A96 HydrophobicContact CG2-CB 4.03Å
57	G	86.1	Confident	85.9	Confident	26 Å²	26	53 Å²	53	27%	0.268	28%	0.278	S	S	.	.	S	Bend	trans	101.2	176.4	-172.4	0	0	0	0	0	111.9	D62	G57-D62 WeakPolarHBondContact CA-OD2 3.36Å
58	D	83.4	Confident	86.3	Confident	66 Å²	66	52.5 Å²	52.5	35%	0.353	28%	0.276	S	S	.	.			trans	-113.6	118.6	-179.3	-171.6	-20.2	0	0	0	109.9	E60 N61 D62	D58-E60 VanDerWaalsContact C-N 3.25Å; D58-E60 PolarHBondContact O-N 2.97Å; D58-E60 PolarHBondContact OD1-N 2.74Å; D58-N61 HydrophobicContact CB-CB 4.23Å; D58-N61 PolarHBondContact OD2-ND2 2.88Å; D58-D62 PolarHBondContact N-OD2 2.78Å; D58-D62 VanDerWaalsContact O-CB 3.25Å; D58-D62 WeakPolarHBondContact O-CB 3.26Å; D58-D62 PolarHBondContact O-N 3.37Å
59	E	80.4	Confident	86.5	Confident	99 Å²	99	48.4 Å²	48.4	46%	0.463	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-32.6	-175.5	-71.2	-173	173.9	0	0	112.5	N40 V41 K43	N40-E59 PolarHBondContact ND2-O 3.39Å; V41-E59 HydrophobicContact CB-CG 4.15Å; V41-E59 HydrophobicContact CG1-CB 4.23Å; V41-E59 HydrophobicContact CG1-CG 3.51Å; V41-E59 HydrophobicContact CG2-CG 3.54Å; K43-E59 VanDerWaalsContact CE-OE1 3.25Å; K43-E59 WeakPolarHBondContact CE-OE1 3.39Å; K43-E59 IonicContact NZ-OE1 3.21Å; K43-E59 PolarHBondContact NZ-OE1 3.03Å
60	E	81.1	Confident	86.8	Confident	176 Å²	176	48.3 Å²	48.3	82%	0.822	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.6	-39.7	-176.2	-63.6	-173	164.7	0	0	113	D58	D58-E60 VanDerWaalsContact C-N 3.25Å; D58-E60 PolarHBondContact O-N 2.97Å; D58-E60 PolarHBondContact OD1-N 2.74Å
61	N	84.1	Confident	86.9	Confident	121 Å²	121	48.8 Å²	48.8	65%	0.647	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.2	-26.6	-169.1	-68.1	-52.7	0	0	0	113.9	D58	D58-N61 HydrophobicContact CB-CB 4.23Å; D58-N61 PolarHBondContact OD2-ND2 2.88Å
62	D	85.6	Confident	86.5	Confident	17 Å²	17	48.2 Å²	48.2	9%	0.091	26%	0.258	C	S	.	.	S	Bend	trans	-82.7	143.3	-174.5	-73.3	-30	0	0	0	112.7	N40 G57 D58 R87	N40-D62 VanDerWaalsContact CB-O 3.32Å; N40-D62 WeakPolarHBondContact CB-O 3.37Å; N40-D62 VanDerWaalsContact CG-O 3.28Å; N40-D62 PolarHBondContact ND2-O 2.94Å; N40-D62 VanDerWaalsContact ND2-O 3.08Å; G57-D62 WeakPolarHBondContact CA-OD2 3.36Å; D58-D62 PolarHBondContact N-OD2 2.78Å; D58-D62 VanDerWaalsContact O-CB 3.25Å; D58-D62 WeakPolarHBondContact O-CB 3.26Å; D58-D62 PolarHBondContact O-N 3.37Å; D62-R87 IonicContact OD1-CZ 2.75Å; D62-R87 IonicContact OD1-NH1 3.4Å; D62-R87 PolarHBondContact OD1-NH1 2.93Å; D62-R87 IonicContact OD1-NH2 2.68Å; D62-R87 PolarHBondContact OD1-NH2 2.82Å; D62-R87 IonicContact OD2-CZ 2.88Å; D62-R87 IonicContact OD2-NH1 3.13Å; D62-R87 PolarHBondContact OD2-NH1 3.41Å
63	P	87.1	Confident	86.1	Confident	35 Å²	35	51.8 Å²	51.8	23%	0.227	28%	0.276	C	S	.	.	P	Polyproline II helix	trans	-69.1	157.8	173.3	27.6	-33.5	0	0	0	111.5	V65 H81	P63-V65 PolarHBondContact O-N 2.65Å; P63-H81 HydrophobicContact CB-CB 4.23Å; P63-H81 HydrophobicContact CG-CB 3.68Å; P63-H81 PolarHBondContact O-ND1 2.97Å
64	Q	87	Confident	85.7	Confident	106 Å²	106	48 Å²	48	50%	0.495	26%	0.264	S	S	.	.	P	Polyproline II helix	trans	-53.7	133.3	-179.8	-168.3	174.6	3	0	0	112.8	N40 H81 E82	N40-Q64 WeakPolarHBondContact OD1-CA 3.48Å; N40-Q64 PolarHBondContact OD1-N 3.27Å; Q64-H81 CarbonylContact O-C 3.53Å; Q64-H81 VanDerWaalsContact O-CA 3.27Å; Q64-H81 WeakPolarHBondContact O-CA 3.31Å; Q64-E82 PolarHBondContact O-N 3.01Å
65	V	90.8	Very high	85.6	Confident	12 Å²	12	55 Å²	55	7%	0.073	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	123.8	177.4	175.9	0	0	0	0	108.7	T37 N40 P63 V79	T37-V65 HydrophobicContact CG2-CB 4.39Å; T37-V65 HydrophobicContact CG2-CG1 3.73Å; N40-V65 VanDerWaalsContact O-CG2 3.28Å; N40-V65 WeakPolarHBondContact O-CG2 3.34Å; P63-V65 PolarHBondContact O-N 2.65Å; V65-V79 HydrophobicContact CB-CG1 4.31Å; V65-V79 HydrophobicContact CG1-CG1 3.67Å; V65-V79 HydrophobicContact CG2-CG1 3.69Å
66	T	88.8	Confident	85.5	Confident	38 Å²	38	54.5 Å²	54.5	23%	0.233	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	-44.5	177.6	60.8	0	0	0	0	111.5	A80 E82 P109 I110	T66-A80 PolarHBondContact N-O 3.43Å; T66-A80 PolarHBondContact OG1-O 3.27Å; T66-E82 HydrophobicContact CG2-CB 4.11Å; T66-P109 HydrophobicContact CG2-CB 4.44Å; T66-I110 WeakPolarHBondContact CB-O 3.46Å; T66-I110 PolarHBondContact OG1-O 2.91Å
67	C	89.1	Confident	85.6	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.1	161.7	175.9	61.5	0	0	0	0	110.7	A80	C67-A80 WeakPolarHBondContact O-CB 3.32Å; C67-A80 PolarHBondContact O-N 2.84Å
68	F	92.6	Very high	85.8	Confident	6 Å²	6	53.1 Å²	53.1	3%	0.026	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	163.9	171	70.9	-98.6	0	0	0	110.5	S24 A26 F35 T37 I42 L77 I78 V79	S24-F68 WeakPolarHBondContact O-CE1 3.18Å; S24-F68 WeakPolarHBondContact O-CZ 3.43Å; A26-F68 HydrophobicContact CB-CE2 3.65Å; A26-F68 HydrophobicContact CB-CZ 4.32Å; F35-F68 HydrophobicContact CB-CE2 3.82Å; F35-F68 HydrophobicContact CB-CZ 3.77Å; F35-F68 WeakPolarHBondContact O-CZ 3.31Å; T37-F68 HydrophobicContact CG2-CD1 3.54Å; T37-F68 HydrophobicContact CG2-CE1 3.58Å; I42-F68 HydrophobicContact CD1-CB 3.79Å; I42-F68 HydrophobicContact CD1-CD1 3.58Å; I42-F68 HydrophobicContact CD1-CD2 4.39Å; I42-F68 HydrophobicContact CD1-CE1 4.21Å; I42-F68 HydrophobicContact CD1-CG 3.68Å; I42-F68 HydrophobicContact CG1-CD1 3.99Å; I42-F68 HydrophobicContact CG1-CE1 4.29Å; I42-F68 HydrophobicContact CG2-CE1 4.41Å; F68-L77 HydrophobicContact CB-CD1 4.33Å; F68-L77 HydrophobicContact CD2-CD1 3.49Å; F68-L77 VanDerWaalsContact CD2-CD1 3.49Å; F68-L77 HydrophobicContact CE2-CD1 4.13Å; F68-L77 HydrophobicContact CG-CD1 4.21Å; F68-I78 CarbonylContact C-O 3.53Å; F68-I78 WeakPolarHBondContact CA-O 3.33Å; F68-I78 WeakPolarHBondContact CB-O 3.46Å; F68-V79 HydrophobicContact CB-CG2 4.31Å
69	S	89	Confident	86.3	Confident	21 Å²	21	50.1 Å²	50.1	15%	0.147	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	146.3	167.9	-168	0	0	0	0	110	I78 Y115	S69-I78 PolarHBondContact N-O 3.45Å; S69-I78 PolarHBondContact O-N 2.89Å; S69-Y115 WeakPolarHBondContact O-CD2 3.27Å; S69-Y115 VanDerWaalsContact O-CE2 3.24Å; S69-Y115 WeakPolarHBondContact O-CE2 3.47Å; S69-Y115 PolarHBondContact OG-N 2.78Å
70	L	88.5	Confident	86.8	Confident	20 Å²	20	45.4 Å²	45.4	11%	0.105	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	143.8	174.6	-169.6	69.5	0	0	0	110.1	A26 F35 L77 L91 Y115	A26-L70 HydrophobicContact CB-CB 4.22Å; F35-L70 HydrophobicContact CD2-CD2 4.21Å; F35-L70 HydrophobicContact CE2-CD1 4.4Å; F35-L70 HydrophobicContact CE2-CD2 3.94Å; F35-L70 HydrophobicContact CZ-CD1 4.4Å; L70-L77 HydrophobicContact CB-CD1 4.49Å; L70-L77 HydrophobicContact CD1-CB 4.18Å; L70-L77 HydrophobicContact CD1-CD1 4.13Å; L70-L91 HydrophobicContact CD1-CD1 3.67Å; L70-Y115 WeakPolarHBondContact O-CD2 3.31Å
71	D	85.6	Confident	87.3	Confident	17 Å²	17	37.2 Å²	37.2	9%	0.091	20%	0.195	C	C	.	.			trans	-64.9	157	169.9	175.3	41.2	0	0	0	111.3	N73 G74 L76 Y115	D71-N73 PolarHBondContact O-N 3.41Å; D71-N73 VanDerWaalsContact O-N 3.12Å; D71-N73 PolarHBondContact OD2-N 3.21Å; D71-G74 PolarHBondContact O-N 3.18Å; D71-L76 HydrophobicContact CB-CB 4.1Å; D71-L76 WeakPolarHBondContact CB-O 3.4Å; D71-L76 PolarHBondContact N-O 3.34Å; D71-Y115 HydrophobicContact CB-CD1 4.4Å; D71-Y115 HydrophobicContact CB-CE1 4.17Å; D71-Y115 HydrophobicContact CB-CE2 4.36Å
72	A	78	Confident	87.4	Confident	35 Å²	35	36.9 Å²	36.9	29%	0.289	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54	-32.9	178	0	0	0	0	0	112.9	K256	A72-K256 WeakPolarHBondContact O-CE 3.26Å; A72-K256 PolarHBondContact O-NZ 3.33Å
73	N	78.4	Confident	87.5	Confident	106 Å²	106	39.5 Å²	39.5	57%	0.567	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.7	-5.8	179.7	-63.8	-36.4	0	0	0	114.1	D71 R75	D71-N73 PolarHBondContact O-N 3.41Å; D71-N73 VanDerWaalsContact O-N 3.12Å; D71-N73 PolarHBondContact OD2-N 3.21Å; N73-R75 VanDerWaalsContact C-N 3.26Å; N73-R75 HydrophobicContact CB-CG 4.37Å; N73-R75 PolarHBondContact O-N 3.26Å
74	G	78.7	Confident	87.5	Confident	13 Å²	13	39 Å²	39	13%	0.134	20%	0.199	C	C	.	.	S	Bend	trans	72.6	12.2	-177.4	0	0	0	0	0	115.5	D71 L91	D71-G74 PolarHBondContact O-N 3.18Å; G74-L91 WeakPolarHBondContact O-CD1 3.39Å
75	R	84.9	Confident	87.6	Confident	178 Å²	178	35.2 Å²	35.2	67%	0.672	18%	0.182	S	C	*	.	S	Bend	trans	-92.2	-30.2	-178.4	-66.7	-175.6	-179.1	179.4	-0.9	114	N73 L91	N73-R75 VanDerWaalsContact C-N 3.26Å; N73-R75 HydrophobicContact CB-CG 4.37Å; N73-R75 PolarHBondContact O-N 3.26Å; R75-L91 PolarHBondContact O-N 3.02Å
76	L	88	Confident	87.6	Confident	49 Å²	49	34.6 Å²	34.6	26%	0.257	18%	0.178	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	136.5	-179.1	-67.2	170.7	0	0	0	109.5	D71 W89 Y115 M138	D71-L76 HydrophobicContact CB-CB 4.1Å; D71-L76 WeakPolarHBondContact CB-O 3.4Å; D71-L76 PolarHBondContact N-O 3.34Å; L76-W89 WeakPolarHBondContact CA-O 3.26Å; L76-Y115 WeakPolarHBondContact CB-OH 3.31Å; L76-M138 HydrophobicContact CD1-CG 4.19Å
77	L	90.8	Very high	87.7	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	128.5	178.8	174.1	73.2	0	0	0	108.5	F35 I42 I56 F68 L70 V79 S88 W89 L91	F35-L77 HydrophobicContact CD1-CD2 4.49Å; I42-L77 HydrophobicContact CD1-CD2 4Å; I56-L77 HydrophobicContact CD1-CD2 3.58Å; I56-L77 HydrophobicContact CG2-CD2 4.47Å; F68-L77 HydrophobicContact CB-CD1 4.33Å; F68-L77 HydrophobicContact CD2-CD1 3.49Å; F68-L77 VanDerWaalsContact CD2-CD1 3.49Å; F68-L77 HydrophobicContact CE2-CD1 4.13Å; F68-L77 HydrophobicContact CG-CD1 4.21Å; L70-L77 HydrophobicContact CB-CD1 4.49Å; L70-L77 HydrophobicContact CD1-CB 4.18Å; L70-L77 HydrophobicContact CD1-CD1 4.13Å; L77-V79 HydrophobicContact CD2-CG2 4.18Å; L77-V79 HydrophobicContact CG-CG2 4.13Å; L77-S88 CarbonylContact O-C 3.59Å; L77-S88 WeakPolarHBondContact O-CA 3.41Å; L77-W89 HydrophobicContact CB-CB 4.26Å; L77-W89 PolarHBondContact N-O 3.06Å; L77-W89 PolarHBondContact O-N 2.75Å; L77-L91 HydrophobicContact CB-CD1 4Å; L77-L91 HydrophobicContact CB-CG 4.32Å
78	I	91	Very high	87.8	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	128.7	173.2	-55.7	163.8	0	0	0	108.9	F68 S69 L86 R87 L113 Y115 F124 M138	F68-I78 CarbonylContact C-O 3.53Å; F68-I78 WeakPolarHBondContact CA-O 3.33Å; F68-I78 WeakPolarHBondContact CB-O 3.46Å; S69-I78 PolarHBondContact N-O 3.45Å; S69-I78 PolarHBondContact O-N 2.89Å; I78-L86 HydrophobicContact CG2-CD2 3.87Å; I78-R87 WeakPolarHBondContact CA-O 3.19Å; I78-L113 HydrophobicContact CB-CD1 4.05Å; I78-L113 HydrophobicContact CB-CD2 4.1Å; I78-L113 HydrophobicContact CD1-CD2 4.3Å; I78-L113 HydrophobicContact CG2-CD1 3.52Å; I78-L113 HydrophobicContact CG2-CD2 4.42Å; I78-Y115 HydrophobicContact CB-CE2 4.21Å; I78-Y115 HydrophobicContact CD1-CD2 4.32Å; I78-Y115 HydrophobicContact CD1-CE1 3.88Å; I78-Y115 HydrophobicContact CD1-CE2 3.5Å; I78-Y115 WeakPolarHBondContact CD1-OH 3.32Å; I78-Y115 HydrophobicContact CG1-CE2 3.63Å; I78-Y115 WeakPolarHBondContact CG1-OH 3.41Å; I78-F124 HydrophobicContact CD1-CB 3.99Å; I78-F124 HydrophobicContact CD1-CD1 3.32Å; I78-F124 HydrophobicContact CD1-CD2 3.64Å; I78-F124 HydrophobicContact CD1-CE1 3.58Å; I78-F124 HydrophobicContact CD1-CE2 3.89Å; I78-F124 HydrophobicContact CD1-CG 3.35Å; I78-F124 HydrophobicContact CD1-CZ 3.88Å; I78-M138 HydrophobicContact CD1-CE 3.27Å; I78-M138 HydrophobicContact CG1-CE 3.63Å
79	V	92.2	Very high	87.6	Confident	4 Å²	4	35.1 Å²	35.1	2%	0.024	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	128.6	179	-172.3	0	0	0	0	108.7	I42 V65 F68 L77 L86 R87	I42-V79 HydrophobicContact CD1-CB 4.25Å; I42-V79 HydrophobicContact CD1-CG1 3.96Å; I42-V79 HydrophobicContact CD1-CG2 3.32Å; V65-V79 HydrophobicContact CB-CG1 4.31Å; V65-V79 HydrophobicContact CG1-CG1 3.67Å; V65-V79 HydrophobicContact CG2-CG1 3.69Å; F68-V79 HydrophobicContact CB-CG2 4.31Å; L77-V79 HydrophobicContact CD2-CG2 4.18Å; L77-V79 HydrophobicContact CG-CG2 4.13Å; V79-L86 CarbonylContact O-C 3.59Å; V79-L86 WeakPolarHBondContact O-CA 3.05Å; V79-R87 PolarHBondContact N-O 2.62Å; V79-R87 PolarHBondContact O-N 3.37Å
80	A	91.3	Very high	87.6	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	134.3	170.9	0	0	0	0	0	110	T66 C67 L86 I110 L113	T66-A80 PolarHBondContact N-O 3.43Å; T66-A80 PolarHBondContact OG1-O 3.27Å; C67-A80 WeakPolarHBondContact O-CB 3.32Å; C67-A80 PolarHBondContact O-N 2.84Å; A80-L86 HydrophobicContact CB-CD2 3.68Å; A80-I110 HydrophobicContact CB-CB 3.96Å; A80-I110 HydrophobicContact CB-CD1 3.94Å; A80-I110 HydrophobicContact CB-CG2 4.02Å; A80-L113 HydrophobicContact CB-CD1 4.33Å
81	H	90.9	Very high	87.5	Confident	4 Å²	4	36.5 Å²	36.5	2%	0.019	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	160.8	177.4	-59.5	-94.1	0	0	0	111.5	P63 Q64 N83 L84 L85	P63-H81 HydrophobicContact CB-CB 4.23Å; P63-H81 HydrophobicContact CG-CB 3.68Å; P63-H81 PolarHBondContact O-ND1 2.97Å; Q64-H81 CarbonylContact O-C 3.53Å; Q64-H81 VanDerWaalsContact O-CA 3.27Å; Q64-H81 WeakPolarHBondContact O-CA 3.31Å; H81-N83 WeakPolarHBondContact CB-OD1 3.24Å; H81-N83 PolarHBondContact O-N 3.38Å; H81-L84 PolarHBondContact O-N 3.36Å; H81-L84 VanDerWaalsContact O-N 3.11Å; H81-L85 HydrophobicContact CB-CB 4.3Å; H81-L85 PolarHBondContact N-O 2.87Å
82	E	87.4	Confident	87.2	Confident	113 Å²	113	40.6 Å²	40.6	53%	0.528	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-35	-176.9	-167.9	-172.3	173.6	0	0	113	Q64 T66 L84	Q64-E82 PolarHBondContact O-N 3.01Å; T66-E82 HydrophobicContact CG2-CB 4.11Å; E82-L84 PolarHBondContact O-N 2.87Å
83	N	87.7	Confident	87	Confident	73 Å²	73	45.6 Å²	45.6	39%	0.39	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.9	17.8	179.4	69	-7.5	0	0	0	114.6	H81 L85 K103	H81-N83 WeakPolarHBondContact CB-OD1 3.24Å; H81-N83 PolarHBondContact O-N 3.38Å; N83-L85 PolarHBondContact O-N 3.24Å; N83-L85 WeakPolarHBondContact OD1-CB 3.25Å; N83-L85 PolarHBondContact OD1-N 3.39Å; N83-K103 WeakPolarHBondContact O-CE 3.5Å
84	L	87.2	Confident	86.8	Confident	23 Å²	23	44.1 Å²	44.1	12%	0.12	22%	0.221	C	C	.	.	S	Bend	trans	65.8	18.7	-176.9	-47.3	172.9	0	0	0	114	H81 E82 K103 V104 G106 G108	H81-L84 PolarHBondContact O-N 3.36Å; H81-L84 VanDerWaalsContact O-N 3.11Å; E82-L84 PolarHBondContact O-N 2.87Å; L84-K103 HydrophobicContact CB-CG 4.33Å; L84-K103 WeakPolarHBondContact O-CA 3.38Å; L84-V104 WeakPolarHBondContact CB-O 3.26Å; L84-V104 PolarHBondContact O-N 2.9Å; L84-G106 VanDerWaalsContact CD1-O 3.3Å; L84-G106 WeakPolarHBondContact CD1-O 3.45Å; L84-G108 WeakPolarHBondContact CD2-O 3.36Å
85	L	89.6	Confident	86.9	Confident	27 Å²	27	47.9 Å²	47.9	14%	0.141	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	131.6	174.9	-166.1	73.1	0	0	0	110.2	H81 N83 R87 S101	H81-L85 HydrophobicContact CB-CB 4.3Å; H81-L85 PolarHBondContact N-O 2.87Å; N83-L85 PolarHBondContact O-N 3.24Å; N83-L85 WeakPolarHBondContact OD1-CB 3.25Å; N83-L85 PolarHBondContact OD1-N 3.39Å; L85-R87 HydrophobicContact CD2-CG 4.06Å; L85-R87 VanDerWaalsContact CD2-NE 3.33Å; L85-R87 HydrophobicContact CG-CG 4.28Å; L85-S101 WeakPolarHBondContact CD1-OG 3.32Å
86	L	90.2	Very high	86.8	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	130.2	166.6	-73.6	172.8	0	0	0	109.1	I78 V79 A80 S101 W102 V104 I110 L113 F124 T126 W136	I78-L86 HydrophobicContact CG2-CD2 3.87Å; V79-L86 CarbonylContact O-C 3.59Å; V79-L86 WeakPolarHBondContact O-CA 3.05Å; A80-L86 HydrophobicContact CB-CD2 3.68Å; L86-S101 WeakPolarHBondContact O-CA 3.24Å; L86-W102 HydrophobicContact CB-CD2 4.18Å; L86-W102 HydrophobicContact CB-CZ2 3.88Å; L86-W102 HydrophobicContact CD1-CZ2 4.2Å; L86-W102 PolarHBondContact N-O 2.58Å; L86-W102 PolarHBondContact O-N 2.95Å; L86-V104 HydrophobicContact CD1-CG2 3.23Å; L86-V104 HydrophobicContact CG-CG2 3.61Å; L86-I110 HydrophobicContact CD1-CD1 4.42Å; L86-I110 HydrophobicContact CD2-CD1 3.79Å; L86-I110 HydrophobicContact CG-CD1 3.99Å; L86-L113 HydrophobicContact CD2-CD1 3.64Å; L86-F124 HydrophobicContact CD1-CE2 4.06Å; L86-F124 HydrophobicContact CD1-CZ 4.35Å; L86-T126 HydrophobicContact CD1-CG2 4.09Å; L86-T126 HydrophobicContact CD2-CG2 4.38Å; L86-W136 HydrophobicContact CD1-CZ2 4.23Å
87	R	90.6	Very high	86.7	Confident	34 Å²	34	42.3 Å²	42.3	13%	0.128	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	127.5	172.8	-65.3	-173.6	-178	174.1	5.6	109.7	D62 I78 V79 L85 K100	D62-R87 IonicContact OD1-CZ 2.75Å; D62-R87 IonicContact OD1-NH1 3.4Å; D62-R87 PolarHBondContact OD1-NH1 2.93Å; D62-R87 IonicContact OD1-NH2 2.68Å; D62-R87 PolarHBondContact OD1-NH2 2.82Å; D62-R87 IonicContact OD2-CZ 2.88Å; D62-R87 IonicContact OD2-NH1 3.13Å; D62-R87 PolarHBondContact OD2-NH1 3.41Å; I78-R87 WeakPolarHBondContact CA-O 3.19Å; V79-R87 PolarHBondContact N-O 2.62Å; V79-R87 PolarHBondContact O-N 3.37Å; L85-R87 HydrophobicContact CD2-CG 4.06Å; L85-R87 VanDerWaalsContact CD2-NE 3.33Å; L85-R87 HydrophobicContact CG-CG 4.28Å; R87-K100 WeakPolarHBondContact CA-O 3.07Å
88	S	90.6	Very high	86.4	Confident	1 Å²	1	46.2 Å²	46.2	1%	0.007	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	134.9	168	179.7	0	0	0	0	109.2	L77 S99 K100	L77-S88 CarbonylContact O-C 3.59Å; L77-S88 WeakPolarHBondContact O-CA 3.41Å; S88-S99 VanDerWaalsContact C-OG 3.26Å; S88-S99 WeakPolarHBondContact CB-OG 3.4Å; S88-S99 PolarHBondContact O-N 2.83Å; S88-S99 PolarHBondContact O-OG 3.08Å; S88-S99 PolarHBondContact OG-OG 3.41Å; S88-K100 PolarHBondContact N-O 2.85Å; S88-K100 PolarHBondContact O-N 2.56Å
89	W	90.1	Very high	86	Confident	19 Å²	19	49.2 Å²	49.2	7%	0.072	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	131.5	179	-64.4	81.9	0	0	0	108.7	I56 L76 L77 A96 V97 I98	I56-W89 HydrophobicContact CG2-CD2 3.42Å; I56-W89 VanDerWaalsContact CG2-CD2 3.42Å; I56-W89 HydrophobicContact CG2-CE3 3.54Å; I56-W89 HydrophobicContact CG2-CG 3.94Å; I56-W89 HydrophobicContact CG2-CH2 3.94Å; I56-W89 HydrophobicContact CG2-CZ2 3.86Å; I56-W89 HydrophobicContact CG2-CZ3 3.79Å; L76-W89 WeakPolarHBondContact CA-O 3.26Å; L77-W89 HydrophobicContact CB-CB 4.26Å; L77-W89 PolarHBondContact N-O 3.06Å; L77-W89 PolarHBondContact O-N 2.75Å; W89-A96 HydrophobicContact CE3-CB 3.92Å; W89-A96 HydrophobicContact CZ3-CB 4.35Å; W89-V97 CarbonylContact C-O 3.56Å; W89-V97 WeakPolarHBondContact CA-O 3.48Å; W89-I98 HydrophobicContact CD2-CG1 3.98Å; W89-I98 HydrophobicContact CE3-CB 4.45Å; W89-I98 HydrophobicContact CE3-CG1 3.64Å; W89-I98 HydrophobicContact CH2-CD1 3.68Å; W89-I98 HydrophobicContact CH2-CG1 3.3Å; W89-I98 HydrophobicContact CZ2-CD1 3.99Å; W89-I98 HydrophobicContact CZ2-CG1 3.64Å; W89-I98 HydrophobicContact CZ3-CB 4.47Å; W89-I98 HydrophobicContact CZ3-CD1 4.13Å; W89-I98 HydrophobicContact CZ3-CG1 3.3Å
90	S	88.3	Confident	85.6	Confident	49 Å²	49	53 Å²	53	34%	0.343	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	126.7	167.5	-170.4	0	0	0	0	108.6	A96 V97	S90-A96 WeakPolarHBondContact O-CA 3.44Å; S90-V97 PolarHBondContact N-O 2.93Å; S90-V97 PolarHBondContact O-N 2.88Å
91	L	85.8	Confident	85.4	Confident	21 Å²	21	55.9 Å²	55.9	11%	0.11	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	107.4	179.2	-57.9	173.9	0	0	0	108.4	F35 I56 L70 G74 R75 L77 A96	F35-L91 HydrophobicContact CE1-CD1 3.76Å; F35-L91 HydrophobicContact CE1-CD2 4.41Å; F35-L91 HydrophobicContact CZ-CD1 3.74Å; I56-L91 HydrophobicContact CD1-CD2 3.73Å; L70-L91 HydrophobicContact CD1-CD1 3.67Å; G74-L91 WeakPolarHBondContact O-CD1 3.39Å; R75-L91 PolarHBondContact O-N 3.02Å; L77-L91 HydrophobicContact CB-CD1 4Å; L77-L91 HydrophobicContact CB-CG 4.32Å; L91-A96 HydrophobicContact CD2-CB 3.9Å
92	D	79.8	Confident	85.3	Confident	103 Å²	103	57.7 Å²	57.7	55%	0.551	32%	0.315	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-130.9	125.2	175.6	-169.4	15.9	0	0	0	110.7	D94 V95	D92-D94 VanDerWaalsContact C-N 3.32Å; D92-D94 PolarHBondContact O-N 2.85Å; D92-D94 VanDerWaalsContact O-N 3.11Å; D92-V95 PolarHBondContact N-O 2.97Å; D92-V95 WeakPolarHBondContact O-CA 3.43Å; D92-V95 PolarHBondContact O-N 3.22Å; D92-V95 VanDerWaalsContact O-O 3.05Å
93	N	74	Confident	85.3	Confident	141 Å²	141	59.3 Å²	59.3	75%	0.754	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	38.2	54.1	176.4	-63.5	-38.8	0	0	0	115.2	V95	N93-V95 PolarHBondContact O-N 2.92Å
94	D	74.6	Confident	85.1	Confident	75 Å²	75	56.3 Å²	56.3	40%	0.401	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.2	5.2	-179.9	-57.5	-38.1	0	0	0	116	K33 Y54 D92	K33-D94 VanDerWaalsContact CE-OD1 3.23Å; K33-D94 WeakPolarHBondContact CE-OD1 3.45Å; K33-D94 IonicContact NZ-OD1 3.48Å; K33-D94 PolarHBondContact NZ-OD1 3.4Å; Y54-D94 HydrophobicContact CD1-CB 3.92Å; Y54-D94 WeakPolarHBondContact CD1-O 3.05Å; Y54-D94 HydrophobicContact CE1-CB 3.79Å; D92-D94 VanDerWaalsContact C-N 3.32Å; D92-D94 PolarHBondContact O-N 2.85Å; D92-D94 VanDerWaalsContact O-N 3.11Å
95	V	79.9	Confident	84.7	Confident	91 Å²	91	57.7 Å²	57.7	55%	0.552	33%	0.325	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.5	123.7	170.5	-174.6	0	0	0	0	109	D92 N93 V97	D92-V95 PolarHBondContact N-O 2.97Å; D92-V95 WeakPolarHBondContact O-CA 3.43Å; D92-V95 PolarHBondContact O-N 3.22Å; D92-V95 VanDerWaalsContact O-O 3.05Å; N93-V95 PolarHBondContact O-N 2.92Å; V95-V97 HydrophobicContact CG1-CG2 3.98Å
96	A	83.1	Confident	84	Confident	23 Å²	23	58.2 Å²	58.2	19%	0.19	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	117.5	172.2	0	0	0	0	0	109.4	Y54 I56 W89 S90 L91	Y54-A96 HydrophobicContact CE2-CB 4.23Å; I56-A96 HydrophobicContact CB-CB 4.38Å; I56-A96 HydrophobicContact CD1-CB 4.09Å; I56-A96 HydrophobicContact CG1-CB 3.74Å; I56-A96 HydrophobicContact CG2-CB 4.03Å; W89-A96 HydrophobicContact CE3-CB 3.92Å; W89-A96 HydrophobicContact CZ3-CB 4.35Å; S90-A96 WeakPolarHBondContact O-CA 3.44Å; L91-A96 HydrophobicContact CD2-CB 3.9Å
97	V	86.5	Confident	83.4	Confident	88 Å²	88	70 Å²	70	53%	0.533	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	131.7	177.2	-177.3	0	0	0	0	109.1	W89 S90 V95 S99	W89-V97 CarbonylContact C-O 3.56Å; W89-V97 WeakPolarHBondContact CA-O 3.48Å; S90-V97 PolarHBondContact N-O 2.93Å; S90-V97 PolarHBondContact O-N 2.88Å; V95-V97 HydrophobicContact CG1-CG2 3.98Å; V97-S99 PolarHBondContact O-N 2.96Å; V97-S99 VanDerWaalsContact O-N 3.13Å
98	I	84.3	Confident	82.9	Confident	81 Å²	81	68.7 Å²	68.7	42%	0.415	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	115.4	172.1	-57.8	174.9	0	0	0	107.8	W89	W89-I98 HydrophobicContact CD2-CG1 3.98Å; W89-I98 HydrophobicContact CE3-CB 4.45Å; W89-I98 HydrophobicContact CE3-CG1 3.64Å; W89-I98 HydrophobicContact CH2-CD1 3.68Å; W89-I98 HydrophobicContact CH2-CG1 3.3Å; W89-I98 HydrophobicContact CZ2-CD1 3.99Å; W89-I98 HydrophobicContact CZ2-CG1 3.64Å; W89-I98 HydrophobicContact CZ3-CB 4.47Å; W89-I98 HydrophobicContact CZ3-CD1 4.13Å; W89-I98 HydrophobicContact CZ3-CG1 3.3Å
99	S	82.2	Confident	82.6	Confident	63 Å²	63	70.7 Å²	70.7	44%	0.441	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	-43.9	176.9	69.2	0	0	0	0	110.8	S88 V97	S88-S99 VanDerWaalsContact C-OG 3.26Å; S88-S99 WeakPolarHBondContact CB-OG 3.4Å; S88-S99 PolarHBondContact O-N 2.83Å; S88-S99 PolarHBondContact O-OG 3.08Å; S88-S99 PolarHBondContact OG-OG 3.41Å; V97-S99 PolarHBondContact O-N 2.96Å; V97-S99 VanDerWaalsContact O-N 3.13Å
100	K	84.2	Confident	82.5	Confident	84 Å²	84	69.9 Å²	69.9	37%	0.365	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.3	153.1	177.5	-161.6	173.2	-173.6	-177.6	0	111.8	R87 S88 W102	R87-K100 WeakPolarHBondContact CA-O 3.07Å; S88-K100 PolarHBondContact N-O 2.85Å; S88-K100 PolarHBondContact O-N 2.56Å; K100-W102 HydrophobicContact CB-CE3 4.03Å; K100-W102 HydrophobicContact CB-CZ3 3.89Å; K100-W102 HydrophobicContact CD-CE3 4.34Å; K100-W102 HydrophobicContact CG-CE3 3.98Å; K100-W102 HydrophobicContact CG-CZ3 4.33Å; K100-W102 WeakPolarHBondContact O-CZ3 3.43Å
101	S	87.1	Confident	82.3	Confident	60 Å²	60	73.2 Å²	73.2	42%	0.42	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	132.5	176.1	169.7	0	0	0	0	109.1	L85 L86	L85-S101 WeakPolarHBondContact CD1-OG 3.32Å; L86-S101 WeakPolarHBondContact O-CA 3.24Å
102	W	89.3	Confident	82.3	Confident	42 Å²	42	78.1 Å²	78.1	16%	0.159	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151	154	177.2	63.7	97	0	0	0	111.5	L86 K100 F124 W136	L86-W102 HydrophobicContact CB-CD2 4.18Å; L86-W102 HydrophobicContact CB-CZ2 3.88Å; L86-W102 HydrophobicContact CD1-CZ2 4.2Å; L86-W102 PolarHBondContact N-O 2.58Å; L86-W102 PolarHBondContact O-N 2.95Å; K100-W102 HydrophobicContact CB-CE3 4.03Å; K100-W102 HydrophobicContact CB-CZ3 3.89Å; K100-W102 HydrophobicContact CD-CE3 4.34Å; K100-W102 HydrophobicContact CG-CE3 3.98Å; K100-W102 HydrophobicContact CG-CZ3 4.33Å; K100-W102 WeakPolarHBondContact O-CZ3 3.43Å; W102-F124 HydrophobicContact CZ2-CE1 4.34Å; W102-F124 AromaticContact CZ2-CZ 3.77Å; W102-F124 HydrophobicContact CZ2-CZ 3.77Å; W102-W136 AromaticContact CD1-CH2 3.92Å; W102-W136 AromaticContact CD1-CZ3 3.74Å; W102-W136 AromaticContact NE1-CE3 3.82Å; W102-W136 AromaticContact NE1-CH2 3.84Å; W102-W136 AromaticContact NE1-CZ3 3.51Å
103	K	85.8	Confident	82.7	Confident	148 Å²	148	73.4 Å²	73.4	64%	0.643	39%	0.39	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98	134.4	-178.4	-166.3	170.4	-176	169.7	0	111.3	N83 L84	N83-K103 WeakPolarHBondContact O-CE 3.5Å; L84-K103 HydrophobicContact CB-CG 4.33Å; L84-K103 WeakPolarHBondContact O-CA 3.38Å
104	V	84.1	Confident	83.2	Confident	9 Å²	9	70.4 Å²	70.4	6%	0.055	38%	0.377	C	S	.	.	P	Polyproline II helix	trans	-82.5	124	172.1	-178.2	0	0	0	0	109.3	L84 L86 G106 I110 K134 W136	L84-V104 WeakPolarHBondContact CB-O 3.26Å; L84-V104 PolarHBondContact O-N 2.9Å; L86-V104 HydrophobicContact CD1-CG2 3.23Å; L86-V104 HydrophobicContact CG-CG2 3.61Å; V104-G106 PolarHBondContact O-N 3.01Å; V104-I110 HydrophobicContact CB-CD1 4.36Å; V104-I110 HydrophobicContact CG2-CD1 3.85Å; V104-K134 HydrophobicContact CG1-CD 3.93Å; V104-W136 HydrophobicContact CB-CZ2 4.26Å; V104-W136 HydrophobicContact CG1-CZ2 3.98Å; V104-W136 HydrophobicContact CG2-CH2 4.1Å; V104-W136 HydrophobicContact CG2-CZ2 3.6Å
105	G	78.2	Confident	83.7	Confident	52 Å²	52	67.4 Å²	67.4	54%	0.536	36%	0.36	S	S	.	.	P	Polyproline II helix	trans	-69.6	121.6	170.7	0	0	0	0	0	111.3	K134	G105-K134 WeakPolarHBondContact O-CE 3.46Å; G105-K134 PolarHBondContact O-NZ 3.14Å
106	G	75.7	Confident	83.6	Confident	39 Å²	39	64 Å²	64	40%	0.402	34%	0.344	S	S	.	.	S	Bend	trans	176.8	174.4	-178	0	0	0	0	0	111.4	L84 V104	L84-G106 VanDerWaalsContact CD1-O 3.3Å; L84-G106 WeakPolarHBondContact CD1-O 3.45Å; V104-G106 PolarHBondContact O-N 3.01Å
107	R	77.5	Confident	83.2	Confident	248 Å²	248	73 Å²	73	94%	0.936	37%	0.373	S	S	*	.	S	Bend	trans	-107.3	-17.1	176.2	-69.9	-168.4	-175.6	-169.9	1.9	113.7	D130	R107-D130 PolarHBondContact N-OD2 2.77Å
108	G	80.4	Confident	82.6	Confident	6 Å²	6	71.8 Å²	71.8	6%	0.062	38%	0.378	C	S	.	.	S	Bend	trans	-119	146.9	-176.4	0	0	0	0	0	113.5	L84 S129	L84-G108 WeakPolarHBondContact CD2-O 3.36Å; G108-S129 WeakPolarHBondContact CA-OG 3.27Å
109	P	84.8	Confident	81.8	Confident	43 Å²	43	71.9 Å²	71.9	28%	0.279	39%	0.391	S	S	.	.			trans	-58.7	151.5	176.6	24.6	-36.2	0	0	0	112.7	T66 Q111 A128 S129	T66-P109 HydrophobicContact CG2-CB 4.44Å; P109-Q111 PolarHBondContact O-N 2.87Å; P109-A128 WeakPolarHBondContact O-CA 3.3Å; P109-S129 VanDerWaalsContact CD-OG 3.24Å; P109-S129 WeakPolarHBondContact CD-OG 3.28Å; P109-S129 PolarHBondContact O-N 3.3Å
110	I	86.9	Confident	81.3	Confident	2 Å²	2	72.7 Å²	72.7	1%	0.01	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	116.2	177.9	-57.6	172	0	0	0	108.4	T66 A80 L86 V104 T126 G127	T66-I110 WeakPolarHBondContact CB-O 3.46Å; T66-I110 PolarHBondContact OG1-O 2.91Å; A80-I110 HydrophobicContact CB-CB 3.96Å; A80-I110 HydrophobicContact CB-CD1 3.94Å; A80-I110 HydrophobicContact CB-CG2 4.02Å; L86-I110 HydrophobicContact CD1-CD1 4.42Å; L86-I110 HydrophobicContact CD2-CD1 3.79Å; L86-I110 HydrophobicContact CG-CD1 3.99Å; V104-I110 HydrophobicContact CB-CD1 4.36Å; V104-I110 HydrophobicContact CG2-CD1 3.85Å; I110-T126 HydrophobicContact CG2-CG2 4.49Å; I110-G127 CarbonylContact C-O 3.56Å
111	Q	84.7	Confident	81	Confident	118 Å²	118	70.7 Å²	70.7	55%	0.551	38%	0.383	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.6	-32.7	-178.5	-69.4	-65.6	-27.7	0	0	112.3	P109 G127	P109-Q111 PolarHBondContact O-N 2.87Å; Q111-G127 PolarHBondContact N-O 2.73Å
112	R	85.1	Confident	80.6	Confident	124 Å²	124	71.5 Å²	71.5	47%	0.468	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	138.4	-178.7	-159.4	67.6	174.7	167.4	-1.6	111.7	V114 T126 G127	R112-V114 HydrophobicContact CG-CG2 4.19Å; R112-T126 WeakPolarHBondContact O-CA 3.36Å; R112-G127 PolarHBondContact N-O 2.9Å; R112-G127 VanDerWaalsContact N-O 3.15Å; R112-G127 PolarHBondContact O-N 2.88Å
113	L	87.8	Confident	80.3	Confident	5 Å²	5	69.8 Å²	69.8	3%	0.026	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	133.7	173.4	-161.7	153	0	0	0	108.5	I78 A80 L86 F124 A125 T126	I78-L113 HydrophobicContact CB-CD1 4.05Å; I78-L113 HydrophobicContact CB-CD2 4.1Å; I78-L113 HydrophobicContact CD1-CD2 4.3Å; I78-L113 HydrophobicContact CG2-CD1 3.52Å; I78-L113 HydrophobicContact CG2-CD2 4.42Å; A80-L113 HydrophobicContact CB-CD1 4.33Å; L86-L113 HydrophobicContact CD2-CD1 3.64Å; L113-F124 HydrophobicContact CD1-CD2 4.47Å; L113-F124 HydrophobicContact CD2-CD2 4.19Å; L113-F124 HydrophobicContact CG-CD2 4.31Å; L113-A125 WeakPolarHBondContact CA-O 3.38Å; L113-T126 HydrophobicContact CD1-CG2 4Å; L113-T126 HydrophobicContact CG-CG2 4.09Å
114	V	84.8	Confident	80.3	Confident	78 Å²	78	62.9 Å²	62.9	47%	0.473	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	123.2	179.9	-178.7	0	0	0	0	109.8	R112 F124 A125	R112-V114 HydrophobicContact CG-CG2 4.19Å; V114-F124 CarbonylContact O-C 3.59Å; V114-F124 WeakPolarHBondContact O-CA 3.2Å; V114-A125 PolarHBondContact N-O 2.86Å; V114-A125 PolarHBondContact O-N 2.86Å
115	Y	85.3	Confident	80.3	Confident	12 Å²	12	63.4 Å²	63.4	5%	0.047	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	142.2	167	-95.2	-78.6	0	0	0	111.7	S69 L70 D71 L76 I78 F124 M138	S69-Y115 WeakPolarHBondContact O-CD2 3.27Å; S69-Y115 VanDerWaalsContact O-CE2 3.24Å; S69-Y115 WeakPolarHBondContact O-CE2 3.47Å; S69-Y115 PolarHBondContact OG-N 2.78Å; L70-Y115 WeakPolarHBondContact O-CD2 3.31Å; D71-Y115 HydrophobicContact CB-CD1 4.4Å; D71-Y115 HydrophobicContact CB-CE1 4.17Å; D71-Y115 HydrophobicContact CB-CE2 4.36Å; L76-Y115 WeakPolarHBondContact CB-OH 3.31Å; I78-Y115 HydrophobicContact CB-CE2 4.21Å; I78-Y115 HydrophobicContact CD1-CD2 4.32Å; I78-Y115 HydrophobicContact CD1-CE1 3.88Å; I78-Y115 HydrophobicContact CD1-CE2 3.5Å; I78-Y115 WeakPolarHBondContact CD1-OH 3.32Å; I78-Y115 HydrophobicContact CG1-CE2 3.63Å; I78-Y115 WeakPolarHBondContact CG1-OH 3.41Å; Y115-F124 HydrophobicContact CD1-CB 3.98Å; Y115-F124 HydrophobicContact CE1-CB 4.34Å; Y115-F124 HydrophobicContact CG-CB 4.25Å; Y115-M138 HydrophobicContact CE1-CE 4.28Å; Y115-M138 WeakPolarHBondContact OH-CE 3.17Å
116	G	78	Confident	80.7	Confident	20 Å²	20	61.1 Å²	61.1	21%	0.206	32%	0.322	C	S	.	.			trans	-65.8	158	169.5	0	0	0	0	0	111.9	F120 S121 M123	G116-F120 WeakPolarHBondContact CA-O 3.32Å; G116-S121 WeakPolarHBondContact O-CA 3.43Å; G116-M123 PolarHBondContact N-O 3.28Å
117	R	74.8	Confident	81.1	Confident	212 Å²	212	60.2 Å²	60.2	80%	0.8	31%	0.313	S	S	*	.			trans	-118.1	158.3	177.9	-66.9	-172.5	175.4	-172.8	-1.6	110.8	A119 F120	R117-A119 PolarHBondContact O-N 3.26Å; R117-F120 PolarHBondContact O-N 3.26Å
118	G	73	Confident	81.4	Confident	62 Å²	62	49.2 Å²	49.2	64%	0.639	28%	0.275	S	S	*	.	G	3₁₀ helix	trans	61.3	-126.2	177.2	0	0	0	0	0	111.8	F120 S121	G118-F120 PolarHBondContact O-N 2.63Å; G118-F120 VanDerWaalsContact O-N 3.12Å; G118-S121 PolarHBondContact O-N 3.22Å; G118-S121 PolarHBondContact O-OG 2.6Å
119	A	67.7	Low	81.3	Confident	83 Å²	83	52.2 Å²	52.2	69%	0.686	30%	0.295	S	S	*	.	G	3₁₀ helix	trans	-59.4	-22.6	179.1	0	0	0	0	0	113.7	R117 Y122	R117-A119 PolarHBondContact O-N 3.26Å; A119-Y122 WeakPolarHBondContact O-CD1 3.41Å; A119-Y122 WeakPolarHBondContact O-CE1 3.29Å
120	F	71.9	Confident	81.1	Confident	79 Å²	79	52.4 Å²	52.4	35%	0.346	29%	0.294	S	S	.	.	G	3₁₀ helix	trans	-100.1	17.3	-177.8	-54.2	-71	0	0	0	113.5	G116 R117 G118 Y122 M123	G116-F120 WeakPolarHBondContact CA-O 3.32Å; R117-F120 PolarHBondContact O-N 3.26Å; G118-F120 PolarHBondContact O-N 2.63Å; G118-F120 VanDerWaalsContact O-N 3.12Å; F120-Y122 PolarHBondContact O-N 2.86Å; F120-Y122 VanDerWaalsContact O-N 3.14Å; F120-M123 HydrophobicContact CD1-SD 4.2Å; F120-M123 PolarHBondContact O-N 2.81Å
121	S	77.3	Confident	80.4	Confident	43 Å²	43	55.1 Å²	55.1	30%	0.301	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-21.5	-179.5	64.8	0	0	0	0	113.9	G116 G118 M123	G116-S121 WeakPolarHBondContact O-CA 3.43Å; G118-S121 PolarHBondContact O-N 3.22Å; G118-S121 PolarHBondContact O-OG 2.6Å; S121-M123 PolarHBondContact O-N 3.11Å
122	Y	79.7	Confident	79.9	Confident	76 Å²	76	50 Å²	50	30%	0.298	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-3.2	174.3	69.1	-86.7	0	0	0	113.4	A119 F120 D137 M138	A119-Y122 WeakPolarHBondContact O-CD1 3.41Å; A119-Y122 WeakPolarHBondContact O-CE1 3.29Å; F120-Y122 PolarHBondContact O-N 2.86Å; F120-Y122 VanDerWaalsContact O-N 3.14Å; Y122-D137 WeakPolarHBondContact CD2-OD1 3.21Å; Y122-M138 WeakPolarHBondContact O-CB 3.43Å; Y122-M138 PolarHBondContact O-N 3.22Å
123	M	83.1	Confident	79.6	Confident	7 Å²	7	45 Å²	45	3%	0.034	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	153.5	-176.5	-60.6	178.1	54.4	0	0	111.6	G116 F120 S121 L135 W136 I144 S154	G116-M123 PolarHBondContact N-O 3.28Å; F120-M123 HydrophobicContact CD1-SD 4.2Å; F120-M123 PolarHBondContact O-N 2.81Å; S121-M123 PolarHBondContact O-N 3.11Å; M123-L135 HydrophobicContact CE-CD1 3.69Å; M123-L135 HydrophobicContact CE-CD2 3.33Å; M123-L135 HydrophobicContact CE-CG 3.44Å; M123-L135 VanDerWaalsContact CE-CG 3.44Å; M123-W136 VanDerWaalsContact CA-O 3.26Å; M123-W136 WeakPolarHBondContact CA-O 3.45Å; M123-I144 HydrophobicContact CE-CD1 3.41Å; M123-I144 VanDerWaalsContact CE-CD1 3.41Å; M123-I144 HydrophobicContact CG-CD1 4.3Å; M123-I144 HydrophobicContact SD-CD1 4.11Å; M123-S154 WeakPolarHBondContact CE-OG 3.34Å; M123-S154 PolarHBondContact SD-OG 3.47Å
124	F	85.4	Confident	79.2	Confident	3 Å²	3	46.2 Å²	46.2	1%	0.013	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	152.6	170.6	70.2	-85	0	0	0	111.2	I78 L86 W102 L113 V114 Y115 T126 W136 M138	I78-F124 HydrophobicContact CD1-CB 3.99Å; I78-F124 HydrophobicContact CD1-CD1 3.32Å; I78-F124 HydrophobicContact CD1-CD2 3.64Å; I78-F124 HydrophobicContact CD1-CE1 3.58Å; I78-F124 HydrophobicContact CD1-CE2 3.89Å; I78-F124 HydrophobicContact CD1-CG 3.35Å; I78-F124 HydrophobicContact CD1-CZ 3.88Å; L86-F124 HydrophobicContact CD1-CE2 4.06Å; L86-F124 HydrophobicContact CD1-CZ 4.35Å; W102-F124 HydrophobicContact CZ2-CE1 4.34Å; W102-F124 AromaticContact CZ2-CZ 3.77Å; W102-F124 HydrophobicContact CZ2-CZ 3.77Å; L113-F124 HydrophobicContact CD1-CD2 4.47Å; L113-F124 HydrophobicContact CD2-CD2 4.19Å; L113-F124 HydrophobicContact CG-CD2 4.31Å; V114-F124 CarbonylContact O-C 3.59Å; V114-F124 WeakPolarHBondContact O-CA 3.2Å; Y115-F124 HydrophobicContact CD1-CB 3.98Å; Y115-F124 HydrophobicContact CE1-CB 4.34Å; Y115-F124 HydrophobicContact CG-CB 4.25Å; F124-T126 HydrophobicContact CD2-CG2 3.99Å; F124-T126 HydrophobicContact CE2-CG2 3.76Å; F124-W136 HydrophobicContact CD1-CB 3.67Å; F124-W136 HydrophobicContact CD2-CB 4.05Å; F124-W136 AromaticContact CD2-CD1 3.87Å; F124-W136 HydrophobicContact CD2-CG 4.17Å; F124-W136 HydrophobicContact CE1-CB 3.17Å; F124-W136 AromaticContact CE1-CG 3.89Å; F124-W136 HydrophobicContact CE1-CG 3.89Å; F124-W136 HydrophobicContact CE2-CB 3.59Å; F124-W136 AromaticContact CE2-CD1 3.3Å; F124-W136 HydrophobicContact CE2-CD2 4.19Å; F124-W136 AromaticContact CE2-CG 3.43Å; F124-W136 HydrophobicContact CE2-CG 3.43Å; F124-W136 VanDerWaalsContact CE2-CG 3.43Å; F124-W136 AromaticContact CE2-NE1 3.98Å; F124-W136 HydrophobicContact CG-CB 4.08Å; F124-W136 HydrophobicContact CZ-CB 3.1Å; F124-W136 AromaticContact CZ-CD1 3.67Å; F124-W136 AromaticContact CZ-CD2 3.85Å; F124-W136 HydrophobicContact CZ-CD2 3.85Å; F124-W136 HydrophobicContact CZ-CE3 4.44Å; F124-W136 AromaticContact CZ-CG 3.24Å; F124-W136 HydrophobicContact CZ-CG 3.24Å; F124-W136 PolarHBondContact N-O 3.23Å; F124-W136 PolarHBondContact O-N 2.89Å; F124-M138 HydrophobicContact CD1-CE 3.79Å; F124-M138 HydrophobicContact CE1-CE 3.63Å
125	A	84.6	Confident	79.1	Confident	19 Å²	19	43.2 Å²	43.2	16%	0.157	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	141.8	178.6	0	0	0	0	0	110.8	L113 V114 K134 L135	L113-A125 WeakPolarHBondContact CA-O 3.38Å; V114-A125 PolarHBondContact N-O 2.86Å; V114-A125 PolarHBondContact O-N 2.86Å; A125-K134 CarbonylContact C-O 3.56Å; A125-K134 VanDerWaalsContact CA-O 3.31Å; A125-K134 WeakPolarHBondContact CA-O 3.43Å; A125-L135 HydrophobicContact CB-CD1 4.22Å
126	T	85.9	Confident	79	Confident	4 Å²	4	43.4 Å²	43.4	3%	0.025	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	125	174.9	57.7	0	0	0	0	109.5	L86 I110 R112 L113 F124 V133 K134 W136	L86-T126 HydrophobicContact CD1-CG2 4.09Å; L86-T126 HydrophobicContact CD2-CG2 4.38Å; I110-T126 HydrophobicContact CG2-CG2 4.49Å; R112-T126 WeakPolarHBondContact O-CA 3.36Å; L113-T126 HydrophobicContact CD1-CG2 4Å; L113-T126 HydrophobicContact CG-CG2 4.09Å; F124-T126 HydrophobicContact CD2-CG2 3.99Å; F124-T126 HydrophobicContact CE2-CG2 3.76Å; T126-V133 CarbonylContact O-C 3.42Å; T126-V133 WeakPolarHBondContact O-CA 3.28Å; T126-K134 PolarHBondContact N-O 3.17Å; T126-K134 PolarHBondContact O-N 2.7Å; T126-K134 PolarHBondContact OG1-O 3.03Å; T126-W136 PolarHBondContact OG1-NE1 3.45Å
127	G	84.5	Confident	79.2	Confident	20 Å²	20	43.4 Å²	43.4	21%	0.206	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	125.9	171.4	0	0	0	0	0	110.7	I110 Q111 R112	I110-G127 CarbonylContact C-O 3.56Å; Q111-G127 PolarHBondContact N-O 2.73Å; R112-G127 PolarHBondContact N-O 2.9Å; R112-G127 VanDerWaalsContact N-O 3.15Å; R112-G127 PolarHBondContact O-N 2.88Å
128	A	84	Confident	79.4	Confident	18 Å²	18	34.3 Å²	34.3	15%	0.149	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	158.9	178.8	0	0	0	0	0	112.2	P109 D130 G131 S132	P109-A128 WeakPolarHBondContact O-CA 3.3Å; A128-D130 WeakPolarHBondContact CB-OD1 3.43Å; A128-D130 PolarHBondContact O-N 2.79Å; A128-G131 PolarHBondContact O-N 3.26Å; A128-S132 PolarHBondContact N-O 2.96Å
129	S	78.6	Confident	79.7	Confident	68 Å²	68	38.1 Å²	38.1	48%	0.476	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-16.7	179.7	62.8	0	0	0	0	114.2	G108 P109 G131	G108-S129 WeakPolarHBondContact CA-OG 3.27Å; P109-S129 VanDerWaalsContact CD-OG 3.24Å; P109-S129 WeakPolarHBondContact CD-OG 3.28Å; P109-S129 PolarHBondContact O-N 3.3Å; S129-G131 PolarHBondContact O-N 2.95Å
130	D	79.6	Confident	79.9	Confident	48 Å²	48	40.4 Å²	40.4	26%	0.257	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.8	7.8	172.7	67.7	0.9	0	0	0	113.1	R107 A128 S132	R107-D130 PolarHBondContact N-OD2 2.77Å; A128-D130 WeakPolarHBondContact CB-OD1 3.43Å; A128-D130 PolarHBondContact O-N 2.79Å; D130-S132 PolarHBondContact O-N 3.41Å; D130-S132 WeakPolarHBondContact OD1-CB 3.32Å; D130-S132 PolarHBondContact OD1-N 3.11Å; D130-S132 PolarHBondContact OD1-OG 3.18Å
131	G	72.2	Confident	79.8	Confident	59 Å²	59	40.7 Å²	40.7	61%	0.608	23%	0.232	S	C	*	.	S	Bend	trans	78.2	0.6	-177.4	0	0	0	0	0	113.8	A128 S129	A128-G131 PolarHBondContact O-N 3.26Å; S129-G131 PolarHBondContact O-N 2.95Å
132	S	74.8	Confident	79.7	Confident	10 Å²	10	42.3 Å²	42.3	7%	0.07	24%	0.24	C	C	.	.			trans	-75.2	129.5	177.9	68.6	0	0	0	0	111.2	A128 D130	A128-S132 PolarHBondContact N-O 2.96Å; D130-S132 PolarHBondContact O-N 3.41Å; D130-S132 WeakPolarHBondContact OD1-CB 3.32Å; D130-S132 PolarHBondContact OD1-N 3.11Å; D130-S132 PolarHBondContact OD1-OG 3.18Å
133	V	78.1	Confident	79.4	Confident	19 Å²	19	42.1 Å²	42.1	12%	0.115	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	124.5	170.5	-178.1	0	0	0	0	107.9	T126 V147 F158	T126-V133 CarbonylContact O-C 3.42Å; T126-V133 WeakPolarHBondContact O-CA 3.28Å; V133-V147 HydrophobicContact CB-CB 4.42Å; V133-V147 HydrophobicContact CB-CG2 4.15Å; V133-V147 PolarHBondContact O-N 3.15Å; V133-F158 HydrophobicContact CG1-CD1 4.25Å; V133-F158 HydrophobicContact CG2-CB 4.46Å; V133-F158 HydrophobicContact CG2-CD1 4.28Å; V133-F158 HydrophobicContact CG2-CD2 3.86Å; V133-F158 HydrophobicContact CG2-CE1 4.49Å; V133-F158 HydrophobicContact CG2-CE2 4.07Å; V133-F158 HydrophobicContact CG2-CG 3.95Å; V133-F158 HydrophobicContact CG2-CZ 4.38Å
134	K	79.7	Confident	78.9	Confident	30 Å²	30	44.2 Å²	44.2	13%	0.13	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	141.6	177.5	-63.5	-170.4	179.5	-168.2	0	111	V104 G105 A125 T126 W136	V104-K134 HydrophobicContact CG1-CD 3.93Å; G105-K134 WeakPolarHBondContact O-CE 3.46Å; G105-K134 PolarHBondContact O-NZ 3.14Å; A125-K134 CarbonylContact C-O 3.56Å; A125-K134 VanDerWaalsContact CA-O 3.31Å; A125-K134 WeakPolarHBondContact CA-O 3.43Å; T126-K134 PolarHBondContact N-O 3.17Å; T126-K134 PolarHBondContact O-N 2.7Å; T126-K134 PolarHBondContact OG1-O 3.03Å; K134-W136 HydrophobicContact CD-CZ2 4.12Å
135	L	82.5	Confident	78.1	Confident	16 Å²	16	44.6 Å²	44.6	8%	0.084	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	134.5	177.5	-169.4	61.9	0	0	0	109.1	M123 A125 C143 I144 G145 S152 V156 W168	M123-L135 HydrophobicContact CE-CD1 3.69Å; M123-L135 HydrophobicContact CE-CD2 3.33Å; M123-L135 HydrophobicContact CE-CG 3.44Å; M123-L135 VanDerWaalsContact CE-CG 3.44Å; A125-L135 HydrophobicContact CB-CD1 4.22Å; L135-C143 CarbonylContact O-C 3.59Å; L135-I144 HydrophobicContact CG-CD1 4.42Å; L135-I144 PolarHBondContact O-N 3.13Å; L135-G145 PolarHBondContact N-O 2.75Å; L135-S152 WeakPolarHBondContact CD2-OG 3.12Å; L135-V156 HydrophobicContact CD1-CG2 3.98Å; L135-V156 HydrophobicContact CD2-CG2 4.1Å; L135-W168 HydrophobicContact CD2-CH2 4.22Å; L135-W168 HydrophobicContact CD2-CZ3 3.69Å
136	W	83.9	Confident	77.2	Confident	15 Å²	15	45.2 Å²	45.2	6%	0.057	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	139.9	-172.7	-61.1	88	0	0	0	110.1	L86 W102 V104 M123 F124 T126 K134 C143	L86-W136 HydrophobicContact CD1-CZ2 4.23Å; W102-W136 AromaticContact CD1-CH2 3.92Å; W102-W136 AromaticContact CD1-CZ3 3.74Å; W102-W136 AromaticContact NE1-CE3 3.82Å; W102-W136 AromaticContact NE1-CH2 3.84Å; W102-W136 AromaticContact NE1-CZ3 3.51Å; V104-W136 HydrophobicContact CB-CZ2 4.26Å; V104-W136 HydrophobicContact CG1-CZ2 3.98Å; V104-W136 HydrophobicContact CG2-CH2 4.1Å; V104-W136 HydrophobicContact CG2-CZ2 3.6Å; M123-W136 VanDerWaalsContact CA-O 3.26Å; M123-W136 WeakPolarHBondContact CA-O 3.45Å; F124-W136 HydrophobicContact CD1-CB 3.67Å; F124-W136 HydrophobicContact CD2-CB 4.05Å; F124-W136 AromaticContact CD2-CD1 3.87Å; F124-W136 HydrophobicContact CD2-CG 4.17Å; F124-W136 HydrophobicContact CE1-CB 3.17Å; F124-W136 AromaticContact CE1-CG 3.89Å; F124-W136 HydrophobicContact CE1-CG 3.89Å; F124-W136 HydrophobicContact CE2-CB 3.59Å; F124-W136 AromaticContact CE2-CD1 3.3Å; F124-W136 HydrophobicContact CE2-CD2 4.19Å; F124-W136 AromaticContact CE2-CG 3.43Å; F124-W136 HydrophobicContact CE2-CG 3.43Å; F124-W136 VanDerWaalsContact CE2-CG 3.43Å; F124-W136 AromaticContact CE2-NE1 3.98Å; F124-W136 HydrophobicContact CG-CB 4.08Å; F124-W136 HydrophobicContact CZ-CB 3.1Å; F124-W136 AromaticContact CZ-CD1 3.67Å; F124-W136 AromaticContact CZ-CD2 3.85Å; F124-W136 HydrophobicContact CZ-CD2 3.85Å; F124-W136 HydrophobicContact CZ-CE3 4.44Å; F124-W136 AromaticContact CZ-CG 3.24Å; F124-W136 HydrophobicContact CZ-CG 3.24Å; F124-W136 PolarHBondContact N-O 3.23Å; F124-W136 PolarHBondContact O-N 2.89Å; T126-W136 PolarHBondContact OG1-NE1 3.45Å; K134-W136 HydrophobicContact CD-CZ2 4.12Å; W136-C143 HydrophobicContact CD2-CB 4.28Å; W136-C143 HydrophobicContact CE3-CB 3.93Å; W136-C143 HydrophobicContact CH2-CB 4.09Å; W136-C143 HydrophobicContact CZ2-CB 4.41Å; W136-C143 HydrophobicContact CZ3-CB 3.84Å
137	D	83	Confident	76.1	Confident	20 Å²	20	47.4 Å²	47.4	11%	0.107	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	124.4	167.8	-169.4	-21.5	0	0	0	108.4	Y122 Q139 Q140 Q141 T142 I144	Y122-D137 WeakPolarHBondContact CD2-OD1 3.21Å; D137-Q139 WeakPolarHBondContact OD1-CB 3.47Å; D137-Q139 PolarHBondContact OD1-N 3.01Å; D137-Q140 HydrophobicContact CB-CB 4.08Å; D137-Q140 PolarHBondContact OD1-N 3.08Å; D137-Q140 WeakPolarHBondContact OD2-CG 3.11Å; D137-Q141 WeakPolarHBondContact O-CA 3.21Å; D137-Q141 PolarHBondContact O-N 3.34Å; D137-T142 PolarHBondContact N-O 3.08Å; D137-I144 HydrophobicContact CB-CD1 3.62Å; D137-I144 HydrophobicContact CB-CG1 3.74Å
138	M	79	Confident	74.5	Confident	22 Å²	22	56 Å²	56	11%	0.108	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-30.7	175.6	-175.1	56.2	64.3	0	0	112.3	L76 I78 Y115 Y122 F124 Q141	L76-M138 HydrophobicContact CD1-CG 4.19Å; I78-M138 HydrophobicContact CD1-CE 3.27Å; I78-M138 HydrophobicContact CG1-CE 3.63Å; Y115-M138 HydrophobicContact CE1-CE 4.28Å; Y115-M138 WeakPolarHBondContact OH-CE 3.17Å; Y122-M138 WeakPolarHBondContact O-CB 3.43Å; Y122-M138 PolarHBondContact O-N 3.22Å; F124-M138 HydrophobicContact CD1-CE 3.79Å; F124-M138 HydrophobicContact CE1-CE 3.63Å; M138-Q141 VanDerWaalsContact O-CG 3.27Å; M138-Q141 WeakPolarHBondContact O-CG 3.46Å
139	Q	78.3	Confident	71.8	Confident	141 Å²	141	60.2 Å²	60.2	66%	0.659	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.8	-48.7	179.1	-69.7	179.4	3.8	0	0	110.9	D137	D137-Q139 WeakPolarHBondContact OD1-CB 3.47Å; D137-Q139 PolarHBondContact OD1-N 3.01Å
140	Q	72.1	Confident	69.6	Low	131 Å²	131	60 Å²	60	61%	0.612	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.2	-15.5	178.5	-58.9	-61.1	-28.9	0	0	112.8	D137 T142	D137-Q140 HydrophobicContact CB-CB 4.08Å; D137-Q140 PolarHBondContact OD1-N 3.08Å; D137-Q140 WeakPolarHBondContact OD2-CG 3.11Å; Q140-T142 PolarHBondContact O-N 3.23Å
141	Q	68.7	Low	67.4	Low	86 Å²	86	62.7 Å²	62.7	40%	0.402	36%	0.356	S	S	.	.			trans	56.4	29.7	-179.4	-56.9	177.3	-17.2	0	0	113.3	D137 M138	D137-Q141 WeakPolarHBondContact O-CA 3.21Å; D137-Q141 PolarHBondContact O-N 3.34Å; M138-Q141 VanDerWaalsContact O-CG 3.27Å; M138-Q141 WeakPolarHBondContact O-CG 3.46Å
142	T	75.6	Confident	65.7	Low	76 Å²	76	60.5 Å²	60.5	47%	0.466	33%	0.331	S	S	.	.	S	Bend	trans	-114	152.5	179.9	52	0	0	0	0	110.9	D137 Q140 I144	D137-T142 PolarHBondContact N-O 3.08Å; Q140-T142 PolarHBondContact O-N 3.23Å; T142-I144 PolarHBondContact O-N 3.23Å
143	C	72.9	Confident	64.2	Low	73 Å²	73	65.6 Å²	65.6	49%	0.493	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	115.4	165	58.4	0	0	0	0	108.3	L135 W136	L135-C143 CarbonylContact O-C 3.59Å; W136-C143 HydrophobicContact CD2-CB 4.28Å; W136-C143 HydrophobicContact CE3-CB 3.93Å; W136-C143 HydrophobicContact CH2-CB 4.09Å; W136-C143 HydrophobicContact CZ2-CB 4.41Å; W136-C143 HydrophobicContact CZ3-CB 3.84Å
144	I	72.8	Confident	62.9	Low	51 Å²	51	64.9 Å²	64.9	26%	0.262	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	-38.1	-179.3	-41.1	-176.8	0	0	0	109.9	M123 L135 D137 T142 S152	M123-I144 HydrophobicContact CE-CD1 3.41Å; M123-I144 VanDerWaalsContact CE-CD1 3.41Å; M123-I144 HydrophobicContact CG-CD1 4.3Å; M123-I144 HydrophobicContact SD-CD1 4.11Å; L135-I144 HydrophobicContact CG-CD1 4.42Å; L135-I144 PolarHBondContact O-N 3.13Å; D137-I144 HydrophobicContact CB-CD1 3.62Å; D137-I144 HydrophobicContact CB-CG1 3.74Å; T142-I144 PolarHBondContact O-N 3.23Å; I144-S152 VanDerWaalsContact CG2-CB 3.49Å; I144-S152 WeakPolarHBondContact CG2-OG 3.46Å
145	G	68.8	Low	62.1	Low	11 Å²	11	68.7 Å²	68.7	11%	0.113	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-166.3	156.9	179.9	0	0	0	0	0	112.2	L135	L135-G145 PolarHBondContact N-O 2.75Å
146	S	66.8	Low	61.3	Low	32 Å²	32	69.4 Å²	69.4	22%	0.224	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	136.8	172.2	-174.6	0	0	0	0	107.8	R148 S149	S146-R148 PolarHBondContact O-N 2.94Å; S146-S149 CarbonylContact O-C 3.46Å; S146-S149 PolarHBondContact O-N 3.38Å
147	V	62.2	Low	60.3	Low	49 Å²	49	70.6 Å²	70.6	30%	0.297	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.9	76	167.9	-175.9	0	0	0	0	108.6	V133 F158 W166	V133-V147 HydrophobicContact CB-CB 4.42Å; V133-V147 HydrophobicContact CB-CG2 4.15Å; V133-V147 PolarHBondContact O-N 3.15Å; V147-F158 HydrophobicContact CG1-CZ 4.2Å; V147-F158 HydrophobicContact CG2-CE1 4.14Å; V147-F158 HydrophobicContact CG2-CZ 4.15Å; V147-W166 HydrophobicContact CG1-CZ3 4.39Å
148	R	50.9	Low	59.5	Low	201 Å²	201	71.1 Å²	71.1	76%	0.758	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-146.1	-30.9	152.1	-77.9	-165.5	-179.5	165.1	4.2	108.9	S146	S146-R148 PolarHBondContact O-N 2.94Å
149	S	28	Very low	58.8	Low	107 Å²	107	71.4 Å²	71.4	75%	0.748	40%	0.398	S	S	*	.	S	Bend	trans	-177.4	120.2	169.4	178	0	0	0	0	107.1	S146	S146-S149 CarbonylContact O-C 3.46Å; S146-S149 PolarHBondContact O-N 3.38Å
150	A	32.6	Very low	58.3	Low	63 Å²	63	66.4 Å²	66.4	52%	0.521	38%	0.378	S	S	.	.			trans	157.6	150.4	154	0	0	0	0	0	115.2
151	T	31.4	Very low	58.2	Low	105 Å²	105	66.9 Å²	66.9	64%	0.644	39%	0.385	S	S	*	.			trans	-74.8	139.7	-175.8	-46.3	0	0	0	0	115
152	S	37.8	Very low	58.4	Low	12 Å²	12	67.9 Å²	67.9	8%	0.084	40%	0.397	C	S	.	.			trans	-160	174.5	169.8	166	0	0	0	0	110.1	L135 I144 W168	L135-S152 WeakPolarHBondContact CD2-OG 3.12Å; I144-S152 VanDerWaalsContact CG2-CB 3.49Å; I144-S152 WeakPolarHBondContact CG2-OG 3.46Å; S152-W168 WeakPolarHBondContact O-CH2 3.35Å; S152-W168 WeakPolarHBondContact O-CZ2 3.43Å; S152-W168 VanDerWaalsContact OG-CH2 3.22Å; S152-W168 WeakPolarHBondContact OG-CH2 3.34Å
153	N	43.8	Very low	58.2	Low	118 Å²	118	64.3 Å²	64.3	63%	0.631	38%	0.375	S	S	*	.	S	Bend	trans	-111.8	32.9	-171.9	-80.2	-6	0	0	0	118	P170	N153-P170 HydrophobicContact CB-CB 4.3Å
154	S	51	Low	58.3	Low	3 Å²	3	60.9 Å²	60.9	2%	0.021	35%	0.352	C	S	.	.	S	Bend	trans	-130.2	163	-177.5	-41.3	0	0	0	0	114.8	M123 W168 P170	M123-S154 WeakPolarHBondContact CE-OG 3.34Å; M123-S154 PolarHBondContact SD-OG 3.47Å; S154-W168 VanDerWaalsContact C-CZ3 3.47Å; S154-W168 VanDerWaalsContact N-CH2 3.31Å; S154-W168 WeakPolarHBondContact O-CH2 3.28Å; S154-W168 WeakPolarHBondContact O-CZ3 3.3Å; S154-P170 WeakPolarHBondContact O-CD 3.43Å
155	K	62.7	Low	58.3	Low	111 Å²	111	58.5 Å²	58.5	48%	0.483	34%	0.34	S	S	.	.			trans	-92.7	110.3	168.7	-72.9	-171.4	178.7	-174.7	0	109.7	W168 Q169	K155-W168 VanDerWaalsContact CA-O 3.25Å; K155-W168 WeakPolarHBondContact CA-O 3.41Å; K155-Q169 HydrophobicContact CD-CG 4.48Å; K155-Q169 HydrophobicContact CG-CG 4.34Å
156	V	64.2	Low	58.5	Low	30 Å²	30	61.6 Å²	61.6	18%	0.182	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	127	178.7	-179.1	0	0	0	0	108.7	L135 M167 W168	L135-V156 HydrophobicContact CD1-CG2 3.98Å; L135-V156 HydrophobicContact CD2-CG2 4.1Å; V156-M167 WeakPolarHBondContact O-CA 3.26Å; V156-W168 HydrophobicContact CB-CE3 4.04Å; V156-W168 HydrophobicContact CG2-CE3 3.88Å; V156-W168 HydrophobicContact CG2-CZ3 4.12Å; V156-W168 PolarHBondContact N-O 3.3Å; V156-W168 PolarHBondContact O-N 2.7Å
157	A	63.2	Low	58.7	Low	40 Å²	40	60.3 Å²	60.3	33%	0.331	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	136.1	174.1	0	0	0	0	0	110	W166 M167 L196	A157-W166 CarbonylContact C-O 3.41Å; A157-W166 VanDerWaalsContact CA-O 3.29Å; A157-W166 WeakPolarHBondContact CA-O 3.41Å; A157-M167 HydrophobicContact CB-CB 4.39Å; A157-M167 HydrophobicContact CB-CG 4.17Å; A157-L196 HydrophobicContact CB-CD1 4.4Å; A157-L196 HydrophobicContact CB-CD2 4.2Å
158	F	67.3	Low	58.9	Low	31 Å²	31	59.8 Å²	59.8	14%	0.136	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	151.3	173.9	57.1	-88.2	0	0	0	110.9	V133 V147 W166 L189	V133-F158 HydrophobicContact CG1-CD1 4.25Å; V133-F158 HydrophobicContact CG2-CB 4.46Å; V133-F158 HydrophobicContact CG2-CD1 4.28Å; V133-F158 HydrophobicContact CG2-CD2 3.86Å; V133-F158 HydrophobicContact CG2-CE1 4.49Å; V133-F158 HydrophobicContact CG2-CE2 4.07Å; V133-F158 HydrophobicContact CG2-CG 3.95Å; V133-F158 HydrophobicContact CG2-CZ 4.38Å; V147-F158 HydrophobicContact CG1-CZ 4.2Å; V147-F158 HydrophobicContact CG2-CE1 4.14Å; V147-F158 HydrophobicContact CG2-CZ 4.15Å; F158-W166 HydrophobicContact CD1-CB 4.18Å; F158-W166 HydrophobicContact CD2-CB 3.85Å; F158-W166 HydrophobicContact CD2-CG 4.33Å; F158-W166 HydrophobicContact CE1-CB 3.72Å; F158-W166 HydrophobicContact CE2-CB 3.36Å; F158-W166 AromaticContact CE2-CD2 3.96Å; F158-W166 HydrophobicContact CE2-CD2 3.96Å; F158-W166 HydrophobicContact CE2-CE3 4.24Å; F158-W166 AromaticContact CE2-CG 3.59Å; F158-W166 HydrophobicContact CE2-CG 3.59Å; F158-W166 HydrophobicContact CG-CB 4.24Å; F158-W166 HydrophobicContact CZ-CB 3.28Å; F158-W166 AromaticContact CZ-CD2 3.95Å; F158-W166 HydrophobicContact CZ-CD2 3.95Å; F158-W166 AromaticContact CZ-CE3 3.82Å; F158-W166 HydrophobicContact CZ-CE3 3.82Å; F158-W166 AromaticContact CZ-CG 3.77Å; F158-W166 HydrophobicContact CZ-CG 3.77Å; F158-W166 PolarHBondContact N-O 2.86Å; F158-W166 PolarHBondContact O-N 3.07Å; F158-L189 VanDerWaalsContact C-CD1 3.44Å
159	G	63.8	Low	59.4	Low	28 Å²	28	52.9 Å²	52.9	29%	0.289	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	142.1	-179.2	0	0	0	0	0	109.5
160	C	68.4	Low	60.5	Low	36 Å²	36	49.5 Å²	49.5	24%	0.243	28%	0.283	C	S	.	.			trans	-106.3	160.2	177.2	-59.3	0	0	0	0	111.1	T162 G163 A164 V186	C160-T162 PolarHBondContact O-N 3.14Å; C160-T162 VanDerWaalsContact O-N 3.13Å; C160-G163 PolarHBondContact O-N 3.5Å; C160-A164 HydrophobicContact CB-CB 4.33Å; C160-A164 PolarHBondContact N-O 3.22Å; C160-V186 PolarHBondContact O-N 3.47Å
161	D	69	Low	61.4	Low	142 Å²	142	54.1 Å²	54.1	76%	0.759	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-20.7	174.9	-61	-28.1	0	0	0	113.1	G163 A185	D161-G163 PolarHBondContact O-N 3.07Å; D161-A185 HydrophobicContact CB-CB 4.38Å; D161-A185 VanDerWaalsContact O-CA 3.31Å; D161-A185 WeakPolarHBondContact O-CA 3.43Å; D161-A185 PolarHBondContact O-N 2.9Å
162	T	74	Confident	62.3	Low	107 Å²	107	50.9 Å²	50.9	66%	0.656	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.3	-1.1	176.5	58	0	0	0	0	113.9	C160 A164	C160-T162 PolarHBondContact O-N 3.14Å; C160-T162 VanDerWaalsContact O-N 3.13Å; T162-A164 PolarHBondContact O-N 3.17Å
163	G	69.9	Low	62.9	Low	0 Å²	0	58.8 Å²	58.8	0%	0	32%	0.316	C	S	.	.	S	Bend	trans	80.9	-2.7	-173.1	0	0	0	0	0	114.4	C160 D161 A184	C160-G163 PolarHBondContact O-N 3.5Å; D161-G163 PolarHBondContact O-N 3.07Å; G163-A184 WeakPolarHBondContact CA-O 3.37Å
164	A	75.1	Confident	62.7	Low	1 Å²	1	61 Å²	61	1%	0.008	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	131.2	174.1	0	0	0	0	0	111.5	C160 T162 Y178	C160-A164 HydrophobicContact CB-CB 4.33Å; C160-A164 PolarHBondContact N-O 3.22Å; T162-A164 PolarHBondContact O-N 3.17Å; A164-Y178 HydrophobicContact CB-CD2 4.36Å; A164-Y178 HydrophobicContact CB-CE2 3.4Å; A164-Y178 VanDerWaalsContact CB-CE2 3.4Å; A164-Y178 WeakPolarHBondContact CB-OH 3.41Å
165	L	74.3	Confident	62.7	Low	2 Å²	2	66 Å²	66	1%	0.01	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	134.4	163.9	-77.5	97.9	0	0	0	109.6	L179 V186 L189 L196 W208	L165-L179 HydrophobicContact CB-CB 3.88Å; L165-L179 PolarHBondContact N-O 3.26Å; L165-L179 PolarHBondContact O-N 3.13Å; L165-V186 HydrophobicContact CD1-CG2 3.99Å; L165-V186 HydrophobicContact CG-CG2 4.38Å; L165-L189 HydrophobicContact CD2-CD2 3.46Å; L165-L189 VanDerWaalsContact CD2-CD2 3.46Å; L165-L189 HydrophobicContact CG-CD2 4.34Å; L165-L196 HydrophobicContact CD2-CD2 4.13Å; L165-W208 HydrophobicContact CD1-CZ2 4.05Å
166	W	73	Confident	62.7	Low	76 Å²	76	64.1 Å²	64.1	29%	0.288	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	126.7	175.1	-71.1	53.4	0	0	0	107.6	V147 A157 F158 N176 Y178	V147-W166 HydrophobicContact CG1-CZ3 4.39Å; A157-W166 CarbonylContact C-O 3.41Å; A157-W166 VanDerWaalsContact CA-O 3.29Å; A157-W166 WeakPolarHBondContact CA-O 3.41Å; F158-W166 HydrophobicContact CD1-CB 4.18Å; F158-W166 HydrophobicContact CD2-CB 3.85Å; F158-W166 HydrophobicContact CD2-CG 4.33Å; F158-W166 HydrophobicContact CE1-CB 3.72Å; F158-W166 HydrophobicContact CE2-CB 3.36Å; F158-W166 AromaticContact CE2-CD2 3.96Å; F158-W166 HydrophobicContact CE2-CD2 3.96Å; F158-W166 HydrophobicContact CE2-CE3 4.24Å; F158-W166 AromaticContact CE2-CG 3.59Å; F158-W166 HydrophobicContact CE2-CG 3.59Å; F158-W166 HydrophobicContact CG-CB 4.24Å; F158-W166 HydrophobicContact CZ-CB 3.28Å; F158-W166 AromaticContact CZ-CD2 3.95Å; F158-W166 HydrophobicContact CZ-CD2 3.95Å; F158-W166 AromaticContact CZ-CE3 3.82Å; F158-W166 HydrophobicContact CZ-CE3 3.82Å; F158-W166 AromaticContact CZ-CG 3.77Å; F158-W166 HydrophobicContact CZ-CG 3.77Å; F158-W166 PolarHBondContact N-O 2.86Å; F158-W166 PolarHBondContact O-N 3.07Å; W166-N176 HydrophobicContact CE3-CB 4.07Å; W166-N176 HydrophobicContact CZ3-CB 4.29Å; W166-Y178 AromaticContact CE2-CD2 3.9Å; W166-Y178 HydrophobicContact CZ2-CD2 4.35Å; W166-Y178 HydrophobicContact CZ2-CE2 4.48Å; W166-Y178 AromaticContact NE1-CD2 3.54Å; W166-Y178 AromaticContact NE1-CE2 3.51Å
167	M	71.4	Confident	62.8	Low	4 Å²	4	64.2 Å²	64.2	2%	0.02	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	123.6	175	-171.6	-159.1	60.5	0	0	108.9	V156 A157 Q169 V177 L210 L213	V156-M167 WeakPolarHBondContact O-CA 3.26Å; A157-M167 HydrophobicContact CB-CB 4.39Å; A157-M167 HydrophobicContact CB-CG 4.17Å; M167-Q169 HydrophobicContact CE-CG 3.92Å; M167-V177 HydrophobicContact CB-CB 4.45Å; M167-V177 HydrophobicContact CE-CB 3.91Å; M167-V177 HydrophobicContact CE-CG1 4.31Å; M167-V177 HydrophobicContact CE-CG2 3.9Å; M167-V177 PolarHBondContact N-O 2.7Å; M167-V177 WeakPolarHBondContact O-CB 3.41Å; M167-V177 PolarHBondContact O-N 2.84Å; M167-L210 HydrophobicContact SD-CD2 4.1Å; M167-L213 HydrophobicContact CE-CD1 3.41Å; M167-L213 VanDerWaalsContact CE-CD1 3.41Å; M167-L213 HydrophobicContact CE-CD2 3.09Å; M167-L213 HydrophobicContact CE-CG 3.84Å; M167-L213 HydrophobicContact SD-CD2 3.49Å; M167-L213 WeakPolarHBondContact SD-CD2 3.5Å
168	W	66.2	Low	63.1	Low	38 Å²	38	66.9 Å²	66.9	14%	0.144	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	133.5	-176.7	176.8	69.3	0	0	0	109.5	L135 S152 S154 K155 V156	L135-W168 HydrophobicContact CD2-CH2 4.22Å; L135-W168 HydrophobicContact CD2-CZ3 3.69Å; S152-W168 WeakPolarHBondContact O-CH2 3.35Å; S152-W168 WeakPolarHBondContact O-CZ2 3.43Å; S152-W168 VanDerWaalsContact OG-CH2 3.22Å; S152-W168 WeakPolarHBondContact OG-CH2 3.34Å; S154-W168 VanDerWaalsContact C-CZ3 3.47Å; S154-W168 VanDerWaalsContact N-CH2 3.31Å; S154-W168 WeakPolarHBondContact O-CH2 3.28Å; S154-W168 WeakPolarHBondContact O-CZ3 3.3Å; K155-W168 VanDerWaalsContact CA-O 3.25Å; K155-W168 WeakPolarHBondContact CA-O 3.41Å; V156-W168 HydrophobicContact CB-CE3 4.04Å; V156-W168 HydrophobicContact CG2-CE3 3.88Å; V156-W168 HydrophobicContact CG2-CZ3 4.12Å; V156-W168 PolarHBondContact N-O 3.3Å; V156-W168 PolarHBondContact O-N 2.7Å
169	Q	60.3	Low	63.4	Low	57 Å²	57	66.1 Å²	66.1	27%	0.266	35%	0.347	S	S	.	.			trans	-120.4	139.6	176.2	-67.3	-165.6	-11.3	0	0	110.2	K155 M167 N171	K155-Q169 HydrophobicContact CD-CG 4.48Å; K155-Q169 HydrophobicContact CG-CG 4.34Å; M167-Q169 HydrophobicContact CE-CG 3.92Å; Q169-N171 VanDerWaalsContact C-N 3.34Å; Q169-N171 PolarHBondContact O-N 3.01Å; Q169-N171 VanDerWaalsContact O-N 3.15Å
170	P	52.2	Low	64	Low	35 Å²	35	74.1 Å²	74.1	23%	0.227	37%	0.368	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	5.4	-165.3	22.9	-28.9	0	0	0	119.1	N153 S154	N153-P170 HydrophobicContact CB-CB 4.3Å; S154-P170 WeakPolarHBondContact O-CD 3.43Å
171	N	51.5	Low	64.7	Low	160 Å²	160	76.3 Å²	76.3	86%	0.856	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-128.1	12	-172.6	-77	-14.7	0	0	0	115.4	Q169	Q169-N171 VanDerWaalsContact C-N 3.34Å; Q169-N171 PolarHBondContact O-N 3.01Å; Q169-N171 VanDerWaalsContact O-N 3.15Å
172	S	50	Low	65.4	Low	37 Å²	37	70 Å²	70	26%	0.259	34%	0.338	S	S	.	.			trans	-111.8	127	172.5	54.3	0	0	0	0	109.1	M174 D175	S172-M174 PolarHBondContact O-N 3.5Å; S172-D175 WeakPolarHBondContact OG-CA 3.25Å; S172-D175 VanDerWaalsContact OG-CB 3.28Å; S172-D175 WeakPolarHBondContact OG-CB 3.35Å; S172-D175 PolarHBondContact OG-N 3.49Å; S172-D175 PolarHBondContact OG-O 2.84Å
173	Q	49.4	Very low	65.9	Low	178 Å²	178	69.8 Å²	69.8	83%	0.832	34%	0.341	S	S	*	.	S	Bend	trans	-62.2	-13.6	178.9	-84.1	-96.1	-54.9	0	0	112.9
174	M	40.5	Very low	66.7	Low	165 Å²	165	71.2 Å²	71.2	81%	0.813	35%	0.352	S	S	*	.	S	Bend	trans	-149.3	1.8	-179.6	-75.6	-63.5	-77.6	0	0	116.5	S172 N176	S172-M174 PolarHBondContact O-N 3.5Å; M174-N176 PolarHBondContact O-N 3.22Å; M174-N176 VanDerWaalsContact O-N 3.07Å
175	D	51.2	Low	67.2	Low	108 Å²	108	72 Å²	72	58%	0.578	36%	0.359	S	S	*	.			trans	-92.2	81.9	-172.9	-54.6	-29.7	0	0	0	111.9	S172 V177	S172-D175 WeakPolarHBondContact OG-CA 3.25Å; S172-D175 VanDerWaalsContact OG-CB 3.28Å; S172-D175 WeakPolarHBondContact OG-CB 3.35Å; S172-D175 PolarHBondContact OG-N 3.49Å; S172-D175 PolarHBondContact OG-O 2.84Å; D175-V177 PolarHBondContact O-N 2.89Å
176	N	62	Low	67.7	Low	72 Å²	72	72.7 Å²	72.7	39%	0.385	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	116.4	151.4	-68.8	-33.9	0	0	0	107.4	W166 M174 Y178	W166-N176 HydrophobicContact CE3-CB 4.07Å; W166-N176 HydrophobicContact CZ3-CB 4.29Å; M174-N176 PolarHBondContact O-N 3.22Å; M174-N176 VanDerWaalsContact O-N 3.07Å; N176-Y178 PolarHBondContact O-N 3.1Å
177	V	65.5	Low	68.2	Low	32 Å²	32	71.3 Å²	71.3	19%	0.194	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	113.3	174.3	-178.2	0	0	0	0	107.5	M167 D175 L179 L213	M167-V177 HydrophobicContact CB-CB 4.45Å; M167-V177 HydrophobicContact CE-CB 3.91Å; M167-V177 HydrophobicContact CE-CG1 4.31Å; M167-V177 HydrophobicContact CE-CG2 3.9Å; M167-V177 PolarHBondContact N-O 2.7Å; M167-V177 WeakPolarHBondContact O-CB 3.41Å; M167-V177 PolarHBondContact O-N 2.84Å; D175-V177 PolarHBondContact O-N 2.89Å; V177-L179 HydrophobicContact CG1-CD2 3.91Å; V177-L179 HydrophobicContact CG1-CG 4Å; V177-L213 HydrophobicContact CB-CD1 4.29Å; V177-L213 HydrophobicContact CG1-CB 4.43Å; V177-L213 HydrophobicContact CG1-CD1 3.86Å; V177-L213 HydrophobicContact CG2-CD1 3.78Å
178	Y	69.6	Low	68.8	Low	95 Å²	95	71.7 Å²	71.7	37%	0.373	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	107.5	176.9	-175.5	-102.9	0	0	0	110	A164 W166 N176 R180	A164-Y178 HydrophobicContact CB-CD2 4.36Å; A164-Y178 HydrophobicContact CB-CE2 3.4Å; A164-Y178 VanDerWaalsContact CB-CE2 3.4Å; A164-Y178 WeakPolarHBondContact CB-OH 3.41Å; W166-Y178 AromaticContact CE2-CD2 3.9Å; W166-Y178 HydrophobicContact CZ2-CD2 4.35Å; W166-Y178 HydrophobicContact CZ2-CE2 4.48Å; W166-Y178 AromaticContact NE1-CD2 3.54Å; W166-Y178 AromaticContact NE1-CE2 3.51Å; N176-Y178 PolarHBondContact O-N 3.1Å; Y178-R180 HydrophobicContact CD1-CB 4.49Å; Y178-R180 HydrophobicContact CD1-CG 4.36Å; Y178-R180 HydrophobicContact CE1-CB 3.98Å; Y178-R180 HydrophobicContact CE1-CG 3.42Å; Y178-R180 VanDerWaalsContact CE1-CG 3.42Å; Y178-R180 VanDerWaalsContact OH-CZ 3.3Å; Y178-R180 PolarHBondContact OH-NE 2.92Å; Y178-R180 PolarHBondContact OH-NH2 3.22Å; Y178-R180 VanDerWaalsContact OH-NH2 3.11Å
179	L	75	Confident	69.7	Low	15 Å²	15	72.5 Å²	72.5	8%	0.079	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	114.1	179	-64.4	173.9	0	0	0	108.9	L165 V177 W208 L213	L165-L179 HydrophobicContact CB-CB 3.88Å; L165-L179 PolarHBondContact N-O 3.26Å; L165-L179 PolarHBondContact O-N 3.13Å; V177-L179 HydrophobicContact CG1-CD2 3.91Å; V177-L179 HydrophobicContact CG1-CG 4Å; L179-W208 HydrophobicContact CB-CE3 4.45Å; L179-W208 HydrophobicContact CB-CH2 3.87Å; L179-W208 HydrophobicContact CB-CZ2 4.35Å; L179-W208 HydrophobicContact CB-CZ3 3.94Å; L179-W208 HydrophobicContact CD1-CD2 4.24Å; L179-W208 HydrophobicContact CD1-CE3 4Å; L179-W208 HydrophobicContact CD1-CZ3 4.3Å; L179-W208 HydrophobicContact CD2-CE3 4.11Å; L179-W208 HydrophobicContact CD2-CZ3 3.85Å; L179-W208 HydrophobicContact CG-CE3 4.42Å; L179-W208 HydrophobicContact CG-CZ3 4.25Å; L179-L213 HydrophobicContact CD2-CB 4.36Å; L179-L213 WeakPolarHBondContact CD2-O 3.33Å
180	R	76.2	Confident	70.7	Confident	196 Å²	196	71.5 Å²	71.5	74%	0.74	37%	0.369	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.3	115.1	177.5	-117.8	-170.3	-162.5	179	9.2	110.1	Y178	Y178-R180 HydrophobicContact CD1-CB 4.49Å; Y178-R180 HydrophobicContact CD1-CG 4.36Å; Y178-R180 HydrophobicContact CE1-CB 3.98Å; Y178-R180 HydrophobicContact CE1-CG 3.42Å; Y178-R180 VanDerWaalsContact CE1-CG 3.42Å; Y178-R180 VanDerWaalsContact OH-CZ 3.3Å; Y178-R180 PolarHBondContact OH-NE 2.92Å; Y178-R180 PolarHBondContact OH-NH2 3.22Å; Y178-R180 VanDerWaalsContact OH-NH2 3.11Å
181	Y	82	Confident	71.9	Confident	83 Å²	83	73.5 Å²	73.5	33%	0.325	39%	0.385	S	S	.	.			trans	-144.9	-49.4	169.9	172.7	-102.5	0	0	0	110.6	A206 W208 L215 S218	Y181-A206 HydrophobicContact CD1-CB 3.55Å; Y181-A206 HydrophobicContact CE1-CB 3.83Å; Y181-A206 HydrophobicContact CG-CB 4.41Å; Y181-W208 VanDerWaalsContact CB-CH2 3.47Å; Y181-W208 HydrophobicContact CG-CH2 4.47Å; Y181-W208 HydrophobicContact CG-CZ2 4.35Å; Y181-L215 HydrophobicContact CD2-CD2 3.41Å; Y181-L215 VanDerWaalsContact CD2-CD2 3.41Å; Y181-L215 HydrophobicContact CE2-CD2 3.53Å; Y181-L215 HydrophobicContact CG-CD1 4.36Å; Y181-L215 HydrophobicContact CG-CD2 4.04Å; Y181-S218 WeakPolarHBondContact OH-CB 3.46Å; Y181-S218 PolarHBondContact OH-OG 3.31Å
182	H	85	Confident	73	Confident	8 Å²	8	69.1 Å²	69.1	4%	0.037	36%	0.361	C	S	.	.			trans	-69	139.4	-178.7	-66.7	-61.2	0	0	0	111.9	V186 S198 S200 D202 T204	H182-V186 HydrophobicContact CB-CG2 4.22Å; H182-S198 WeakPolarHBondContact NE2-CB 3.29Å; H182-S198 PolarHBondContact NE2-O 2.94Å; H182-S198 PolarHBondContact NE2-OG 3.33Å; H182-S200 VanDerWaalsContact CG-CB 3.48Å; H182-S200 WeakPolarHBondContact ND1-CB 3.39Å; H182-D202 WeakPolarHBondContact CA-OD2 3.36Å; H182-D202 WeakPolarHBondContact CB-OD2 3.48Å; H182-D202 IonicContact CE1-OD2 2.68Å; H182-D202 IonicContact CG-OD2 3.42Å; H182-D202 IonicContact ND1-OD1 3.97Å; H182-D202 PolarHBondContact ND1-OD1 2.85Å; H182-D202 IonicContact ND1-OD2 2.79Å; H182-D202 PolarHBondContact ND1-OD2 3.27Å; H182-T204 PolarHBondContact CE1-OG1 2.99Å; H182-T204 PolarHBondContact ND1-OG1 3.1Å
183	S	84	Confident	74.1	Confident	104 Å²	104	74.7 Å²	74.7	73%	0.727	39%	0.388	S	S	*	.	S	Bend	trans	-93.9	-6.5	176.4	62.8	0	0	0	0	113.2	D202	S183-D202 PolarHBondContact N-OD2 3.38Å; S183-D202 WeakPolarHBondContact OG-CB 3.17Å
184	A	86.6	Confident	75.7	Confident	29 Å²	29	69.7 Å²	69.7	24%	0.24	37%	0.369	C	S	.	.	S	Bend	trans	-139.6	172	-179.2	0	0	0	0	0	111.1	G163 V186 S200 R201 D202	G163-A184 WeakPolarHBondContact CA-O 3.37Å; A184-V186 PolarHBondContact O-N 3.19Å; A184-S200 PolarHBondContact O-OG 3.44Å; A184-R201 HydrophobicContact CB-CB 4.31Å; A184-D202 HydrophobicContact CB-CB 3.99Å
185	A	84.4	Confident	77.8	Confident	19 Å²	19	63.5 Å²	63.5	16%	0.157	34%	0.339	C	S	.	.			trans	-48.6	129.3	-177.4	0	0	0	0	0	113.4	D161 T187 S200 R201	D161-A185 HydrophobicContact CB-CB 4.38Å; D161-A185 VanDerWaalsContact O-CA 3.31Å; D161-A185 WeakPolarHBondContact O-CA 3.43Å; D161-A185 PolarHBondContact O-N 2.9Å; A185-T187 PolarHBondContact O-N 2.69Å; A185-S200 WeakPolarHBondContact O-CA 3.45Å; A185-S200 PolarHBondContact O-OG 3.21Å; A185-R201 PolarHBondContact O-N 3.44Å
186	V	85.5	Confident	79.4	Confident	15 Å²	15	58.6 Å²	58.6	9%	0.091	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	108.2	173.1	-176.2	0	0	0	0	108.2	C160 L165 H182 A184 L189 G199	C160-V186 PolarHBondContact O-N 3.47Å; L165-V186 HydrophobicContact CD1-CG2 3.99Å; L165-V186 HydrophobicContact CG-CG2 4.38Å; H182-V186 HydrophobicContact CB-CG2 4.22Å; A184-V186 PolarHBondContact O-N 3.19Å; V186-L189 HydrophobicContact CG1-CD1 4.3Å; V186-L189 HydrophobicContact CG1-CD2 3.96Å; V186-L189 HydrophobicContact CG1-CG 3.82Å; V186-G199 WeakPolarHBondContact CA-O 3.29Å
187	T	84.7	Confident	80.6	Confident	47 Å²	47	56.8 Å²	56.8	29%	0.288	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	-31.4	-175	51.3	0	0	0	0	112.3	A185 G199 R201 V225 E226	A185-T187 PolarHBondContact O-N 2.69Å; T187-G199 PolarHBondContact N-O 3.39Å; T187-G199 PolarHBondContact OG1-O 2.87Å; T187-R201 HydrophobicContact CG2-CG 3.68Å; T187-V225 WeakPolarHBondContact CB-O 3.24Å; T187-V225 WeakPolarHBondContact CG2-O 3.46Å; T187-V225 PolarHBondContact OG1-O 2.85Å; T187-E226 WeakPolarHBondContact CB-O 3.26Å; T187-E226 PolarHBondContact OG1-O 3.49Å
188	S	83.6	Confident	81.6	Confident	13 Å²	13	55.3 Å²	55.3	9%	0.091	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	137	-175.3	54.9	0	0	0	0	111.8	S198 G199 L228	S188-S198 WeakPolarHBondContact O-CA 3.46Å; S188-G199 PolarHBondContact N-O 3.01Å; S188-G199 PolarHBondContact O-N 3.13Å; S188-L228 WeakPolarHBondContact OG-CG 3.32Å
189	L	83.9	Confident	82.5	Confident	54 Å²	54	50.8 Å²	50.8	28%	0.283	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	128.2	176.3	-78	169.7	0	0	0	109.6	F158 L165 V186 L196 F197 S198	F158-L189 VanDerWaalsContact C-CD1 3.44Å; L165-L189 HydrophobicContact CD2-CD2 3.46Å; L165-L189 VanDerWaalsContact CD2-CD2 3.46Å; L165-L189 HydrophobicContact CG-CD2 4.34Å; V186-L189 HydrophobicContact CG1-CD1 4.3Å; V186-L189 HydrophobicContact CG1-CD2 3.96Å; V186-L189 HydrophobicContact CG1-CG 3.82Å; L189-L196 HydrophobicContact CD2-CD1 4.31Å; L189-F197 WeakPolarHBondContact CA-O 3.29Å; L189-S198 VanDerWaalsContact CD2-CB 3.47Å
190	I	81.5	Confident	83.2	Confident	36 Å²	36	50 Å²	50	19%	0.185	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	125.7	179.6	-56.6	177.3	0	0	0	108.6	F197 L228 L230	I190-F197 PolarHBondContact N-O 3.06Å; I190-F197 PolarHBondContact O-N 2.87Å; I190-L228 HydrophobicContact CD1-CB 3.51Å; I190-L228 WeakPolarHBondContact CD1-O 3.41Å; I190-L228 HydrophobicContact CG1-CB 4.4Å; I190-L230 HydrophobicContact CG2-CB 3.94Å
191	S	77.2	Confident	83.9	Confident	78 Å²	78	46.8 Å²	46.8	55%	0.545	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	145.8	171.5	53.7	0	0	0	0	111.2
192	N	75.2	Confident	84.2	Confident	68 Å²	68	44.3 Å²	44.3	36%	0.364	25%	0.251	S	S	.	.			trans	-105.3	177.8	154.7	-161.7	-3	0	0	0	108.1	V194 L195 L210 L230	N192-V194 PolarHBondContact O-N 2.73Å; N192-V194 VanDerWaalsContact O-N 3.1Å; N192-L195 PolarHBondContact N-O 3.4Å; N192-L210 WeakPolarHBondContact O-CD1 3.36Å; N192-L230 HydrophobicContact CB-CD2 3.77Å
193	D	74.3	Confident	84.5	Confident	154 Å²	154	49.3 Å²	49.3	82%	0.824	27%	0.273	S	S	*	.	S	Bend	trans	-61.4	-22.2	178.5	-67.9	-24.6	0	0	0	113.3
194	V	80.9	Confident	84.8	Confident	72 Å²	72	45.5 Å²	45.5	44%	0.436	25%	0.245	S	C	.	.	S	Bend	trans	-116.4	-36.5	-175.2	-176.5	0	0	0	0	113.4	N192 L210	N192-V194 PolarHBondContact O-N 2.73Å; N192-V194 VanDerWaalsContact O-N 3.1Å; V194-L210 WeakPolarHBondContact O-CB 3.23Å; V194-L210 PolarHBondContact O-N 2.97Å
195	L	85.5	Confident	85	Confident	36 Å²	36	45.5 Å²	45.5	19%	0.188	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	143.9	-170.5	-62.4	174.9	0	0	0	110.9	N192 F197 V207 W208 K216	N192-L195 PolarHBondContact N-O 3.4Å; L195-F197 HydrophobicContact CB-CE2 3.87Å; L195-F197 HydrophobicContact CB-CZ 4.14Å; L195-F197 HydrophobicContact CD1-CZ 4.06Å; L195-V207 HydrophobicContact CB-CG1 4.43Å; L195-V207 HydrophobicContact CD1-CG1 4.17Å; L195-V207 HydrophobicContact CD2-CG1 4.27Å; L195-W208 CarbonylContact C-O 3.38Å; L195-W208 VanDerWaalsContact CA-O 3.3Å; L195-W208 WeakPolarHBondContact CA-O 3.45Å; L195-K216 HydrophobicContact CD2-CD 3.98Å
196	L	84.6	Confident	85.2	Confident	5 Å²	5	44.6 Å²	44.6	3%	0.026	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	130.7	169.4	172.4	74.2	0	0	0	108.9	A157 L165 L189 W208 L210	A157-L196 HydrophobicContact CB-CD1 4.4Å; A157-L196 HydrophobicContact CB-CD2 4.2Å; L165-L196 HydrophobicContact CD2-CD2 4.13Å; L189-L196 HydrophobicContact CD2-CD1 4.31Å; L196-W208 HydrophobicContact CB-CB 4.13Å; L196-W208 PolarHBondContact N-O 3.29Å; L196-W208 PolarHBondContact O-N 3.26Å; L196-L210 HydrophobicContact CB-CD2 3.78Å; L196-L210 HydrophobicContact CB-CG 4.09Å
197	F	87.7	Confident	85.4	Confident	34 Å²	34	44.2 Å²	44.2	15%	0.149	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	130.4	176.9	-62.2	-90.1	0	0	0	109	L189 I190 L195 A206 V207 L230	L189-F197 WeakPolarHBondContact CA-O 3.29Å; I190-F197 PolarHBondContact N-O 3.06Å; I190-F197 PolarHBondContact O-N 2.87Å; L195-F197 HydrophobicContact CB-CE2 3.87Å; L195-F197 HydrophobicContact CB-CZ 4.14Å; L195-F197 HydrophobicContact CD1-CZ 4.06Å; F197-A206 WeakPolarHBondContact CA-O 3.34Å; F197-V207 HydrophobicContact CD1-CB 4.33Å; F197-V207 HydrophobicContact CD1-CG1 4.12Å; F197-V207 HydrophobicContact CD1-CG2 3.72Å; F197-V207 HydrophobicContact CE1-CB 4.22Å; F197-V207 HydrophobicContact CE1-CG1 3.67Å; F197-V207 HydrophobicContact CE1-CG2 3.63Å; F197-V207 HydrophobicContact CZ-CG1 4.13Å; F197-L230 HydrophobicContact CD2-CD1 4.48Å; F197-L230 HydrophobicContact CE2-CD1 3.92Å; F197-L230 HydrophobicContact CZ-CD1 4.33Å
198	S	87.5	Confident	85.5	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	124.5	175.6	60.7	0	0	0	0	110.6	H182 S188 L189 I205 A206 W208	H182-S198 WeakPolarHBondContact NE2-CB 3.29Å; H182-S198 PolarHBondContact NE2-O 2.94Å; H182-S198 PolarHBondContact NE2-OG 3.33Å; S188-S198 WeakPolarHBondContact O-CA 3.46Å; L189-S198 VanDerWaalsContact CD2-CB 3.47Å; S198-I205 CarbonylContact O-C 3.6Å; S198-I205 VanDerWaalsContact O-CA 3.28Å; S198-I205 WeakPolarHBondContact O-CA 3.25Å; S198-A206 PolarHBondContact N-O 3.49Å; S198-A206 PolarHBondContact O-N 2.85Å; S198-A206 WeakPolarHBondContact OG-CB 3Å; S198-W208 PolarHBondContact OG-NE1 3.1Å
199	G	88	Confident	85.6	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	136.6	173.9	0	0	0	0	0	110.2	V186 T187 S188	V186-G199 WeakPolarHBondContact CA-O 3.29Å; T187-G199 PolarHBondContact N-O 3.39Å; T187-G199 PolarHBondContact OG1-O 2.87Å; S188-G199 PolarHBondContact N-O 3.01Å; S188-G199 PolarHBondContact O-N 3.13Å
200	S	90.2	Very high	85.2	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	159.1	179.8	173.7	0	0	0	0	112.3	H182 A184 A185 D202 K203 T204 V225	H182-S200 VanDerWaalsContact CG-CB 3.48Å; H182-S200 WeakPolarHBondContact ND1-CB 3.39Å; A184-S200 PolarHBondContact O-OG 3.44Å; A185-S200 WeakPolarHBondContact O-CA 3.45Å; A185-S200 PolarHBondContact O-OG 3.21Å; S200-D202 VanDerWaalsContact CB-OD1 3.29Å; S200-D202 WeakPolarHBondContact CB-OD1 3.18Å; S200-D202 PolarHBondContact O-N 3.3Å; S200-D202 PolarHBondContact OG-N 3.41Å; S200-D202 PolarHBondContact OG-OD1 2.83Å; S200-K203 PolarHBondContact O-N 3.37Å; S200-T204 PolarHBondContact N-O 3.45Å; S200-V225 PolarHBondContact O-N 2.84Å
201	R	89	Confident	85.2	Confident	128 Å²	128	49 Å²	49	48%	0.483	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-7.7	170.1	-68.2	-172.8	171.3	161.3	5.1	113.5	A184 A185 T187 K203 A224 E226	A184-R201 HydrophobicContact CB-CB 4.31Å; A185-R201 PolarHBondContact O-N 3.44Å; T187-R201 HydrophobicContact CG2-CG 3.68Å; R201-K203 PolarHBondContact O-N 3Å; R201-K203 VanDerWaalsContact O-N 3.13Å; R201-A224 HydrophobicContact CB-CB 4.27Å; R201-A224 HydrophobicContact CG-CB 4.27Å; R201-E226 IonicContact CZ-OE1 3.47Å; R201-E226 IonicContact CZ-OE2 2.91Å; R201-E226 IonicContact NE-OE1 3.95Å; R201-E226 PolarHBondContact NE-OE1 3.49Å; R201-E226 IonicContact NE-OE2 3.62Å; R201-E226 IonicContact NH2-OE1 2.95Å; R201-E226 PolarHBondContact NH2-OE1 2.8Å; R201-E226 IonicContact NH2-OE2 3.59Å; R201-E226 PolarHBondContact NH2-OE2 2.82Å
202	D	89.2	Confident	85.2	Confident	31 Å²	31	48.1 Å²	48.1	17%	0.166	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.4	2.7	169.4	69.4	9.3	0	0	0	113.6	H182 S183 A184 S200 T204	H182-D202 WeakPolarHBondContact CA-OD2 3.36Å; H182-D202 WeakPolarHBondContact CB-OD2 3.48Å; H182-D202 IonicContact CE1-OD2 2.68Å; H182-D202 IonicContact CG-OD2 3.42Å; H182-D202 IonicContact ND1-OD1 3.97Å; H182-D202 PolarHBondContact ND1-OD1 2.85Å; H182-D202 IonicContact ND1-OD2 2.79Å; H182-D202 PolarHBondContact ND1-OD2 3.27Å; S183-D202 PolarHBondContact N-OD2 3.38Å; S183-D202 WeakPolarHBondContact OG-CB 3.17Å; A184-D202 HydrophobicContact CB-CB 3.99Å; S200-D202 VanDerWaalsContact CB-OD1 3.29Å; S200-D202 WeakPolarHBondContact CB-OD1 3.18Å; S200-D202 PolarHBondContact O-N 3.3Å; S200-D202 PolarHBondContact OG-N 3.41Å; S200-D202 PolarHBondContact OG-OD1 2.83Å; D202-T204 VanDerWaalsContact C-N 3.31Å; D202-T204 WeakPolarHBondContact OD1-CA 3.05Å; D202-T204 WeakPolarHBondContact OD1-CB 2.99Å; D202-T204 PolarHBondContact OD1-N 3.16Å; D202-T204 PolarHBondContact OD1-OG1 2.61Å; D202-T204 PolarHBondContact OD2-OG1 3.27Å
203	K	90.8	Very high	85.4	Confident	112 Å²	112	46.5 Å²	46.5	49%	0.487	23%	0.231	S	C	.	.	S	Bend	trans	71.9	23.1	178.9	-46.2	168.8	170.3	-168.3	0	113.3	S200 R201 A221 Y222 E223	S200-K203 PolarHBondContact O-N 3.37Å; R201-K203 PolarHBondContact O-N 3Å; R201-K203 VanDerWaalsContact O-N 3.13Å; K203-A221 WeakPolarHBondContact O-CA 3.25Å; K203-A221 WeakPolarHBondContact O-CB 3.35Å; K203-A221 PolarHBondContact O-N 2.89Å; K203-Y222 WeakPolarHBondContact CD-O 3.47Å; K203-Y222 PolarHBondContact O-N 2.91Å; K203-E223 VanDerWaalsContact CA-O 3.31Å; K203-E223 WeakPolarHBondContact CA-O 3.39Å
204	T	91	Very high	85.8	Confident	24 Å²	24	45.8 Å²	45.8	15%	0.147	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	151.8	177.6	72.7	0	0	0	0	112.3	H182 S200 D202 I219	H182-T204 PolarHBondContact CE1-OG1 2.99Å; H182-T204 PolarHBondContact ND1-OG1 3.1Å; S200-T204 PolarHBondContact N-O 3.45Å; D202-T204 VanDerWaalsContact C-N 3.31Å; D202-T204 WeakPolarHBondContact OD1-CA 3.05Å; D202-T204 WeakPolarHBondContact OD1-CB 2.99Å; D202-T204 PolarHBondContact OD1-N 3.16Å; D202-T204 PolarHBondContact OD1-OG1 2.61Å; D202-T204 PolarHBondContact OD2-OG1 3.27Å; T204-I219 WeakPolarHBondContact CA-O 3.37Å
205	I	90.2	Very high	86.1	Confident	29 Å²	29	45.5 Å²	45.5	15%	0.149	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	118.1	169.3	-57	164.5	0	0	0	107.1	S198 I219 A221 V225 L228	S198-I205 CarbonylContact O-C 3.6Å; S198-I205 VanDerWaalsContact O-CA 3.28Å; S198-I205 WeakPolarHBondContact O-CA 3.25Å; I205-I219 HydrophobicContact CB-CB 4.25Å; I205-I219 PolarHBondContact N-O 3.35Å; I205-I219 PolarHBondContact O-N 2.89Å; I205-A221 HydrophobicContact CD1-CB 4.43Å; I205-A221 HydrophobicContact CG1-CB 4.48Å; I205-V225 HydrophobicContact CD1-CG2 4.37Å; I205-V225 HydrophobicContact CG1-CG2 3.89Å; I205-L228 HydrophobicContact CD1-CD2 3.7Å; I205-L228 HydrophobicContact CG1-CD1 4.42Å; I205-L228 HydrophobicContact CG1-CD2 4.15Å; I205-L228 HydrophobicContact CG2-CD1 3.99Å
206	A	89.5	Confident	86.1	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	137.3	175.6	0	0	0	0	0	111	Y181 F197 S198 W208 L215	Y181-A206 HydrophobicContact CD1-CB 3.55Å; Y181-A206 HydrophobicContact CE1-CB 3.83Å; Y181-A206 HydrophobicContact CG-CB 4.41Å; F197-A206 WeakPolarHBondContact CA-O 3.34Å; S198-A206 PolarHBondContact N-O 3.49Å; S198-A206 PolarHBondContact O-N 2.85Å; S198-A206 WeakPolarHBondContact OG-CB 3Å; A206-W208 HydrophobicContact CB-CZ2 4.2Å; A206-L215 HydrophobicContact CB-CD1 3.48Å; A206-L215 VanDerWaalsContact CB-CD1 3.48Å
207	V	89.7	Confident	86.2	Confident	7 Å²	7	56.3 Å²	56.3	4%	0.042	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	115.3	175.6	-171.8	0	0	0	0	107.7	L195 F197 K216 R217 I219	L195-V207 HydrophobicContact CB-CG1 4.43Å; L195-V207 HydrophobicContact CD1-CG1 4.17Å; L195-V207 HydrophobicContact CD2-CG1 4.27Å; F197-V207 HydrophobicContact CD1-CB 4.33Å; F197-V207 HydrophobicContact CD1-CG1 4.12Å; F197-V207 HydrophobicContact CD1-CG2 3.72Å; F197-V207 HydrophobicContact CE1-CB 4.22Å; F197-V207 HydrophobicContact CE1-CG1 3.67Å; F197-V207 HydrophobicContact CE1-CG2 3.63Å; F197-V207 HydrophobicContact CZ-CG1 4.13Å; V207-K216 WeakPolarHBondContact O-CB 3.41Å; V207-K216 PolarHBondContact O-N 3.19Å; V207-R217 HydrophobicContact CB-CB 4.12Å; V207-R217 HydrophobicContact CG2-CB 4.2Å; V207-R217 PolarHBondContact N-O 3.25Å; V207-R217 PolarHBondContact O-N 2.78Å; V207-I219 HydrophobicContact CG2-CD1 4.03Å
208	W	86.6	Confident	86.3	Confident	11 Å²	11	57 Å²	57	4%	0.042	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	142.8	-179.2	-52	87.3	0	0	0	109.8	L165 L179 Y181 L195 L196 S198 A206 E214 L215	L165-W208 HydrophobicContact CD1-CZ2 4.05Å; L179-W208 HydrophobicContact CB-CE3 4.45Å; L179-W208 HydrophobicContact CB-CH2 3.87Å; L179-W208 HydrophobicContact CB-CZ2 4.35Å; L179-W208 HydrophobicContact CB-CZ3 3.94Å; L179-W208 HydrophobicContact CD1-CD2 4.24Å; L179-W208 HydrophobicContact CD1-CE3 4Å; L179-W208 HydrophobicContact CD1-CZ3 4.3Å; L179-W208 HydrophobicContact CD2-CE3 4.11Å; L179-W208 HydrophobicContact CD2-CZ3 3.85Å; L179-W208 HydrophobicContact CG-CE3 4.42Å; L179-W208 HydrophobicContact CG-CZ3 4.25Å; Y181-W208 VanDerWaalsContact CB-CH2 3.47Å; Y181-W208 HydrophobicContact CG-CH2 4.47Å; Y181-W208 HydrophobicContact CG-CZ2 4.35Å; L195-W208 CarbonylContact C-O 3.38Å; L195-W208 VanDerWaalsContact CA-O 3.3Å; L195-W208 WeakPolarHBondContact CA-O 3.45Å; L196-W208 HydrophobicContact CB-CB 4.13Å; L196-W208 PolarHBondContact N-O 3.29Å; L196-W208 PolarHBondContact O-N 3.26Å; S198-W208 PolarHBondContact OG-NE1 3.1Å; A206-W208 HydrophobicContact CB-CZ2 4.2Å; W208-E214 WeakPolarHBondContact CA-O 3.01Å; W208-L215 HydrophobicContact CD2-CD1 4.24Å; W208-L215 HydrophobicContact CE3-CB 4.08Å; W208-L215 HydrophobicContact CE3-CD1 4.38Å; W208-L215 HydrophobicContact CH2-CB 4.49Å; W208-L215 HydrophobicContact CH2-CD1 4.43Å; W208-L215 HydrophobicContact CZ2-CD1 4.28Å; W208-L215 HydrophobicContact CZ3-CB 3.95Å; W208-L215 HydrophobicContact CZ3-CD1 4.47Å
209	D	85.1	Confident	86.3	Confident	37 Å²	37	59 Å²	59	20%	0.198	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	124.8	167.8	-170	-25.1	0	0	0	109.4	K211 S212 L213 E214	D209-K211 PolarHBondContact O-N 3.46Å; D209-K211 PolarHBondContact OD1-N 2.67Å; D209-S212 WeakPolarHBondContact CB-OG 3.28Å; D209-L213 WeakPolarHBondContact O-CA 3.49Å; D209-L213 PolarHBondContact O-N 2.72Å; D209-E214 PolarHBondContact N-O 3.45Å; D209-E214 VanDerWaalsContact N-O 3.08Å
210	L	76.8	Confident	86.3	Confident	29 Å²	29	62.2 Å²	62.2	15%	0.152	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-15.8	-178.8	-76.1	171.9	0	0	0	113.5	M167 N192 V194 L196 L213	M167-L210 HydrophobicContact SD-CD2 4.1Å; N192-L210 WeakPolarHBondContact O-CD1 3.36Å; V194-L210 WeakPolarHBondContact O-CB 3.23Å; V194-L210 PolarHBondContact O-N 2.97Å; L196-L210 HydrophobicContact CB-CD2 3.78Å; L196-L210 HydrophobicContact CB-CG 4.09Å; L210-L213 WeakPolarHBondContact O-CD2 3.24Å
211	K	80.2	Confident	86.1	Confident	173 Å²	173	63.9 Å²	63.9	75%	0.752	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.8	-51.9	178.1	-67.5	-175.6	179.9	-179.8	0	111.9	D209	D209-K211 PolarHBondContact O-N 3.46Å; D209-K211 PolarHBondContact OD1-N 2.67Å
212	S	78.4	Confident	85.9	Confident	61 Å²	61	65.4 Å²	65.4	43%	0.427	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-19.5	179.9	65.8	0	0	0	0	113.6	D209 E214	D209-S212 WeakPolarHBondContact CB-OG 3.28Å; S212-E214 PolarHBondContact O-N 2.86Å; S212-E214 PolarHBondContact OG-N 2.97Å
213	L	77.9	Confident	85.8	Confident	34 Å²	34	71.1 Å²	71.1	18%	0.178	35%	0.346	C	S	.	.			trans	62	20.9	-176.2	-51.1	175	0	0	0	113.6	M167 V177 L179 D209 L210	M167-L213 HydrophobicContact CE-CD1 3.41Å; M167-L213 VanDerWaalsContact CE-CD1 3.41Å; M167-L213 HydrophobicContact CE-CD2 3.09Å; M167-L213 HydrophobicContact CE-CG 3.84Å; M167-L213 HydrophobicContact SD-CD2 3.49Å; M167-L213 WeakPolarHBondContact SD-CD2 3.5Å; V177-L213 HydrophobicContact CB-CD1 4.29Å; V177-L213 HydrophobicContact CG1-CB 4.43Å; V177-L213 HydrophobicContact CG1-CD1 3.86Å; V177-L213 HydrophobicContact CG2-CD1 3.78Å; L179-L213 HydrophobicContact CD2-CB 4.36Å; L179-L213 WeakPolarHBondContact CD2-O 3.33Å; D209-L213 WeakPolarHBondContact O-CA 3.49Å; D209-L213 PolarHBondContact O-N 2.72Å; L210-L213 WeakPolarHBondContact O-CD2 3.24Å
214	E	84.4	Confident	85.7	Confident	138 Å²	138	68 Å²	68	65%	0.645	34%	0.341	S	S	*	.			trans	-96.2	150.7	175.6	-65.5	-180	161.6	0	0	111.1	W208 D209 S212 K216	W208-E214 WeakPolarHBondContact CA-O 3.01Å; D209-E214 PolarHBondContact N-O 3.45Å; D209-E214 VanDerWaalsContact N-O 3.08Å; S212-E214 PolarHBondContact O-N 2.86Å; S212-E214 PolarHBondContact OG-N 2.97Å; E214-K216 PolarHBondContact O-N 3.02Å; E214-K216 VanDerWaalsContact O-N 3.16Å
215	L	85.3	Confident	85.6	Confident	66 Å²	66	67.5 Å²	67.5	35%	0.346	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	107.7	170.7	-179.6	73.1	0	0	0	109	Y181 A206 W208	Y181-L215 HydrophobicContact CD2-CD2 3.41Å; Y181-L215 VanDerWaalsContact CD2-CD2 3.41Å; Y181-L215 HydrophobicContact CE2-CD2 3.53Å; Y181-L215 HydrophobicContact CG-CD1 4.36Å; Y181-L215 HydrophobicContact CG-CD2 4.04Å; A206-L215 HydrophobicContact CB-CD1 3.48Å; A206-L215 VanDerWaalsContact CB-CD1 3.48Å; W208-L215 HydrophobicContact CD2-CD1 4.24Å; W208-L215 HydrophobicContact CE3-CB 4.08Å; W208-L215 HydrophobicContact CE3-CD1 4.38Å; W208-L215 HydrophobicContact CH2-CB 4.49Å; W208-L215 HydrophobicContact CH2-CD1 4.43Å; W208-L215 HydrophobicContact CZ2-CD1 4.28Å; W208-L215 HydrophobicContact CZ3-CB 3.95Å; W208-L215 HydrophobicContact CZ3-CD1 4.47Å
216	K	86.7	Confident	85.5	Confident	137 Å²	137	67.6 Å²	67.6	60%	0.596	34%	0.338	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.7	-37.3	179.3	-173.3	174.7	-176.3	169.8	0	112.3	L195 V207 E214	L195-K216 HydrophobicContact CD2-CD 3.98Å; V207-K216 WeakPolarHBondContact O-CB 3.41Å; V207-K216 PolarHBondContact O-N 3.19Å; E214-K216 PolarHBondContact O-N 3.02Å; E214-K216 VanDerWaalsContact O-N 3.16Å
217	R	86.8	Confident	85.4	Confident	132 Å²	132	68.8 Å²	68.8	50%	0.498	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.7	143.9	-177.6	-174.5	177.3	-68.5	-156.3	-3.3	110.9	V207 I219 F238	V207-R217 HydrophobicContact CB-CB 4.12Å; V207-R217 HydrophobicContact CG2-CB 4.2Å; V207-R217 PolarHBondContact N-O 3.25Å; V207-R217 PolarHBondContact O-N 2.78Å; R217-I219 HydrophobicContact CG-CG1 4.12Å; R217-F238 VanDerWaalsContact NH1-CD2 3.33Å
218	S	88.6	Confident	85.3	Confident	47 Å²	47	70.1 Å²	70.1	33%	0.329	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	135	162	171.8	0	0	0	0	109.9	Y181	Y181-S218 WeakPolarHBondContact OH-CB 3.46Å; Y181-S218 PolarHBondContact OH-OG 3.31Å
219	I	89	Confident	85.2	Confident	44 Å²	44	71.9 Å²	71.9	23%	0.226	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	116.1	178.2	-56.2	167.1	0	0	0	107.4	T204 I205 V207 R217 A221 F238	T204-I219 WeakPolarHBondContact CA-O 3.37Å; I205-I219 HydrophobicContact CB-CB 4.25Å; I205-I219 PolarHBondContact N-O 3.35Å; I205-I219 PolarHBondContact O-N 2.89Å; V207-I219 HydrophobicContact CG2-CD1 4.03Å; R217-I219 HydrophobicContact CG-CG1 4.12Å; I219-A221 PolarHBondContact O-N 3.32Å; I219-F238 HydrophobicContact CD1-CD1 4.21Å; I219-F238 HydrophobicContact CD1-CE1 3.42Å; I219-F238 VanDerWaalsContact CD1-CE1 3.42Å; I219-F238 HydrophobicContact CD1-CZ 3.92Å
220	P	87.8	Confident	84.9	Confident	66 Å²	66	72.8 Å²	72.8	43%	0.429	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	119.9	174	28.5	-32.2	0	0	0	110	Y222	P220-Y222 HydrophobicContact CB-CD2 4.44Å; P220-Y222 HydrophobicContact CB-CE1 4.25Å; P220-Y222 HydrophobicContact CB-CE2 4.01Å; P220-Y222 HydrophobicContact CG-CE2 4.01Å; P220-Y222 WeakPolarHBondContact O-CE2 3.13Å
221	A	85.3	Confident	84.9	Confident	36 Å²	36	73.9 Å²	73.9	30%	0.298	37%	0.373	S	S	.	.			trans	-84.9	-20.9	173.5	0	0	0	0	0	112.2	K203 I205 I219 E223 V225	K203-A221 WeakPolarHBondContact O-CA 3.25Å; K203-A221 WeakPolarHBondContact O-CB 3.35Å; K203-A221 PolarHBondContact O-N 2.89Å; I205-A221 HydrophobicContact CD1-CB 4.43Å; I205-A221 HydrophobicContact CG1-CB 4.48Å; I219-A221 PolarHBondContact O-N 3.32Å; A221-E223 PolarHBondContact O-N 2.81Å; A221-V225 HydrophobicContact CB-CG2 3.52Å
222	Y	85.4	Confident	84.4	Confident	159 Å²	159	71.2 Å²	71.2	62%	0.624	37%	0.367	S	S	*	.	S	Bend	trans	65.4	-17	-177	-55.5	-82.3	0	0	0	115.7	K203 P220	K203-Y222 WeakPolarHBondContact CD-O 3.47Å; K203-Y222 PolarHBondContact O-N 2.91Å; P220-Y222 HydrophobicContact CB-CD2 4.44Å; P220-Y222 HydrophobicContact CB-CE1 4.25Å; P220-Y222 HydrophobicContact CB-CE2 4.01Å; P220-Y222 HydrophobicContact CG-CE2 4.01Å; P220-Y222 WeakPolarHBondContact O-CE2 3.13Å
223	E	86.7	Confident	83.6	Confident	152 Å²	152	72.3 Å²	72.3	71%	0.71	37%	0.371	S	S	*	.	S	Bend	trans	-122.9	158.1	170	-68	-178.2	173.3	0	0	110.2	K203 A221 V225	K203-E223 VanDerWaalsContact CA-O 3.31Å; K203-E223 WeakPolarHBondContact CA-O 3.39Å; A221-E223 PolarHBondContact O-N 2.81Å; E223-V225 PolarHBondContact O-N 2.8Å
224	A	88.1	Confident	82.7	Confident	45 Å²	45	76.5 Å²	76.5	37%	0.372	40%	0.403	S	S	.	.			trans	-63.7	124.5	179.5	0	0	0	0	0	109.6	R201	R201-A224 HydrophobicContact CB-CB 4.27Å; R201-A224 HydrophobicContact CG-CB 4.27Å
225	V	88.3	Confident	81.3	Confident	14 Å²	14	75.2 Å²	75.2	9%	0.085	40%	0.401	C	S	.	.			trans	-82.4	121.1	179.7	-177	0	0	0	0	108	T187 S200 I205 A221 E223 L228	T187-V225 WeakPolarHBondContact CB-O 3.24Å; T187-V225 WeakPolarHBondContact CG2-O 3.46Å; T187-V225 PolarHBondContact OG1-O 2.85Å; S200-V225 PolarHBondContact O-N 2.84Å; I205-V225 HydrophobicContact CD1-CG2 4.37Å; I205-V225 HydrophobicContact CG1-CG2 3.89Å; A221-V225 HydrophobicContact CB-CG2 3.52Å; E223-V225 PolarHBondContact O-N 2.8Å; V225-L228 HydrophobicContact CG1-CD1 4.38Å; V225-L228 HydrophobicContact CG1-CD2 3.74Å; V225-L228 HydrophobicContact CG1-CG 3.79Å
226	E	88.8	Confident	79.8	Confident	32 Å²	32	76.1 Å²	76.1	15%	0.15	43%	0.426	C	S	.	.			trans	-95.6	-37	172.9	-66.9	-57.6	136.8	0	0	111.9	T187 R201 R248	T187-E226 WeakPolarHBondContact CB-O 3.26Å; T187-E226 PolarHBondContact OG1-O 3.49Å; R201-E226 IonicContact CZ-OE1 3.47Å; R201-E226 IonicContact CZ-OE2 2.91Å; R201-E226 IonicContact NE-OE1 3.95Å; R201-E226 PolarHBondContact NE-OE1 3.49Å; R201-E226 IonicContact NE-OE2 3.62Å; R201-E226 IonicContact NH2-OE1 2.95Å; R201-E226 PolarHBondContact NH2-OE1 2.8Å; R201-E226 IonicContact NH2-OE2 3.59Å; R201-E226 PolarHBondContact NH2-OE2 2.82Å; E226-R248 IonicContact OE1-CZ 2.84Å; E226-R248 IonicContact OE1-NH2 3.99Å; E226-R248 PolarHBondContact OE1-NH2 2.8Å; E226-R248 IonicContact OE2-NH2 2.9Å
227	S	87.8	Confident	78.5	Confident	24 Å²	24	74.6 Å²	74.6	17%	0.168	43%	0.428	C	S	.	.			trans	-148	152.9	-176.8	-160.4	0	0	0	0	111.6	L252	S227-L252 VanDerWaalsContact CB-N 3.33Å; S227-L252 PolarHBondContact OG-N 2.9Å
228	L	87.2	Confident	77	Confident	35 Å²	35	75.1 Å²	75.1	18%	0.183	43%	0.434	C	S	.	.			trans	-129	158.1	176.5	-68.5	173.9	0	0	0	108.5	S188 I190 I205 V225	S188-L228 WeakPolarHBondContact OG-CG 3.32Å; I190-L228 HydrophobicContact CD1-CB 3.51Å; I190-L228 WeakPolarHBondContact CD1-O 3.41Å; I190-L228 HydrophobicContact CG1-CB 4.4Å; I205-L228 HydrophobicContact CD1-CD2 3.7Å; I205-L228 HydrophobicContact CG1-CD1 4.42Å; I205-L228 HydrophobicContact CG1-CD2 4.15Å; I205-L228 HydrophobicContact CG2-CD1 3.99Å; V225-L228 HydrophobicContact CG1-CD1 4.38Å; V225-L228 HydrophobicContact CG1-CD2 3.74Å; V225-L228 HydrophobicContact CG1-CG 3.79Å
229	I	84.7	Confident	75.9	Confident	48 Å²	48	76.8 Å²	76.8	25%	0.246	45%	0.446	C	S	.	.			trans	-137	143.3	164	-60.3	161.9	0	0	0	107.1	L231 L252 G254 C261	I229-L231 HydrophobicContact CG2-CD2 3.95Å; I229-L231 HydrophobicContact CG2-CG 4.13Å; I229-L252 HydrophobicContact CD1-CB 3.52Å; I229-L252 HydrophobicContact CG1-CB 3.62Å; I229-G254 VanDerWaalsContact CD1-N 3.35Å; I229-C261 HydrophobicContact CD1-CB 3.72Å
230	L	79.8	Confident	74.8	Confident	57 Å²	57	82.9 Å²	82.9	30%	0.298	47%	0.471	S	S	.	.			trans	-93.3	120.7	165.8	-175.3	70.1	0	0	0	109.7	I190 N192 F197	I190-L230 HydrophobicContact CG2-CB 3.94Å; N192-L230 HydrophobicContact CB-CD2 3.77Å; F197-L230 HydrophobicContact CD2-CD1 4.48Å; F197-L230 HydrophobicContact CE2-CD1 3.92Å; F197-L230 HydrophobicContact CZ-CD1 4.33Å
231	L	75.2	Confident	73.9	Confident	52 Å²	52	87.1 Å²	87.1	27%	0.272	48%	0.479	S	S	.	.			trans	-112.5	125.3	176	-63.2	168.8	0	0	0	109.2	I229 T233 C275	I229-L231 HydrophobicContact CG2-CD2 3.95Å; I229-L231 HydrophobicContact CG2-CG 4.13Å; L231-T233 VanDerWaalsContact C-N 3.31Å; L231-T233 HydrophobicContact CB-CG2 4.43Å; L231-T233 PolarHBondContact O-N 2.83Å; L231-C275 HydrophobicContact CD1-CB 3.99Å; L231-C275 VanDerWaalsContact CD1-SG 3.55Å
232	N	69.3	Low	73.2	Confident	116 Å²	116	91.3 Å²	91.3	62%	0.62	50%	0.5	S	S	*	.			trans	-78.4	82.9	172	-73.7	-13.3	0	0	0	109.4
233	T	62	Low	72.5	Confident	85 Å²	85	86.2 Å²	86.2	52%	0.521	49%	0.491	S	S	.	.			trans	-89.2	141.6	167.4	59.1	0	0	0	0	109.3	L231 N235	L231-T233 VanDerWaalsContact C-N 3.31Å; L231-T233 HydrophobicContact CB-CG2 4.43Å; L231-T233 PolarHBondContact O-N 2.83Å; T233-N235 PolarHBondContact O-N 3.09Å; T233-N235 VanDerWaalsContact O-N 3.13Å
234	S	60.2	Low	71.5	Confident	122 Å²	122	85 Å²	85	85%	0.853	50%	0.498	S	S	*	.	S	Bend	trans	-60.6	-20.3	179.5	47.8	0	0	0	0	113.3	G236	S234-G236 PolarHBondContact O-N 2.91Å
235	N	55.3	Low	70.7	Confident	111 Å²	111	84.2 Å²	84.2	59%	0.594	49%	0.489	S	S	*	.			trans	-89.5	96.1	179.8	-65	-12.5	0	0	0	109.8	T233 T237	T233-N235 PolarHBondContact O-N 3.09Å; T233-N235 VanDerWaalsContact O-N 3.13Å; N235-T237 PolarHBondContact O-N 3.02Å
236	G	54	Low	69.8	Low	85 Å²	85	88.5 Å²	88.5	88%	0.876	51%	0.508	S	S	*	.			trans	-64.2	17.8	174.4	0	0	0	0	0	115.7	S234	S234-G236 PolarHBondContact O-N 2.91Å
237	T	58.2	Low	69.4	Low	105 Å²	105	88.2 Å²	88.2	64%	0.644	51%	0.509	S	S	*	.	S	Bend	trans	-98.3	128.9	178.3	50.4	0	0	0	0	110.8	N235 S239	N235-T237 PolarHBondContact O-N 3.02Å; T237-S239 PolarHBondContact O-N 2.77Å; T237-S239 VanDerWaalsContact O-N 3.1Å
238	F	55.9	Low	69.3	Low	142 Å²	142	93 Å²	93	62%	0.623	52%	0.524	S	S	*	.			trans	-63.2	111.8	168	-75.7	-87.1	0	0	0	109.2	R217 I219	R217-F238 VanDerWaalsContact NH1-CD2 3.33Å; I219-F238 HydrophobicContact CD1-CD1 4.21Å; I219-F238 HydrophobicContact CD1-CE1 3.42Å; I219-F238 VanDerWaalsContact CD1-CE1 3.42Å; I219-F238 HydrophobicContact CD1-CZ 3.92Å
239	S	64.6	Low	69.3	Low	83 Å²	83	93.5 Å²	93.5	58%	0.58	53%	0.528	S	S	*	.			trans	-113.3	131.6	169.6	65.9	0	0	0	0	108.9	T237	T237-S239 PolarHBondContact O-N 2.77Å; T237-S239 VanDerWaalsContact O-N 3.1Å
240	K	67.5	Low	69.4	Low	172 Å²	172	94.4 Å²	94.4	75%	0.748	54%	0.536	S	S	*	.			trans	-89.5	113.8	170.7	-175.2	177.2	179.9	178.3	0	107.2
241	R	68.1	Low	69.7	Low	155 Å²	155	92.9 Å²	92.9	59%	0.585	53%	0.527	S	S	*	.			trans	-124.1	143.3	169.2	-65.7	178.7	174.9	175	-8	108.2	S276 L278	R241-S276 PolarHBondContact NH1-O 2.82Å; R241-L278 HydrophobicContact CB-CD1 3.38Å; R241-L278 HydrophobicContact CG-CD1 4.42Å
242	T	70.9	Confident	70.3	Confident	123 Å²	123	93 Å²	93	76%	0.755	53%	0.528	S	S	*	.			trans	-120.3	119.8	-175.8	50	0	0	0	0	108.6
243	A	70.6	Confident	70.9	Confident	52 Å²	52	88.4 Å²	88.4	43%	0.43	50%	0.503	S	S	.	.			trans	-103.4	137.4	162.2	0	0	0	0	0	107.8	F273 L278	A243-F273 HydrophobicContact CB-CE1 4.06Å; A243-L278 HydrophobicContact CB-CB 4.19Å
244	C	64.8	Low	71.6	Confident	127 Å²	127	85.8 Å²	85.8	86%	0.858	49%	0.493	S	S	*	.			trans	-98.6	128.6	176.1	-175.2	0	0	0	0	108.5
245	V	71.5	Confident	72.2	Confident	29 Å²	29	80.1 Å²	80.1	18%	0.176	45%	0.454	C	S	.	.			trans	-110.8	149.3	168	-177	0	0	0	0	106.8	S247 V249 T265 H271 F273	V245-S247 PolarHBondContact O-N 2.84Å; V245-V249 HydrophobicContact CG2-CG2 4.47Å; V245-T265 HydrophobicContact CG1-CG2 3.56Å; V245-H271 WeakPolarHBondContact CG1-NE2 3.28Å; V245-F273 HydrophobicContact CG2-CE2 4.31Å; V245-F273 HydrophobicContact CG2-CZ 3.69Å
246	Q	70.7	Confident	72.8	Confident	103 Å²	103	80.6 Å²	80.6	48%	0.481	45%	0.45	S	S	.	.	S	Bend	trans	-59.4	-29.6	-177.1	-73.7	172.5	-20.5	0	0	112.8	L323	Q246-L323 PolarHBondContact NE2-O 2.86Å
247	S	80.5	Confident	73.3	Confident	26 Å²	26	80.1 Å²	80.1	18%	0.182	43%	0.431	C	S	.	.	S	Bend	trans	-133.4	170.8	-176.8	54.1	0	0	0	0	113.4	V245 V249 T265 D267	V245-S247 PolarHBondContact O-N 2.84Å; S247-V249 PolarHBondContact O-N 2.81Å; S247-T265 WeakPolarHBondContact OG-CB 3.3Å; S247-D267 WeakPolarHBondContact CB-OD2 3.39Å; S247-D267 PolarHBondContact OG-OD2 2.99Å
248	R	85.1	Confident	73.7	Confident	125 Å²	125	77.6 Å²	77.6	47%	0.472	41%	0.413	S	S	.	.			trans	-64.6	131.2	-176.2	-176.6	-175.9	-179	-176.8	2.8	110.5	E226 T265 E266	E226-R248 IonicContact OE1-CZ 2.84Å; E226-R248 IonicContact OE1-NH2 3.99Å; E226-R248 PolarHBondContact OE1-NH2 2.8Å; E226-R248 IonicContact OE2-NH2 2.9Å; R248-T265 CarbonylContact O-C 3.6Å; R248-T265 WeakPolarHBondContact O-CA 3.47Å; R248-E266 HydrophobicContact CB-CB 4.5Å; R248-E266 PolarHBondContact O-N 3.36Å
249	V	86.8	Confident	74.7	Confident	45 Å²	45	77.3 Å²	77.3	27%	0.273	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	123.3	173.3	179.7	0	0	0	0	109.5	V245 S247 L252 A263	V245-V249 HydrophobicContact CG2-CG2 4.47Å; S247-V249 PolarHBondContact O-N 2.81Å; V249-L252 HydrophobicContact CG1-CD2 3.79Å; V249-L252 HydrophobicContact CG1-CG 3.98Å; V249-A263 HydrophobicContact CG1-CB 4.02Å; V249-A263 HydrophobicContact CG2-CB 4.3Å
250	V	86.1	Confident	75.5	Confident	68 Å²	68	74.6 Å²	74.6	41%	0.412	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	-42.3	179.5	178.8	0	0	0	0	110.8	V264 E266	V250-V264 PolarHBondContact N-O 3.01Å; V250-E266 HydrophobicContact CG2-CB 3.93Å
251	Q	86.9	Confident	76.4	Confident	25 Å²	25	66.9 Å²	66.9	12%	0.117	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	141.1	-177.3	-170.2	176.5	-23.4	0	0	111.4	V25 I253 V264	V25-Q251 PolarHBondContact O-NE2 2.8Å; Q251-I253 HydrophobicContact CG-CG1 4.29Å; Q251-V264 HydrophobicContact CB-CB 4.2Å; Q251-V264 HydrophobicContact CB-CG2 4.27Å; Q251-V264 PolarHBondContact N-O 2.71Å; Q251-V264 PolarHBondContact O-N 3.12Å
252	L	86.9	Confident	77.3	Confident	54 Å²	54	59.7 Å²	59.7	28%	0.283	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	135.2	171.3	-71.8	177.5	0	0	0	109.1	S227 I229 V249 F262 A263	S227-L252 VanDerWaalsContact CB-N 3.33Å; S227-L252 PolarHBondContact OG-N 2.9Å; I229-L252 HydrophobicContact CD1-CB 3.52Å; I229-L252 HydrophobicContact CG1-CB 3.62Å; V249-L252 HydrophobicContact CG1-CD2 3.79Å; V249-L252 HydrophobicContact CG1-CG 3.98Å; L252-F262 CarbonylContact C-O 3.46Å; L252-F262 WeakPolarHBondContact CA-O 3.49Å; L252-A263 HydrophobicContact CD2-CB 3.61Å
253	I	83.3	Confident	78.1	Confident	19 Å²	19	54 Å²	54	10%	0.097	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	122.4	176.7	-57.6	166.8	0	0	0	110.1	V25 V27 Q251 C261 F262	V25-I253 HydrophobicContact CB-CD1 3.55Å; V25-I253 HydrophobicContact CG1-CD1 3.32Å; V25-I253 WeakPolarHBondContact O-CD1 3.43Å; V27-I253 HydrophobicContact CB-CG2 4.34Å; V27-I253 HydrophobicContact CG2-CG2 3.86Å; Q251-I253 HydrophobicContact CG-CG1 4.29Å; I253-C261 CarbonylContact O-C 3.59Å; I253-C261 VanDerWaalsContact O-CA 3.29Å; I253-C261 WeakPolarHBondContact O-CA 3.41Å; I253-C261 WeakPolarHBondContact O-CB 3.2Å; I253-F262 HydrophobicContact CB-CB 4.34Å; I253-F262 PolarHBondContact N-O 2.81Å; I253-F262 PolarHBondContact O-N 3.43Å
254	G	76.2	Confident	79	Confident	31 Å²	31	51.6 Å²	51.6	32%	0.32	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	134.7	173.9	0	0	0	0	0	111.7	I229	I229-G254 VanDerWaalsContact CD1-N 3.35Å
255	C	73.3	Confident	80.2	Confident	3 Å²	3	45.7 Å²	45.7	2%	0.02	24%	0.241	C	C	.	.			trans	-75	148.5	167.6	-79.8	0	0	0	0	110.7	N31 T257 N258 S260	N31-C255 VanDerWaalsContact CG-SG 3.57Å; N31-C255 VanDerWaalsContact OD1-CB 3.23Å; N31-C255 WeakPolarHBondContact OD1-CB 3.24Å; N31-C255 PolarHBondContact OD1-SG 2.59Å; C255-T257 PolarHBondContact O-N 3.36Å; C255-T257 VanDerWaalsContact O-N 3.17Å; C255-N258 PolarHBondContact O-N 3.31Å; C255-S260 VanDerWaalsContact CB-O 3.28Å; C255-S260 WeakPolarHBondContact CB-O 3.24Å; C255-S260 WeakPolarHBondContact CB-OG 3.32Å; C255-S260 PolarHBondContact N-O 3.05Å; C255-S260 VanDerWaalsContact N-O 3.1Å; C255-S260 PolarHBondContact SG-OG 3.41Å
256	K	67.2	Low	80.8	Confident	120 Å²	120	50 Å²	50	52%	0.522	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-27.1	-178.7	-80.8	-166.2	179.7	-178.2	0	113.8	A29 N31 A72 N258	A29-K256 HydrophobicContact CB-CD 3.99Å; A29-K256 VanDerWaalsContact CB-NZ 3.31Å; N31-K256 PolarHBondContact OD1-N 3.2Å; A72-K256 WeakPolarHBondContact O-CE 3.26Å; A72-K256 PolarHBondContact O-NZ 3.33Å; K256-N258 PolarHBondContact O-N 3.41Å
257	T	64.7	Low	81.5	Confident	76 Å²	76	49.1 Å²	49.1	47%	0.466	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-11.2	175.6	50.1	0	0	0	0	112.6	N31 C255 E259	N31-T257 WeakPolarHBondContact ND2-CG2 3.4Å; N31-T257 PolarHBondContact ND2-OG1 2.86Å; C255-T257 PolarHBondContact O-N 3.36Å; C255-T257 VanDerWaalsContact O-N 3.17Å; T257-E259 PolarHBondContact O-N 3.34Å
258	N	66.1	Low	81.9	Confident	51 Å²	51	50.2 Å²	50.2	27%	0.273	26%	0.259	S	S	.	.	S	Bend	trans	56.4	4.5	-175.3	-62.8	-37.9	0	0	0	115.5	C255 K256	C255-N258 PolarHBondContact O-N 3.31Å; K256-N258 PolarHBondContact O-N 3.41Å
259	E	76.5	Confident	82.2	Confident	137 Å²	137	44.5 Å²	44.5	64%	0.64	24%	0.238	S	C	*	.	S	Bend	trans	-85.8	-30	177.9	-70.1	178.7	167.1	0	0	111.9	T257 N274 C275	T257-E259 PolarHBondContact O-N 3.34Å; E259-N274 PolarHBondContact O-OD1 2.88Å; E259-C275 VanDerWaalsContact C-SG 3.59Å; E259-C275 VanDerWaalsContact O-CB 3.31Å; E259-C275 WeakPolarHBondContact O-CB 3.46Å; E259-C275 PolarHBondContact O-N 3.46Å; E259-C275 PolarHBondContact O-SG 3.31Å; E259-C275 VanDerWaalsContact O-SG 3.33Å
260	S	82.9	Confident	82.3	Confident	25 Å²	25	42.4 Å²	42.4	18%	0.175	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	153.8	-176.5	59.6	0	0	0	0	112.9	C255 F273	C255-S260 VanDerWaalsContact CB-O 3.28Å; C255-S260 WeakPolarHBondContact CB-O 3.24Å; C255-S260 WeakPolarHBondContact CB-OG 3.32Å; C255-S260 PolarHBondContact N-O 3.05Å; C255-S260 VanDerWaalsContact N-O 3.1Å; C255-S260 PolarHBondContact SG-OG 3.41Å; S260-F273 CarbonylContact C-O 3.58Å; S260-F273 WeakPolarHBondContact CA-O 3.25Å; S260-F273 WeakPolarHBondContact CB-O 3.37Å
261	C	84.8	Confident	82.4	Confident	10 Å²	10	39.8 Å²	39.8	7%	0.068	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	145	174.1	61.6	0	0	0	0	111.2	I229 I253 L272 F273	I229-C261 HydrophobicContact CD1-CB 3.72Å; I253-C261 CarbonylContact O-C 3.59Å; I253-C261 VanDerWaalsContact O-CA 3.29Å; I253-C261 WeakPolarHBondContact O-CA 3.41Å; I253-C261 WeakPolarHBondContact O-CB 3.2Å; C261-L272 WeakPolarHBondContact O-CA 3Å; C261-F273 PolarHBondContact N-O 2.88Å; C261-F273 PolarHBondContact O-N 3.1Å
262	F	87.2	Confident	82.4	Confident	5 Å²	5	40 Å²	40	2%	0.022	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	134.5	171.8	-72.6	-85.5	0	0	0	109.9	V27 L47 L252 I253 H271 L272	V27-F262 HydrophobicContact CG1-CE2 4.49Å; V27-F262 HydrophobicContact CG2-CD2 3.74Å; V27-F262 HydrophobicContact CG2-CE2 3.92Å; L47-F262 HydrophobicContact CD1-CE2 3.94Å; L47-F262 HydrophobicContact CD1-CZ 3.65Å; L47-F262 HydrophobicContact CD2-CE1 3.78Å; L47-F262 HydrophobicContact CD2-CE2 4.36Å; L47-F262 HydrophobicContact CD2-CZ 3.39Å; L47-F262 HydrophobicContact CG-CZ 4.14Å; L252-F262 CarbonylContact C-O 3.46Å; L252-F262 WeakPolarHBondContact CA-O 3.49Å; I253-F262 HydrophobicContact CB-CB 4.34Å; I253-F262 PolarHBondContact N-O 2.81Å; I253-F262 PolarHBondContact O-N 3.43Å; F262-H271 CarbonylContact C-O 3.6Å; F262-H271 WeakPolarHBondContact CA-O 3.43Å; F262-L272 HydrophobicContact CD1-CB 4.1Å; F262-L272 HydrophobicContact CD1-CD1 4Å; F262-L272 HydrophobicContact CD2-CD1 3.9Å; F262-L272 HydrophobicContact CE1-CB 3.82Å; F262-L272 HydrophobicContact CE1-CD1 3.75Å; F262-L272 HydrophobicContact CE1-CD2 4.4Å; F262-L272 HydrophobicContact CE1-CG 4.19Å; F262-L272 HydrophobicContact CE2-CD1 3.65Å; F262-L272 HydrophobicContact CG-CD1 4.07Å; F262-L272 HydrophobicContact CZ-CB 4.39Å; F262-L272 HydrophobicContact CZ-CD1 3.56Å; F262-L272 HydrophobicContact CZ-CD2 4.21Å; F262-L272 HydrophobicContact CZ-CG 4.26Å
263	A	88.4	Confident	82.4	Confident	2 Å²	2	38 Å²	38	2%	0.017	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	128	164	0	0	0	0	0	109.6	V249 L252 F270 H271 F273	V249-A263 HydrophobicContact CG1-CB 4.02Å; V249-A263 HydrophobicContact CG2-CB 4.3Å; L252-A263 HydrophobicContact CD2-CB 3.61Å; A263-F270 CarbonylContact O-C 3.57Å; A263-F270 WeakPolarHBondContact O-CA 3.26Å; A263-H271 HydrophobicContact CB-CB 4.45Å; A263-H271 PolarHBondContact N-O 3.3Å; A263-H271 PolarHBondContact O-N 3.45Å; A263-F273 HydrophobicContact CB-CD2 4.11Å; A263-F273 HydrophobicContact CB-CE2 3.65Å
264	V	89.6	Confident	82.3	Confident	3 Å²	3	39.7 Å²	39.7	2%	0.018	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	126.2	174	-168.2	0	0	0	0	107.9	F20 V25 V250 Q251 N269 F270	F20-V264 HydrophobicContact CD1-CG1 4.35Å; F20-V264 HydrophobicContact CE1-CG1 3.49Å; F20-V264 VanDerWaalsContact CE1-CG1 3.49Å; F20-V264 HydrophobicContact CZ-CG1 3.71Å; V25-V264 HydrophobicContact CG2-CG2 4.44Å; V250-V264 PolarHBondContact N-O 3.01Å; Q251-V264 HydrophobicContact CB-CB 4.2Å; Q251-V264 HydrophobicContact CB-CG2 4.27Å; Q251-V264 PolarHBondContact N-O 2.71Å; Q251-V264 PolarHBondContact O-N 3.12Å; V264-N269 WeakPolarHBondContact CA-O 3.41Å; V264-F270 HydrophobicContact CB-CD1 4.46Å; V264-F270 HydrophobicContact CB-CE1 4.26Å; V264-F270 HydrophobicContact CG1-CD1 4.41Å; V264-F270 HydrophobicContact CG1-CE1 3.92Å; V264-F270 HydrophobicContact CG1-CZ 4.08Å; V264-F270 HydrophobicContact CG2-CD1 3.69Å; V264-F270 HydrophobicContact CG2-CE1 3.44Å; V264-F270 VanDerWaalsContact CG2-CE1 3.44Å; V264-F270 HydrophobicContact CG2-CZ 4.38Å
265	T	89	Confident	82.2	Confident	3 Å²	3	39 Å²	39	2%	0.018	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	164.8	179.8	56.6	0	0	0	0	111.8	V245 S247 R248 D267 E268 N269	V245-T265 HydrophobicContact CG1-CG2 3.56Å; S247-T265 WeakPolarHBondContact OG-CB 3.3Å; R248-T265 CarbonylContact O-C 3.6Å; R248-T265 WeakPolarHBondContact O-CA 3.47Å; T265-D267 PolarHBondContact O-N 3.29Å; T265-E268 PolarHBondContact O-N 2.82Å; T265-N269 PolarHBondContact N-O 2.87Å; T265-N269 WeakPolarHBondContact OG1-CA 3.39Å; T265-N269 VanDerWaalsContact OG1-CB 3.29Å; T265-N269 WeakPolarHBondContact OG1-CB 3.48Å; T265-N269 PolarHBondContact OG1-N 2.73Å; T265-N269 PolarHBondContact OG1-O 2.67Å
266	E	85.7	Confident	82.3	Confident	118 Å²	118	41.7 Å²	41.7	55%	0.551	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-31.9	173.3	-170.3	168.8	-179.8	0	0	112.1	R248 V250 E268	R248-E266 HydrophobicContact CB-CB 4.5Å; R248-E266 PolarHBondContact O-N 3.36Å; V250-E266 HydrophobicContact CG2-CB 3.93Å; E266-E268 PolarHBondContact O-N 2.92Å; E266-E268 VanDerWaalsContact O-N 3.13Å
267	D	85	Confident	82.7	Confident	86 Å²	86	40.5 Å²	40.5	46%	0.46	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.8	22.7	176.5	-51.2	-43.6	0	0	0	113.4	S247 T265 N269	S247-D267 WeakPolarHBondContact CB-OD2 3.39Å; S247-D267 PolarHBondContact OG-OD2 2.99Å; T265-D267 PolarHBondContact O-N 3.29Å; D267-N269 PolarHBondContact O-N 3.24Å; D267-N269 VanDerWaalsContact O-N 3.1Å; D267-N269 PolarHBondContact O-ND2 2.99Å
268	E	89.3	Confident	83.2	Confident	48 Å²	48	39.5 Å²	39.5	22%	0.224	21%	0.209	C	C	.	.	S	Bend	trans	62.6	20.4	176.1	-56.7	179.2	159.3	0	0	114.4	F20 S21 T265 E266 G286 N287	F20-E268 HydrophobicContact CD1-CB 3.73Å; F20-E268 HydrophobicContact CD1-CG 4.06Å; F20-E268 HydrophobicContact CE1-CB 4.23Å; F20-E268 HydrophobicContact CE1-CG 4.24Å; S21-E268 VanDerWaalsContact CA-OE1 3.26Å; S21-E268 WeakPolarHBondContact CA-OE1 3.27Å; T265-E268 PolarHBondContact O-N 2.82Å; E266-E268 PolarHBondContact O-N 2.92Å; E266-E268 VanDerWaalsContact O-N 3.13Å; E268-G286 WeakPolarHBondContact O-CA 3.31Å; E268-G286 PolarHBondContact O-N 3.1Å; E268-N287 HydrophobicContact CB-CB 4.39Å; E268-N287 WeakPolarHBondContact OE2-CB 3.46Å; E268-N287 PolarHBondContact OE2-ND2 3.15Å
269	N	90.3	Very high	83.9	Confident	5 Å²	5	43.9 Å²	43.9	3%	0.027	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	148.4	175.6	-54.1	-56.3	0	0	0	112.1	V264 T265 D267 L323	V264-N269 WeakPolarHBondContact CA-O 3.41Å; T265-N269 PolarHBondContact N-O 2.87Å; T265-N269 WeakPolarHBondContact OG1-CA 3.39Å; T265-N269 VanDerWaalsContact OG1-CB 3.29Å; T265-N269 WeakPolarHBondContact OG1-CB 3.48Å; T265-N269 PolarHBondContact OG1-N 2.73Å; T265-N269 PolarHBondContact OG1-O 2.67Å; D267-N269 PolarHBondContact O-N 3.24Å; D267-N269 VanDerWaalsContact O-N 3.1Å; D267-N269 PolarHBondContact O-ND2 2.99Å; N269-L323 WeakPolarHBondContact ND2-CD2 3.3Å
270	F	90	Very high	84.1	Confident	1 Å²	1	40.2 Å²	40.2	0%	0.004	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	131.9	176.7	-63.3	-96.9	0	0	0	110.5	F19 F20 V25 L34 T36 A263 V264 Q283 L284	F19-F270 HydrophobicContact CD2-CE2 4.41Å; F19-F270 AromaticContact CE2-CD2 3.87Å; F19-F270 HydrophobicContact CE2-CD2 3.87Å; F19-F270 AromaticContact CE2-CE2 3.51Å; F19-F270 HydrophobicContact CE2-CE2 3.51Å; F19-F270 HydrophobicContact CE2-CZ 4.2Å; F19-F270 HydrophobicContact CZ-CD2 4.06Å; F19-F270 HydrophobicContact CZ-CE2 4.13Å; F20-F270 HydrophobicContact CB-CE2 3.72Å; F20-F270 HydrophobicContact CB-CZ 3.97Å; F20-F270 AromaticContact CD1-CE2 3.7Å; F20-F270 HydrophobicContact CD1-CE2 3.7Å; F20-F270 AromaticContact CD1-CZ 3.71Å; F20-F270 HydrophobicContact CD1-CZ 3.71Å; F20-F270 AromaticContact CD2-CZ 3.98Å; F20-F270 HydrophobicContact CD2-CZ 3.98Å; F20-F270 HydrophobicContact CE1-CE2 4.46Å; F20-F270 HydrophobicContact CE1-CZ 4.16Å; F20-F270 HydrophobicContact CE2-CZ 4.39Å; F20-F270 AromaticContact CG-CE2 3.75Å; F20-F270 HydrophobicContact CG-CE2 3.75Å; F20-F270 AromaticContact CG-CZ 3.61Å; F20-F270 HydrophobicContact CG-CZ 3.61Å; F20-F270 HydrophobicContact CZ-CZ 4.47Å; V25-F270 HydrophobicContact CB-CE1 4.36Å; V25-F270 HydrophobicContact CG1-CE1 3.82Å; V25-F270 HydrophobicContact CG1-CZ 4.49Å; V25-F270 HydrophobicContact CG2-CE1 3.87Å; V25-F270 HydrophobicContact CG2-CZ 3.94Å; L34-F270 HydrophobicContact CD2-CD1 4.21Å; L34-F270 HydrophobicContact CD2-CE1 4.2Å; T36-F270 HydrophobicContact CG2-CE1 4.36Å; T36-F270 HydrophobicContact CG2-CE2 4.5Å; T36-F270 HydrophobicContact CG2-CZ 3.81Å; A263-F270 CarbonylContact O-C 3.57Å; A263-F270 WeakPolarHBondContact O-CA 3.26Å; V264-F270 HydrophobicContact CB-CD1 4.46Å; V264-F270 HydrophobicContact CB-CE1 4.26Å; V264-F270 HydrophobicContact CG1-CD1 4.41Å; V264-F270 HydrophobicContact CG1-CE1 3.92Å; V264-F270 HydrophobicContact CG1-CZ 4.08Å; V264-F270 HydrophobicContact CG2-CD1 3.69Å; V264-F270 HydrophobicContact CG2-CE1 3.44Å; V264-F270 VanDerWaalsContact CG2-CE1 3.44Å; V264-F270 HydrophobicContact CG2-CZ 4.38Å; F270-Q283 CarbonylContact O-C 3.59Å; F270-Q283 VanDerWaalsContact O-CA 3.29Å; F270-Q283 WeakPolarHBondContact O-CA 3.47Å; F270-L284 HydrophobicContact CB-CB 4.13Å; F270-L284 PolarHBondContact N-O 2.91Å; F270-L284 PolarHBondContact O-N 3.26Å
271	H	88	Confident	84.1	Confident	13 Å²	13	42.7 Å²	42.7	6%	0.06	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	116.7	173.7	-59.5	-94.6	0	0	0	109.3	V245 F262 A263 F273 Q283	V245-H271 WeakPolarHBondContact CG1-NE2 3.28Å; F262-H271 CarbonylContact C-O 3.6Å; F262-H271 WeakPolarHBondContact CA-O 3.43Å; A263-H271 HydrophobicContact CB-CB 4.45Å; A263-H271 PolarHBondContact N-O 3.3Å; A263-H271 PolarHBondContact O-N 3.45Å; H271-F273 HydrophobicContact CB-CD2 4.18Å; H271-F273 HydrophobicContact CB-CE2 3.5Å; H271-F273 HydrophobicContact CB-CZ 3.87Å; H271-Q283 PolarHBondContact CE1-NE2 2.91Å
272	L	87.2	Confident	84.1	Confident	29 Å²	29	43.6 Å²	43.6	15%	0.152	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	119.3	169.2	-175	60.1	0	0	0	108.5	C261 F262 V280 T281 K282	C261-L272 WeakPolarHBondContact O-CA 3Å; F262-L272 HydrophobicContact CD1-CB 4.1Å; F262-L272 HydrophobicContact CD1-CD1 4Å; F262-L272 HydrophobicContact CD2-CD1 3.9Å; F262-L272 HydrophobicContact CE1-CB 3.82Å; F262-L272 HydrophobicContact CE1-CD1 3.75Å; F262-L272 HydrophobicContact CE1-CD2 4.4Å; F262-L272 HydrophobicContact CE1-CG 4.19Å; F262-L272 HydrophobicContact CE2-CD1 3.65Å; F262-L272 HydrophobicContact CG-CD1 4.07Å; F262-L272 HydrophobicContact CZ-CB 4.39Å; F262-L272 HydrophobicContact CZ-CD1 3.56Å; F262-L272 HydrophobicContact CZ-CD2 4.21Å; F262-L272 HydrophobicContact CZ-CG 4.26Å; L272-V280 CarbonylContact O-C 3.51Å; L272-V280 WeakPolarHBondContact O-CA 3.17Å; L272-T281 WeakPolarHBondContact CD2-OG1 3.17Å; L272-T281 VanDerWaalsContact CG-OG1 3.25Å; L272-T281 WeakPolarHBondContact CG-OG1 3.47Å; L272-T281 PolarHBondContact O-N 3.11Å; L272-T281 PolarHBondContact O-OG1 2.77Å; L272-K282 HydrophobicContact CB-CB 4.03Å; L272-K282 WeakPolarHBondContact CB-O 3.49Å; L272-K282 HydrophobicContact CD2-CB 4.19Å; L272-K282 PolarHBondContact N-O 3.22Å
273	F	85.1	Confident	84.1	Confident	13 Å²	13	43.6 Å²	43.6	6%	0.057	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	142.2	175.4	-68.7	-80.9	0	0	0	110.5	A243 V245 S260 C261 A263 H271 L278 K279 V280	A243-F273 HydrophobicContact CB-CE1 4.06Å; V245-F273 HydrophobicContact CG2-CE2 4.31Å; V245-F273 HydrophobicContact CG2-CZ 3.69Å; S260-F273 CarbonylContact C-O 3.58Å; S260-F273 WeakPolarHBondContact CA-O 3.25Å; S260-F273 WeakPolarHBondContact CB-O 3.37Å; C261-F273 PolarHBondContact N-O 2.88Å; C261-F273 PolarHBondContact O-N 3.1Å; A263-F273 HydrophobicContact CB-CD2 4.11Å; A263-F273 HydrophobicContact CB-CE2 3.65Å; H271-F273 HydrophobicContact CB-CD2 4.18Å; H271-F273 HydrophobicContact CB-CE2 3.5Å; H271-F273 HydrophobicContact CB-CZ 3.87Å; F273-L278 WeakPolarHBondContact CD1-O 3.39Å; F273-K279 WeakPolarHBondContact CA-O 3.24Å; F273-V280 HydrophobicContact CD1-CG2 3.93Å; F273-V280 HydrophobicContact CE1-CB 4.45Å; F273-V280 HydrophobicContact CE1-CG2 3.32Å; F273-V280 HydrophobicContact CZ-CG2 3.81Å
274	N	82.7	Confident	84.1	Confident	55 Å²	55	43.7 Å²	43.7	29%	0.294	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	126.1	159	-175.1	-5.5	0	0	0	108.9	E259 S276 D277 L278 K279 T281	E259-N274 PolarHBondContact O-OD1 2.88Å; N274-S276 PolarHBondContact ND2-OG 3.17Å; N274-S276 PolarHBondContact O-N 3.12Å; N274-S276 PolarHBondContact OD1-N 3.36Å; N274-S276 VanDerWaalsContact OD1-N 3.13Å; N274-S276 PolarHBondContact OD1-OG 3.48Å; N274-D277 PolarHBondContact O-N 3.33Å; N274-L278 WeakPolarHBondContact O-CA 3.04Å; N274-L278 PolarHBondContact O-N 3.08Å; N274-K279 PolarHBondContact N-O 3.34Å; N274-K279 VanDerWaalsContact N-O 3.08Å; N274-T281 HydrophobicContact CB-CG2 3.95Å
275	C	73.5	Confident	84	Confident	16 Å²	16	44 Å²	44	11%	0.108	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-23.9	-177.9	-62.3	0	0	0	0	112.7	L231 E259	L231-C275 HydrophobicContact CD1-CB 3.99Å; L231-C275 VanDerWaalsContact CD1-SG 3.55Å; E259-C275 VanDerWaalsContact C-SG 3.59Å; E259-C275 VanDerWaalsContact O-CB 3.31Å; E259-C275 WeakPolarHBondContact O-CB 3.46Å; E259-C275 PolarHBondContact O-N 3.46Å; E259-C275 PolarHBondContact O-SG 3.31Å; E259-C275 VanDerWaalsContact O-SG 3.33Å
276	S	76.1	Confident	83.8	Confident	60 Å²	60	43.9 Å²	43.9	42%	0.42	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-40.4	179.7	73.9	0	0	0	0	112.9	R241 N274	R241-S276 PolarHBondContact NH1-O 2.82Å; N274-S276 PolarHBondContact ND2-OG 3.17Å; N274-S276 PolarHBondContact O-N 3.12Å; N274-S276 PolarHBondContact OD1-N 3.36Å; N274-S276 VanDerWaalsContact OD1-N 3.13Å; N274-S276 PolarHBondContact OD1-OG 3.48Å
277	D	74.3	Confident	83.9	Confident	95 Å²	95	40.5 Å²	40.5	51%	0.508	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-114.4	-13.3	-170.1	-67.9	15.2	0	0	0	112.4	N274 K279	N274-D277 PolarHBondContact O-N 3.33Å; D277-K279 HydrophobicContact CB-CB 4.35Å; D277-K279 HydrophobicContact CB-CD 4.28Å; D277-K279 HydrophobicContact CB-CG 4.07Å; D277-K279 PolarHBondContact O-N 3.48Å; D277-K279 VanDerWaalsContact O-N 3.1Å
278	L	76.7	Confident	83.9	Confident	55 Å²	55	36.6 Å²	36.6	29%	0.288	20%	0.196	S	C	.	.			trans	50.8	25.8	-169.3	-66.9	166.9	0	0	0	113.5	R241 A243 F273 N274	R241-L278 HydrophobicContact CB-CD1 3.38Å; R241-L278 HydrophobicContact CG-CD1 4.42Å; A243-L278 HydrophobicContact CB-CB 4.19Å; F273-L278 WeakPolarHBondContact CD1-O 3.39Å; N274-L278 WeakPolarHBondContact O-CA 3.04Å; N274-L278 PolarHBondContact O-N 3.08Å
279	K	79.9	Confident	83.9	Confident	142 Å²	142	36.5 Å²	36.5	62%	0.617	20%	0.2	S	C	*	.			trans	-81.1	139.6	169.2	-71	-179.3	178.4	178.5	0	109.3	F273 N274 D277 T281	F273-K279 WeakPolarHBondContact CA-O 3.24Å; N274-K279 PolarHBondContact N-O 3.34Å; N274-K279 VanDerWaalsContact N-O 3.08Å; D277-K279 HydrophobicContact CB-CB 4.35Å; D277-K279 HydrophobicContact CB-CD 4.28Å; D277-K279 HydrophobicContact CB-CG 4.07Å; D277-K279 PolarHBondContact O-N 3.48Å; D277-K279 VanDerWaalsContact O-N 3.1Å; K279-T281 PolarHBondContact O-N 2.71Å
280	V	81.1	Confident	84	Confident	61 Å²	61	38.5 Å²	38.5	37%	0.37	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	121.4	170.2	-178.6	0	0	0	0	107.3	L272 F273 Q283	L272-V280 CarbonylContact O-C 3.51Å; L272-V280 WeakPolarHBondContact O-CA 3.17Å; F273-V280 HydrophobicContact CD1-CG2 3.93Å; F273-V280 HydrophobicContact CE1-CB 4.45Å; F273-V280 HydrophobicContact CE1-CG2 3.32Å; F273-V280 HydrophobicContact CZ-CG2 3.81Å; V280-Q283 HydrophobicContact CG1-CB 4.27Å
281	T	81.8	Confident	84.3	Confident	77 Å²	77	38.5 Å²	38.5	47%	0.472	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	-33.5	174	55.8	0	0	0	0	111.2	L272 N274 K279	L272-T281 WeakPolarHBondContact CD2-OG1 3.17Å; L272-T281 VanDerWaalsContact CG-OG1 3.25Å; L272-T281 WeakPolarHBondContact CG-OG1 3.47Å; L272-T281 PolarHBondContact O-N 3.11Å; L272-T281 PolarHBondContact O-OG1 2.77Å; N274-T281 HydrophobicContact CB-CG2 3.95Å; K279-T281 PolarHBondContact O-N 2.71Å
282	K	85.1	Confident	84.7	Confident	28 Å²	28	39 Å²	39	12%	0.122	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	125	178.7	-157.9	177	-171.3	176.7	0	111.1	L47 D48 S50 L272 L284 T318 H320	L47-K282 PolarHBondContact O-NZ 3.48Å; D48-K282 PolarHBondContact O-NZ 3.16Å; S50-K282 WeakPolarHBondContact OG-CE 3.24Å; S50-K282 PolarHBondContact OG-NZ 2.87Å; L272-K282 HydrophobicContact CB-CB 4.03Å; L272-K282 WeakPolarHBondContact CB-O 3.49Å; L272-K282 HydrophobicContact CD2-CB 4.19Å; L272-K282 PolarHBondContact N-O 3.22Å; K282-L284 HydrophobicContact CD-CD2 4Å; K282-L284 HydrophobicContact CG-CD2 4.1Å; K282-T318 WeakPolarHBondContact CE-O 3.36Å; K282-T318 PolarHBondContact NZ-O 3.41Å; K282-H320 VanDerWaalsContact CA-CD2 3.4Å; K282-H320 WeakPolarHBondContact CA-CD2 3.48Å; K282-H320 HydrophobicContact CG-CB 4.36Å
283	Q	88.2	Confident	85.1	Confident	6 Å²	6	37.9 Å²	37.9	3%	0.028	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	132.1	166.7	-179.6	176.6	12.9	0	0	110.3	F270 H271 V280 H320 C321 L323	F270-Q283 CarbonylContact O-C 3.59Å; F270-Q283 VanDerWaalsContact O-CA 3.29Å; F270-Q283 WeakPolarHBondContact O-CA 3.47Å; H271-Q283 PolarHBondContact CE1-NE2 2.91Å; V280-Q283 HydrophobicContact CG1-CB 4.27Å; Q283-H320 PolarHBondContact N-CD2 2.94Å; Q283-H320 PolarHBondContact N-NE2 2.9Å; Q283-H320 PolarHBondContact O-CD2 2.77Å; Q283-C321 WeakPolarHBondContact CB-O 3.39Å; Q283-C321 VanDerWaalsContact CD-O 3.28Å; Q283-C321 WeakPolarHBondContact CG-O 3.3Å; Q283-C321 PolarHBondContact O-N 2.68Å; Q283-C321 PolarHBondContact OE1-O 2.64Å; Q283-L323 HydrophobicContact CG-CD1 4.27Å
284	L	88.6	Confident	85.6	Confident	4 Å²	4	37.2 Å²	37.2	2%	0.021	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	140.3	175.2	-49.6	172.8	0	0	0	108.8	F19 L47 S50 F270 K282	F19-L284 HydrophobicContact CZ-CB 4.28Å; L47-L284 HydrophobicContact CD2-CD1 4.03Å; S50-L284 WeakPolarHBondContact OG-CD2 3.26Å; F270-L284 HydrophobicContact CB-CB 4.13Å; F270-L284 PolarHBondContact N-O 2.91Å; F270-L284 PolarHBondContact O-N 3.26Å; K282-L284 HydrophobicContact CD-CD2 4Å; K282-L284 HydrophobicContact CG-CD2 4.1Å
285	V	87.2	Confident	86.1	Confident	10 Å²	10	34.6 Å²	34.6	6%	0.061	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	119.6	174	176.9	0	0	0	0	107.7	F19 N287 N288 C321 L323	F19-V285 WeakPolarHBondContact CE1-O 3.47Å; V285-N287 WeakPolarHBondContact CG1-O 3.3Å; V285-N288 WeakPolarHBondContact CG1-OD1 3.49Å; V285-C321 HydrophobicContact CG2-CB 3.87Å; V285-C321 WeakPolarHBondContact CG2-SG 3.33Å; V285-L323 HydrophobicContact CG2-CD1 3.53Å
286	G	84.9	Confident	87	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	19%	0.187	C	C	.	.	S	Bend	trans	-72.1	-36.4	179.4	0	0	0	0	0	113	P18 F19 F20 E268	P18-G286 WeakPolarHBondContact CA-O 3.14Å; F19-G286 PolarHBondContact N-O 2.78Å; F20-G286 PolarHBondContact N-O 3.01Å; E268-G286 WeakPolarHBondContact O-CA 3.31Å; E268-G286 PolarHBondContact O-N 3.1Å
287	N	87.1	Confident	87.6	Confident	46 Å²	46	31.2 Å²	31.2	25%	0.246	17%	0.167	C	C	.	.			trans	-139.3	121.2	177	-171	-5	0	0	0	110.5	E268 V285 S289 R312	E268-N287 HydrophobicContact CB-CB 4.39Å; E268-N287 WeakPolarHBondContact OE2-CB 3.46Å; E268-N287 PolarHBondContact OE2-ND2 3.15Å; V285-N287 WeakPolarHBondContact CG1-O 3.3Å; N287-S289 VanDerWaalsContact C-N 3.26Å; N287-S289 PolarHBondContact O-N 3.04Å; N287-S289 PolarHBondContact OD1-N 2.98Å; N287-R312 PolarHBondContact O-NH2 3.22Å
288	N	85.6	Confident	88.1	Confident	5 Å²	5	27.9 Å²	27.9	3%	0.027	15%	0.151	C	C	.	.			trans	-77.9	-15.7	179.6	-57.7	-35.3	0	0	0	112	V285 V291 T306 R312 Y314 G582	V285-N288 WeakPolarHBondContact CG1-OD1 3.49Å; N288-V291 HydrophobicContact CB-CG2 4.47Å; N288-T306 HydrophobicContact CB-CG2 4.47Å; N288-T306 WeakPolarHBondContact O-CB 3.19Å; N288-T306 VanDerWaalsContact O-CG2 3.23Å; N288-T306 WeakPolarHBondContact O-CG2 3.39Å; N288-R312 PolarHBondContact O-NH1 3.06Å; N288-Y314 PolarHBondContact OD1-OH 2.99Å; N288-G582 WeakPolarHBondContact CB-O 3.22Å; N288-G582 PolarHBondContact ND2-O 2.78Å
289	S	88.3	Confident	88.3	Confident	45 Å²	45	27.2 Å²	27.2	32%	0.315	15%	0.148	S	C	.	.			trans	55.5	-168.1	-161.6	-162.9	0	0	0	0	111.3	N287 V291 G582	N287-S289 VanDerWaalsContact C-N 3.26Å; N287-S289 PolarHBondContact O-N 3.04Å; N287-S289 PolarHBondContact OD1-N 2.98Å; S289-V291 PolarHBondContact O-N 3.4Å; S289-G582 WeakPolarHBondContact O-CA 3.45Å
290	I	93.5	Very high	88.7	Confident	48 Å²	48	25.2 Å²	25.2	25%	0.246	14%	0.144	C	C	.	.	S	Bend	trans	-59.5	124.7	178	-59.1	169.5	0	0	0	109	T306 N307 E580	I290-T306 CarbonylContact O-C 3.49Å; I290-T306 WeakPolarHBondContact O-CA 3.1Å; I290-N307 HydrophobicContact CB-CB 4.13Å; I290-N307 PolarHBondContact O-N 2.95Å; I290-E580 HydrophobicContact CD1-CG 4.27Å; I290-E580 HydrophobicContact CG1-CG 4.15Å
291	V	95.5	Very high	89.2	Confident	0 Å²	0	23.8 Å²	23.8	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	115.5	173.8	176.7	0	0	0	0	108.3	N288 S289 V294 V304 A305 T306 W564 A565 G579 L584	N288-V291 HydrophobicContact CB-CG2 4.47Å; S289-V291 PolarHBondContact O-N 3.4Å; V291-V294 HydrophobicContact CG1-CG2 3.78Å; V291-V304 HydrophobicContact CB-CG1 4.44Å; V291-V304 HydrophobicContact CG1-CG1 3.58Å; V291-V304 HydrophobicContact CG2-CG1 4.17Å; V291-A305 CarbonylContact C-O 3.59Å; V291-T306 HydrophobicContact CG2-CG2 4.22Å; V291-W564 WeakPolarHBondContact O-CB 2.93Å; V291-A565 HydrophobicContact CG1-CB 4Å; V291-G579 PolarHBondContact N-O 3.08Å; V291-G579 VanDerWaalsContact N-O 3.09Å; V291-L584 HydrophobicContact CB-CD2 4.42Å; V291-L584 HydrophobicContact CG1-CD2 3.9Å; V291-L584 HydrophobicContact CG2-CD2 3.78Å; V291-L584 HydrophobicContact CG2-CG 4Å
292	N	95.6	Very high	89.7	Confident	25 Å²	25	20.1 Å²	20.1	13%	0.134	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	-40.3	-178.6	-66.3	-36.1	0	0	0	112.2	A305 T306 I330 V331 L332 R523	N292-A305 PolarHBondContact N-O 2.82Å; N292-T306 VanDerWaalsContact ND2-C 3.34Å; N292-T306 PolarHBondContact ND2-O 2.84Å; N292-I330 WeakPolarHBondContact ND2-CG2 3.07Å; N292-V331 PolarHBondContact ND2-O 2.96Å; N292-L332 WeakPolarHBondContact CB-O 3.49Å; N292-R523 PolarHBondContact O-NH2 3.26Å; N292-R523 VanDerWaalsContact O-NH2 3.12Å
293	D	95.6	Very high	90.2	Very high	4 Å²	4	18.8 Å²	18.8	2%	0.021	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.3	158	-177.3	-154.6	21.1	0	0	0	111.6	A305 C333 V334 R523	D293-A305 HydrophobicContact CB-CB 4.18Å; D293-A305 PolarHBondContact N-O 2.77Å; D293-A305 PolarHBondContact O-N 2.79Å; D293-C333 VanDerWaalsContact OD2-CA 3.26Å; D293-C333 WeakPolarHBondContact OD2-CA 3.43Å; D293-C333 WeakPolarHBondContact OD2-CB 3.47Å; D293-C333 PolarHBondContact OD2-SG 3.49Å; D293-V334 PolarHBondContact OD2-N 3.03Å; D293-V334 VanDerWaalsContact OD2-O 3.09Å; D293-R523 VanDerWaalsContact CG-NH2 3.32Å; D293-R523 IonicContact OD1-CZ 3.41Å; D293-R523 IonicContact OD1-NH1 3.46Å; D293-R523 PolarHBondContact OD1-NH1 2.79Å; D293-R523 IonicContact OD1-NH2 2.71Å; D293-R523 PolarHBondContact OD1-NH2 2.82Å
294	V	95.4	Very high	90.5	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	137.5	179.5	174.7	0	0	0	0	108.6	V291 F302 V303 V304 A565 E567 I576 L584	V291-V294 HydrophobicContact CG1-CG2 3.78Å; V294-F302 HydrophobicContact CG1-CD2 4.2Å; V294-V303 CarbonylContact C-O 3.54Å; V294-V303 WeakPolarHBondContact CA-O 3.4Å; V294-V304 HydrophobicContact CG2-CG1 4.17Å; V294-V304 HydrophobicContact CG2-CG2 4.26Å; V294-A565 HydrophobicContact CB-CB 4.13Å; V294-A565 HydrophobicContact CG2-CB 3.7Å; V294-E567 WeakPolarHBondContact O-CB 3.49Å; V294-I576 HydrophobicContact CG1-CB 4.06Å; V294-I576 HydrophobicContact CG1-CD1 4.34Å; V294-I576 HydrophobicContact CG1-CG2 3.72Å; V294-L584 HydrophobicContact CG2-CD2 3.94Å
295	A	93.8	Very high	90.8	Very high	0 Å²	0	18.3 Å²	18.3	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	138.9	172.3	0	0	0	0	0	112.7	F302 V303 V334 A336 E567	A295-F302 CarbonylContact O-C 3.59Å; A295-F302 WeakPolarHBondContact O-CA 3.49Å; A295-V303 PolarHBondContact N-O 2.78Å; A295-V303 PolarHBondContact O-N 2.72Å; A295-V334 HydrophobicContact CB-CB 4.29Å; A295-V334 HydrophobicContact CB-CG1 3.68Å; A295-A336 HydrophobicContact CB-CB 3.98Å; A295-E567 WeakPolarHBondContact CA-OE2 3.34Å
296	S	92	Very high	91.2	Very high	5 Å²	5	17.8 Å²	17.8	4%	0.035	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	117.9	177	66.8	0	0	0	0	111.1	A336 E567 F568	S296-A336 VanDerWaalsContact O-CB 3.22Å; S296-A336 WeakPolarHBondContact O-CB 3.04Å; S296-E567 PolarHBondContact N-OE1 2.98Å; S296-E567 PolarHBondContact OG-OE1 3.49Å; S296-F568 PolarHBondContact OG-O 3.33Å; S296-F568 VanDerWaalsContact OG-O 3.04Å
297	L	88.8	Confident	91.6	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	12%	0.117	C	C	.	.	S	Bend	trans	-90.3	-43.5	179.5	-174.3	61	0	0	0	111.6	H301 V303 A336 T341 L343 F344 F358 K570	L297-H301 PolarHBondContact N-O 2.84Å; L297-V303 HydrophobicContact CB-CG2 4.45Å; L297-A336 HydrophobicContact CD1-CB 4.4Å; L297-T341 VanDerWaalsContact CD1-C 3.46Å; L297-T341 VanDerWaalsContact CD1-O 3.24Å; L297-T341 WeakPolarHBondContact CD1-O 3.37Å; L297-T341 WeakPolarHBondContact CG-O 3.47Å; L297-T341 WeakPolarHBondContact O-CA 3.3Å; L297-T341 WeakPolarHBondContact O-CG2 3.3Å; L297-L343 VanDerWaalsContact CD1-O 3.31Å; L297-L343 WeakPolarHBondContact CD1-O 3.26Å; L297-F344 HydrophobicContact CD2-CD1 4.41Å; L297-F358 HydrophobicContact CD2-CB 3.49Å; L297-F358 VanDerWaalsContact CD2-CB 3.49Å; L297-F358 HydrophobicContact CD2-CD1 3.17Å; L297-F358 HydrophobicContact CD2-CD2 3.8Å; L297-F358 HydrophobicContact CD2-CE1 3.74Å; L297-F358 HydrophobicContact CD2-CE2 4.32Å; L297-F358 HydrophobicContact CD2-CG 3.19Å; L297-F358 HydrophobicContact CD2-CZ 4.29Å; L297-F358 HydrophobicContact CG-CD1 4.22Å; L297-K570 WeakPolarHBondContact O-CE 3.49Å; L297-K570 PolarHBondContact O-NZ 3.36Å
298	S	84.9	Confident	91.8	Very high	24 Å²	24	20.2 Å²	20.2	17%	0.168	11%	0.114	C	C	.	.	S	Bend	trans	-142.1	180	173	63.5	0	0	0	0	109.2	D300 H301	S298-D300 PolarHBondContact O-N 2.84Å; S298-D300 PolarHBondContact OG-N 2.93Å; S298-H301 PolarHBondContact N-O 3.23Å; S298-H301 VanDerWaalsContact O-O 3.06Å; S298-H301 WeakPolarHBondContact OG-CB 3.42Å; S298-H301 PolarHBondContact OG-N 2.79Å; S298-H301 PolarHBondContact OG-ND1 2.72Å; S298-H301 VanDerWaalsContact OG-ND1 3.13Å
299	D	82.1	Confident	92.1	Very high	42 Å²	42	21.2 Å²	21.2	23%	0.225	12%	0.124	C	C	.	.	S	Bend	trans	-66.5	-25.9	174.3	-62.5	-22.8	0	0	0	111.8	S569 K571	D299-S569 PolarHBondContact OD1-OG 2.77Å; D299-K571 PolarHBondContact OD1-N 3.17Å; D299-K571 WeakPolarHBondContact OD2-CD 3.34Å; D299-K571 WeakPolarHBondContact OD2-CE 3.49Å; D299-K571 WeakPolarHBondContact OD2-CG 3.27Å; D299-K571 IonicContact OD2-NZ 3.96Å; D299-K571 PolarHBondContact OD2-NZ 3.37Å
300	D	87.7	Confident	92.3	Very high	99 Å²	99	21 Å²	21	53%	0.529	12%	0.119	S	C	.	.	S	Bend	trans	-98.7	-19.4	-176.1	-57.6	-28	0	0	0	112.9	S298 N315 V316	S298-D300 PolarHBondContact O-N 2.84Å; S298-D300 PolarHBondContact OG-N 2.93Å; D300-N315 CarbonylContact O-C 3.41Å; D300-N315 WeakPolarHBondContact O-CA 3.37Å; D300-V316 WeakPolarHBondContact O-CG2 3.49Å; D300-V316 PolarHBondContact O-N 3.4Å
301	H	91.4	Very high	92.3	Very high	31 Å²	31	18.7 Å²	18.7	14%	0.144	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	133.4	-173.7	-54.1	77.5	0	0	0	111.9	L297 S298 Y314 F358 I361	L297-H301 PolarHBondContact N-O 2.84Å; S298-H301 PolarHBondContact N-O 3.23Å; S298-H301 VanDerWaalsContact O-O 3.06Å; S298-H301 WeakPolarHBondContact OG-CB 3.42Å; S298-H301 PolarHBondContact OG-N 2.79Å; S298-H301 PolarHBondContact OG-ND1 2.72Å; S298-H301 VanDerWaalsContact OG-ND1 3.13Å; H301-Y314 VanDerWaalsContact CA-O 3.26Å; H301-Y314 WeakPolarHBondContact CA-O 3.41Å; H301-F358 HydrophobicContact CB-CZ 4.19Å; H301-F358 AromaticContact CD2-CZ 3.67Å; H301-F358 AromaticContact CG-CZ 3.82Å; H301-I361 WeakPolarHBondContact NE2-CD1 3.5Å; H301-I361 WeakPolarHBondContact NE2-CG1 3.3Å
302	F	92.8	Very high	92.2	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	154.5	174.5	65	-82.8	0	0	0	110.5	F16 V294 A295 V304 V313 Y314 V316 I576 L584 I586	F16-F302 HydrophobicContact CD2-CZ 4.31Å; F16-F302 HydrophobicContact CE2-CE1 4.41Å; F16-F302 HydrophobicContact CE2-CZ 4.09Å; V294-F302 HydrophobicContact CG1-CD2 4.2Å; A295-F302 CarbonylContact O-C 3.59Å; A295-F302 WeakPolarHBondContact O-CA 3.49Å; F302-V304 HydrophobicContact CD2-CG2 3.53Å; F302-V304 HydrophobicContact CE2-CG2 3.49Å; F302-V304 VanDerWaalsContact CE2-CG2 3.49Å; F302-V313 WeakPolarHBondContact O-CA 3.45Å; F302-Y314 HydrophobicContact CD2-CD2 4.37Å; F302-Y314 HydrophobicContact CE1-CG 4.23Å; F302-Y314 AromaticContact CE2-CD2 3.71Å; F302-Y314 HydrophobicContact CE2-CD2 3.71Å; F302-Y314 AromaticContact CE2-CG 3.82Å; F302-Y314 HydrophobicContact CE2-CG 3.82Å; F302-Y314 HydrophobicContact CZ-CD1 4.31Å; F302-Y314 HydrophobicContact CZ-CD2 4Å; F302-Y314 AromaticContact CZ-CG 3.6Å; F302-Y314 HydrophobicContact CZ-CG 3.6Å; F302-Y314 PolarHBondContact N-O 2.88Å; F302-Y314 PolarHBondContact O-N 3.28Å; F302-V316 HydrophobicContact CD1-CG2 3.6Å; F302-V316 HydrophobicContact CE1-CG2 3.82Å; F302-I576 HydrophobicContact CB-CD1 3.64Å; F302-I576 HydrophobicContact CD1-CD1 4.15Å; F302-I576 HydrophobicContact CD2-CD1 4.23Å; F302-I576 HydrophobicContact CD2-CG2 4.44Å; F302-I576 HydrophobicContact CE2-CG2 4.46Å; F302-I576 HydrophobicContact CG-CD1 3.76Å; F302-L584 HydrophobicContact CE2-CD1 4.37Å; F302-I586 HydrophobicContact CD1-CD1 4.49Å; F302-I586 HydrophobicContact CE1-CD1 3.74Å; F302-I586 HydrophobicContact CZ-CD1 4.15Å
303	V	94.7	Very high	92.1	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	137.7	-177.2	-173.9	0	0	0	0	108	V294 A295 L297 I311 R312 V313 V334 F344	V294-V303 CarbonylContact C-O 3.54Å; V294-V303 WeakPolarHBondContact CA-O 3.4Å; A295-V303 PolarHBondContact N-O 2.78Å; A295-V303 PolarHBondContact O-N 2.72Å; L297-V303 HydrophobicContact CB-CG2 4.45Å; V303-I311 HydrophobicContact CG1-CG2 3.23Å; V303-R312 CarbonylContact C-O 3.54Å; V303-R312 WeakPolarHBondContact CA-O 3.43Å; V303-V313 HydrophobicContact CG1-CG2 4.18Å; V303-V313 HydrophobicContact CG2-CG1 4.37Å; V303-V313 HydrophobicContact CG2-CG2 3.99Å; V303-V334 HydrophobicContact CB-CG1 3.98Å; V303-V334 HydrophobicContact CG1-CG1 3.73Å; V303-V334 HydrophobicContact CG1-CG2 4.43Å; V303-F344 HydrophobicContact CG1-CD2 4.16Å; V303-F344 HydrophobicContact CG1-CE2 4.06Å; V303-F344 HydrophobicContact CG2-CD1 4.27Å; V303-F344 HydrophobicContact CG2-CD2 4.47Å; V303-F344 HydrophobicContact CG2-CE1 4.47Å; V303-F344 HydrophobicContact CG2-CG 4.26Å
304	V	95.2	Very high	91.9	Very high	0 Å²	0	18.3 Å²	18.3	0%	0	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	128.6	-176.2	-173.3	0	0	0	0	108.6	V291 V294 F302 T306 R312 Y314 L584	V291-V304 HydrophobicContact CB-CG1 4.44Å; V291-V304 HydrophobicContact CG1-CG1 3.58Å; V291-V304 HydrophobicContact CG2-CG1 4.17Å; V294-V304 HydrophobicContact CG2-CG1 4.17Å; V294-V304 HydrophobicContact CG2-CG2 4.26Å; F302-V304 HydrophobicContact CD2-CG2 3.53Å; F302-V304 HydrophobicContact CE2-CG2 3.49Å; F302-V304 VanDerWaalsContact CE2-CG2 3.49Å; V304-T306 HydrophobicContact CG1-CG2 3.8Å; V304-R312 HydrophobicContact CB-CB 4.32Å; V304-R312 PolarHBondContact N-O 3.44Å; V304-R312 PolarHBondContact O-N 2.78Å; V304-R312 VanDerWaalsContact O-N 3.09Å; V304-Y314 HydrophobicContact CB-CD2 4.42Å; V304-Y314 HydrophobicContact CB-CE2 4.23Å; V304-Y314 HydrophobicContact CG2-CD2 3.66Å; V304-Y314 HydrophobicContact CG2-CE2 3.83Å; V304-L584 HydrophobicContact CG1-CD1 4.2Å; V304-L584 HydrophobicContact CG1-CD2 3.92Å; V304-L584 HydrophobicContact CG2-CD1 3.9Å; V304-L584 HydrophobicContact CG2-CD2 4.02Å
305	A	95.3	Very high	91.7	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	133.2	163.7	0	0	0	0	0	109.5	V291 N292 D293 V331 V334	V291-A305 CarbonylContact C-O 3.59Å; N292-A305 PolarHBondContact N-O 2.82Å; D293-A305 HydrophobicContact CB-CB 4.18Å; D293-A305 PolarHBondContact N-O 2.77Å; D293-A305 PolarHBondContact O-N 2.79Å; A305-V331 HydrophobicContact CB-CB 3.98Å; A305-V331 HydrophobicContact CB-CG1 3.64Å; A305-V334 HydrophobicContact CB-CB 4.49Å; A305-V334 HydrophobicContact CB-CG2 3.57Å
306	T	94	Very high	91.4	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	174.1	-176	41.5	0	0	0	0	109.3	N288 I290 V291 N292 V304 S308 R312	N288-T306 HydrophobicContact CB-CG2 4.47Å; N288-T306 WeakPolarHBondContact O-CB 3.19Å; N288-T306 VanDerWaalsContact O-CG2 3.23Å; N288-T306 WeakPolarHBondContact O-CG2 3.39Å; I290-T306 CarbonylContact O-C 3.49Å; I290-T306 WeakPolarHBondContact O-CA 3.1Å; V291-T306 HydrophobicContact CG2-CG2 4.22Å; N292-T306 VanDerWaalsContact ND2-C 3.34Å; N292-T306 PolarHBondContact ND2-O 2.84Å; V304-T306 HydrophobicContact CG1-CG2 3.8Å; T306-S308 PolarHBondContact O-N 3.03Å; T306-S308 PolarHBondContact OG1-OG 3.21Å; T306-R312 VanDerWaalsContact CG2-NH1 3.28Å; T306-R312 PolarHBondContact OG1-NH1 2.8Å
307	N	93.3	Very high	91.1	Very high	69 Å²	69	23.4 Å²	23.4	37%	0.369	14%	0.14	S	C	.	.	S	Bend	trans	-71.3	45.3	173.4	-163.7	36.3	0	0	0	113.1	I290 I330	I290-N307 HydrophobicContact CB-CB 4.13Å; I290-N307 PolarHBondContact O-N 2.95Å; N307-I330 WeakPolarHBondContact OD1-CD1 3.48Å; N307-I330 WeakPolarHBondContact OD1-CG1 3.42Å
308	S	91.9	Very high	90.9	Very high	27 Å²	27	25.9 Å²	25.9	19%	0.189	16%	0.155	C	C	.	.	S	Bend	trans	-140.8	158.9	-179.7	57.4	0	0	0	0	109.4	T306 D310 R312 I330 V331	T306-S308 PolarHBondContact O-N 3.03Å; T306-S308 PolarHBondContact OG1-OG 3.21Å; S308-D310 VanDerWaalsContact C-N 3.28Å; S308-D310 PolarHBondContact OG-O 2.86Å; S308-D310 VanDerWaalsContact OG-O 3.12Å; S308-R312 PolarHBondContact OG-NH1 3.33Å; S308-I330 WeakPolarHBondContact O-CA 3.01Å; S308-V331 PolarHBondContact O-N 3.32Å
309	A	92.1	Very high	90.8	Very high	27 Å²	27	24.9 Å²	24.9	22%	0.223	15%	0.149	C	C	.	.	S	Bend	trans	-72.3	-25.5	174.8	0	0	0	0	0	112.7	H327 D329 V331	A309-H327 WeakPolarHBondContact O-CB 3.35Å; A309-D329 WeakPolarHBondContact CA-O 3.5Å; A309-V331 WeakPolarHBondContact O-CG2 3.16Å
310	D	92	Very high	91.1	Very high	39 Å²	39	23.7 Å²	23.7	21%	0.209	14%	0.142	C	C	.	.	S	Bend	trans	-83	141.2	179.4	-57.7	-38.9	0	0	0	111.6	S308 S325	S308-D310 VanDerWaalsContact C-N 3.28Å; S308-D310 PolarHBondContact OG-O 2.86Å; S308-D310 VanDerWaalsContact OG-O 3.12Å; D310-S325 WeakPolarHBondContact OD1-CA 3.42Å; D310-S325 WeakPolarHBondContact OD1-CB 3.25Å
311	I	93.6	Very high	91.1	Very high	0 Å²	0	19 Å²	19	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	137.4	174.4	-59.7	168.8	0	0	0	108.2	V303 V324 V331 F344 S346 W356	V303-I311 HydrophobicContact CG1-CG2 3.23Å; I311-V324 HydrophobicContact CB-CB 4.32Å; I311-V324 PolarHBondContact N-O 2.95Å; I311-V324 PolarHBondContact O-N 2.98Å; I311-V331 HydrophobicContact CG1-CG1 4.33Å; I311-V331 HydrophobicContact CG1-CG2 3.87Å; I311-F344 HydrophobicContact CD1-CE2 4.15Å; I311-F344 HydrophobicContact CG2-CE2 4.15Å; I311-S346 WeakPolarHBondContact CD1-OG 3.22Å; I311-W356 HydrophobicContact CD1-CD2 4.33Å; I311-W356 VanDerWaalsContact CD1-CE2 3.48Å; I311-W356 HydrophobicContact CD1-CH2 4.46Å; I311-W356 HydrophobicContact CD1-CZ2 3.58Å
312	R	93.1	Very high	91	Very high	16 Å²	16	19.7 Å²	19.7	6%	0.06	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	126.8	-178.8	-68.3	-179.2	172.6	116.8	-11.9	110.8	N287 N288 V303 V304 T306 S308 Y314 L323	N287-R312 PolarHBondContact O-NH2 3.22Å; N288-R312 PolarHBondContact O-NH1 3.06Å; V303-R312 CarbonylContact C-O 3.54Å; V303-R312 WeakPolarHBondContact CA-O 3.43Å; V304-R312 HydrophobicContact CB-CB 4.32Å; V304-R312 PolarHBondContact N-O 3.44Å; V304-R312 PolarHBondContact O-N 2.78Å; V304-R312 VanDerWaalsContact O-N 3.09Å; T306-R312 VanDerWaalsContact CG2-NH1 3.28Å; T306-R312 PolarHBondContact OG1-NH1 2.8Å; S308-R312 PolarHBondContact OG-NH1 3.33Å; R312-Y314 HydrophobicContact CB-CD2 4.3Å; R312-Y314 HydrophobicContact CB-CE2 3.65Å; R312-L323 HydrophobicContact CG-CG 4.36Å
313	V	93.7	Very high	90.8	Very high	0 Å²	0	20 Å²	20	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	113.3	176.5	-175.8	0	0	0	0	109.4	F302 V303 C321 Q322 V324 F358 I364	F302-V313 WeakPolarHBondContact O-CA 3.45Å; V303-V313 HydrophobicContact CG1-CG2 4.18Å; V303-V313 HydrophobicContact CG2-CG1 4.37Å; V303-V313 HydrophobicContact CG2-CG2 3.99Å; V313-C321 CarbonylContact O-C 3.51Å; V313-C321 WeakPolarHBondContact O-CA 3.25Å; V313-Q322 PolarHBondContact N-O 3.43Å; V313-Q322 PolarHBondContact O-N 3.33Å; V313-V324 HydrophobicContact CG2-CG2 4.2Å; V313-F358 HydrophobicContact CG1-CD2 4.35Å; V313-F358 HydrophobicContact CG1-CE2 3.85Å; V313-I364 HydrophobicContact CB-CD1 4.02Å; V313-I364 HydrophobicContact CG1-CD1 4.3Å; V313-I364 HydrophobicContact CG2-CD1 3.69Å
314	Y	92.4	Very high	90.6	Very high	6 Å²	6	20.4 Å²	20.4	2%	0.024	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	145.8	-177.6	-73.5	-93.2	0	0	0	111.8	N288 H301 F302 V304 R312 H320 C321 L584	N288-Y314 PolarHBondContact OD1-OH 2.99Å; H301-Y314 VanDerWaalsContact CA-O 3.26Å; H301-Y314 WeakPolarHBondContact CA-O 3.41Å; F302-Y314 HydrophobicContact CD2-CD2 4.37Å; F302-Y314 HydrophobicContact CE1-CG 4.23Å; F302-Y314 AromaticContact CE2-CD2 3.71Å; F302-Y314 HydrophobicContact CE2-CD2 3.71Å; F302-Y314 AromaticContact CE2-CG 3.82Å; F302-Y314 HydrophobicContact CE2-CG 3.82Å; F302-Y314 HydrophobicContact CZ-CD1 4.31Å; F302-Y314 HydrophobicContact CZ-CD2 4Å; F302-Y314 AromaticContact CZ-CG 3.6Å; F302-Y314 HydrophobicContact CZ-CG 3.6Å; F302-Y314 PolarHBondContact N-O 2.88Å; F302-Y314 PolarHBondContact O-N 3.28Å; V304-Y314 HydrophobicContact CB-CD2 4.42Å; V304-Y314 HydrophobicContact CB-CE2 4.23Å; V304-Y314 HydrophobicContact CG2-CD2 3.66Å; V304-Y314 HydrophobicContact CG2-CE2 3.83Å; R312-Y314 HydrophobicContact CB-CD2 4.3Å; R312-Y314 HydrophobicContact CB-CE2 3.65Å; Y314-H320 CarbonylContact C-O 3.59Å; Y314-H320 WeakPolarHBondContact CA-O 3.38Å; Y314-C321 HydrophobicContact CD1-CB 3.73Å; Y314-C321 HydrophobicContact CE1-CB 3.5Å; Y314-C321 VanDerWaalsContact CE1-CB 3.5Å; Y314-C321 HydrophobicContact CE2-CB 4.47Å; Y314-C321 HydrophobicContact CG-CB 4.31Å; Y314-L584 HydrophobicContact CD2-CD1 4.31Å; Y314-L584 HydrophobicContact CE2-CD1 3.75Å
315	N	90.8	Very high	90.2	Very high	29 Å²	29	23.7 Å²	23.7	16%	0.155	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	125.3	159.2	-177.5	-32.7	0	0	0	109.7	D300 A317 T318 G319 H320 I361	D300-N315 CarbonylContact O-C 3.41Å; D300-N315 WeakPolarHBondContact O-CA 3.37Å; N315-A317 PolarHBondContact O-N 3.46Å; N315-A317 PolarHBondContact OD1-N 2.96Å; N315-T318 WeakPolarHBondContact CB-OG1 3.48Å; N315-G319 VanDerWaalsContact O-CA 3.31Å; N315-G319 WeakPolarHBondContact O-CA 3.34Å; N315-G319 PolarHBondContact O-N 2.91Å; N315-H320 HydrophobicContact CB-CB 4.32Å; N315-H320 PolarHBondContact N-O 3.34Å; N315-I361 HydrophobicContact CB-CD1 4.08Å
316	V	87.1	Confident	89.8	Confident	16 Å²	16	24.9 Å²	24.9	10%	0.097	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-43.6	-177.7	173.1	0	0	0	0	112.5	D300 F302 I586	D300-V316 WeakPolarHBondContact O-CG2 3.49Å; D300-V316 PolarHBondContact O-N 3.4Å; F302-V316 HydrophobicContact CD1-CG2 3.6Å; F302-V316 HydrophobicContact CE1-CG2 3.82Å; V316-I586 HydrophobicContact CB-CD1 4.17Å; V316-I586 HydrophobicContact CG1-CD1 3.71Å; V316-I586 HydrophobicContact CG2-CD1 3.97Å
317	A	86.3	Confident	89.7	Confident	67 Å²	67	25.4 Å²	25.4	55%	0.554	16%	0.162	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.3	-35.7	-170	0	0	0	0	0	113.4	N315	N315-A317 PolarHBondContact O-N 3.46Å; N315-A317 PolarHBondContact OD1-N 2.96Å
318	T	83.5	Confident	89.7	Confident	52 Å²	52	27.8 Å²	27.8	32%	0.319	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.9	-17.4	-174.8	58.7	0	0	0	0	112.8	S50 K282 N315 H320	S50-T318 PolarHBondContact OG-O 3.43Å; K282-T318 WeakPolarHBondContact CE-O 3.36Å; K282-T318 PolarHBondContact NZ-O 3.41Å; N315-T318 WeakPolarHBondContact CB-OG1 3.48Å; T318-H320 PolarHBondContact O-N 2.94Å; T318-H320 WeakPolarHBondContact OG1-CB 3.44Å; T318-H320 PolarHBondContact OG1-N 2.78Å
319	G	83.7	Confident	89.8	Confident	3 Å²	3	29.3 Å²	29.3	3%	0.031	19%	0.185	C	C	.	.			trans	65.5	13.5	-169.4	0	0	0	0	0	113.8	F16 N315 C321	F16-G319 VanDerWaalsContact CE1-CA 3.44Å; N315-G319 VanDerWaalsContact O-CA 3.31Å; N315-G319 WeakPolarHBondContact O-CA 3.34Å; N315-G319 PolarHBondContact O-N 2.91Å; G319-C321 PolarHBondContact O-N 3.33Å
320	H	88.1	Confident	90	Very high	17 Å²	17	29.6 Å²	29.6	8%	0.079	18%	0.183	C	C	.	.			trans	-63.7	126	173.4	-177.7	-109.1	0	0	0	110.2	K282 Q283 Y314 N315 T318 I361	K282-H320 VanDerWaalsContact CA-CD2 3.4Å; K282-H320 WeakPolarHBondContact CA-CD2 3.48Å; K282-H320 HydrophobicContact CG-CB 4.36Å; Q283-H320 PolarHBondContact N-CD2 2.94Å; Q283-H320 PolarHBondContact N-NE2 2.9Å; Q283-H320 PolarHBondContact O-CD2 2.77Å; Y314-H320 CarbonylContact C-O 3.59Å; Y314-H320 WeakPolarHBondContact CA-O 3.38Å; N315-H320 HydrophobicContact CB-CB 4.32Å; N315-H320 PolarHBondContact N-O 3.34Å; T318-H320 PolarHBondContact O-N 2.94Å; T318-H320 WeakPolarHBondContact OG1-CB 3.44Å; T318-H320 PolarHBondContact OG1-N 2.78Å; H320-I361 WeakPolarHBondContact CE1-CG2 3.25Å; H320-I361 WeakPolarHBondContact ND1-CG2 3.44Å
321	C	89	Confident	90.2	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	118.4	-177.5	-176.5	0	0	0	0	111.1	Q283 V285 V313 Y314 G319	Q283-C321 WeakPolarHBondContact CB-O 3.39Å; Q283-C321 VanDerWaalsContact CD-O 3.28Å; Q283-C321 WeakPolarHBondContact CG-O 3.3Å; Q283-C321 PolarHBondContact O-N 2.68Å; Q283-C321 PolarHBondContact OE1-O 2.64Å; V285-C321 HydrophobicContact CG2-CB 3.87Å; V285-C321 WeakPolarHBondContact CG2-SG 3.33Å; V313-C321 CarbonylContact O-C 3.51Å; V313-C321 WeakPolarHBondContact O-CA 3.25Å; Y314-C321 HydrophobicContact CD1-CB 3.73Å; Y314-C321 HydrophobicContact CE1-CB 3.5Å; Y314-C321 VanDerWaalsContact CE1-CB 3.5Å; Y314-C321 HydrophobicContact CE2-CB 4.47Å; Y314-C321 HydrophobicContact CG-CB 4.31Å; G319-C321 PolarHBondContact O-N 3.33Å
322	Q	89	Confident	90.3	Very high	46 Å²	46	29.8 Å²	29.8	22%	0.215	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	130.1	170.4	-177.5	67.3	18.4	0	0	110.3	V313 V324 I361 I364	V313-Q322 PolarHBondContact N-O 3.43Å; V313-Q322 PolarHBondContact O-N 3.33Å; Q322-V324 HydrophobicContact CG-CG2 4.28Å; Q322-I361 HydrophobicContact CB-CG2 3.94Å; Q322-I361 WeakPolarHBondContact CG-O 3.41Å; Q322-I364 HydrophobicContact CG-CD1 4.36Å
323	L	88.5	Confident	90.4	Very high	5 Å²	5	29.3 Å²	29.3	3%	0.026	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	120.4	172.2	-83.5	75.9	0	0	0	110.4	Q246 N269 Q283 V285 R312	Q246-L323 PolarHBondContact NE2-O 2.86Å; N269-L323 WeakPolarHBondContact ND2-CD2 3.3Å; Q283-L323 HydrophobicContact CG-CD1 4.27Å; V285-L323 HydrophobicContact CG2-CD1 3.53Å; R312-L323 HydrophobicContact CG-CG 4.36Å
324	V	89.5	Confident	90.5	Very high	10 Å²	10	29.5 Å²	29.5	6%	0.061	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	107.4	-178.7	-176.7	0	0	0	0	108.7	I311 V313 Q322 W356 I364	I311-V324 HydrophobicContact CB-CB 4.32Å; I311-V324 PolarHBondContact N-O 2.95Å; I311-V324 PolarHBondContact O-N 2.98Å; V313-V324 HydrophobicContact CG2-CG2 4.2Å; Q322-V324 HydrophobicContact CG-CG2 4.28Å; V324-W356 HydrophobicContact CG1-CE3 3.69Å; V324-W356 HydrophobicContact CG1-CH2 3.86Å; V324-W356 HydrophobicContact CG1-CZ3 3.3Å; V324-I364 HydrophobicContact CG1-CB 4.38Å; V324-I364 HydrophobicContact CG1-CG2 3.87Å; V324-I364 HydrophobicContact CG2-CB 3.9Å; V324-I364 HydrophobicContact CG2-CD1 3.55Å; V324-I364 HydrophobicContact CG2-CG1 4.28Å; V324-I364 HydrophobicContact CG2-CG2 3.85Å
325	S	88	Confident	90.5	Very high	68 Å²	68	29.7 Å²	29.7	48%	0.476	19%	0.186	S	C	.	.			trans	-88.4	145.8	177.7	61.2	0	0	0	0	111.5	D310	D310-S325 WeakPolarHBondContact OD1-CA 3.42Å; D310-S325 WeakPolarHBondContact OD1-CB 3.25Å
326	G	86.1	Confident	90.6	Very high	26 Å²	26	28.9 Å²	28.9	27%	0.268	18%	0.183	S	C	.	.			trans	173.2	-38.3	169.7	0	0	0	0	0	113.1	R354	G326-R354 PolarHBondContact O-NH1 3.15Å; G326-R354 PolarHBondContact O-NH2 3Å
327	H	92.7	Very high	90.8	Very high	11 Å²	11	28.2 Å²	28.2	5%	0.051	18%	0.179	C	C	.	.			trans	-66.2	156.8	168.3	-78	-70.2	0	0	0	110.8	A309 V331 S346 S348 D350 T352	A309-H327 WeakPolarHBondContact O-CB 3.35Å; H327-V331 HydrophobicContact CB-CG2 4.35Å; H327-S346 PolarHBondContact CD2-OG 3.37Å; H327-S346 PolarHBondContact NE2-OG 2.92Å; H327-S348 VanDerWaalsContact CE1-CB 3.47Å; H327-S348 WeakPolarHBondContact CE1-CB 3.47Å; H327-S348 WeakPolarHBondContact ND1-CB 3.37Å; H327-D350 WeakPolarHBondContact CA-OD2 3.45Å; H327-D350 IonicContact CE1-OD1 3.74Å; H327-D350 IonicContact CE1-OD2 2.79Å; H327-D350 IonicContact CG-OD2 3.29Å; H327-D350 IonicContact ND1-OD1 2.61Å; H327-D350 PolarHBondContact ND1-OD1 2.77Å; H327-D350 IonicContact ND1-OD2 2.89Å; H327-D350 PolarHBondContact ND1-OD2 2.78Å; H327-T352 PolarHBondContact CE1-OG1 2.86Å; H327-T352 PolarHBondContact ND1-OG1 2.92Å
328	T	92.8	Very high	90.7	Very high	119 Å²	119	29.9 Å²	29.9	73%	0.73	17%	0.174	S	C	*	.	S	Bend	trans	-102.7	-8.9	178.5	57.6	0	0	0	0	113.1	D350	T328-D350 PolarHBondContact N-OD2 2.92Å; T328-D350 VanDerWaalsContact OG1-CB 3.26Å; T328-D350 WeakPolarHBondContact OG1-CB 3.37Å
329	D	94	Very high	90.8	Very high	59 Å²	59	31.1 Å²	31.1	32%	0.316	17%	0.173	S	C	.	.	S	Bend	trans	-147.8	174.5	-178.9	-160	-1.6	0	0	0	109.7	A309 V331 S348 K349 D350	A309-D329 WeakPolarHBondContact CA-O 3.5Å; D329-V331 PolarHBondContact O-N 3.27Å; D329-S348 PolarHBondContact O-OG 3.08Å; D329-K349 HydrophobicContact CB-CB 4.27Å; D329-K349 WeakPolarHBondContact OD2-CG 3.47Å; D329-D350 HydrophobicContact CB-CB 3.93Å
330	I	95.2	Very high	90.9	Very high	32 Å²	32	32.1 Å²	32.1	16%	0.164	18%	0.179	C	C	.	.			trans	-47.2	129.4	-173	-63.7	152.4	0	0	0	113.1	N292 N307 S308 L332 S348 K349	N292-I330 WeakPolarHBondContact ND2-CG2 3.07Å; N307-I330 WeakPolarHBondContact OD1-CD1 3.48Å; N307-I330 WeakPolarHBondContact OD1-CG1 3.42Å; S308-I330 WeakPolarHBondContact O-CA 3.01Å; I330-L332 HydrophobicContact CG2-CD2 4.05Å; I330-S348 CarbonylContact O-C 3.57Å; I330-S348 VanDerWaalsContact O-CA 3.26Å; I330-S348 WeakPolarHBondContact O-CA 3.23Å; I330-S348 WeakPolarHBondContact O-CB 3.36Å; I330-S348 PolarHBondContact O-OG 3.23Å; I330-K349 HydrophobicContact CB-CB 4.39Å; I330-K349 HydrophobicContact CD1-CD 4.28Å; I330-K349 PolarHBondContact O-N 3.38Å
331	V	96.2	Very high	90.8	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82	124.1	172.5	-170	0	0	0	0	109.6	N292 A305 S308 A309 I311 H327 D329 V334 S347	N292-V331 PolarHBondContact ND2-O 2.96Å; A305-V331 HydrophobicContact CB-CB 3.98Å; A305-V331 HydrophobicContact CB-CG1 3.64Å; S308-V331 PolarHBondContact O-N 3.32Å; A309-V331 WeakPolarHBondContact O-CG2 3.16Å; I311-V331 HydrophobicContact CG1-CG1 4.33Å; I311-V331 HydrophobicContact CG1-CG2 3.87Å; H327-V331 HydrophobicContact CB-CG2 4.35Å; D329-V331 PolarHBondContact O-N 3.27Å; V331-V334 HydrophobicContact CG1-CG2 4.04Å; V331-S347 CarbonylContact C-O 3.55Å; V331-S347 VanDerWaalsContact CG1-O 3.32Å; V331-S347 WeakPolarHBondContact CG1-O 3.28Å
332	L	95.7	Very high	90.7	Very high	43 Å²	43	36.8 Å²	36.8	23%	0.225	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	-41.7	-173.5	-67.5	179.4	0	0	0	113.3	N292 I330 S347 K349 S376	N292-L332 WeakPolarHBondContact CB-O 3.49Å; I330-L332 HydrophobicContact CG2-CD2 4.05Å; L332-S347 PolarHBondContact N-O 3.27Å; L332-K349 HydrophobicContact CD1-CB 4.49Å; L332-S376 WeakPolarHBondContact CD1-OG 3.31Å
333	C	95.4	Very high	90.9	Very high	7 Å²	7	34.9 Å²	34.9	5%	0.047	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	140.6	-177.2	164.5	0	0	0	0	110.6	D293 S346 S347 S378	D293-C333 VanDerWaalsContact OD2-CA 3.26Å; D293-C333 WeakPolarHBondContact OD2-CA 3.43Å; D293-C333 WeakPolarHBondContact OD2-CB 3.47Å; D293-C333 PolarHBondContact OD2-SG 3.49Å; C333-S346 CarbonylContact O-C 3.54Å; C333-S346 WeakPolarHBondContact O-CA 3.43Å; C333-S347 VanDerWaalsContact CB-OG 3.24Å; C333-S347 WeakPolarHBondContact CB-OG 3.47Å; C333-S347 PolarHBondContact N-O 3.02Å; C333-S347 PolarHBondContact N-OG 2.91Å; C333-S347 PolarHBondContact O-N 2.93Å; C333-S347 PolarHBondContact O-OG 3.49Å; C333-S378 WeakPolarHBondContact CB-O 3.1Å
334	V	95.6	Very high	91.1	Very high	3 Å²	3	34.7 Å²	34.7	2%	0.018	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	137	175.4	176.2	0	0	0	0	108.2	D293 A295 V303 A305 V331 F344 L345	D293-V334 PolarHBondContact OD2-N 3.03Å; D293-V334 VanDerWaalsContact OD2-O 3.09Å; A295-V334 HydrophobicContact CB-CB 4.29Å; A295-V334 HydrophobicContact CB-CG1 3.68Å; V303-V334 HydrophobicContact CB-CG1 3.98Å; V303-V334 HydrophobicContact CG1-CG1 3.73Å; V303-V334 HydrophobicContact CG1-CG2 4.43Å; A305-V334 HydrophobicContact CB-CB 4.49Å; A305-V334 HydrophobicContact CB-CG2 3.57Å; V331-V334 HydrophobicContact CG1-CG2 4.04Å; V334-F344 HydrophobicContact CG1-CD2 4.28Å; V334-L345 CarbonylContact C-O 3.59Å; V334-L345 VanDerWaalsContact CA-O 3.24Å; V334-L345 WeakPolarHBondContact CA-O 3.41Å
335	S	94.1	Very high	91.4	Very high	10 Å²	10	34.2 Å²	34.2	7%	0.07	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	129	179.1	-172.7	0	0	0	0	109.9	F344 L345 A380 W382	S335-F344 WeakPolarHBondContact O-CA 3.06Å; S335-L345 PolarHBondContact N-O 3.13Å; S335-L345 PolarHBondContact O-N 3.43Å; S335-A380 VanDerWaalsContact CB-O 3.24Å; S335-A380 WeakPolarHBondContact CB-O 3.08Å; S335-W382 PolarHBondContact O-NE1 3.11Å
336	A	92.8	Very high	91.8	Very high	13 Å²	13	31 Å²	31	11%	0.107	18%	0.176	C	C	.	.			trans	-106.3	134.9	172.1	0	0	0	0	0	109.9	A295 S296 L297 F344	A295-A336 HydrophobicContact CB-CB 3.98Å; S296-A336 VanDerWaalsContact O-CB 3.22Å; S296-A336 WeakPolarHBondContact O-CB 3.04Å; L297-A336 HydrophobicContact CD1-CB 4.4Å; A336-F344 HydrophobicContact CB-CB 4.48Å
337	P	90.2	Very high	92.3	Very high	2 Å²	2	29.8 Å²	29.8	1%	0.013	16%	0.164	C	C	.	.			trans	-71.7	143.2	175.9	29.2	-28.6	0	0	0	111	W339 L343 W382 K570	P337-W339 VanDerWaalsContact C-N 3.33Å; P337-W339 HydrophobicContact CB-CD2 4.03Å; P337-W339 VanDerWaalsContact CB-CE2 3.4Å; P337-W339 HydrophobicContact CB-CG 4.44Å; P337-W339 HydrophobicContact CB-CH2 3.87Å; P337-W339 HydrophobicContact CB-CZ2 3.34Å; P337-W339 HydrophobicContact CG-CH2 3.74Å; P337-W339 HydrophobicContact CG-CZ2 3.75Å; P337-W339 HydrophobicContact CG-CZ3 4.36Å; P337-W339 PolarHBondContact O-N 3.28Å; P337-L343 WeakPolarHBondContact CD-O 3.39Å; P337-L343 HydrophobicContact CG-CB 4.3Å; P337-W382 HydrophobicContact CB-CB 4.13Å; P337-W382 HydrophobicContact CB-CD2 4.1Å; P337-W382 HydrophobicContact CB-CE3 4.44Å; P337-W382 HydrophobicContact CB-CG 3.97Å; P337-W382 HydrophobicContact CG-CD2 4.12Å; P337-W382 HydrophobicContact CG-CE3 4.45Å; P337-W382 HydrophobicContact CG-CG 4.38Å; P337-K570 PolarHBondContact O-NZ 2.87Å
338	K	84.3	Confident	92.5	Very high	102 Å²	102	29.3 Å²	29.3	44%	0.443	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-32.5	176.5	-63.6	-166.1	178.3	-163	0	112.9	H486	K338-H486 PolarHBondContact NZ-CE1 3.06Å; K338-H486 PolarHBondContact NZ-NE2 2.82Å
339	W	86.2	Confident	92.6	Very high	77 Å²	77	28.3 Å²	28.3	29%	0.292	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.5	-6.8	-176.8	51.9	-98.3	0	0	0	114.8	P337 L343 W382 S383 L387	P337-W339 VanDerWaalsContact C-N 3.33Å; P337-W339 HydrophobicContact CB-CD2 4.03Å; P337-W339 VanDerWaalsContact CB-CE2 3.4Å; P337-W339 HydrophobicContact CB-CG 4.44Å; P337-W339 HydrophobicContact CB-CH2 3.87Å; P337-W339 HydrophobicContact CB-CZ2 3.34Å; P337-W339 HydrophobicContact CG-CH2 3.74Å; P337-W339 HydrophobicContact CG-CZ2 3.75Å; P337-W339 HydrophobicContact CG-CZ3 4.36Å; P337-W339 PolarHBondContact O-N 3.28Å; W339-L343 HydrophobicContact CH2-CD1 3.93Å; W339-L343 HydrophobicContact CZ3-CD1 4.18Å; W339-W382 HydrophobicContact CH2-CE3 4.2Å; W339-W382 HydrophobicContact CH2-CZ3 4.1Å; W339-W382 AromaticContact CZ2-CE3 3.77Å; W339-W382 HydrophobicContact CZ2-CE3 3.77Å; W339-W382 HydrophobicContact CZ2-CZ3 4.13Å; W339-S383 PolarHBondContact NE1-O 3.15Å; W339-L387 HydrophobicContact CE3-CD1 4.49Å; W339-L387 HydrophobicContact CE3-CG 4.14Å; W339-L387 HydrophobicContact CH2-CB 4.4Å; W339-L387 HydrophobicContact CH2-CD1 3.87Å; W339-L387 HydrophobicContact CH2-CD2 3.07Å; W339-L387 HydrophobicContact CH2-CG 3.15Å; W339-L387 HydrophobicContact CZ2-CD2 3.61Å; W339-L387 HydrophobicContact CZ2-CG 3.7Å; W339-L387 HydrophobicContact CZ3-CD1 3.6Å; W339-L387 HydrophobicContact CZ3-CD2 3.76Å; W339-L387 HydrophobicContact CZ3-CG 3.32Å
340	S	85.6	Confident	92.7	Very high	24 Å²	24	26.5 Å²	26.5	17%	0.168	14%	0.137	C	C	.	.			trans	-142.8	141.1	176.6	174.7	0	0	0	0	112.3	S342 K570	S340-S342 PolarHBondContact OG-N 2.99Å; S340-S342 VanDerWaalsContact OG-N 3.11Å; S340-K570 VanDerWaalsContact C-NZ 3.32Å; S340-K570 PolarHBondContact O-NZ 3.17Å
341	T	85.8	Confident	92.6	Very high	74 Å²	74	27.8 Å²	27.8	45%	0.454	14%	0.144	S	C	.	.	S	Bend	trans	-97.8	5.4	174.9	55.4	0	0	0	0	112.6	L297 K570	L297-T341 VanDerWaalsContact CD1-C 3.46Å; L297-T341 VanDerWaalsContact CD1-O 3.24Å; L297-T341 WeakPolarHBondContact CD1-O 3.37Å; L297-T341 WeakPolarHBondContact CG-O 3.47Å; L297-T341 WeakPolarHBondContact O-CA 3.3Å; L297-T341 WeakPolarHBondContact O-CG2 3.3Å; T341-K570 HydrophobicContact CG2-CD 4.38Å
342	S	88.1	Confident	92.6	Very high	41 Å²	41	28.8 Å²	28.8	29%	0.287	15%	0.15	S	C	.	.	S	Bend	trans	-117.8	2.4	-171.9	-56.8	0	0	0	0	113.6	S340 R357 F358	S340-S342 PolarHBondContact OG-N 2.99Å; S340-S342 VanDerWaalsContact OG-N 3.11Å; S342-R357 CarbonylContact O-C 3.53Å; S342-R357 VanDerWaalsContact O-CA 3.3Å; S342-R357 WeakPolarHBondContact O-CA 3.5Å; S342-F358 WeakPolarHBondContact CA-O 3.41Å; S342-F358 VanDerWaalsContact CB-O 3.24Å; S342-F358 WeakPolarHBondContact CB-O 3.26Å; S342-F358 PolarHBondContact O-N 3.01Å
343	L	91.5	Very high	92.5	Very high	7 Å²	7	26.7 Å²	26.7	4%	0.037	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	144.8	-178.1	-65.5	172.4	0	0	0	109.4	L297 P337 W339 W356 R357 W382 L387 F409	L297-L343 VanDerWaalsContact CD1-O 3.31Å; L297-L343 WeakPolarHBondContact CD1-O 3.26Å; P337-L343 WeakPolarHBondContact CD-O 3.39Å; P337-L343 HydrophobicContact CG-CB 4.3Å; W339-L343 HydrophobicContact CH2-CD1 3.93Å; W339-L343 HydrophobicContact CZ3-CD1 4.18Å; L343-W356 VanDerWaalsContact CA-O 3.3Å; L343-W356 WeakPolarHBondContact CA-O 3.2Å; L343-W356 WeakPolarHBondContact CD2-O 3.23Å; L343-R357 HydrophobicContact CD2-CB 4.15Å; L343-R357 HydrophobicContact CD2-CG 4.35Å; L343-W382 HydrophobicContact CB-CH2 3.86Å; L343-W382 HydrophobicContact CB-CZ2 4.11Å; L343-W382 HydrophobicContact CD1-CH2 4.27Å; L343-L387 HydrophobicContact CD1-CD1 4.32Å; L343-L387 HydrophobicContact CD1-CD2 3.97Å; L343-F409 HydrophobicContact CD1-CD1 3.95Å; L343-F409 HydrophobicContact CD1-CE1 4.22Å; L343-F409 HydrophobicContact CD1-CG 4.22Å; L343-F409 HydrophobicContact CD2-CD1 3.64Å; L343-F409 HydrophobicContact CD2-CE1 3.99Å; L343-F409 HydrophobicContact CG-CD1 4.49Å
344	F	94.2	Very high	92.5	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	158.5	167.9	64.4	-88.9	0	0	0	109.8	L297 V303 I311 V334 S335 A336 W356 F358 I364	L297-F344 HydrophobicContact CD2-CD1 4.41Å; V303-F344 HydrophobicContact CG1-CD2 4.16Å; V303-F344 HydrophobicContact CG1-CE2 4.06Å; V303-F344 HydrophobicContact CG2-CD1 4.27Å; V303-F344 HydrophobicContact CG2-CD2 4.47Å; V303-F344 HydrophobicContact CG2-CE1 4.47Å; V303-F344 HydrophobicContact CG2-CG 4.26Å; I311-F344 HydrophobicContact CD1-CE2 4.15Å; I311-F344 HydrophobicContact CG2-CE2 4.15Å; V334-F344 HydrophobicContact CG1-CD2 4.28Å; S335-F344 WeakPolarHBondContact O-CA 3.06Å; A336-F344 HydrophobicContact CB-CB 4.48Å; F344-W356 HydrophobicContact CD1-CB 3.86Å; F344-W356 HydrophobicContact CD2-CB 3.86Å; F344-W356 AromaticContact CD2-CD1 3.67Å; F344-W356 AromaticContact CD2-CG 3.96Å; F344-W356 HydrophobicContact CD2-CG 3.96Å; F344-W356 HydrophobicContact CE1-CB 3.44Å; F344-W356 VanDerWaalsContact CE1-CB 3.44Å; F344-W356 HydrophobicContact CE1-CG 4.23Å; F344-W356 HydrophobicContact CE2-CB 3.43Å; F344-W356 VanDerWaalsContact CE2-CB 3.43Å; F344-W356 AromaticContact CE2-CD1 3.29Å; F344-W356 HydrophobicContact CE2-CD2 4.15Å; F344-W356 AromaticContact CE2-CG 3.33Å; F344-W356 HydrophobicContact CE2-CG 3.33Å; F344-W356 HydrophobicContact CG-CB 4.06Å; F344-W356 HydrophobicContact CZ-CB 3.21Å; F344-W356 AromaticContact CZ-CD1 3.97Å; F344-W356 HydrophobicContact CZ-CD2 4.17Å; F344-W356 AromaticContact CZ-CG 3.5Å; F344-W356 HydrophobicContact CZ-CG 3.5Å; F344-W356 VanDerWaalsContact CZ-CG 3.5Å; F344-W356 PolarHBondContact N-O 3.35Å; F344-W356 VanDerWaalsContact N-O 3.1Å; F344-W356 PolarHBondContact O-N 3.07Å; F344-F358 HydrophobicContact CD1-CB 4.33Å; F344-F358 HydrophobicContact CE1-CB 4.19Å; F344-I364 HydrophobicContact CE1-CG2 3.95Å; F344-I364 HydrophobicContact CZ-CG2 3.88Å
345	L	95	Very high	92.4	Very high	1 Å²	1	28.1 Å²	28.1	1%	0.005	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	135.8	-176.8	174.8	68.6	0	0	0	107.4	V334 S335 A353 R354 I355 I370 A380 W382 C390	V334-L345 CarbonylContact C-O 3.59Å; V334-L345 VanDerWaalsContact CA-O 3.24Å; V334-L345 WeakPolarHBondContact CA-O 3.41Å; S335-L345 PolarHBondContact N-O 3.13Å; S335-L345 PolarHBondContact O-N 3.43Å; L345-A353 HydrophobicContact CD1-CB 4.26Å; L345-R354 CarbonylContact C-O 3.59Å; L345-R354 WeakPolarHBondContact CA-O 3.13Å; L345-R354 WeakPolarHBondContact CD1-O 3.39Å; L345-I355 HydrophobicContact CD1-CG1 3.72Å; L345-I370 HydrophobicContact CD1-CD1 4Å; L345-A380 HydrophobicContact CD1-CB 4.49Å; L345-A380 HydrophobicContact CD2-CB 3.51Å; L345-A380 HydrophobicContact CG-CB 3.91Å; L345-W382 HydrophobicContact CB-CZ2 3.83Å; L345-C390 HydrophobicContact CD2-CB 4.17Å
346	S	96.5	Very high	92.3	Very high	1 Å²	1	27.9 Å²	27.9	1%	0.007	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	153.8	170.2	62	0	0	0	0	109.8	I311 H327 C333 A353 R354 W356	I311-S346 WeakPolarHBondContact CD1-OG 3.22Å; H327-S346 PolarHBondContact CD2-OG 3.37Å; H327-S346 PolarHBondContact NE2-OG 2.92Å; C333-S346 CarbonylContact O-C 3.54Å; C333-S346 WeakPolarHBondContact O-CA 3.43Å; S346-A353 CarbonylContact O-C 3.53Å; S346-A353 WeakPolarHBondContact O-CA 3.19Å; S346-A353 VanDerWaalsContact O-CB 3.3Å; S346-A353 WeakPolarHBondContact O-CB 3.09Å; S346-R354 PolarHBondContact N-O 2.67Å; S346-R354 PolarHBondContact O-N 3.37Å; S346-R354 PolarHBondContact OG-O 3.48Å; S346-W356 PolarHBondContact OG-NE1 2.76Å
347	S	95.9	Very high	92.2	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	141.7	172.6	49.6	0	0	0	0	108.8	V331 L332 C333	V331-S347 CarbonylContact C-O 3.55Å; V331-S347 VanDerWaalsContact CG1-O 3.32Å; V331-S347 WeakPolarHBondContact CG1-O 3.28Å; L332-S347 PolarHBondContact N-O 3.27Å; C333-S347 VanDerWaalsContact CB-OG 3.24Å; C333-S347 WeakPolarHBondContact CB-OG 3.47Å; C333-S347 PolarHBondContact N-O 3.02Å; C333-S347 PolarHBondContact N-OG 2.91Å; C333-S347 PolarHBondContact O-N 2.93Å; C333-S347 PolarHBondContact O-OG 3.49Å
348	S	96.7	Very high	92.2	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	160.7	-171.4	168.6	0	0	0	0	111.4	H327 D329 I330 D350 N351 T352 V377	H327-S348 VanDerWaalsContact CE1-CB 3.47Å; H327-S348 WeakPolarHBondContact CE1-CB 3.47Å; H327-S348 WeakPolarHBondContact ND1-CB 3.37Å; D329-S348 PolarHBondContact O-OG 3.08Å; I330-S348 CarbonylContact O-C 3.57Å; I330-S348 VanDerWaalsContact O-CA 3.26Å; I330-S348 WeakPolarHBondContact O-CA 3.23Å; I330-S348 WeakPolarHBondContact O-CB 3.36Å; I330-S348 PolarHBondContact O-OG 3.23Å; S348-D350 VanDerWaalsContact CB-OD1 3.3Å; S348-D350 WeakPolarHBondContact CB-OD1 3.28Å; S348-D350 PolarHBondContact O-N 2.84Å; S348-D350 VanDerWaalsContact OG-CG 3.25Å; S348-D350 PolarHBondContact OG-N 3.07Å; S348-D350 VanDerWaalsContact OG-N 3.1Å; S348-D350 PolarHBondContact OG-OD1 2.76Å; S348-N351 PolarHBondContact O-N 2.74Å; S348-T352 PolarHBondContact N-O 2.91Å; S348-V377 PolarHBondContact O-N 3.35Å; S348-V377 VanDerWaalsContact O-N 3.1Å
349	K	95.9	Very high	92.1	Very high	98 Å²	98	28.8 Å²	28.8	43%	0.426	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-14.7	170	-164.2	175.5	-178.6	-176.9	0	113.2	D329 I330 L332 N351 S376	D329-K349 HydrophobicContact CB-CB 4.27Å; D329-K349 WeakPolarHBondContact OD2-CG 3.47Å; I330-K349 HydrophobicContact CB-CB 4.39Å; I330-K349 HydrophobicContact CD1-CD 4.28Å; I330-K349 PolarHBondContact O-N 3.38Å; L332-K349 HydrophobicContact CD1-CB 4.49Å; K349-N351 PolarHBondContact O-N 2.99Å; K349-N351 PolarHBondContact O-OD1 2.94Å; K349-S376 WeakPolarHBondContact CA-OG 3.26Å
350	D	94.9	Very high	91.9	Very high	21 Å²	21	26.2 Å²	26.2	11%	0.112	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.6	9.6	173.3	71.6	7.8	0	0	0	114.6	H327 T328 D329 S348 T352	H327-D350 WeakPolarHBondContact CA-OD2 3.45Å; H327-D350 IonicContact CE1-OD1 3.74Å; H327-D350 IonicContact CE1-OD2 2.79Å; H327-D350 IonicContact CG-OD2 3.29Å; H327-D350 IonicContact ND1-OD1 2.61Å; H327-D350 PolarHBondContact ND1-OD1 2.77Å; H327-D350 IonicContact ND1-OD2 2.89Å; H327-D350 PolarHBondContact ND1-OD2 2.78Å; T328-D350 PolarHBondContact N-OD2 2.92Å; T328-D350 VanDerWaalsContact OG1-CB 3.26Å; T328-D350 WeakPolarHBondContact OG1-CB 3.37Å; D329-D350 HydrophobicContact CB-CB 3.93Å; S348-D350 VanDerWaalsContact CB-OD1 3.3Å; S348-D350 WeakPolarHBondContact CB-OD1 3.28Å; S348-D350 PolarHBondContact O-N 2.84Å; S348-D350 VanDerWaalsContact OG-CG 3.25Å; S348-D350 PolarHBondContact OG-N 3.07Å; S348-D350 VanDerWaalsContact OG-N 3.1Å; S348-D350 PolarHBondContact OG-OD1 2.76Å; D350-T352 PolarHBondContact O-N 3.09Å; D350-T352 WeakPolarHBondContact OD1-CA 3.5Å; D350-T352 VanDerWaalsContact OD1-CB 3.28Å; D350-T352 WeakPolarHBondContact OD1-CB 3.43Å; D350-T352 PolarHBondContact OD1-N 2.96Å; D350-T352 PolarHBondContact OD1-OG1 3.12Å; D350-T352 PolarHBondContact OD2-OG1 2.72Å
351	N	95	Very high	91.4	Very high	60 Å²	60	26.5 Å²	26.5	32%	0.321	15%	0.147	S	C	.	.	S	Bend	trans	66.4	14.7	-176.7	-42.4	-45.3	0	0	0	113.9	S348 K349 R375 S376	S348-N351 PolarHBondContact O-N 2.74Å; K349-N351 PolarHBondContact O-N 2.99Å; K349-N351 PolarHBondContact O-OD1 2.94Å; N351-R375 WeakPolarHBondContact OD1-CA 3.5Å; N351-R375 PolarHBondContact OD1-O 2.82Å; N351-S376 PolarHBondContact OD1-N 2.77Å
352	T	94.4	Very high	90.9	Very high	20 Å²	20	28.9 Å²	28.9	12%	0.123	16%	0.157	C	C	.	.			trans	-117.8	154.3	177.3	78.1	0	0	0	0	112	H327 S348 D350 V369 I370 T371	H327-T352 PolarHBondContact CE1-OG1 2.86Å; H327-T352 PolarHBondContact ND1-OG1 2.92Å; S348-T352 PolarHBondContact N-O 2.91Å; D350-T352 PolarHBondContact O-N 3.09Å; D350-T352 WeakPolarHBondContact OD1-CA 3.5Å; D350-T352 VanDerWaalsContact OD1-CB 3.28Å; D350-T352 WeakPolarHBondContact OD1-CB 3.43Å; D350-T352 PolarHBondContact OD1-N 2.96Å; D350-T352 PolarHBondContact OD1-OG1 3.12Å; D350-T352 PolarHBondContact OD2-OG1 2.72Å; T352-V369 HydrophobicContact CG2-CG1 4.27Å; T352-I370 WeakPolarHBondContact CA-O 3.44Å; T352-I370 WeakPolarHBondContact CB-O 3.37Å; T352-T371 HydrophobicContact CG2-CG2 4.35Å
353	A	94.4	Very high	90.7	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	150.2	160.7	0	0	0	0	0	108.7	L345 S346 I370 V377 A380	L345-A353 HydrophobicContact CD1-CB 4.26Å; S346-A353 CarbonylContact O-C 3.53Å; S346-A353 WeakPolarHBondContact O-CA 3.19Å; S346-A353 VanDerWaalsContact O-CB 3.3Å; S346-A353 WeakPolarHBondContact O-CB 3.09Å; A353-I370 HydrophobicContact CB-CB 3.96Å; A353-I370 HydrophobicContact CB-CD1 4.04Å; A353-I370 HydrophobicContact CB-CG2 4.23Å; A353-I370 PolarHBondContact N-O 2.86Å; A353-I370 VanDerWaalsContact N-O 3.13Å; A353-I370 WeakPolarHBondContact O-CA 3.21Å; A353-I370 VanDerWaalsContact O-CB 3.28Å; A353-I370 WeakPolarHBondContact O-CB 3.43Å; A353-I370 PolarHBondContact O-N 3.07Å; A353-V377 HydrophobicContact CB-CG1 4.46Å; A353-A380 HydrophobicContact CB-CB 4.44Å
354	R	94.5	Very high	90.6	Very high	39 Å²	39	31.7 Å²	31.7	15%	0.147	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	137.4	-175.6	-69.7	-177.2	-179.2	-148.2	8.4	111.3	G326 L345 S346 W356 C368 V369	G326-R354 PolarHBondContact O-NH1 3.15Å; G326-R354 PolarHBondContact O-NH2 3Å; L345-R354 CarbonylContact C-O 3.59Å; L345-R354 WeakPolarHBondContact CA-O 3.13Å; L345-R354 WeakPolarHBondContact CD1-O 3.39Å; S346-R354 PolarHBondContact N-O 2.67Å; S346-R354 PolarHBondContact O-N 3.37Å; S346-R354 PolarHBondContact OG-O 3.48Å; R354-W356 HydrophobicContact CB-CZ2 4.08Å; R354-W356 PolarHBondContact O-NE1 3.14Å; R354-C368 WeakPolarHBondContact CA-O 3.41Å; R354-V369 HydrophobicContact CG-CG1 4.38Å; R354-V369 HydrophobicContact CG-CG2 4.24Å
355	I	94.1	Very high	90.3	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	127.8	173.1	-61.8	171.3	0	0	0	108	L345 V367 C368 I370 W382 L404 F409 L421	L345-I355 HydrophobicContact CD1-CG1 3.72Å; I355-V367 PolarHBondContact O-N 3.28Å; I355-C368 HydrophobicContact CB-CB 4.1Å; I355-C368 HydrophobicContact CD1-CB 4.21Å; I355-C368 HydrophobicContact CG1-CB 4.43Å; I355-C368 PolarHBondContact N-O 3.16Å; I355-C368 PolarHBondContact O-N 3.2Å; I355-I370 HydrophobicContact CD1-CD1 4.44Å; I355-I370 HydrophobicContact CG1-CD1 4.47Å; I355-W382 HydrophobicContact CD1-CH2 4.36Å; I355-W382 HydrophobicContact CG1-CH2 4.29Å; I355-W382 HydrophobicContact CG1-CZ2 4.45Å; I355-W382 HydrophobicContact CG2-CH2 3.54Å; I355-W382 HydrophobicContact CG2-CZ2 3.96Å; I355-L404 HydrophobicContact CD1-CD1 4.09Å; I355-L404 HydrophobicContact CD1-CD2 3.58Å; I355-F409 HydrophobicContact CG2-CE1 3.78Å; I355-F409 HydrophobicContact CG2-CZ 4.32Å; I355-L421 HydrophobicContact CD1-CD1 4.19Å
356	W	92.9	Very high	90	Very high	5 Å²	5	37.8 Å²	37.8	2%	0.019	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	145.9	-177.2	-56.8	87.1	0	0	0	109.9	I311 V324 L343 F344 S346 R354 I364 H365 C366	I311-W356 HydrophobicContact CD1-CD2 4.33Å; I311-W356 VanDerWaalsContact CD1-CE2 3.48Å; I311-W356 HydrophobicContact CD1-CH2 4.46Å; I311-W356 HydrophobicContact CD1-CZ2 3.58Å; V324-W356 HydrophobicContact CG1-CE3 3.69Å; V324-W356 HydrophobicContact CG1-CH2 3.86Å; V324-W356 HydrophobicContact CG1-CZ3 3.3Å; L343-W356 VanDerWaalsContact CA-O 3.3Å; L343-W356 WeakPolarHBondContact CA-O 3.2Å; L343-W356 WeakPolarHBondContact CD2-O 3.23Å; F344-W356 HydrophobicContact CD1-CB 3.86Å; F344-W356 HydrophobicContact CD2-CB 3.86Å; F344-W356 AromaticContact CD2-CD1 3.67Å; F344-W356 AromaticContact CD2-CG 3.96Å; F344-W356 HydrophobicContact CD2-CG 3.96Å; F344-W356 HydrophobicContact CE1-CB 3.44Å; F344-W356 VanDerWaalsContact CE1-CB 3.44Å; F344-W356 HydrophobicContact CE1-CG 4.23Å; F344-W356 HydrophobicContact CE2-CB 3.43Å; F344-W356 VanDerWaalsContact CE2-CB 3.43Å; F344-W356 AromaticContact CE2-CD1 3.29Å; F344-W356 HydrophobicContact CE2-CD2 4.15Å; F344-W356 AromaticContact CE2-CG 3.33Å; F344-W356 HydrophobicContact CE2-CG 3.33Å; F344-W356 HydrophobicContact CG-CB 4.06Å; F344-W356 HydrophobicContact CZ-CB 3.21Å; F344-W356 AromaticContact CZ-CD1 3.97Å; F344-W356 HydrophobicContact CZ-CD2 4.17Å; F344-W356 AromaticContact CZ-CG 3.5Å; F344-W356 HydrophobicContact CZ-CG 3.5Å; F344-W356 VanDerWaalsContact CZ-CG 3.5Å; F344-W356 PolarHBondContact N-O 3.35Å; F344-W356 VanDerWaalsContact N-O 3.1Å; F344-W356 PolarHBondContact O-N 3.07Å; S346-W356 PolarHBondContact OG-NE1 2.76Å; R354-W356 HydrophobicContact CB-CZ2 4.08Å; R354-W356 PolarHBondContact O-NE1 3.14Å; W356-I364 HydrophobicContact CE3-CG2 4.33Å; W356-H365 WeakPolarHBondContact CA-O 3.35Å; W356-C366 HydrophobicContact CD2-CB 4.28Å; W356-C366 HydrophobicContact CE3-CB 3.75Å; W356-C366 HydrophobicContact CH2-CB 4.06Å; W356-C366 HydrophobicContact CZ3-CB 3.63Å
357	R	90.2	Very high	89.7	Confident	51 Å²	51	38.8 Å²	38.8	19%	0.192	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	132.1	167.7	-174.9	-174.9	-175.6	123.3	5	109.4	S342 L343 I364 H365 V367 F409 E411	S342-R357 CarbonylContact O-C 3.53Å; S342-R357 VanDerWaalsContact O-CA 3.3Å; S342-R357 WeakPolarHBondContact O-CA 3.5Å; L343-R357 HydrophobicContact CD2-CB 4.15Å; L343-R357 HydrophobicContact CD2-CG 4.35Å; R357-I364 WeakPolarHBondContact O-CA 3.46Å; R357-H365 PolarHBondContact N-O 2.89Å; R357-H365 PolarHBondContact O-N 3.25Å; R357-H365 VanDerWaalsContact O-N 3.17Å; R357-V367 HydrophobicContact CB-CG2 3.66Å; R357-F409 PolarHBondContact NH1-O 3.25Å; R357-E411 IonicContact NH2-OE1 3.7Å
358	F	89.1	Confident	89.4	Confident	14 Å²	14	38.8 Å²	38.8	6%	0.061	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	114.9	174.2	177.6	-94.8	0	0	0	108.8	L297 H301 V313 S342 F344 G360 I364	L297-F358 HydrophobicContact CD2-CB 3.49Å; L297-F358 VanDerWaalsContact CD2-CB 3.49Å; L297-F358 HydrophobicContact CD2-CD1 3.17Å; L297-F358 HydrophobicContact CD2-CD2 3.8Å; L297-F358 HydrophobicContact CD2-CE1 3.74Å; L297-F358 HydrophobicContact CD2-CE2 4.32Å; L297-F358 HydrophobicContact CD2-CG 3.19Å; L297-F358 HydrophobicContact CD2-CZ 4.29Å; L297-F358 HydrophobicContact CG-CD1 4.22Å; H301-F358 HydrophobicContact CB-CZ 4.19Å; H301-F358 AromaticContact CD2-CZ 3.67Å; H301-F358 AromaticContact CG-CZ 3.82Å; V313-F358 HydrophobicContact CG1-CD2 4.35Å; V313-F358 HydrophobicContact CG1-CE2 3.85Å; S342-F358 WeakPolarHBondContact CA-O 3.41Å; S342-F358 VanDerWaalsContact CB-O 3.24Å; S342-F358 WeakPolarHBondContact CB-O 3.26Å; S342-F358 PolarHBondContact O-N 3.01Å; F344-F358 HydrophobicContact CD1-CB 4.33Å; F344-F358 HydrophobicContact CE1-CB 4.19Å; F358-G360 VanDerWaalsContact CE2-C 3.43Å; F358-G360 VanDerWaalsContact CE2-O 3.3Å; F358-G360 WeakPolarHBondContact CE2-O 3.36Å; F358-I364 HydrophobicContact CD2-CD1 3.72Å; F358-I364 HydrophobicContact CD2-CG1 3.76Å; F358-I364 HydrophobicContact CE2-CD1 4.04Å; F358-I364 HydrophobicContact CE2-CG1 4.34Å
359	S	83.5	Confident	89.2	Confident	71 Å²	71	39.7 Å²	39.7	50%	0.497	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	-21.5	170.4	-165.1	0	0	0	0	112.2	D363	S359-D363 PolarHBondContact N-O 3.32Å; S359-D363 VanDerWaalsContact N-O 3.15Å
360	G	81.6	Confident	89	Confident	24 Å²	24	35.1 Å²	35.1	25%	0.247	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-179.6	172.6	-178.8	0	0	0	0	0	108	F358 D362 D363	F358-G360 VanDerWaalsContact CE2-C 3.43Å; F358-G360 VanDerWaalsContact CE2-O 3.3Å; F358-G360 WeakPolarHBondContact CE2-O 3.36Å; G360-D362 PolarHBondContact O-N 3.09Å; G360-D363 PolarHBondContact O-N 3.29Å; G360-D363 VanDerWaalsContact O-N 3.17Å
361	I	75.1	Confident	88.8	Confident	29 Å²	29	36.6 Å²	36.6	15%	0.149	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.6	-41.8	-178.5	-67.8	172.2	0	0	0	111.4	H301 N315 H320 Q322	H301-I361 WeakPolarHBondContact NE2-CD1 3.5Å; H301-I361 WeakPolarHBondContact NE2-CG1 3.3Å; N315-I361 HydrophobicContact CB-CD1 4.08Å; H320-I361 WeakPolarHBondContact CE1-CG2 3.25Å; H320-I361 WeakPolarHBondContact ND1-CG2 3.44Å; Q322-I361 HydrophobicContact CB-CG2 3.94Å; Q322-I361 WeakPolarHBondContact CG-O 3.41Å
362	D	75.7	Confident	88.4	Confident	125 Å²	125	36 Å²	36	67%	0.668	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.3	-16.6	-175.7	-57.2	-23.9	0	0	0	113.2	G360	G360-D362 PolarHBondContact O-N 3.09Å
363	D	83.3	Confident	88.2	Confident	87 Å²	87	35.6 Å²	35.6	47%	0.465	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	76.6	-171.3	-79.8	-24.3	0	0	0	111.2	S359 G360	S359-D363 PolarHBondContact N-O 3.32Å; S359-D363 VanDerWaalsContact N-O 3.15Å; G360-D363 PolarHBondContact O-N 3.29Å; G360-D363 VanDerWaalsContact O-N 3.17Å
364	I	88.9	Confident	88.1	Confident	19 Å²	19	41 Å²	41	10%	0.097	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	119.1	179.2	-48.1	177.8	0	0	0	110.1	V313 Q322 V324 F344 W356 R357 F358	V313-I364 HydrophobicContact CB-CD1 4.02Å; V313-I364 HydrophobicContact CG1-CD1 4.3Å; V313-I364 HydrophobicContact CG2-CD1 3.69Å; Q322-I364 HydrophobicContact CG-CD1 4.36Å; V324-I364 HydrophobicContact CG1-CB 4.38Å; V324-I364 HydrophobicContact CG1-CG2 3.87Å; V324-I364 HydrophobicContact CG2-CB 3.9Å; V324-I364 HydrophobicContact CG2-CD1 3.55Å; V324-I364 HydrophobicContact CG2-CG1 4.28Å; V324-I364 HydrophobicContact CG2-CG2 3.85Å; F344-I364 HydrophobicContact CE1-CG2 3.95Å; F344-I364 HydrophobicContact CZ-CG2 3.88Å; W356-I364 HydrophobicContact CE3-CG2 4.33Å; R357-I364 WeakPolarHBondContact O-CA 3.46Å; F358-I364 HydrophobicContact CD2-CD1 3.72Å; F358-I364 HydrophobicContact CD2-CG1 3.76Å; F358-I364 HydrophobicContact CE2-CD1 4.04Å; F358-I364 HydrophobicContact CE2-CG1 4.34Å
365	H	88.6	Confident	88.1	Confident	103 Å²	103	45.8 Å²	45.8	48%	0.477	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	145	-176.6	-59	80.5	0	0	0	111.1	W356 R357	W356-H365 WeakPolarHBondContact CA-O 3.35Å; R357-H365 PolarHBondContact N-O 2.89Å; R357-H365 PolarHBondContact O-N 3.25Å; R357-H365 VanDerWaalsContact O-N 3.17Å
366	C	89.1	Confident	88.2	Confident	27 Å²	27	46 Å²	46	18%	0.182	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	121.4	175.5	-173.2	0	0	0	0	109.8	W356	W356-C366 HydrophobicContact CD2-CB 4.28Å; W356-C366 HydrophobicContact CE3-CB 3.75Å; W356-C366 HydrophobicContact CH2-CB 4.06Å; W356-C366 HydrophobicContact CZ3-CB 3.63Å
367	V	89.4	Confident	88.4	Confident	21 Å²	21	45.8 Å²	45.8	13%	0.127	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	-45	-179.5	-176.9	0	0	0	0	111	I355 R357 W408 F409 P418 I419	I355-V367 PolarHBondContact O-N 3.28Å; R357-V367 HydrophobicContact CB-CG2 3.66Å; V367-W408 WeakPolarHBondContact CG1-O 3.45Å; V367-F409 HydrophobicContact CG1-CD1 4.2Å; V367-F409 HydrophobicContact CG1-CE1 4.18Å; V367-P418 WeakPolarHBondContact O-CA 3.48Å; V367-I419 PolarHBondContact O-N 3.22Å
368	C	89.9	Confident	88.6	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	141.6	-177	-58.5	0	0	0	0	111.6	R354 I355 I419 L421	R354-C368 WeakPolarHBondContact CA-O 3.41Å; I355-C368 HydrophobicContact CB-CB 4.1Å; I355-C368 HydrophobicContact CD1-CB 4.21Å; I355-C368 HydrophobicContact CG1-CB 4.43Å; I355-C368 PolarHBondContact N-O 3.16Å; I355-C368 PolarHBondContact O-N 3.2Å; C368-I419 CarbonylContact C-O 3.58Å; C368-I419 VanDerWaalsContact CA-O 3.23Å; C368-I419 WeakPolarHBondContact CA-O 3.14Å; C368-L421 HydrophobicContact CB-CD1 3.55Å; C368-L421 HydrophobicContact CB-CG 3.92Å
369	V	92.3	Very high	88.8	Confident	20 Å²	20	43.8 Å²	43.8	12%	0.121	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	115.9	168.7	-175.7	0	0	0	0	108.6	T352 R354 T371 P418 I419 S420 L421	T352-V369 HydrophobicContact CG2-CG1 4.27Å; R354-V369 HydrophobicContact CG-CG1 4.38Å; R354-V369 HydrophobicContact CG-CG2 4.24Å; V369-T371 HydrophobicContact CG1-CG2 3.79Å; V369-P418 HydrophobicContact CG2-CB 3.92Å; V369-P418 HydrophobicContact CG2-CG 3.92Å; V369-I419 PolarHBondContact N-O 2.78Å; V369-S420 CarbonylContact O-C 3.5Å; V369-S420 WeakPolarHBondContact O-CA 3.48Å; V369-L421 PolarHBondContact O-N 3.48Å
370	I	92.5	Very high	89.3	Confident	1 Å²	1	40.5 Å²	40.5	1%	0.005	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	116.5	173.3	-67.9	165	0	0	0	107.9	L345 T352 A353 I355 F402 L421	L345-I370 HydrophobicContact CD1-CD1 4Å; T352-I370 WeakPolarHBondContact CA-O 3.44Å; T352-I370 WeakPolarHBondContact CB-O 3.37Å; A353-I370 HydrophobicContact CB-CB 3.96Å; A353-I370 HydrophobicContact CB-CD1 4.04Å; A353-I370 HydrophobicContact CB-CG2 4.23Å; A353-I370 PolarHBondContact N-O 2.86Å; A353-I370 VanDerWaalsContact N-O 3.13Å; A353-I370 WeakPolarHBondContact O-CA 3.21Å; A353-I370 VanDerWaalsContact O-CB 3.28Å; A353-I370 WeakPolarHBondContact O-CB 3.43Å; A353-I370 PolarHBondContact O-N 3.07Å; I355-I370 HydrophobicContact CD1-CD1 4.44Å; I355-I370 HydrophobicContact CG1-CD1 4.47Å; I370-F402 HydrophobicContact CB-CE1 4.43Å; I370-F402 HydrophobicContact CD1-CD2 4.28Å; I370-F402 HydrophobicContact CD1-CG 4.36Å; I370-F402 HydrophobicContact CG1-CD1 4.3Å; I370-F402 HydrophobicContact CG1-CG 4.29Å; I370-F402 HydrophobicContact CG2-CD1 3.91Å; I370-F402 HydrophobicContact CG2-CD2 4Å; I370-F402 HydrophobicContact CG2-CE1 3.37Å; I370-F402 HydrophobicContact CG2-CE2 3.52Å; I370-F402 HydrophobicContact CG2-CG 4.2Å; I370-F402 HydrophobicContact CG2-CZ 3.17Å; I370-L421 HydrophobicContact CG1-CB 4.13Å; I370-L421 HydrophobicContact CG1-CD1 3.96Å
371	T	89.5	Confident	90	Very high	52 Å²	52	40.6 Å²	40.6	32%	0.319	22%	0.224	S	C	.	.			trans	-120.2	161.5	178.2	60.9	0	0	0	0	111.1	T352 V369 S420 L421	T352-T371 HydrophobicContact CG2-CG2 4.35Å; V369-T371 HydrophobicContact CG1-CG2 3.79Å; T371-S420 PolarHBondContact OG1-OG 2.67Å; T371-L421 PolarHBondContact N-O 3.41Å
372	G	87.1	Confident	90.9	Very high	47 Å²	47	39.4 Å²	39.4	49%	0.485	22%	0.218	S	C	.	.			trans	123.2	-7.1	170.8	0	0	0	0	0	114.6	K400	G372-K400 VanDerWaalsContact C-NZ 3.31Å; G372-K400 PolarHBondContact O-NZ 2.88Å
373	H	91.6	Very high	91.6	Very high	13 Å²	13	33.5 Å²	33.5	6%	0.06	19%	0.187	C	C	.	.			trans	-72.7	147	167.4	-77.3	-69.6	0	0	0	110.8	V377 S392 S394 D396	H373-V377 HydrophobicContact CB-CG2 4Å; H373-S392 PolarHBondContact NE2-OG 3Å; H373-S394 WeakPolarHBondContact ND1-CB 3.24Å; H373-D396 IonicContact CE1-OD2 3.29Å; H373-D396 IonicContact CG-OD2 2.65Å; H373-D396 IonicContact ND1-OD1 3.3Å; H373-D396 IonicContact ND1-OD2 2.83Å; H373-D396 PolarHBondContact ND1-OD2 3.32Å
374	T	92.1	Very high	91.9	Very high	112 Å²	112	31.5 Å²	31.5	69%	0.687	18%	0.176	S	C	*	.	S	Bend	trans	-97.4	-9.9	179.2	57	0	0	0	0	112.7	D396	T374-D396 PolarHBondContact N-OD2 2.89Å; T374-D396 VanDerWaalsContact OG1-CB 3.28Å; T374-D396 WeakPolarHBondContact OG1-CB 3.34Å
375	R	94.6	Very high	91.7	Very high	140 Å²	140	35.8 Å²	35.8	53%	0.528	20%	0.195	S	C	.	.	S	Bend	trans	-138.8	175.2	175.6	-64.6	-170.7	169.7	-171	-3.9	110.6	N351 V377 S394 E395 D396	N351-R375 WeakPolarHBondContact OD1-CA 3.5Å; N351-R375 PolarHBondContact OD1-O 2.82Å; R375-V377 PolarHBondContact O-N 3.5Å; R375-S394 PolarHBondContact O-OG 3.17Å; R375-E395 HydrophobicContact CB-CB 4.01Å; R375-D396 HydrophobicContact CB-CB 4.07Å; R375-D396 HydrophobicContact CG-CB 4.21Å
376	S	95.5	Very high	91.3	Very high	6 Å²	6	36.8 Å²	36.8	4%	0.042	20%	0.198	C	C	.	.			trans	-43.7	132.2	177.9	-179.5	0	0	0	0	112.4	L332 K349 N351 S378 S394 E395	L332-S376 WeakPolarHBondContact CD1-OG 3.31Å; K349-S376 WeakPolarHBondContact CA-OG 3.26Å; N351-S376 PolarHBondContact OD1-N 2.77Å; S376-S378 PolarHBondContact O-N 3.29Å; S376-S394 VanDerWaalsContact O-CA 3.28Å; S376-S394 WeakPolarHBondContact O-CA 3.45Å; S376-S394 VanDerWaalsContact O-CB 3.32Å; S376-S394 WeakPolarHBondContact O-CB 3.36Å; S376-S394 PolarHBondContact O-OG 3.26Å; S376-E395 PolarHBondContact O-N 3.34Å
377	V	96.2	Very high	90.7	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	105	176.1	-173.5	0	0	0	0	107.5	S348 A353 H373 R375 A393	S348-V377 PolarHBondContact O-N 3.35Å; S348-V377 VanDerWaalsContact O-N 3.1Å; A353-V377 HydrophobicContact CB-CG1 4.46Å; H373-V377 HydrophobicContact CB-CG2 4Å; R375-V377 PolarHBondContact O-N 3.5Å; V377-A393 CarbonylContact C-O 3.6Å; V377-A393 VanDerWaalsContact CG1-O 3.29Å; V377-A393 WeakPolarHBondContact CG1-O 3.49Å
378	S	94.5	Very high	90.4	Very high	19 Å²	19	37.4 Å²	37.4	13%	0.133	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	-36.8	-172.7	50.4	0	0	0	0	113.1	C333 S376 A393 I434	C333-S378 WeakPolarHBondContact CB-O 3.1Å; S376-S378 PolarHBondContact O-N 3.29Å; S378-A393 PolarHBondContact N-O 2.86Å; S378-A393 PolarHBondContact OG-O 3.18Å; S378-I434 WeakPolarHBondContact CB-O 3.45Å; S378-I434 PolarHBondContact OG-O 2.86Å
379	A	94.2	Very high	90.5	Very high	4 Å²	4	38 Å²	38	3%	0.033	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150	144.3	-178.9	0	0	0	0	0	111.6	S392 A393 I437	A379-S392 WeakPolarHBondContact O-CA 3.49Å; A379-A393 PolarHBondContact N-O 3.08Å; A379-A393 PolarHBondContact O-N 3.48Å; A379-I437 HydrophobicContact CB-CG2 3.82Å
380	A	94.7	Very high	90.4	Very high	2 Å²	2	37 Å²	37	2%	0.017	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	136	173.2	0	0	0	0	0	110.7	S335 L345 A353 I391	S335-A380 VanDerWaalsContact CB-O 3.24Å; S335-A380 WeakPolarHBondContact CB-O 3.08Å; L345-A380 HydrophobicContact CD1-CB 4.49Å; L345-A380 HydrophobicContact CD2-CB 3.51Å; L345-A380 HydrophobicContact CG-CB 3.91Å; A353-A380 HydrophobicContact CB-CB 4.44Å; A380-I391 CarbonylContact C-O 3.58Å; A380-I391 VanDerWaalsContact CA-O 3.25Å; A380-I391 WeakPolarHBondContact CA-O 3.37Å
381	H	94.8	Very high	90.5	Very high	25 Å²	25	37 Å²	37	12%	0.116	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	150.6	-175.6	-87.1	81.1	0	0	0	112.7	C390 I391 I437 I439 R483	H381-C390 WeakPolarHBondContact O-CA 3.28Å; H381-C390 WeakPolarHBondContact O-CB 3.4Å; H381-I391 PolarHBondContact N-O 2.98Å; H381-I391 PolarHBondContact O-N 2.98Å; H381-I437 HydrophobicContact CB-CG2 4.23Å; H381-I437 PolarHBondContact CE1-O 3.03Å; H381-I437 PolarHBondContact ND1-O 2.89Å; H381-I439 HydrophobicContact CB-CD1 3.94Å; H381-I439 HydrophobicContact CB-CG1 4.44Å; H381-R483 PolarHBondContact NE2-NH1 3.05Å; H381-R483 VanDerWaalsContact NE2-NH1 3.13Å
382	W	93.5	Very high	90.8	Very high	5 Å²	5	34.5 Å²	34.5	2%	0.019	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	152.2	175.3	-65	86.1	0	0	0	112.4	S335 P337 W339 L343 L345 I355 N384 L387 L404 I439	S335-W382 PolarHBondContact O-NE1 3.11Å; P337-W382 HydrophobicContact CB-CB 4.13Å; P337-W382 HydrophobicContact CB-CD2 4.1Å; P337-W382 HydrophobicContact CB-CE3 4.44Å; P337-W382 HydrophobicContact CB-CG 3.97Å; P337-W382 HydrophobicContact CG-CD2 4.12Å; P337-W382 HydrophobicContact CG-CE3 4.45Å; P337-W382 HydrophobicContact CG-CG 4.38Å; W339-W382 HydrophobicContact CH2-CE3 4.2Å; W339-W382 HydrophobicContact CH2-CZ3 4.1Å; W339-W382 AromaticContact CZ2-CE3 3.77Å; W339-W382 HydrophobicContact CZ2-CE3 3.77Å; W339-W382 HydrophobicContact CZ2-CZ3 4.13Å; L343-W382 HydrophobicContact CB-CH2 3.86Å; L343-W382 HydrophobicContact CB-CZ2 4.11Å; L343-W382 HydrophobicContact CD1-CH2 4.27Å; L345-W382 HydrophobicContact CB-CZ2 3.83Å; I355-W382 HydrophobicContact CD1-CH2 4.36Å; I355-W382 HydrophobicContact CG1-CH2 4.29Å; I355-W382 HydrophobicContact CG1-CZ2 4.45Å; I355-W382 HydrophobicContact CG2-CH2 3.54Å; I355-W382 HydrophobicContact CG2-CZ2 3.96Å; W382-N384 PolarHBondContact O-N 3.27Å; W382-L387 HydrophobicContact CZ3-CD2 3.85Å; W382-L404 HydrophobicContact CE3-CD1 4.14Å; W382-L404 HydrophobicContact CZ3-CD1 3.76Å; W382-I439 VanDerWaalsContact O-CD1 3.26Å; W382-I439 WeakPolarHBondContact O-CD1 3.42Å
383	S	91.8	Very high	91.1	Very high	1 Å²	1	32.3 Å²	32.3	1%	0.007	16%	0.16	C	C	.	.			trans	-56.9	134.4	156.8	155	0	0	0	0	110.3	W339 K386 F389 D443	W339-S383 PolarHBondContact NE1-O 3.15Å; S383-K386 PolarHBondContact OG-O 3.46Å; S383-F389 VanDerWaalsContact CB-O 3.25Å; S383-F389 WeakPolarHBondContact CB-O 3.36Å; S383-F389 PolarHBondContact N-O 2.99Å; S383-F389 VanDerWaalsContact N-O 3.08Å; S383-D443 VanDerWaalsContact OG-CG 3.28Å; S383-D443 PolarHBondContact OG-OD2 3.48Å
384	N	88.5	Confident	91.3	Very high	44 Å²	44	31.7 Å²	31.7	24%	0.235	16%	0.157	C	C	.	.	S	Bend	trans	-83.4	-22.9	-174.2	-74.2	-51.3	0	0	0	113.5	W382 I439 S440 D443	W382-N384 PolarHBondContact O-N 3.27Å; N384-I439 PolarHBondContact ND2-O 2.92Å; N384-S440 PolarHBondContact ND2-O 2.9Å; N384-D443 PolarHBondContact N-OD1 3.17Å; N384-D443 PolarHBondContact N-OD2 3.12Å
385	Q	84.5	Confident	91.4	Very high	109 Å²	109	29.4 Å²	29.4	51%	0.509	14%	0.138	S	C	.	.	S	Bend	trans	-88.9	-50.3	-177.6	-63.1	-171.3	-18.6	0	0	113.2	P441 N442 D443	Q385-P441 WeakPolarHBondContact CG-O 3.35Å; Q385-N442 PolarHBondContact NE2-O 3.46Å; Q385-D443 VanDerWaalsContact CB-OD2 3.24Å; Q385-D443 WeakPolarHBondContact CB-OD2 3.46Å; Q385-D443 WeakPolarHBondContact CG-OD2 3.42Å; Q385-D443 PolarHBondContact N-OD2 3.35Å
386	K	82	Confident	91.3	Very high	124 Å²	124	23.7 Å²	23.7	54%	0.539	12%	0.118	S	C	.	.	S	Bend	trans	-158	162.7	-171.9	69.4	-167.2	175.2	-179	0	110.9	S383 S388	S383-K386 PolarHBondContact OG-O 3.46Å; K386-S388 VanDerWaalsContact C-N 3.27Å; K386-S388 WeakPolarHBondContact CE-OG 3.32Å; K386-S388 WeakPolarHBondContact CG-OG 3.47Å; K386-S388 PolarHBondContact O-N 3.41Å; K386-S388 PolarHBondContact O-OG 3Å
387	L	76.5	Confident	91.2	Very high	34 Å²	34	25 Å²	25	18%	0.178	13%	0.126	C	C	.	.	S	Bend	trans	-57.1	82.9	169.3	-79.2	164.5	0	0	0	112.4	W339 L343 W382 L404 K406 F409	W339-L387 HydrophobicContact CE3-CD1 4.49Å; W339-L387 HydrophobicContact CE3-CG 4.14Å; W339-L387 HydrophobicContact CH2-CB 4.4Å; W339-L387 HydrophobicContact CH2-CD1 3.87Å; W339-L387 HydrophobicContact CH2-CD2 3.07Å; W339-L387 HydrophobicContact CH2-CG 3.15Å; W339-L387 HydrophobicContact CZ2-CD2 3.61Å; W339-L387 HydrophobicContact CZ2-CG 3.7Å; W339-L387 HydrophobicContact CZ3-CD1 3.6Å; W339-L387 HydrophobicContact CZ3-CD2 3.76Å; W339-L387 HydrophobicContact CZ3-CG 3.32Å; L343-L387 HydrophobicContact CD1-CD1 4.32Å; L343-L387 HydrophobicContact CD1-CD2 3.97Å; W382-L387 HydrophobicContact CZ3-CD2 3.85Å; L387-L404 HydrophobicContact CD2-CD1 4.48Å; L387-K406 HydrophobicContact CB-CG 4.36Å; L387-F409 HydrophobicContact CD1-CD2 4.27Å; L387-F409 HydrophobicContact CD2-CD2 4.24Å; L387-F409 HydrophobicContact CD2-CE2 3.93Å; L387-F409 HydrophobicContact CD2-CZ 4.41Å
388	S	82.9	Confident	91.1	Very high	27 Å²	27	26.1 Å²	26.1	19%	0.189	13%	0.133	C	C	.	.	S	Bend	trans	-118.9	-54.8	179.1	-53.3	0	0	0	0	111.4	K386 L404	K386-S388 VanDerWaalsContact C-N 3.27Å; K386-S388 WeakPolarHBondContact CE-OG 3.32Å; K386-S388 WeakPolarHBondContact CG-OG 3.47Å; K386-S388 PolarHBondContact O-N 3.41Å; K386-S388 PolarHBondContact O-OG 3Å; S388-L404 PolarHBondContact O-N 3.3Å
389	F	90.4	Very high	91	Very high	12 Å²	12	25.3 Å²	25.3	5%	0.053	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.6	162.7	-177	62.5	-92.7	0	0	0	111.1	S383 I391 I401 F402 I439 D443 I460	S383-F389 VanDerWaalsContact CB-O 3.25Å; S383-F389 WeakPolarHBondContact CB-O 3.36Å; S383-F389 PolarHBondContact N-O 2.99Å; S383-F389 VanDerWaalsContact N-O 3.08Å; F389-I391 HydrophobicContact CD2-CD1 4.34Å; F389-I391 HydrophobicContact CD2-CG1 3.86Å; F389-I391 HydrophobicContact CE2-CD1 3.91Å; F389-I391 HydrophobicContact CE2-CG1 3.9Å; F389-I401 HydrophobicContact CB-CG2 3.8Å; F389-I401 HydrophobicContact CD2-CG2 3.93Å; F389-I401 HydrophobicContact CG-CG2 4.05Å; F389-F402 CarbonylContact C-O 3.6Å; F389-F402 WeakPolarHBondContact CA-O 3.46Å; F389-F402 VanDerWaalsContact CB-O 3.24Å; F389-F402 WeakPolarHBondContact CB-O 3.14Å; F389-I439 HydrophobicContact CE2-CD1 4.24Å; F389-D443 HydrophobicContact CE1-CB 4.34Å; F389-D443 HydrophobicContact CZ-CB 4.12Å; F389-I460 HydrophobicContact CE1-CG2 4.22Å; F389-I460 HydrophobicContact CE2-CD1 4Å; F389-I460 HydrophobicContact CE2-CG2 4.48Å; F389-I460 HydrophobicContact CZ-CD1 3.88Å; F389-I460 HydrophobicContact CZ-CG2 3.92Å
390	C	91.8	Very high	91	Very high	1 Å²	1	26.2 Å²	26.2	1%	0.007	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	157.2	163	59.8	0	0	0	0	109.4	L345 H381 I401 F402 L404	L345-C390 HydrophobicContact CD2-CB 4.17Å; H381-C390 WeakPolarHBondContact O-CA 3.28Å; H381-C390 WeakPolarHBondContact O-CB 3.4Å; C390-I401 WeakPolarHBondContact O-CA 3.44Å; C390-F402 PolarHBondContact N-O 3.27Å; C390-F402 PolarHBondContact O-N 3.41Å; C390-L404 HydrophobicContact CB-CD1 4.35Å
391	I	94	Very high	90.9	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	134.8	178.4	-47.5	-175.7	0	0	0	108.6	A380 H381 F389 V399 K400 I401 I437 I439 A446 I460	A380-I391 CarbonylContact C-O 3.58Å; A380-I391 VanDerWaalsContact CA-O 3.25Å; A380-I391 WeakPolarHBondContact CA-O 3.37Å; H381-I391 PolarHBondContact N-O 2.98Å; H381-I391 PolarHBondContact O-N 2.98Å; F389-I391 HydrophobicContact CD2-CD1 4.34Å; F389-I391 HydrophobicContact CD2-CG1 3.86Å; F389-I391 HydrophobicContact CE2-CD1 3.91Å; F389-I391 HydrophobicContact CE2-CG1 3.9Å; I391-V399 HydrophobicContact CG2-CG1 3.33Å; I391-K400 CarbonylContact C-O 3.5Å; I391-K400 VanDerWaalsContact CA-O 3.3Å; I391-K400 WeakPolarHBondContact CA-O 3.47Å; I391-K400 WeakPolarHBondContact CG2-O 3.28Å; I391-I401 HydrophobicContact CD1-CD1 3.83Å; I391-I401 HydrophobicContact CD1-CG1 4.13Å; I391-I401 HydrophobicContact CG1-CD1 4.06Å; I391-I401 HydrophobicContact CG1-CG1 3.9Å; I391-I401 HydrophobicContact CG2-CG1 4.17Å; I391-I437 HydrophobicContact CB-CD1 3.85Å; I391-I437 HydrophobicContact CG2-CD1 3.26Å; I391-I439 HydrophobicContact CB-CD1 4.33Å; I391-I439 HydrophobicContact CD1-CD1 3.84Å; I391-I439 HydrophobicContact CD1-CG1 3.89Å; I391-I439 HydrophobicContact CG1-CD1 3.83Å; I391-I439 HydrophobicContact CG1-CG1 4.42Å; I391-A446 HydrophobicContact CD1-CB 4.04Å; I391-I460 HydrophobicContact CD1-CD1 3.89Å
392	S	94.7	Very high	90.7	Very high	0 Å²	0	25 Å²	25	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	145.9	169.2	62.2	0	0	0	0	110.9	H373 A379 V399 K400 F402	H373-S392 PolarHBondContact NE2-OG 3Å; A379-S392 WeakPolarHBondContact O-CA 3.49Å; S392-V399 CarbonylContact O-C 3.57Å; S392-V399 WeakPolarHBondContact O-CA 3.49Å; S392-K400 PolarHBondContact N-O 3.14Å; S392-K400 PolarHBondContact O-N 3.33Å; S392-F402 VanDerWaalsContact OG-CE2 3.26Å; S392-F402 WeakPolarHBondContact OG-CE2 3.46Å
393	A	94.5	Very high	90.5	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	146.2	171.8	0	0	0	0	0	109	V377 S378 A379 V399 I434 I437	V377-A393 CarbonylContact C-O 3.6Å; V377-A393 VanDerWaalsContact CG1-O 3.29Å; V377-A393 WeakPolarHBondContact CG1-O 3.49Å; S378-A393 PolarHBondContact N-O 2.86Å; S378-A393 PolarHBondContact OG-O 3.18Å; A379-A393 PolarHBondContact N-O 3.08Å; A379-A393 PolarHBondContact O-N 3.48Å; A393-V399 HydrophobicContact CB-CG2 4.4Å; A393-I434 HydrophobicContact CB-CB 4.2Å; A393-I434 HydrophobicContact CB-CD1 4.32Å; A393-I434 HydrophobicContact CB-CG2 3.71Å; A393-I437 HydrophobicContact CB-CB 4.32Å; A393-I437 HydrophobicContact CB-CD1 4.5Å
394	S	95.1	Very high	90.3	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	160.1	-176.2	169.4	0	0	0	0	111.5	H373 R375 S376 D396 T397 T398	H373-S394 WeakPolarHBondContact ND1-CB 3.24Å; R375-S394 PolarHBondContact O-OG 3.17Å; S376-S394 VanDerWaalsContact O-CA 3.28Å; S376-S394 WeakPolarHBondContact O-CA 3.45Å; S376-S394 VanDerWaalsContact O-CB 3.32Å; S376-S394 WeakPolarHBondContact O-CB 3.36Å; S376-S394 PolarHBondContact O-OG 3.26Å; S394-D396 VanDerWaalsContact CB-OD1 3.27Å; S394-D396 WeakPolarHBondContact CB-OD1 3.36Å; S394-D396 PolarHBondContact O-N 2.82Å; S394-D396 VanDerWaalsContact OG-CG 3.26Å; S394-D396 PolarHBondContact OG-N 2.66Å; S394-D396 VanDerWaalsContact OG-N 3.11Å; S394-D396 PolarHBondContact OG-OD1 3.37Å; S394-T397 PolarHBondContact O-N 3.21Å; S394-T397 VanDerWaalsContact O-N 3.15Å; S394-T398 PolarHBondContact N-O 2.81Å
395	E	94.1	Very high	90.1	Very high	65 Å²	65	36.2 Å²	36.2	30%	0.304	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-11.5	167.4	-64.8	-177.9	179.5	0	0	113.1	R375 S376 T397 N433	R375-E395 HydrophobicContact CB-CB 4.01Å; S376-E395 PolarHBondContact O-N 3.34Å; E395-T397 PolarHBondContact O-N 3.47Å; E395-T397 VanDerWaalsContact O-N 3.17Å; E395-N433 HydrophobicContact CG-CB 4.39Å; E395-N433 PolarHBondContact O-OD1 2.67Å
396	D	93	Very high	89.7	Confident	20 Å²	20	37.9 Å²	37.9	11%	0.107	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.5	4.8	170.2	71.1	13.2	0	0	0	113.5	H373 T374 R375 S394 T398	H373-D396 IonicContact CE1-OD2 3.29Å; H373-D396 IonicContact CG-OD2 2.65Å; H373-D396 IonicContact ND1-OD1 3.3Å; H373-D396 IonicContact ND1-OD2 2.83Å; H373-D396 PolarHBondContact ND1-OD2 3.32Å; T374-D396 PolarHBondContact N-OD2 2.89Å; T374-D396 VanDerWaalsContact OG1-CB 3.28Å; T374-D396 WeakPolarHBondContact OG1-CB 3.34Å; R375-D396 HydrophobicContact CB-CB 4.07Å; R375-D396 HydrophobicContact CG-CB 4.21Å; S394-D396 VanDerWaalsContact CB-OD1 3.27Å; S394-D396 WeakPolarHBondContact CB-OD1 3.36Å; S394-D396 PolarHBondContact O-N 2.82Å; S394-D396 VanDerWaalsContact OG-CG 3.26Å; S394-D396 PolarHBondContact OG-N 2.66Å; S394-D396 VanDerWaalsContact OG-N 3.11Å; S394-D396 PolarHBondContact OG-OD1 3.37Å; D396-T398 PolarHBondContact O-N 3.19Å; D396-T398 WeakPolarHBondContact OD1-CA 3.4Å; D396-T398 VanDerWaalsContact OD1-CB 3.26Å; D396-T398 WeakPolarHBondContact OD1-CB 3.28Å; D396-T398 PolarHBondContact OD1-N 3.3Å; D396-T398 PolarHBondContact OD1-OG1 3.48Å; D396-T398 PolarHBondContact OD2-OG1 3.36Å
397	T	93.2	Very high	89.4	Confident	33 Å²	33	35.4 Å²	35.4	20%	0.202	17%	0.171	C	C	.	.	S	Bend	trans	68	7.1	-177.9	74.2	0	0	0	0	114.9	S394 E395 A429 H430	S394-T397 PolarHBondContact O-N 3.21Å; S394-T397 VanDerWaalsContact O-N 3.15Å; E395-T397 PolarHBondContact O-N 3.47Å; E395-T397 VanDerWaalsContact O-N 3.17Å; T397-A429 PolarHBondContact O-N 2.83Å; T397-H430 VanDerWaalsContact CB-O 3.31Å; T397-H430 WeakPolarHBondContact CB-O 3.35Å; T397-H430 PolarHBondContact O-N 3.43Å
398	T	93.8	Very high	89.4	Confident	23 Å²	23	36.4 Å²	36.4	14%	0.141	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	150	-179.5	77.6	0	0	0	0	112.7	S394 D396 K400 Q427 V428	S394-T398 PolarHBondContact N-O 2.81Å; D396-T398 PolarHBondContact O-N 3.19Å; D396-T398 WeakPolarHBondContact OD1-CA 3.4Å; D396-T398 VanDerWaalsContact OD1-CB 3.26Å; D396-T398 WeakPolarHBondContact OD1-CB 3.28Å; D396-T398 PolarHBondContact OD1-N 3.3Å; D396-T398 PolarHBondContact OD1-OG1 3.48Å; D396-T398 PolarHBondContact OD2-OG1 3.36Å; T398-K400 VanDerWaalsContact OG1-CE 3.32Å; T398-K400 WeakPolarHBondContact OG1-CE 3.44Å; T398-Q427 CarbonylContact C-O 3.57Å; T398-Q427 VanDerWaalsContact CA-O 3.26Å; T398-Q427 WeakPolarHBondContact CA-O 3.46Å; T398-V428 HydrophobicContact CG2-CG2 4.33Å
399	V	93.3	Very high	89	Confident	2 Å²	2	36.1 Å²	36.1	1%	0.012	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	131.9	172.3	179.1	0	0	0	0	107.6	I391 S392 A393 Q427 A429 I434 I437 T448 L466	I391-V399 HydrophobicContact CG2-CG1 3.33Å; S392-V399 CarbonylContact O-C 3.57Å; S392-V399 WeakPolarHBondContact O-CA 3.49Å; A393-V399 HydrophobicContact CB-CG2 4.4Å; V399-Q427 PolarHBondContact N-O 3.11Å; V399-Q427 PolarHBondContact O-N 3.49Å; V399-A429 HydrophobicContact CB-CB 4.43Å; V399-A429 HydrophobicContact CG2-CB 3.54Å; V399-I434 HydrophobicContact CG2-CD1 3.71Å; V399-I437 HydrophobicContact CG1-CD1 3.87Å; V399-T448 HydrophobicContact CG2-CG2 3.88Å; V399-L466 HydrophobicContact CB-CD1 4.39Å; V399-L466 HydrophobicContact CG1-CD1 3.85Å
400	K	93.4	Very high	88.2	Confident	23 Å²	23	40 Å²	40	10%	0.1	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	133.6	-175.5	-59	-169.1	-177.3	-165.9	0	110.9	G372 I391 S392 T398 F402 A423 V425 T426	G372-K400 VanDerWaalsContact C-NZ 3.31Å; G372-K400 PolarHBondContact O-NZ 2.88Å; I391-K400 CarbonylContact C-O 3.5Å; I391-K400 VanDerWaalsContact CA-O 3.3Å; I391-K400 WeakPolarHBondContact CA-O 3.47Å; I391-K400 WeakPolarHBondContact CG2-O 3.28Å; S392-K400 PolarHBondContact N-O 3.14Å; S392-K400 PolarHBondContact O-N 3.33Å; T398-K400 VanDerWaalsContact OG1-CE 3.32Å; T398-K400 WeakPolarHBondContact OG1-CE 3.44Å; K400-F402 HydrophobicContact CB-CE2 3.51Å; K400-F402 HydrophobicContact CB-CZ 3.64Å; K400-F402 HydrophobicContact CD-CZ 4.29Å; K400-A423 HydrophobicContact CB-CB 4.1Å; K400-A423 HydrophobicContact CD-CB 4.03Å; K400-A423 HydrophobicContact CG-CB 4.41Å; K400-V425 VanDerWaalsContact CA-O 3.31Å; K400-V425 WeakPolarHBondContact CA-O 2.98Å; K400-T426 HydrophobicContact CD-CG2 3.77Å; K400-T426 HydrophobicContact CG-CG2 3.84Å
401	I	92.8	Very high	86.6	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	134.5	174	-55.1	-161	0	0	0	109.8	F389 C390 I391 S424 V425 I460 C464 L466	F389-I401 HydrophobicContact CB-CG2 3.8Å; F389-I401 HydrophobicContact CD2-CG2 3.93Å; F389-I401 HydrophobicContact CG-CG2 4.05Å; C390-I401 WeakPolarHBondContact O-CA 3.44Å; I391-I401 HydrophobicContact CD1-CD1 3.83Å; I391-I401 HydrophobicContact CD1-CG1 4.13Å; I391-I401 HydrophobicContact CG1-CD1 4.06Å; I391-I401 HydrophobicContact CG1-CG1 3.9Å; I391-I401 HydrophobicContact CG2-CG1 4.17Å; I401-S424 WeakPolarHBondContact O-CB 3.47Å; I401-S424 PolarHBondContact O-N 3.5Å; I401-V425 PolarHBondContact N-O 3.35Å; I401-V425 PolarHBondContact O-N 3.41Å; I401-I460 HydrophobicContact CD1-CG2 4.48Å; I401-C464 HydrophobicContact CG2-CB 3.98Å; I401-L466 HydrophobicContact CD1-CD1 3.77Å; I401-L466 HydrophobicContact CD1-CD2 3.79Å; I401-L466 HydrophobicContact CD1-CG 3.47Å; I401-L466 VanDerWaalsContact CD1-CG 3.47Å; I401-L466 HydrophobicContact CG1-CD1 3.7Å; I401-L466 HydrophobicContact CG1-CG 4Å
402	F	91.5	Very high	84.8	Confident	1 Å²	1	51.5 Å²	51.5	0%	0.004	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	121.1	177	-56	-94	0	0	0	109.3	I370 F389 C390 S392 K400 L421 A423	I370-F402 HydrophobicContact CB-CE1 4.43Å; I370-F402 HydrophobicContact CD1-CD2 4.28Å; I370-F402 HydrophobicContact CD1-CG 4.36Å; I370-F402 HydrophobicContact CG1-CD1 4.3Å; I370-F402 HydrophobicContact CG1-CG 4.29Å; I370-F402 HydrophobicContact CG2-CD1 3.91Å; I370-F402 HydrophobicContact CG2-CD2 4Å; I370-F402 HydrophobicContact CG2-CE1 3.37Å; I370-F402 HydrophobicContact CG2-CE2 3.52Å; I370-F402 HydrophobicContact CG2-CG 4.2Å; I370-F402 HydrophobicContact CG2-CZ 3.17Å; F389-F402 CarbonylContact C-O 3.6Å; F389-F402 WeakPolarHBondContact CA-O 3.46Å; F389-F402 VanDerWaalsContact CB-O 3.24Å; F389-F402 WeakPolarHBondContact CB-O 3.14Å; C390-F402 PolarHBondContact N-O 3.27Å; C390-F402 PolarHBondContact O-N 3.41Å; S392-F402 VanDerWaalsContact OG-CE2 3.26Å; S392-F402 WeakPolarHBondContact OG-CE2 3.46Å; K400-F402 HydrophobicContact CB-CE2 3.51Å; K400-F402 HydrophobicContact CB-CZ 3.64Å; K400-F402 HydrophobicContact CD-CZ 4.29Å; F402-L421 HydrophobicContact CD1-CB 4.21Å; F402-A423 HydrophobicContact CD1-CB 4.35Å; F402-A423 HydrophobicContact CE1-CB 3.67Å; F402-A423 VanDerWaalsContact CE1-N 3.31Å; F402-A423 HydrophobicContact CZ-CB 3.86Å
403	R	88.8	Confident	82.9	Confident	149 Å²	149	54.6 Å²	54.6	56%	0.562	28%	0.278	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.8	127.8	176.1	-164.8	172	-173	159.7	2.3	110.1	W408	R403-W408 WeakPolarHBondContact O-CZ3 3.44Å
404	L	88	Confident	81	Confident	10 Å²	10	60 Å²	60	5%	0.052	30%	0.301	C	S	.	.			trans	-101.4	138.5	-178.2	-59.8	177.5	0	0	0	110.5	I355 W382 L387 S388 C390 W408 F409 L421	I355-L404 HydrophobicContact CD1-CD1 4.09Å; I355-L404 HydrophobicContact CD1-CD2 3.58Å; W382-L404 HydrophobicContact CE3-CD1 4.14Å; W382-L404 HydrophobicContact CZ3-CD1 3.76Å; L387-L404 HydrophobicContact CD2-CD1 4.48Å; S388-L404 PolarHBondContact O-N 3.3Å; C390-L404 HydrophobicContact CB-CD1 4.35Å; L404-W408 HydrophobicContact CD2-CZ3 4.23Å; L404-F409 HydrophobicContact CB-CE2 4.33Å; L404-L421 HydrophobicContact CD2-CD1 3.76Å
405	K	83.2	Confident	79	Confident	127 Å²	127	69.4 Å²	69.4	55%	0.552	35%	0.348	S	S	*	.			trans	-106.4	135.4	173.1	-61.7	-176.7	-177	178	0	109.6	S407 W408 F409	K405-S407 PolarHBondContact O-N 3.22Å; K405-W408 HydrophobicContact CB-CD2 3.82Å; K405-W408 HydrophobicContact CB-CE3 4.06Å; K405-W408 HydrophobicContact CB-CG 4.36Å; K405-W408 HydrophobicContact CB-CH2 4.28Å; K405-W408 HydrophobicContact CB-CZ2 4.06Å; K405-W408 HydrophobicContact CB-CZ3 4.29Å; K405-W408 HydrophobicContact CD-CH2 4.25Å; K405-W408 HydrophobicContact CD-CZ2 3.67Å; K405-W408 HydrophobicContact CG-CD2 4.48Å; K405-W408 HydrophobicContact CG-CH2 3.94Å; K405-W408 HydrophobicContact CG-CZ2 3.81Å; K405-W408 HydrophobicContact CG-CZ3 4.34Å; K405-W408 VanDerWaalsContact N-CE3 3.33Å; K405-W408 PolarHBondContact O-N 3.32Å; K405-F409 WeakPolarHBondContact O-CD2 3.48Å; K405-F409 WeakPolarHBondContact O-CE2 3.38Å
406	K	77.2	Confident	77.6	Confident	144 Å²	144	69.1 Å²	69.1	63%	0.626	36%	0.362	S	S	*	.	G	3₁₀ helix	trans	-58.5	-34.8	179.2	-68.6	-174.8	177.1	-175.2	0	113	L387 W408 F409	L387-K406 HydrophobicContact CB-CG 4.36Å; K406-W408 PolarHBondContact O-N 2.86Å; K406-W408 VanDerWaalsContact O-N 3.07Å; K406-F409 PolarHBondContact O-N 3.5Å
407	S	75.7	Confident	76.8	Confident	73 Å²	73	77 Å²	77	51%	0.51	40%	0.398	S	S	.	.	G	3₁₀ helix	trans	-58.7	-20.8	179.8	57.4	0	0	0	0	114.6	K405 F409	K405-S407 PolarHBondContact O-N 3.22Å; S407-F409 PolarHBondContact O-N 2.91Å
408	W	76.4	Confident	76.2	Confident	55 Å²	55	78.4 Å²	78.4	21%	0.208	41%	0.407	C	S	.	.	G	3₁₀ helix	trans	-77.1	-10.8	177.3	-58.5	-30.7	0	0	0	113.1	V367 R403 L404 K405 K406 I419 L421	V367-W408 WeakPolarHBondContact CG1-O 3.45Å; R403-W408 WeakPolarHBondContact O-CZ3 3.44Å; L404-W408 HydrophobicContact CD2-CZ3 4.23Å; K405-W408 HydrophobicContact CB-CD2 3.82Å; K405-W408 HydrophobicContact CB-CE3 4.06Å; K405-W408 HydrophobicContact CB-CG 4.36Å; K405-W408 HydrophobicContact CB-CH2 4.28Å; K405-W408 HydrophobicContact CB-CZ2 4.06Å; K405-W408 HydrophobicContact CB-CZ3 4.29Å; K405-W408 HydrophobicContact CD-CH2 4.25Å; K405-W408 HydrophobicContact CD-CZ2 3.67Å; K405-W408 HydrophobicContact CG-CD2 4.48Å; K405-W408 HydrophobicContact CG-CH2 3.94Å; K405-W408 HydrophobicContact CG-CZ2 3.81Å; K405-W408 HydrophobicContact CG-CZ3 4.34Å; K405-W408 VanDerWaalsContact N-CE3 3.33Å; K405-W408 PolarHBondContact O-N 3.32Å; K406-W408 PolarHBondContact O-N 2.86Å; K406-W408 VanDerWaalsContact O-N 3.07Å; W408-I419 HydrophobicContact CB-CD1 4.06Å; W408-I419 HydrophobicContact CG-CD1 3.91Å; W408-L421 HydrophobicContact CE3-CD2 4.05Å; W408-L421 HydrophobicContact CH2-CD2 3.45Å; W408-L421 VanDerWaalsContact CH2-CD2 3.45Å; W408-L421 HydrophobicContact CZ2-CD2 4.26Å; W408-L421 HydrophobicContact CZ3-CD1 4.49Å; W408-L421 HydrophobicContact CZ3-CD2 3.31Å
409	F	74.8	Confident	75.8	Confident	20 Å²	20	80.2 Å²	80.2	9%	0.088	42%	0.416	C	S	.	.	G	3₁₀ helix	trans	-115.5	14.3	-175.3	-52.5	-73.6	0	0	0	112.5	L343 I355 R357 V367 L387 L404 K405 K406 S407	L343-F409 HydrophobicContact CD1-CD1 3.95Å; L343-F409 HydrophobicContact CD1-CE1 4.22Å; L343-F409 HydrophobicContact CD1-CG 4.22Å; L343-F409 HydrophobicContact CD2-CD1 3.64Å; L343-F409 HydrophobicContact CD2-CE1 3.99Å; L343-F409 HydrophobicContact CG-CD1 4.49Å; I355-F409 HydrophobicContact CG2-CE1 3.78Å; I355-F409 HydrophobicContact CG2-CZ 4.32Å; R357-F409 PolarHBondContact NH1-O 3.25Å; V367-F409 HydrophobicContact CG1-CD1 4.2Å; V367-F409 HydrophobicContact CG1-CE1 4.18Å; L387-F409 HydrophobicContact CD1-CD2 4.27Å; L387-F409 HydrophobicContact CD2-CD2 4.24Å; L387-F409 HydrophobicContact CD2-CE2 3.93Å; L387-F409 HydrophobicContact CD2-CZ 4.41Å; L404-F409 HydrophobicContact CB-CE2 4.33Å; K405-F409 WeakPolarHBondContact O-CD2 3.48Å; K405-F409 WeakPolarHBondContact O-CE2 3.38Å; K406-F409 PolarHBondContact O-N 3.5Å; S407-F409 PolarHBondContact O-N 2.91Å
410	D	72.2	Confident	75.4	Confident	94 Å²	94	83.6 Å²	83.6	50%	0.503	44%	0.44	S	S	.	.	S	Bend	trans	-76.1	150	171.9	-69.7	-29.3	0	0	0	110.6	S412 S413	D410-S412 PolarHBondContact O-N 3.08Å; D410-S412 VanDerWaalsContact O-N 3.08Å; D410-S413 PolarHBondContact O-N 3.21Å; D410-S413 PolarHBondContact O-OG 3.48Å
411	E	59.7	Low	75	Confident	125 Å²	125	83 Å²	83	58%	0.584	44%	0.437	S	S	*	.	G	3₁₀ helix	trans	-63.7	-15.8	-171.7	-77.9	-175	164.9	0	0	115.2	R357 S413 K414	R357-E411 IonicContact NH2-OE1 3.7Å; E411-S413 VanDerWaalsContact C-N 3.26Å; E411-S413 PolarHBondContact O-N 2.89Å; E411-K414 WeakPolarHBondContact O-CG 3.46Å
412	S	56.1	Low	74.7	Confident	118 Å²	118	91.6 Å²	91.6	83%	0.825	48%	0.475	S	S	*	.	G	3₁₀ helix	trans	-71.3	-17	-176.1	49.8	0	0	0	0	113.7	D410 K414	D410-S412 PolarHBondContact O-N 3.08Å; D410-S412 VanDerWaalsContact O-N 3.08Å; S412-K414 PolarHBondContact O-N 3.38Å
413	S	54.5	Low	74.3	Confident	64 Å²	64	93.2 Å²	93.2	45%	0.448	49%	0.488	S	S	.	.	G	3₁₀ helix	trans	-97.2	30.2	-176.5	70.1	0	0	0	0	114.4	D410 E411 M415	D410-S413 PolarHBondContact O-N 3.21Å; D410-S413 PolarHBondContact O-OG 3.48Å; E411-S413 VanDerWaalsContact C-N 3.26Å; E411-S413 PolarHBondContact O-N 2.89Å; S413-M415 VanDerWaalsContact C-N 3.26Å; S413-M415 PolarHBondContact O-N 2.88Å
414	K	55.4	Low	74.1	Confident	115 Å²	115	89.3 Å²	89.3	50%	0.5	48%	0.484	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-19.8	-177	-81.6	177.5	-176.6	-172.5	0	115.1	E411 S412	E411-K414 WeakPolarHBondContact O-CG 3.46Å; S412-K414 PolarHBondContact O-N 3.38Å
415	M	51.6	Low	74.1	Confident	197 Å²	197	90.2 Å²	90.2	97%	0.97	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-134.5	53.1	-171.9	-63.9	-147.3	-163.2	0	0	113.4	S413	S413-M415 VanDerWaalsContact C-N 3.26Å; S413-M415 PolarHBondContact O-N 2.88Å
416	G	65.8	Low	74.4	Confident	58 Å²	58	88 Å²	88	60%	0.598	49%	0.487	S	S	*	.	S	Bend	trans	-122	162.1	174.5	0	0	0	0	0	112.4
417	E	75.4	Confident	75	Confident	186 Å²	186	85 Å²	85	87%	0.869	48%	0.475	S	S	*	.	P	Polyproline II helix	trans	-57.3	142.5	165	-67	178.3	173.8	0	0	110
418	P	80.8	Confident	75.7	Confident	62 Å²	62	86.3 Å²	86.3	40%	0.403	48%	0.48	S	S	.	.	P	Polyproline II helix	trans	-68.1	141.2	-176	30.1	-36.5	0	0	0	111.1	V367 V369 S420	V367-P418 WeakPolarHBondContact O-CA 3.48Å; V369-P418 HydrophobicContact CG2-CB 3.92Å; V369-P418 HydrophobicContact CG2-CG 3.92Å; P418-S420 PolarHBondContact O-N 3.06Å
419	I	85.8	Confident	76.1	Confident	61 Å²	61	83.8 Å²	83.8	31%	0.313	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	119.6	-175.3	-60.2	164	0	0	0	109.3	V367 C368 V369 W408 L421	V367-I419 PolarHBondContact O-N 3.22Å; C368-I419 CarbonylContact C-O 3.58Å; C368-I419 VanDerWaalsContact CA-O 3.23Å; C368-I419 WeakPolarHBondContact CA-O 3.14Å; V369-I419 PolarHBondContact N-O 2.78Å; W408-I419 HydrophobicContact CB-CD1 4.06Å; W408-I419 HydrophobicContact CG-CD1 3.91Å; I419-L421 HydrophobicContact CG2-CD2 4.25Å; I419-L421 PolarHBondContact O-N 3.34Å
420	S	84.6	Confident	76.8	Confident	74 Å²	74	83.2 Å²	83.2	52%	0.517	47%	0.468	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	116.2	173.1	-172.9	0	0	0	0	110.8	V369 T371 P418	V369-S420 CarbonylContact O-C 3.5Å; V369-S420 WeakPolarHBondContact O-CA 3.48Å; T371-S420 PolarHBondContact OG1-OG 2.67Å; P418-S420 PolarHBondContact O-N 3.06Å
421	L	85.9	Confident	77.7	Confident	10 Å²	10	83.7 Å²	83.7	5%	0.052	48%	0.479	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	130.8	179.4	-67.1	177	0	0	0	111	I355 C368 V369 I370 T371 F402 L404 W408 I419	I355-L421 HydrophobicContact CD1-CD1 4.19Å; C368-L421 HydrophobicContact CB-CD1 3.55Å; C368-L421 HydrophobicContact CB-CG 3.92Å; V369-L421 PolarHBondContact O-N 3.48Å; I370-L421 HydrophobicContact CG1-CB 4.13Å; I370-L421 HydrophobicContact CG1-CD1 3.96Å; T371-L421 PolarHBondContact N-O 3.41Å; F402-L421 HydrophobicContact CD1-CB 4.21Å; L404-L421 HydrophobicContact CD2-CD1 3.76Å; W408-L421 HydrophobicContact CE3-CD2 4.05Å; W408-L421 HydrophobicContact CH2-CD2 3.45Å; W408-L421 VanDerWaalsContact CH2-CD2 3.45Å; W408-L421 HydrophobicContact CZ2-CD2 4.26Å; W408-L421 HydrophobicContact CZ3-CD1 4.49Å; W408-L421 HydrophobicContact CZ3-CD2 3.31Å; I419-L421 HydrophobicContact CG2-CD2 4.25Å; I419-L421 PolarHBondContact O-N 3.34Å
422	K	84.8	Confident	79.3	Confident	180 Å²	180	81.1 Å²	81.1	78%	0.783	47%	0.47	S	S	*	.	P	Polyproline II helix	trans	-95.7	145	171.4	-64.2	-175.2	-179.8	-178.9	0	110.5	S424	K422-S424 PolarHBondContact O-N 3.29Å
423	A	83.9	Confident	81.1	Confident	35 Å²	35	78 Å²	78	29%	0.289	44%	0.443	S	S	.	.	P	Polyproline II helix	trans	-63.1	132.3	177.3	0	0	0	0	0	110.7	K400 F402 T426	K400-A423 HydrophobicContact CB-CB 4.1Å; K400-A423 HydrophobicContact CD-CB 4.03Å; K400-A423 HydrophobicContact CG-CB 4.41Å; F402-A423 HydrophobicContact CD1-CB 4.35Å; F402-A423 HydrophobicContact CE1-CB 3.67Å; F402-A423 VanDerWaalsContact CE1-N 3.31Å; F402-A423 HydrophobicContact CZ-CB 3.86Å; A423-T426 HydrophobicContact CB-CG2 3.69Å
424	S	85.6	Confident	83	Confident	67 Å²	67	75 Å²	75	47%	0.469	42%	0.422	S	S	.	.	S	Bend	trans	-77.2	-37.7	171.9	-64.2	0	0	0	0	111.2	I401 K422	I401-S424 WeakPolarHBondContact O-CB 3.47Å; I401-S424 PolarHBondContact O-N 3.5Å; K422-S424 PolarHBondContact O-N 3.29Å
425	V	87.4	Confident	84.9	Confident	29 Å²	29	70.9 Å²	70.9	18%	0.176	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	139.1	177.9	176.2	0	0	0	0	108.7	K400 I401 Q427 C464	K400-V425 VanDerWaalsContact CA-O 3.31Å; K400-V425 WeakPolarHBondContact CA-O 2.98Å; I401-V425 PolarHBondContact N-O 3.35Å; I401-V425 PolarHBondContact O-N 3.41Å; V425-Q427 HydrophobicContact CG1-CG 4.06Å; V425-C464 VanDerWaalsContact CG2-O 3.32Å; V425-C464 WeakPolarHBondContact CG2-O 3.48Å
426	T	89.5	Confident	86.9	Confident	81 Å²	81	61.9 Å²	61.9	50%	0.497	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	124.2	173.6	59.9	0	0	0	0	108.5	K400 A423	K400-T426 HydrophobicContact CD-CG2 3.77Å; K400-T426 HydrophobicContact CG-CG2 3.84Å; A423-T426 HydrophobicContact CB-CG2 3.69Å
427	Q	89.8	Confident	88.3	Confident	80 Å²	80	59.2 Å²	59.2	37%	0.374	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	138.6	176.8	-73.6	-65.6	-10.8	0	0	110.4	T398 V399 V425 A429 L466	T398-Q427 CarbonylContact C-O 3.57Å; T398-Q427 VanDerWaalsContact CA-O 3.26Å; T398-Q427 WeakPolarHBondContact CA-O 3.46Å; V399-Q427 PolarHBondContact N-O 3.11Å; V399-Q427 PolarHBondContact O-N 3.49Å; V425-Q427 HydrophobicContact CG1-CG 4.06Å; Q427-A429 PolarHBondContact O-N 2.88Å; Q427-L466 HydrophobicContact CG-CB 3.96Å; Q427-L466 HydrophobicContact CG-CD1 4.47Å
428	V	89.2	Confident	89.1	Confident	102 Å²	102	50.5 Å²	50.5	62%	0.618	30%	0.296	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.8	112.9	169.7	-178.4	0	0	0	0	107.2	T398	T398-V428 HydrophobicContact CG2-CG2 4.33Å
429	A	85.1	Confident	89.8	Confident	1 Å²	1	48 Å²	48	1%	0.008	28%	0.279	C	S	.	.			trans	-93.1	-50.6	-172.2	0	0	0	0	0	111.8	T397 V399 Q427 I434 K456 W458	T397-A429 PolarHBondContact O-N 2.83Å; V399-A429 HydrophobicContact CB-CB 4.43Å; V399-A429 HydrophobicContact CG2-CB 3.54Å; Q427-A429 PolarHBondContact O-N 2.88Å; A429-I434 HydrophobicContact CB-CD1 3.97Å; A429-K456 WeakPolarHBondContact O-CD 3.31Å; A429-K456 VanDerWaalsContact O-CE 3.31Å; A429-K456 WeakPolarHBondContact O-CE 3.33Å; A429-K456 PolarHBondContact O-NZ 3.01Å; A429-W458 HydrophobicContact CB-CH2 4.1Å; A429-W458 HydrophobicContact CB-CZ2 3.46Å; A429-W458 VanDerWaalsContact CB-CZ2 3.46Å
430	H	90.8	Very high	90.1	Very high	8 Å²	8	45.2 Å²	45.2	4%	0.037	27%	0.265	C	S	.	.			trans	-128.5	171.9	-167.6	-75.1	-83.8	0	0	0	112.6	T397 I434 T448 S450 D452 T454	T397-H430 VanDerWaalsContact CB-O 3.31Å; T397-H430 WeakPolarHBondContact CB-O 3.35Å; T397-H430 PolarHBondContact O-N 3.43Å; H430-I434 HydrophobicContact CB-CG1 4.2Å; H430-T448 PolarHBondContact NE2-O 3.31Å; H430-T448 PolarHBondContact NE2-OG1 2.85Å; H430-S450 VanDerWaalsContact CG-CB 3.44Å; H430-S450 VanDerWaalsContact ND1-CB 3.32Å; H430-S450 WeakPolarHBondContact ND1-CB 3.03Å; H430-D452 WeakPolarHBondContact CB-OD2 3.07Å; H430-D452 IonicContact CE1-OD1 3.96Å; H430-D452 IonicContact CE1-OD2 3.81Å; H430-D452 IonicContact CG-OD2 3.52Å; H430-D452 IonicContact ND1-OD1 2.99Å; H430-D452 PolarHBondContact ND1-OD1 2.84Å; H430-D452 IonicContact ND1-OD2 3.46Å; H430-D452 PolarHBondContact ND1-OD2 3.29Å; H430-T454 PolarHBondContact CE1-OG1 3.25Å; H430-T454 VanDerWaalsContact CE1-OG1 3.26Å; H430-T454 PolarHBondContact ND1-OG1 3.19Å
431	S	91	Very high	90.3	Very high	105 Å²	105	44 Å²	44	73%	0.734	26%	0.255	S	S	*	.	S	Bend	trans	-93.8	-9.9	173.4	58.3	0	0	0	0	113.3	D452	S431-D452 PolarHBondContact N-OD2 3.48Å; S431-D452 WeakPolarHBondContact OG-CB 3.28Å
432	N	93	Very high	90.5	Very high	71 Å²	71	46.7 Å²	46.7	38%	0.38	27%	0.27	S	S	.	.	S	Bend	trans	-140.6	176.2	-178.8	-155	-6.7	0	0	0	110.5	I434 S450 M451 D452	N432-I434 PolarHBondContact O-N 2.91Å; N432-S450 PolarHBondContact O-OG 3.26Å; N432-M451 HydrophobicContact CB-CB 4.4Å; N432-D452 HydrophobicContact CB-CB 3.92Å
433	N	92.9	Very high	90.7	Very high	51 Å²	51	38.8 Å²	38.8	27%	0.273	24%	0.236	S	C	.	.			trans	-51.5	127.7	-176.7	-66.1	0.2	0	0	0	112.1	E395 S450 M451	E395-N433 HydrophobicContact CG-CB 4.39Å; E395-N433 PolarHBondContact O-OD1 2.67Å; N433-S450 WeakPolarHBondContact O-CA 3.29Å; N433-S450 PolarHBondContact O-OG 2.91Å; N433-M451 HydrophobicContact CB-CG 4.4Å; N433-M451 PolarHBondContact O-N 2.93Å
434	I	95.2	Very high	91	Very high	1 Å²	1	45.2 Å²	45.2	1%	0.005	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	123.9	174.2	-52.4	174.2	0	0	0	107.4	S378 A393 V399 A429 H430 N432 G449	S378-I434 WeakPolarHBondContact CB-O 3.45Å; S378-I434 PolarHBondContact OG-O 2.86Å; A393-I434 HydrophobicContact CB-CB 4.2Å; A393-I434 HydrophobicContact CB-CD1 4.32Å; A393-I434 HydrophobicContact CB-CG2 3.71Å; V399-I434 HydrophobicContact CG2-CD1 3.71Å; A429-I434 HydrophobicContact CB-CD1 3.97Å; H430-I434 HydrophobicContact CB-CG1 4.2Å; N432-I434 PolarHBondContact O-N 2.91Å; I434-G449 WeakPolarHBondContact CG2-O 3.45Å
435	C	94.2	Very high	91.3	Very high	30 Å²	30	43.5 Å²	43.5	20%	0.203	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	-38.1	-178.7	-68.2	0	0	0	0	112	G449 M451 V479 W480	C435-G449 PolarHBondContact N-O 2.93Å; C435-M451 VanDerWaalsContact SG-CG 3.54Å; C435-M451 VanDerWaalsContact SG-SD 3.62Å; C435-V479 WeakPolarHBondContact CB-O 3.45Å; C435-W480 HydrophobicContact CB-CE3 4.39Å
436	C	93.7	Very high	91.6	Very high	8 Å²	8	42.1 Å²	42.1	5%	0.054	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	158.7	-171.2	56.6	0	0	0	0	112	G449 W480 D481	C436-G449 PolarHBondContact N-O 2.96Å; C436-G449 PolarHBondContact O-N 3.49Å; C436-G449 VanDerWaalsContact O-N 3.11Å; C436-W480 VanDerWaalsContact CB-O 3.29Å; C436-W480 WeakPolarHBondContact CB-O 3.31Å; C436-W480 PolarHBondContact SG-O 3.42Å; C436-D481 WeakPolarHBondContact SG-CA 3.43Å
437	I	94.9	Very high	91.9	Very high	1 Å²	1	38.3 Å²	38.3	1%	0.005	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	141.8	172.4	-168.8	165	0	0	0	109.1	A379 H381 I391 A393 V399 A447 T448	A379-I437 HydrophobicContact CB-CG2 3.82Å; H381-I437 HydrophobicContact CB-CG2 4.23Å; H381-I437 PolarHBondContact CE1-O 3.03Å; H381-I437 PolarHBondContact ND1-O 2.89Å; I391-I437 HydrophobicContact CB-CD1 3.85Å; I391-I437 HydrophobicContact CG2-CD1 3.26Å; A393-I437 HydrophobicContact CB-CB 4.32Å; A393-I437 HydrophobicContact CB-CD1 4.5Å; V399-I437 HydrophobicContact CG1-CD1 3.87Å; I437-A447 CarbonylContact C-O 3.59Å; I437-A447 WeakPolarHBondContact CA-O 3.33Å; I437-T448 HydrophobicContact CB-CG2 4.49Å; I437-T448 HydrophobicContact CD1-CG2 4Å; I437-T448 HydrophobicContact CG1-CG2 3.94Å
438	A	93.9	Very high	92.2	Very high	3 Å²	3	34.5 Å²	34.5	3%	0.025	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	151.3	169.2	0	0	0	0	0	110.3	A446 A447 V482 F484	A438-A446 CarbonylContact O-C 3.52Å; A438-A446 WeakPolarHBondContact O-CA 3.27Å; A438-A447 PolarHBondContact N-O 3.3Å; A438-A447 PolarHBondContact O-N 3.28Å; A438-V482 WeakPolarHBondContact CB-O 3.39Å; A438-F484 HydrophobicContact CB-CD2 3.8Å; A438-F484 HydrophobicContact CB-CE2 3.98Å; A438-F484 WeakPolarHBondContact O-CE2 3.2Å
439	I	94.1	Very high	92.5	Very high	10 Å²	10	29.6 Å²	29.6	5%	0.051	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	138	174.3	-62.6	163.2	0	0	0	107.1	H381 W382 N384 F389 I391 D443 I460 F484	H381-I439 HydrophobicContact CB-CD1 3.94Å; H381-I439 HydrophobicContact CB-CG1 4.44Å; W382-I439 VanDerWaalsContact O-CD1 3.26Å; W382-I439 WeakPolarHBondContact O-CD1 3.42Å; N384-I439 PolarHBondContact ND2-O 2.92Å; F389-I439 HydrophobicContact CE2-CD1 4.24Å; I391-I439 HydrophobicContact CB-CD1 4.33Å; I391-I439 HydrophobicContact CD1-CD1 3.84Å; I391-I439 HydrophobicContact CD1-CG1 3.89Å; I391-I439 HydrophobicContact CG1-CD1 3.83Å; I391-I439 HydrophobicContact CG1-CG1 4.42Å; I439-D443 WeakPolarHBondContact CG2-OD1 3.44Å; I439-I460 HydrophobicContact CG2-CD1 4.4Å; I439-F484 VanDerWaalsContact C-CD2 3.5Å
440	S	92.4	Very high	93	Very high	3 Å²	3	29.6 Å²	29.6	2%	0.021	16%	0.159	C	C	.	.			trans	-66.7	154.6	177.8	62.2	0	0	0	0	111	N384 N442 D443 R444 L445	N384-S440 PolarHBondContact ND2-O 2.9Å; S440-N442 WeakPolarHBondContact CB-OD1 3.49Å; S440-N442 PolarHBondContact O-N 2.95Å; S440-N442 PolarHBondContact OG-OD1 3.37Å; S440-D443 PolarHBondContact O-N 2.9Å; S440-R444 PolarHBondContact OG-N 2.91Å; S440-L445 WeakPolarHBondContact CB-O 3.25Å; S440-L445 PolarHBondContact N-O 2.83Å; S440-L445 PolarHBondContact OG-N 3.32Å; S440-L445 PolarHBondContact OG-O 3.04Å; S440-L445 VanDerWaalsContact OG-O 3.05Å
441	P	89.6	Confident	93.2	Very high	47 Å²	47	32.5 Å²	32.5	31%	0.305	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60	-22.5	179.6	-22.4	31.8	0	0	0	114	Q385	Q385-P441 WeakPolarHBondContact CG-O 3.35Å
442	N	88.9	Confident	93.3	Very high	67 Å²	67	28.8 Å²	28.8	36%	0.358	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.4	3.9	178.4	67.1	1.9	0	0	0	114.2	Q385 S440 R444	Q385-N442 PolarHBondContact NE2-O 3.46Å; S440-N442 WeakPolarHBondContact CB-OD1 3.49Å; S440-N442 PolarHBondContact O-N 2.95Å; S440-N442 PolarHBondContact OG-OD1 3.37Å; N442-R444 PolarHBondContact O-N 3.34Å; N442-R444 PolarHBondContact OD1-N 3.31Å
443	D	89.5	Confident	93.4	Very high	14 Å²	14	30.5 Å²	30.5	8%	0.075	15%	0.15	C	C	.	.	S	Bend	trans	56.3	14.4	-177.4	-65.6	-26.2	0	0	0	115.7	S383 N384 Q385 F389 I439 S440	S383-D443 VanDerWaalsContact OG-CG 3.28Å; S383-D443 PolarHBondContact OG-OD2 3.48Å; N384-D443 PolarHBondContact N-OD1 3.17Å; N384-D443 PolarHBondContact N-OD2 3.12Å; Q385-D443 VanDerWaalsContact CB-OD2 3.24Å; Q385-D443 WeakPolarHBondContact CB-OD2 3.46Å; Q385-D443 WeakPolarHBondContact CG-OD2 3.42Å; Q385-D443 PolarHBondContact N-OD2 3.35Å; F389-D443 HydrophobicContact CE1-CB 4.34Å; F389-D443 HydrophobicContact CZ-CB 4.12Å; I439-D443 WeakPolarHBondContact CG2-OD1 3.44Å; S440-D443 PolarHBondContact O-N 2.9Å
444	R	90.6	Very high	93.5	Very high	171 Å²	171	29.1 Å²	29.1	65%	0.645	14%	0.143	S	C	*	.	S	Bend	trans	-92.7	-21.5	179.6	-65.9	-175.8	-177.3	177.2	-0.2	113.6	S440 N442 T459 I460	S440-R444 PolarHBondContact OG-N 2.91Å; N442-R444 PolarHBondContact O-N 3.34Å; N442-R444 PolarHBondContact OD1-N 3.31Å; R444-T459 CarbonylContact O-C 3.53Å; R444-T459 WeakPolarHBondContact O-CA 3.42Å; R444-I460 PolarHBondContact O-N 2.87Å
445	L	92.5	Very high	93.5	Very high	30 Å²	30	29 Å²	29	16%	0.157	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	142.8	-177	-61.3	170.5	0	0	0	109.8	S440 L457 W458 F484 L505	S440-L445 WeakPolarHBondContact CB-O 3.25Å; S440-L445 PolarHBondContact N-O 2.83Å; S440-L445 PolarHBondContact OG-N 3.32Å; S440-L445 PolarHBondContact OG-O 3.04Å; S440-L445 VanDerWaalsContact OG-O 3.05Å; L445-L457 HydrophobicContact CB-CD1 4.15Å; L445-L457 HydrophobicContact CD1-CD2 4.37Å; L445-L457 HydrophobicContact CD2-CD2 4.24Å; L445-L457 HydrophobicContact CD2-CG 4.28Å; L445-W458 CarbonylContact C-O 3.6Å; L445-W458 WeakPolarHBondContact CA-O 3.27Å; L445-F484 HydrophobicContact CB-CE1 4.25Å; L445-F484 HydrophobicContact CB-CZ 4.11Å; L445-L505 HydrophobicContact CD1-CD1 4.03Å; L445-L505 HydrophobicContact CD1-CD2 4.45Å
446	A	93.4	Very high	93.5	Very high	1 Å²	1	29.6 Å²	29.6	1%	0.008	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	144.8	164	0	0	0	0	0	109	I391 A438 L457 W458 I460	I391-A446 HydrophobicContact CD1-CB 4.04Å; A438-A446 CarbonylContact O-C 3.52Å; A438-A446 WeakPolarHBondContact O-CA 3.27Å; A446-L457 CarbonylContact O-C 3.44Å; A446-W458 HydrophobicContact CB-CB 4.33Å; A446-W458 PolarHBondContact N-O 2.94Å; A446-W458 PolarHBondContact O-N 2.93Å; A446-I460 HydrophobicContact CB-CD1 3.89Å; A446-I460 HydrophobicContact CB-CG1 4.29Å
447	A	95.2	Very high	93.6	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	139	174.2	0	0	0	0	0	109.5	I437 A438 V455 K456 L457 V482 F484 L491	I437-A447 CarbonylContact C-O 3.59Å; I437-A447 WeakPolarHBondContact CA-O 3.33Å; A438-A447 PolarHBondContact N-O 3.3Å; A438-A447 PolarHBondContact O-N 3.28Å; A447-V455 HydrophobicContact CB-CG1 4.45Å; A447-K456 CarbonylContact C-O 3.44Å; A447-K456 WeakPolarHBondContact CA-O 3.42Å; A447-L457 HydrophobicContact CB-CD1 4.14Å; A447-V482 HydrophobicContact CB-CG1 3.58Å; A447-F484 HydrophobicContact CB-CE2 3.71Å; A447-F484 HydrophobicContact CB-CZ 3.58Å; A447-L491 HydrophobicContact CB-CD1 3.84Å; A447-L491 HydrophobicContact CB-CD2 4Å
448	T	95.6	Very high	93.5	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	130.1	179.6	54.5	0	0	0	0	109.5	V399 H430 I437 V455 K456 W458	V399-T448 HydrophobicContact CG2-CG2 3.88Å; H430-T448 PolarHBondContact NE2-O 3.31Å; H430-T448 PolarHBondContact NE2-OG1 2.85Å; I437-T448 HydrophobicContact CB-CG2 4.49Å; I437-T448 HydrophobicContact CD1-CG2 4Å; I437-T448 HydrophobicContact CG1-CG2 3.94Å; T448-V455 VanDerWaalsContact O-CA 3.31Å; T448-V455 WeakPolarHBondContact O-CA 3.18Å; T448-K456 PolarHBondContact N-O 2.92Å; T448-K456 PolarHBondContact O-N 3.31Å; T448-K456 PolarHBondContact OG1-O 2.94Å; T448-W458 PolarHBondContact OG1-NE1 3.28Å
449	G	95.1	Very high	93.4	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	138.3	175.6	0	0	0	0	0	110.8	I434 C435 C436	I434-G449 WeakPolarHBondContact CG2-O 3.45Å; C435-G449 PolarHBondContact N-O 2.93Å; C436-G449 PolarHBondContact N-O 2.96Å; C436-G449 PolarHBondContact O-N 3.49Å; C436-G449 VanDerWaalsContact O-N 3.11Å
450	S	95.9	Very high	93.2	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	159.8	-175	172.4	0	0	0	0	112.8	H430 N432 N433 D452 K453 T454 V479	H430-S450 VanDerWaalsContact CG-CB 3.44Å; H430-S450 VanDerWaalsContact ND1-CB 3.32Å; H430-S450 WeakPolarHBondContact ND1-CB 3.03Å; N432-S450 PolarHBondContact O-OG 3.26Å; N433-S450 WeakPolarHBondContact O-CA 3.29Å; N433-S450 PolarHBondContact O-OG 2.91Å; S450-D452 VanDerWaalsContact CB-OD1 3.27Å; S450-D452 WeakPolarHBondContact CB-OD1 3.49Å; S450-D452 PolarHBondContact O-N 3.42Å; S450-D452 VanDerWaalsContact OG-CG 3.28Å; S450-D452 PolarHBondContact OG-N 3.24Å; S450-D452 VanDerWaalsContact OG-N 3.13Å; S450-D452 PolarHBondContact OG-OD1 2.96Å; S450-K453 PolarHBondContact O-N 2.84Å; S450-T454 PolarHBondContact N-O 3.35Å; S450-V479 PolarHBondContact O-N 3.32Å; S450-V479 VanDerWaalsContact O-N 3.08Å
451	M	95.1	Very high	92.9	Very high	70 Å²	70	34 Å²	34	35%	0.345	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-10.4	169.2	-65.8	-59.3	-78.5	0	0	113.1	N432 N433 C435 K453 W480	N432-M451 HydrophobicContact CB-CB 4.4Å; N433-M451 HydrophobicContact CB-CG 4.4Å; N433-M451 PolarHBondContact O-N 2.93Å; C435-M451 VanDerWaalsContact SG-CG 3.54Å; C435-M451 VanDerWaalsContact SG-SD 3.62Å; M451-K453 PolarHBondContact O-N 2.9Å; M451-W480 HydrophobicContact CE-CH2 4.42Å; M451-W480 HydrophobicContact CE-CZ2 4.23Å; M451-W480 HydrophobicContact SD-CH2 4.29Å; M451-W480 HydrophobicContact SD-CZ2 4.23Å
452	D	94.1	Very high	92.3	Very high	27 Å²	27	41.1 Å²	41.1	14%	0.144	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.1	3.2	170.7	72.2	9.3	0	0	0	114	H430 S431 N432 S450 T454	H430-D452 WeakPolarHBondContact CB-OD2 3.07Å; H430-D452 IonicContact CE1-OD1 3.96Å; H430-D452 IonicContact CE1-OD2 3.81Å; H430-D452 IonicContact CG-OD2 3.52Å; H430-D452 IonicContact ND1-OD1 2.99Å; H430-D452 PolarHBondContact ND1-OD1 2.84Å; H430-D452 IonicContact ND1-OD2 3.46Å; H430-D452 PolarHBondContact ND1-OD2 3.29Å; S431-D452 PolarHBondContact N-OD2 3.48Å; S431-D452 WeakPolarHBondContact OG-CB 3.28Å; N432-D452 HydrophobicContact CB-CB 3.92Å; S450-D452 VanDerWaalsContact CB-OD1 3.27Å; S450-D452 WeakPolarHBondContact CB-OD1 3.49Å; S450-D452 PolarHBondContact O-N 3.42Å; S450-D452 VanDerWaalsContact OG-CG 3.28Å; S450-D452 PolarHBondContact OG-N 3.24Å; S450-D452 VanDerWaalsContact OG-N 3.13Å; S450-D452 PolarHBondContact OG-OD1 2.96Å; D452-T454 PolarHBondContact O-N 3.13Å; D452-T454 WeakPolarHBondContact OD1-CA 3.42Å; D452-T454 WeakPolarHBondContact OD1-CB 3.4Å; D452-T454 PolarHBondContact OD1-N 3.19Å; D452-T454 PolarHBondContact OD1-OG1 2.91Å; D452-T454 PolarHBondContact OD2-OG1 3.46Å
453	K	94.4	Very high	91.6	Very high	107 Å²	107	43.8 Å²	43.8	47%	0.465	20%	0.204	S	C	.	.	S	Bend	trans	72.1	8.9	179.5	-42.1	168.4	-179.5	-178.8	0	113.8	S450 M451 K476	S450-K453 PolarHBondContact O-N 2.84Å; M451-K453 PolarHBondContact O-N 2.9Å; K453-K476 WeakPolarHBondContact CD-O 3.48Å; K453-K476 WeakPolarHBondContact CE-O 3.37Å
454	T	94.9	Very high	90.9	Very high	21 Å²	21	43.5 Å²	43.5	13%	0.129	20%	0.203	C	C	.	.			trans	-109.2	148.4	-179.2	75.9	0	0	0	0	111.4	H430 S450 D452 T471 I472 T473	H430-T454 PolarHBondContact CE1-OG1 3.25Å; H430-T454 VanDerWaalsContact CE1-OG1 3.26Å; H430-T454 PolarHBondContact ND1-OG1 3.19Å; S450-T454 PolarHBondContact N-O 3.35Å; D452-T454 PolarHBondContact O-N 3.13Å; D452-T454 WeakPolarHBondContact OD1-CA 3.42Å; D452-T454 WeakPolarHBondContact OD1-CB 3.4Å; D452-T454 PolarHBondContact OD1-N 3.19Å; D452-T454 PolarHBondContact OD1-OG1 2.91Å; D452-T454 PolarHBondContact OD2-OG1 3.46Å; T454-T471 HydrophobicContact CG2-CG2 4.35Å; T454-I472 WeakPolarHBondContact CA-O 3.16Å; T454-T473 HydrophobicContact CG2-CG2 3.89Å
455	V	95.7	Very high	90.5	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	121.5	166.6	-177.3	0	0	0	0	107.9	A447 T448 I472 V479 V482 L491 T493	A447-V455 HydrophobicContact CB-CG1 4.45Å; T448-V455 VanDerWaalsContact O-CA 3.31Å; T448-V455 WeakPolarHBondContact O-CA 3.18Å; V455-I472 HydrophobicContact CB-CB 4.24Å; V455-I472 PolarHBondContact N-O 3.32Å; V455-I472 PolarHBondContact O-N 3.2Å; V455-V479 HydrophobicContact CG2-CB 4.14Å; V455-V479 HydrophobicContact CG2-CG1 3.83Å; V455-V479 HydrophobicContact CG2-CG2 3.75Å; V455-V482 HydrophobicContact CG1-CG1 4.32Å; V455-V482 HydrophobicContact CG1-CG2 4.06Å; V455-V482 HydrophobicContact CG2-CG2 4.23Å; V455-L491 HydrophobicContact CG1-CD2 3.91Å; V455-T493 HydrophobicContact CG1-CG2 4.37Å; V455-T493 HydrophobicContact CG2-CG2 3.89Å
456	K	95	Very high	90.1	Very high	42 Å²	42	40.7 Å²	40.7	18%	0.183	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	131.3	178.3	-74	-177.7	178.4	-172.5	0	110.1	A429 A447 T448 W458 L468 T471	A429-K456 WeakPolarHBondContact O-CD 3.31Å; A429-K456 VanDerWaalsContact O-CE 3.31Å; A429-K456 WeakPolarHBondContact O-CE 3.33Å; A429-K456 PolarHBondContact O-NZ 3.01Å; A447-K456 CarbonylContact C-O 3.44Å; A447-K456 WeakPolarHBondContact CA-O 3.42Å; T448-K456 PolarHBondContact N-O 2.92Å; T448-K456 PolarHBondContact O-N 3.31Å; T448-K456 PolarHBondContact OG1-O 2.94Å; K456-W458 HydrophobicContact CB-CZ2 4Å; K456-W458 HydrophobicContact CD-CZ2 3.93Å; K456-L468 HydrophobicContact CB-CD1 3.88Å; K456-L468 HydrophobicContact CD-CD1 3.98Å; K456-L468 HydrophobicContact CG-CD1 4.02Å; K456-T471 HydrophobicContact CG-CG2 3.89Å
457	L	94.4	Very high	89.9	Confident	4 Å²	4	47.9 Å²	47.9	2%	0.021	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	130.8	174.5	-170.1	72	0	0	0	108.9	L445 A446 A447 S469 G470 F484 L505 L508	L445-L457 HydrophobicContact CB-CD1 4.15Å; L445-L457 HydrophobicContact CD1-CD2 4.37Å; L445-L457 HydrophobicContact CD2-CD2 4.24Å; L445-L457 HydrophobicContact CD2-CG 4.28Å; A446-L457 CarbonylContact O-C 3.44Å; A447-L457 HydrophobicContact CB-CD1 4.14Å; L457-S469 WeakPolarHBondContact O-CB 3.37Å; L457-S469 PolarHBondContact O-N 3.41Å; L457-G470 PolarHBondContact N-O 3.49Å; L457-G470 PolarHBondContact O-N 3.38Å; L457-F484 HydrophobicContact CD1-CE1 3.96Å; L457-F484 HydrophobicContact CD1-CZ 3.75Å; L457-L505 HydrophobicContact CD1-CD2 4.23Å; L457-L505 HydrophobicContact CD2-CD2 4.24Å; L457-L508 HydrophobicContact CD2-CD2 3.9Å
458	W	93.9	Very high	89.6	Confident	11 Å²	11	52 Å²	52	4%	0.042	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	131.8	-177.1	-54.1	87.8	0	0	0	109.5	A429 L445 A446 T448 K456 L466 R467 L468	A429-W458 HydrophobicContact CB-CH2 4.1Å; A429-W458 HydrophobicContact CB-CZ2 3.46Å; A429-W458 VanDerWaalsContact CB-CZ2 3.46Å; L445-W458 CarbonylContact C-O 3.6Å; L445-W458 WeakPolarHBondContact CA-O 3.27Å; A446-W458 HydrophobicContact CB-CB 4.33Å; A446-W458 PolarHBondContact N-O 2.94Å; A446-W458 PolarHBondContact O-N 2.93Å; T448-W458 PolarHBondContact OG1-NE1 3.28Å; K456-W458 HydrophobicContact CB-CZ2 4Å; K456-W458 HydrophobicContact CD-CZ2 3.93Å; W458-L466 HydrophobicContact CB-CD2 3.59Å; W458-L466 HydrophobicContact CE3-CB 4.2Å; W458-L466 HydrophobicContact CG-CD2 4.15Å; W458-R467 CarbonylContact C-O 3.58Å; W458-R467 WeakPolarHBondContact CA-O 3.29Å; W458-L468 HydrophobicContact CD2-CD1 4.31Å; W458-L468 HydrophobicContact CE3-CB 4.1Å; W458-L468 HydrophobicContact CE3-CD1 4.26Å; W458-L468 HydrophobicContact CH2-CB 4.38Å; W458-L468 HydrophobicContact CH2-CD1 3.99Å; W458-L468 HydrophobicContact CZ2-CD1 4.01Å; W458-L468 HydrophobicContact CZ3-CB 3.83Å; W458-L468 HydrophobicContact CZ3-CD1 4.13Å
459	T	92	Very high	89.2	Confident	45 Å²	45	55.1 Å²	55.1	28%	0.276	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	130.8	166.8	-50.2	0	0	0	0	109.3	R444 L466 R467 S469	R444-T459 CarbonylContact O-C 3.53Å; R444-T459 WeakPolarHBondContact O-CA 3.42Å; T459-L466 WeakPolarHBondContact O-CA 3.38Å; T459-R467 PolarHBondContact N-O 3.38Å; T459-R467 PolarHBondContact O-N 3.47Å; T459-S469 WeakPolarHBondContact OG1-CB 3.19Å
460	I	89.3	Confident	89	Confident	10 Å²	10	55.8 Å²	55.8	5%	0.051	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	110.2	175.6	-54.1	169.3	0	0	0	107.5	F389 I391 I401 I439 R444 A446 R465 L466	F389-I460 HydrophobicContact CE1-CG2 4.22Å; F389-I460 HydrophobicContact CE2-CD1 4Å; F389-I460 HydrophobicContact CE2-CG2 4.48Å; F389-I460 HydrophobicContact CZ-CD1 3.88Å; F389-I460 HydrophobicContact CZ-CG2 3.92Å; I391-I460 HydrophobicContact CD1-CD1 3.89Å; I401-I460 HydrophobicContact CD1-CG2 4.48Å; I439-I460 HydrophobicContact CG2-CD1 4.4Å; R444-I460 PolarHBondContact O-N 2.87Å; A446-I460 HydrophobicContact CB-CD1 3.89Å; A446-I460 HydrophobicContact CB-CG1 4.29Å; I460-R465 WeakPolarHBondContact CA-O 3.16Å; I460-L466 HydrophobicContact CG1-CD2 4.02Å
461	D	85.1	Confident	88.9	Confident	46 Å²	46	58.7 Å²	58.7	25%	0.246	29%	0.286	C	S	.	.			trans	-71	160.2	172.3	-72.9	-22.7	0	0	0	110.4	E463 C464 R465 R467	D461-E463 PolarHBondContact O-N 2.67Å; D461-E463 VanDerWaalsContact O-N 3.09Å; D461-C464 WeakPolarHBondContact O-CA 3.44Å; D461-C464 PolarHBondContact O-N 3.37Å; D461-R465 HydrophobicContact CB-CB 4.28Å; D461-R465 PolarHBondContact N-O 3.46Å; D461-R467 IonicContact OD1-NE 3.15Å; D461-R467 IonicContact OD2-CZ 2.88Å; D461-R467 VanDerWaalsContact OD2-CZ 3.29Å; D461-R467 IonicContact OD2-NE 2.96Å; D461-R467 PolarHBondContact OD2-NE 3.19Å; D461-R467 IonicContact OD2-NH2 3.29Å; D461-R467 PolarHBondContact OD2-NH2 3.46Å
462	Q	76.6	Confident	88.9	Confident	198 Å²	198	55.7 Å²	55.7	93%	0.925	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	-25.6	174.8	-64.7	-175.9	4.9	0	0	113	C464	Q462-C464 PolarHBondContact O-N 3.02Å
463	E	74.6	Confident	88.8	Confident	123 Å²	123	59.6 Å²	59.6	58%	0.575	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	9.5	173	-67.6	-174.3	-178.8	0	0	113.9	D461 R465	D461-E463 PolarHBondContact O-N 2.67Å; D461-E463 VanDerWaalsContact O-N 3.09Å; E463-R465 HydrophobicContact CB-CG 4.26Å; E463-R465 PolarHBondContact O-N 3.38Å; E463-R465 IonicContact OE2-CZ 3.08Å; E463-R465 VanDerWaalsContact OE2-CZ 3.29Å; E463-R465 IonicContact OE2-NE 2.99Å; E463-R465 PolarHBondContact OE2-NE 3.12Å; E463-R465 IonicContact OE2-NH2 2.74Å; E463-R465 PolarHBondContact OE2-NH2 3.46Å
464	C	74.9	Confident	88.5	Confident	7 Å²	7	57.6 Å²	57.6	5%	0.047	29%	0.291	C	S	.	.			trans	61.5	29.4	-177	-57.4	0	0	0	0	113.4	I401 V425 D461 Q462	I401-C464 HydrophobicContact CG2-CB 3.98Å; V425-C464 VanDerWaalsContact CG2-O 3.32Å; V425-C464 WeakPolarHBondContact CG2-O 3.48Å; D461-C464 WeakPolarHBondContact O-CA 3.44Å; D461-C464 PolarHBondContact O-N 3.37Å; Q462-C464 PolarHBondContact O-N 3.02Å
465	R	82	Confident	88.5	Confident	135 Å²	135	57.2 Å²	57.2	51%	0.509	29%	0.287	S	S	.	.			trans	-88.9	137.1	172.4	-60.2	-173.8	-165	-153.8	5.3	110.2	I460 D461 E463	I460-R465 WeakPolarHBondContact CA-O 3.16Å; D461-R465 HydrophobicContact CB-CB 4.28Å; D461-R465 PolarHBondContact N-O 3.46Å; E463-R465 HydrophobicContact CB-CG 4.26Å; E463-R465 PolarHBondContact O-N 3.38Å; E463-R465 IonicContact OE2-CZ 3.08Å; E463-R465 VanDerWaalsContact OE2-CZ 3.29Å; E463-R465 IonicContact OE2-NE 2.99Å; E463-R465 PolarHBondContact OE2-NE 3.12Å; E463-R465 IonicContact OE2-NH2 2.74Å; E463-R465 PolarHBondContact OE2-NH2 3.46Å
466	L	85.6	Confident	88.4	Confident	8 Å²	8	65.4 Å²	65.4	4%	0.042	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	122.9	172.8	-75	165.9	0	0	0	109.6	V399 I401 Q427 W458 T459 I460	V399-L466 HydrophobicContact CB-CD1 4.39Å; V399-L466 HydrophobicContact CG1-CD1 3.85Å; I401-L466 HydrophobicContact CD1-CD1 3.77Å; I401-L466 HydrophobicContact CD1-CD2 3.79Å; I401-L466 HydrophobicContact CD1-CG 3.47Å; I401-L466 VanDerWaalsContact CD1-CG 3.47Å; I401-L466 HydrophobicContact CG1-CD1 3.7Å; I401-L466 HydrophobicContact CG1-CG 4Å; Q427-L466 HydrophobicContact CG-CB 3.96Å; Q427-L466 HydrophobicContact CG-CD1 4.47Å; W458-L466 HydrophobicContact CB-CD2 3.59Å; W458-L466 HydrophobicContact CE3-CB 4.2Å; W458-L466 HydrophobicContact CG-CD2 4.15Å; T459-L466 WeakPolarHBondContact O-CA 3.38Å; I460-L466 HydrophobicContact CG1-CD2 4.02Å
467	R	87.8	Confident	88.4	Confident	152 Å²	152	71.2 Å²	71.2	57%	0.574	34%	0.344	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.9	136.3	168	-60.5	-174.4	-165.9	-153.9	1.8	109	W458 T459 D461 S469	W458-R467 CarbonylContact C-O 3.58Å; W458-R467 WeakPolarHBondContact CA-O 3.29Å; T459-R467 PolarHBondContact N-O 3.38Å; T459-R467 PolarHBondContact O-N 3.47Å; D461-R467 IonicContact OD1-NE 3.15Å; D461-R467 IonicContact OD2-CZ 2.88Å; D461-R467 VanDerWaalsContact OD2-CZ 3.29Å; D461-R467 IonicContact OD2-NE 2.96Å; D461-R467 PolarHBondContact OD2-NE 3.19Å; D461-R467 IonicContact OD2-NH2 3.29Å; D461-R467 PolarHBondContact OD2-NH2 3.46Å; R467-S469 PolarHBondContact O-N 3.26Å
468	L	89.5	Confident	88.3	Confident	87 Å²	87	71.5 Å²	71.5	46%	0.455	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	115.7	175.1	-177.3	66.8	0	0	0	109	K456 W458	K456-L468 HydrophobicContact CB-CD1 3.88Å; K456-L468 HydrophobicContact CD-CD1 3.98Å; K456-L468 HydrophobicContact CG-CD1 4.02Å; W458-L468 HydrophobicContact CD2-CD1 4.31Å; W458-L468 HydrophobicContact CE3-CB 4.1Å; W458-L468 HydrophobicContact CE3-CD1 4.26Å; W458-L468 HydrophobicContact CH2-CB 4.38Å; W458-L468 HydrophobicContact CH2-CD1 3.99Å; W458-L468 HydrophobicContact CZ2-CD1 4.01Å; W458-L468 HydrophobicContact CZ3-CB 3.83Å; W458-L468 HydrophobicContact CZ3-CD1 4.13Å
469	S	88.2	Confident	88.4	Confident	64 Å²	64	71 Å²	71	45%	0.448	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	-30.7	178.5	-170	0	0	0	0	112	L457 T459 R467	L457-S469 WeakPolarHBondContact O-CB 3.37Å; L457-S469 PolarHBondContact O-N 3.41Å; T459-S469 WeakPolarHBondContact OG1-CB 3.19Å; R467-S469 PolarHBondContact O-N 3.26Å
470	G	91	Very high	88.6	Confident	15 Å²	15	72.6 Å²	72.6	16%	0.155	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	175.9	166	179.4	0	0	0	0	0	112.8	L457	L457-G470 PolarHBondContact N-O 3.49Å; L457-G470 PolarHBondContact O-N 3.38Å
471	T	93.2	Very high	88.9	Confident	60 Å²	60	72.4 Å²	72.4	37%	0.368	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	128.1	179.2	-55.1	0	0	0	0	109.1	T454 K456 T473	T454-T471 HydrophobicContact CG2-CG2 4.35Å; K456-T471 HydrophobicContact CG-CG2 3.89Å; T471-T473 HydrophobicContact CG2-CG2 3.98Å
472	I	94.3	Very high	89.4	Confident	7 Å²	7	70.2 Å²	70.2	4%	0.036	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	119.5	177.9	-60	166.7	0	0	0	107.9	T454 V455 D474 L491 F503 L508	T454-I472 WeakPolarHBondContact CA-O 3.16Å; V455-I472 HydrophobicContact CB-CB 4.24Å; V455-I472 PolarHBondContact N-O 3.32Å; V455-I472 PolarHBondContact O-N 3.2Å; I472-D474 HydrophobicContact CG2-CB 4.16Å; I472-L491 HydrophobicContact CD1-CD2 4.19Å; I472-F503 HydrophobicContact CD1-CB 4.05Å; I472-F503 HydrophobicContact CD1-CD1 4.15Å; I472-F503 HydrophobicContact CD1-CD2 4.2Å; I472-F503 HydrophobicContact CD1-CG 3.87Å; I472-F503 HydrophobicContact CG2-CD1 3.79Å; I472-F503 HydrophobicContact CG2-CD2 4.4Å; I472-F503 HydrophobicContact CG2-CE1 3.36Å; I472-F503 HydrophobicContact CG2-CE2 4.01Å; I472-F503 HydrophobicContact CG2-CG 4.3Å; I472-F503 HydrophobicContact CG2-CZ 3.51Å; I472-L508 HydrophobicContact CD1-CD2 4.21Å; I472-L508 HydrophobicContact CG1-CB 4.31Å; I472-L508 HydrophobicContact CG1-CD2 4.3Å
473	T	91.5	Very high	90.3	Very high	109 Å²	109	63.1 Å²	63.1	67%	0.669	30%	0.299	S	S	*	.			trans	-121	55.4	-177.8	60.6	0	0	0	0	111.2	T454 T471	T454-T473 HydrophobicContact CG2-CG2 3.89Å; T471-T473 HydrophobicContact CG2-CG2 3.98Å
474	D	90.1	Very high	91.3	Very high	66 Å²	66	57.6 Å²	57.6	35%	0.353	27%	0.273	S	S	.	.			trans	-112.1	-11.5	-172.9	-172.6	45.5	0	0	0	113.3	I472 K501 F503	I472-D474 HydrophobicContact CG2-CB 4.16Å; D474-K501 PolarHBondContact O-NZ 2.97Å; D474-K501 IonicContact OD1-NZ 3Å; D474-K501 PolarHBondContact OD1-NZ 3Å; D474-K501 WeakPolarHBondContact OD2-CD 3.45Å; D474-K501 WeakPolarHBondContact OD2-CE 3.4Å; D474-K501 IonicContact OD2-NZ 3.63Å; D474-K501 PolarHBondContact OD2-NZ 2.93Å; D474-F503 HydrophobicContact CB-CE1 3.93Å; D474-F503 HydrophobicContact CB-CZ 3.89Å
475	H	93.1	Very high	92.1	Very high	13 Å²	13	57.5 Å²	57.5	6%	0.06	27%	0.272	C	S	.	.			trans	-87.4	144.7	178.1	-75.1	-67.7	0	0	0	112.6	V479 T493 S495 D497	H475-V479 HydrophobicContact CB-CG2 4.13Å; H475-T493 PolarHBondContact CE1-OG1 3.34Å; H475-T493 WeakPolarHBondContact NE2-CB 3.35Å; H475-T493 PolarHBondContact NE2-OG1 3.49Å; H475-S495 WeakPolarHBondContact ND1-CB 3.31Å; H475-S495 PolarHBondContact ND1-OG 3.45Å; H475-D497 IonicContact CG-OD2 3.95Å; H475-D497 IonicContact ND1-OD1 3.86Å; H475-D497 IonicContact ND1-OD2 2.66Å; H475-D497 PolarHBondContact ND1-OD2 3.44Å; H475-D497 VanDerWaalsContact ND1-OD2 3.07Å
476	K	93.5	Very high	92.4	Very high	171 Å²	171	54.3 Å²	54.3	74%	0.743	26%	0.263	S	S	*	.	S	Bend	trans	-85.2	-24.5	179.5	-63.9	176.9	-178.3	172.2	0	112.6	K453 D497	K453-K476 WeakPolarHBondContact CD-O 3.48Å; K453-K476 WeakPolarHBondContact CE-O 3.37Å; K476-D497 HydrophobicContact CB-CB 4Å; K476-D497 PolarHBondContact N-OD2 3.24Å; K476-D497 VanDerWaalsContact N-OD2 3.14Å
477	R	95.3	Very high	92.4	Very high	164 Å²	164	58.2 Å²	58.2	62%	0.619	29%	0.287	S	S	*	.	S	Bend	trans	-129.6	176.2	-179.5	-71.8	178.8	177.2	-97.7	4.2	110.1	G496 D497	R477-G496 VanDerWaalsContact CD-C 3.49Å; R477-G496 WeakPolarHBondContact CD-O 3.39Å; R477-D497 HydrophobicContact CB-CB 4.25Å; R477-D497 HydrophobicContact CG-CB 4.47Å
478	G	93.7	Very high	92.4	Very high	10 Å²	10	54.8 Å²	54.8	10%	0.103	28%	0.28	C	S	.	.			trans	-59.4	145.5	-179.9	0	0	0	0	0	112.3	S495 G496	G478-S495 WeakPolarHBondContact O-CA 3.3Å; G478-G496 PolarHBondContact O-N 3.34Å
479	V	96.2	Very high	92.5	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	120.3	179	-177.8	0	0	0	0	108.3	C435 S450 V455 H475 V482 A494	C435-V479 WeakPolarHBondContact CB-O 3.45Å; S450-V479 PolarHBondContact O-N 3.32Å; S450-V479 VanDerWaalsContact O-N 3.08Å; V455-V479 HydrophobicContact CG2-CB 4.14Å; V455-V479 HydrophobicContact CG2-CG1 3.83Å; V455-V479 HydrophobicContact CG2-CG2 3.75Å; H475-V479 HydrophobicContact CB-CG2 4.13Å; V479-V482 HydrophobicContact CG1-CG2 3.74Å; V479-A494 CarbonylContact C-O 3.51Å; V479-A494 WeakPolarHBondContact CA-O 3.4Å; V479-A494 WeakPolarHBondContact CG1-O 3.4Å
480	W	95.6	Very high	92.7	Very high	79 Å²	79	55.3 Å²	55.3	30%	0.299	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	-41.1	-176.7	-74.1	109.8	0	0	0	112.4	C435 C436 M451 A494 L522 W564	C435-W480 HydrophobicContact CB-CE3 4.39Å; C436-W480 VanDerWaalsContact CB-O 3.29Å; C436-W480 WeakPolarHBondContact CB-O 3.31Å; C436-W480 PolarHBondContact SG-O 3.42Å; M451-W480 HydrophobicContact CE-CH2 4.42Å; M451-W480 HydrophobicContact CE-CZ2 4.23Å; M451-W480 HydrophobicContact SD-CH2 4.29Å; M451-W480 HydrophobicContact SD-CZ2 4.23Å; W480-A494 PolarHBondContact N-O 3.12Å; W480-L522 HydrophobicContact CB-CD2 4.44Å; W480-L522 WeakPolarHBondContact CB-O 3.17Å; W480-L522 HydrophobicContact CD2-CD2 3.84Å; W480-L522 HydrophobicContact CE3-CD2 4.43Å; W480-L522 HydrophobicContact CG-CD2 3.82Å; W480-W564 HydrophobicContact CZ3-CZ3 4.35Å
481	D	96	Very high	92.9	Very high	6 Å²	6	54.7 Å²	54.7	3%	0.032	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	150.4	-176.9	-167.1	18	0	0	0	111.9	C436 T493 A494 L522 R523 V524	C436-D481 WeakPolarHBondContact SG-CA 3.43Å; D481-T493 WeakPolarHBondContact O-CA 3.42Å; D481-A494 HydrophobicContact CB-CB 4.12Å; D481-A494 PolarHBondContact N-O 2.99Å; D481-A494 PolarHBondContact O-N 2.95Å; D481-L522 VanDerWaalsContact CB-O 3.29Å; D481-L522 WeakPolarHBondContact CB-O 3.25Å; D481-R523 WeakPolarHBondContact OD2-CA 3.38Å; D481-R523 WeakPolarHBondContact OD2-CD 3.39Å; D481-V524 HydrophobicContact CB-CG1 4.26Å; D481-V524 PolarHBondContact OD2-N 3.39Å
482	V	95.6	Very high	93	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	130.4	-178.7	177.6	0	0	0	0	107.8	A438 A447 V455 V479 L491 A492 T493	A438-V482 WeakPolarHBondContact CB-O 3.39Å; A447-V482 HydrophobicContact CB-CG1 3.58Å; V455-V482 HydrophobicContact CG1-CG1 4.32Å; V455-V482 HydrophobicContact CG1-CG2 4.06Å; V455-V482 HydrophobicContact CG2-CG2 4.23Å; V479-V482 HydrophobicContact CG1-CG2 3.74Å; V482-L491 HydrophobicContact CG1-CD1 3.39Å; V482-L491 HydrophobicContact CG1-CD2 4.02Å; V482-L491 HydrophobicContact CG1-CG 3.85Å; V482-A492 CarbonylContact C-O 3.58Å; V482-A492 WeakPolarHBondContact CA-O 3.43Å; V482-T493 HydrophobicContact CG1-CG2 4.46Å; V482-T493 HydrophobicContact CG2-CG2 4.22Å
483	R	95.6	Very high	93.1	Very high	49 Å²	49	51.5 Å²	51.5	19%	0.185	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	137.7	-179.9	-147.7	75.7	-178.1	174.9	-2.6	111.3	H381 A492 V524 F526	H381-R483 PolarHBondContact NE2-NH1 3.05Å; H381-R483 VanDerWaalsContact NE2-NH1 3.13Å; R483-A492 PolarHBondContact N-O 2.66Å; R483-A492 PolarHBondContact O-N 3.21Å; R483-V524 HydrophobicContact CB-CG1 4.26Å; R483-F526 HydrophobicContact CB-CD2 4.21Å; R483-F526 HydrophobicContact CB-CE2 4.39Å; R483-F526 HydrophobicContact CG-CD2 4.34Å; R483-F526 WeakPolarHBondContact O-CE2 2.88Å
484	F	94.6	Very high	93.3	Very high	8 Å²	8	46.3 Å²	46.3	4%	0.035	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	142.6	170.8	-71.2	-85.8	0	0	0	110.6	A438 I439 L445 A447 L457 L491 L505 F526	A438-F484 HydrophobicContact CB-CD2 3.8Å; A438-F484 HydrophobicContact CB-CE2 3.98Å; A438-F484 WeakPolarHBondContact O-CE2 3.2Å; I439-F484 VanDerWaalsContact C-CD2 3.5Å; L445-F484 HydrophobicContact CB-CE1 4.25Å; L445-F484 HydrophobicContact CB-CZ 4.11Å; A447-F484 HydrophobicContact CB-CE2 3.71Å; A447-F484 HydrophobicContact CB-CZ 3.58Å; L457-F484 HydrophobicContact CD1-CE1 3.96Å; L457-F484 HydrophobicContact CD1-CZ 3.75Å; F484-L491 HydrophobicContact CD1-CD1 3.75Å; F484-L491 HydrophobicContact CD2-CD1 4.13Å; F484-L491 HydrophobicContact CE1-CD1 3.74Å; F484-L491 HydrophobicContact CE2-CD1 4.09Å; F484-L491 HydrophobicContact CG-CD1 3.96Å; F484-L491 HydrophobicContact CZ-CD1 3.91Å; F484-L505 HydrophobicContact CD1-CD1 4.21Å; F484-L505 HydrophobicContact CD1-CD2 4.18Å; F484-L505 HydrophobicContact CE1-CD1 4.25Å; F484-L505 HydrophobicContact CE1-CD2 3.71Å; F484-F526 WeakPolarHBondContact O-CD2 3.37Å
485	S	92.2	Very high	93.5	Very high	5 Å²	5	43.1 Å²	43.1	4%	0.035	20%	0.2	C	C	.	.			trans	-69.4	145.9	165.6	179.3	0	0	0	0	110.4	V487 D488 V490	S485-V487 PolarHBondContact OG-N 3.41Å; S485-D488 WeakPolarHBondContact CB-O 3.38Å; S485-D488 PolarHBondContact OG-N 3.19Å; S485-V490 PolarHBondContact N-O 3.38Å
486	H	87.7	Confident	93.6	Very high	67 Å²	67	43 Å²	43	31%	0.31	20%	0.202	S	C	.	.	S	Bend	trans	-83.4	-23	176.6	-66.1	-50.8	0	0	0	113.2	K338	K338-H486 PolarHBondContact NZ-CE1 3.06Å; K338-H486 PolarHBondContact NZ-NE2 2.82Å
487	V	87	Confident	93.7	Very high	90 Å²	90	35.8 Å²	35.8	55%	0.545	17%	0.172	S	C	.	.	S	Bend	trans	-107.3	-47.2	-172.6	-178.5	0	0	0	0	110.6	S485	S485-V487 PolarHBondContact OG-N 3.41Å
488	D	87	Confident	93.6	Very high	81 Å²	81	34.8 Å²	34.8	43%	0.433	17%	0.168	S	C	.	.	S	Bend	trans	-101.4	153.6	-175	-61.2	-37.5	0	0	0	111.3	S485 V490	S485-D488 WeakPolarHBondContact CB-O 3.38Å; S485-D488 PolarHBondContact OG-N 3.19Å; D488-V490 HydrophobicContact CB-CB 4.22Å; D488-V490 HydrophobicContact CB-CG2 3.84Å; D488-V490 PolarHBondContact O-N 2.95Å
489	Q	90.7	Very high	93.7	Very high	140 Å²	140	35.1 Å²	35.1	65%	0.654	17%	0.168	S	C	*	.	S	Bend	trans	-79	62.4	175.1	-66.7	-172	7.2	0	0	111.3	L505	Q489-L505 HydrophobicContact CB-CB 4.44Å; Q489-L505 HydrophobicContact CB-CD1 4.14Å; Q489-L505 WeakPolarHBondContact O-CG 3.49Å; Q489-L505 PolarHBondContact O-N 3.16Å
490	V	93.3	Very high	93.7	Very high	22 Å²	22	35.1 Å²	35.1	13%	0.133	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	144.3	-168.3	175.2	0	0	0	0	111	S485 D488 M502 F503	S485-V490 PolarHBondContact N-O 3.38Å; D488-V490 HydrophobicContact CB-CB 4.22Å; D488-V490 HydrophobicContact CB-CG2 3.84Å; D488-V490 PolarHBondContact O-N 2.95Å; V490-M502 HydrophobicContact CB-CG 4.47Å; V490-M502 HydrophobicContact CG1-CB 4.38Å; V490-M502 HydrophobicContact CG1-CE 4.21Å; V490-M502 HydrophobicContact CG1-CG 3.01Å; V490-M502 HydrophobicContact CG1-SD 3.63Å; V490-F503 CarbonylContact C-O 3.47Å; V490-F503 VanDerWaalsContact CA-O 3.28Å; V490-F503 WeakPolarHBondContact CA-O 3.45Å; V490-F503 WeakPolarHBondContact CG1-O 3.35Å
491	L	94.3	Very high	93.7	Very high	1 Å²	1	32.5 Å²	32.5	1%	0.005	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	124.5	176.6	-172.2	68.6	0	0	0	109.9	A447 V455 I472 V482 F484 T493 M502 F503 L505	A447-L491 HydrophobicContact CB-CD1 3.84Å; A447-L491 HydrophobicContact CB-CD2 4Å; V455-L491 HydrophobicContact CG1-CD2 3.91Å; I472-L491 HydrophobicContact CD1-CD2 4.19Å; V482-L491 HydrophobicContact CG1-CD1 3.39Å; V482-L491 HydrophobicContact CG1-CD2 4.02Å; V482-L491 HydrophobicContact CG1-CG 3.85Å; F484-L491 HydrophobicContact CD1-CD1 3.75Å; F484-L491 HydrophobicContact CD2-CD1 4.13Å; F484-L491 HydrophobicContact CE1-CD1 3.74Å; F484-L491 HydrophobicContact CE2-CD1 4.09Å; F484-L491 HydrophobicContact CG-CD1 3.96Å; F484-L491 HydrophobicContact CZ-CD1 3.91Å; L491-T493 HydrophobicContact CD2-CG2 4.26Å; L491-T493 HydrophobicContact CG-CG2 4.27Å; L491-M502 CarbonylContact O-C 3.54Å; L491-M502 VanDerWaalsContact O-CA 3.31Å; L491-M502 WeakPolarHBondContact O-CA 3.28Å; L491-F503 HydrophobicContact CB-CB 4.4Å; L491-F503 PolarHBondContact N-O 3.3Å; L491-F503 PolarHBondContact O-N 3.13Å; L491-L505 HydrophobicContact CB-CD2 4.06Å
492	A	95.6	Very high	93.6	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	143.4	167.4	0	0	0	0	0	110.8	V482 R483 K501 V524 F526 L533	V482-A492 CarbonylContact C-O 3.58Å; V482-A492 WeakPolarHBondContact CA-O 3.43Å; R483-A492 PolarHBondContact N-O 2.66Å; R483-A492 PolarHBondContact O-N 3.21Å; A492-K501 CarbonylContact C-O 3.55Å; A492-K501 VanDerWaalsContact CA-O 3.31Å; A492-K501 WeakPolarHBondContact CA-O 3.33Å; A492-V524 HydrophobicContact CB-CG1 4.34Å; A492-V524 HydrophobicContact CB-CG2 3.87Å; A492-F526 HydrophobicContact CB-CD2 4.47Å; A492-F526 HydrophobicContact CB-CE1 4.44Å; A492-F526 HydrophobicContact CB-CE2 3.39Å; A492-F526 HydrophobicContact CB-CZ 3.39Å; A492-L533 HydrophobicContact CB-CD1 3.83Å
493	T	96.3	Very high	93.6	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	132.7	-179.8	59.7	0	0	0	0	109.3	V455 H475 D481 V482 L491 V500 K501 F503	V455-T493 HydrophobicContact CG1-CG2 4.37Å; V455-T493 HydrophobicContact CG2-CG2 3.89Å; H475-T493 PolarHBondContact CE1-OG1 3.34Å; H475-T493 WeakPolarHBondContact NE2-CB 3.35Å; H475-T493 PolarHBondContact NE2-OG1 3.49Å; D481-T493 WeakPolarHBondContact O-CA 3.42Å; V482-T493 HydrophobicContact CG1-CG2 4.46Å; V482-T493 HydrophobicContact CG2-CG2 4.22Å; L491-T493 HydrophobicContact CD2-CG2 4.26Å; L491-T493 HydrophobicContact CG-CG2 4.27Å; T493-V500 CarbonylContact O-C 3.5Å; T493-V500 VanDerWaalsContact O-CA 3.29Å; T493-V500 WeakPolarHBondContact O-CA 3.23Å; T493-V500 WeakPolarHBondContact O-CG1 3.34Å; T493-K501 PolarHBondContact N-O 3.11Å; T493-K501 PolarHBondContact O-N 2.86Å; T493-K501 PolarHBondContact OG1-O 3.35Å; T493-F503 HydrophobicContact CG2-CD2 3.93Å; T493-F503 HydrophobicContact CG2-CE2 3.94Å; T493-F503 WeakPolarHBondContact OG1-CE2 3.43Å
494	A	95.6	Very high	93.5	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	131.9	174.9	0	0	0	0	0	109.5	V479 W480 D481 V521 V524	V479-A494 CarbonylContact C-O 3.51Å; V479-A494 WeakPolarHBondContact CA-O 3.4Å; V479-A494 WeakPolarHBondContact CG1-O 3.4Å; W480-A494 PolarHBondContact N-O 3.12Å; D481-A494 HydrophobicContact CB-CB 4.12Å; D481-A494 PolarHBondContact N-O 2.99Å; D481-A494 PolarHBondContact O-N 2.95Å; A494-V521 HydrophobicContact CB-CB 4.06Å; A494-V521 HydrophobicContact CB-CG1 3.73Å; A494-V524 HydrophobicContact CB-CB 4.09Å; A494-V524 HydrophobicContact CB-CG1 3.97Å
495	S	95.8	Very high	93.2	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	155	-172.9	154.5	0	0	0	0	112.4	H475 G478 D497 R498 T499 V521	H475-S495 WeakPolarHBondContact ND1-CB 3.31Å; H475-S495 PolarHBondContact ND1-OG 3.45Å; G478-S495 WeakPolarHBondContact O-CA 3.3Å; S495-D497 WeakPolarHBondContact CB-OD1 3.37Å; S495-D497 PolarHBondContact O-N 2.75Å; S495-D497 VanDerWaalsContact O-N 3.1Å; S495-D497 PolarHBondContact OG-N 2.92Å; S495-D497 VanDerWaalsContact OG-N 3.08Å; S495-D497 PolarHBondContact OG-OD1 3.36Å; S495-D497 PolarHBondContact OG-OD2 2.95Å; S495-R498 PolarHBondContact O-N 2.92Å; S495-T499 PolarHBondContact N-O 3.39Å; S495-V521 PolarHBondContact O-N 2.85Å
496	G	94.5	Very high	93	Very high	11 Å²	11	36.4 Å²	36.4	11%	0.113	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-8	173	0	0	0	0	0	114.2	R477 G478 R498	R477-G496 VanDerWaalsContact CD-C 3.49Å; R477-G496 WeakPolarHBondContact CD-O 3.39Å; G478-G496 PolarHBondContact O-N 3.34Å; G496-R498 PolarHBondContact O-N 2.71Å
497	D	94.4	Very high	93	Very high	19 Å²	19	38 Å²	38	10%	0.102	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.6	5.7	173.9	65.5	4.8	0	0	0	113.9	H475 K476 R477 S495 T499	H475-D497 IonicContact CG-OD2 3.95Å; H475-D497 IonicContact ND1-OD1 3.86Å; H475-D497 IonicContact ND1-OD2 2.66Å; H475-D497 PolarHBondContact ND1-OD2 3.44Å; H475-D497 VanDerWaalsContact ND1-OD2 3.07Å; K476-D497 HydrophobicContact CB-CB 4Å; K476-D497 PolarHBondContact N-OD2 3.24Å; K476-D497 VanDerWaalsContact N-OD2 3.14Å; R477-D497 HydrophobicContact CB-CB 4.25Å; R477-D497 HydrophobicContact CG-CB 4.47Å; S495-D497 WeakPolarHBondContact CB-OD1 3.37Å; S495-D497 PolarHBondContact O-N 2.75Å; S495-D497 VanDerWaalsContact O-N 3.1Å; S495-D497 PolarHBondContact OG-N 2.92Å; S495-D497 VanDerWaalsContact OG-N 3.08Å; S495-D497 PolarHBondContact OG-OD1 3.36Å; S495-D497 PolarHBondContact OG-OD2 2.95Å; D497-T499 VanDerWaalsContact CG-OG1 3.26Å; D497-T499 PolarHBondContact O-N 3.46Å; D497-T499 PolarHBondContact OD1-N 3.02Å; D497-T499 PolarHBondContact OD1-OG1 3.43Å; D497-T499 PolarHBondContact OD2-OG1 3.27Å
498	R	94.9	Very high	93.1	Very high	143 Å²	143	35.9 Å²	35.9	54%	0.54	19%	0.185	S	C	.	.	S	Bend	trans	72.4	15.5	178.7	-43.9	171.2	-75.2	-163.6	2.8	113.3	S495 G496 E518 T519	S495-R498 PolarHBondContact O-N 2.92Å; G496-R498 PolarHBondContact O-N 2.71Å; R498-E518 WeakPolarHBondContact CD-O 3.26Å; R498-T519 WeakPolarHBondContact CA-O 3.15Å; R498-T519 WeakPolarHBondContact CB-O 3.33Å; R498-T519 WeakPolarHBondContact CG-O 3.2Å
499	T	94.9	Very high	93.3	Very high	17 Å²	17	37 Å²	37	10%	0.104	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	146	179.1	69.6	0	0	0	0	110.7	S495 D497 T513 E515	S495-T499 PolarHBondContact N-O 3.39Å; D497-T499 VanDerWaalsContact CG-OG1 3.26Å; D497-T499 PolarHBondContact O-N 3.46Å; D497-T499 PolarHBondContact OD1-N 3.02Å; D497-T499 PolarHBondContact OD1-OG1 3.43Å; D497-T499 PolarHBondContact OD2-OG1 3.27Å; T499-T513 HydrophobicContact CG2-CG2 4.22Å; T499-E515 HydrophobicContact CG2-CG 4.25Å
500	V	96.2	Very high	93.3	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	127.6	161.2	-179.7	0	0	0	0	107	T493 F514 V521 V524 L533	T493-V500 CarbonylContact O-C 3.5Å; T493-V500 VanDerWaalsContact O-CA 3.29Å; T493-V500 WeakPolarHBondContact O-CA 3.23Å; T493-V500 WeakPolarHBondContact O-CG1 3.34Å; V500-F514 HydrophobicContact CB-CB 4.19Å; V500-F514 HydrophobicContact CB-CD2 4.06Å; V500-F514 HydrophobicContact CG1-CD2 4.02Å; V500-F514 PolarHBondContact N-O 2.89Å; V500-F514 WeakPolarHBondContact O-CD2 3.45Å; V500-F514 PolarHBondContact O-N 3.37Å; V500-V521 HydrophobicContact CG2-CB 4.28Å; V500-V521 HydrophobicContact CG2-CG1 3.79Å; V500-V521 HydrophobicContact CG2-CG2 4.11Å; V500-V524 HydrophobicContact CG1-CG2 3.94Å; V500-L533 HydrophobicContact CG1-CD1 4.09Å; V500-L533 HydrophobicContact CG1-CD2 4.07Å
501	K	95.4	Very high	93.3	Very high	23 Å²	23	35.6 Å²	35.6	10%	0.1	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	152.8	177.8	-68.5	-170.8	175.6	-174.6	0	110.6	D474 A492 T493 F503 T513	D474-K501 PolarHBondContact O-NZ 2.97Å; D474-K501 IonicContact OD1-NZ 3Å; D474-K501 PolarHBondContact OD1-NZ 3Å; D474-K501 WeakPolarHBondContact OD2-CD 3.45Å; D474-K501 WeakPolarHBondContact OD2-CE 3.4Å; D474-K501 IonicContact OD2-NZ 3.63Å; D474-K501 PolarHBondContact OD2-NZ 2.93Å; A492-K501 CarbonylContact C-O 3.55Å; A492-K501 VanDerWaalsContact CA-O 3.31Å; A492-K501 WeakPolarHBondContact CA-O 3.33Å; T493-K501 PolarHBondContact N-O 3.11Å; T493-K501 PolarHBondContact O-N 2.86Å; T493-K501 PolarHBondContact OG1-O 3.35Å; K501-F503 HydrophobicContact CB-CD2 4.41Å; K501-F503 HydrophobicContact CB-CE2 3.54Å; K501-F503 HydrophobicContact CB-CZ 3.78Å; K501-F503 HydrophobicContact CD-CZ 4.03Å; K501-T513 HydrophobicContact CG-CG2 4.03Å
502	M	95	Very high	93.2	Very high	7 Å²	7	38.2 Å²	38.2	3%	0.034	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	120	-175.1	-177.4	177.5	-82.7	0	0	108.6	V490 L491 C510 V511 K512 F514 F526 L533 I547	V490-M502 HydrophobicContact CB-CG 4.47Å; V490-M502 HydrophobicContact CG1-CB 4.38Å; V490-M502 HydrophobicContact CG1-CE 4.21Å; V490-M502 HydrophobicContact CG1-CG 3.01Å; V490-M502 HydrophobicContact CG1-SD 3.63Å; L491-M502 CarbonylContact O-C 3.54Å; L491-M502 VanDerWaalsContact O-CA 3.31Å; L491-M502 WeakPolarHBondContact O-CA 3.28Å; M502-C510 CarbonylContact O-C 3.58Å; M502-V511 PolarHBondContact O-N 3.34Å; M502-K512 HydrophobicContact CB-CB 4.09Å; M502-K512 PolarHBondContact N-O 3.18Å; M502-K512 PolarHBondContact O-N 2.9Å; M502-K512 HydrophobicContact SD-CB 4.45Å; M502-K512 HydrophobicContact SD-CD 4.44Å; M502-F514 HydrophobicContact CB-CE2 4.14Å; M502-F514 HydrophobicContact CE-CE2 3.92Å; M502-F514 HydrophobicContact CE-CZ 3.92Å; M502-F526 HydrophobicContact CE-CE1 3.72Å; M502-F526 HydrophobicContact CE-CZ 3.98Å; M502-L533 HydrophobicContact CE-CD1 4.19Å; M502-I547 HydrophobicContact CE-CD1 4.23Å; M502-I547 HydrophobicContact CE-CG1 4.03Å; M502-I547 HydrophobicContact CE-CG2 3.85Å; M502-I547 HydrophobicContact SD-CG2 4.09Å
503	F	94.6	Very high	93.1	Very high	2 Å²	2	40.6 Å²	40.6	1%	0.009	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	138	-173.7	-63.1	-86.2	0	0	0	111.9	I472 D474 V490 L491 T493 K501 N509 C510	I472-F503 HydrophobicContact CD1-CB 4.05Å; I472-F503 HydrophobicContact CD1-CD1 4.15Å; I472-F503 HydrophobicContact CD1-CD2 4.2Å; I472-F503 HydrophobicContact CD1-CG 3.87Å; I472-F503 HydrophobicContact CG2-CD1 3.79Å; I472-F503 HydrophobicContact CG2-CD2 4.4Å; I472-F503 HydrophobicContact CG2-CE1 3.36Å; I472-F503 HydrophobicContact CG2-CE2 4.01Å; I472-F503 HydrophobicContact CG2-CG 4.3Å; I472-F503 HydrophobicContact CG2-CZ 3.51Å; D474-F503 HydrophobicContact CB-CE1 3.93Å; D474-F503 HydrophobicContact CB-CZ 3.89Å; V490-F503 CarbonylContact C-O 3.47Å; V490-F503 VanDerWaalsContact CA-O 3.28Å; V490-F503 WeakPolarHBondContact CA-O 3.45Å; V490-F503 WeakPolarHBondContact CG1-O 3.35Å; L491-F503 HydrophobicContact CB-CB 4.4Å; L491-F503 PolarHBondContact N-O 3.3Å; L491-F503 PolarHBondContact O-N 3.13Å; T493-F503 HydrophobicContact CG2-CD2 3.93Å; T493-F503 HydrophobicContact CG2-CE2 3.94Å; T493-F503 WeakPolarHBondContact OG1-CE2 3.43Å; K501-F503 HydrophobicContact CB-CD2 4.41Å; K501-F503 HydrophobicContact CB-CE2 3.54Å; K501-F503 HydrophobicContact CB-CZ 3.78Å; K501-F503 HydrophobicContact CD-CZ 4.03Å; F503-N509 WeakPolarHBondContact CA-O 3.3Å; F503-C510 HydrophobicContact CD1-CB 4.02Å; F503-C510 HydrophobicContact CE1-CB 3.61Å; F503-C510 HydrophobicContact CZ-CB 4.33Å
504	S	93	Very high	93	Very high	21 Å²	21	40.6 Å²	40.6	15%	0.147	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72	127.5	169.8	-180	0	0	0	0	109	P506 D507 L508 N509	S504-P506 WeakPolarHBondContact OG-CD 3.16Å; S504-P506 WeakPolarHBondContact OG-CG 3.13Å; S504-D507 PolarHBondContact OG-OD2 3.5Å; S504-L508 WeakPolarHBondContact O-CA 3.43Å; S504-L508 PolarHBondContact O-N 2.89Å; S504-N509 PolarHBondContact N-O 3.19Å
505	L	88.9	Confident	92.8	Very high	29 Å²	29	47.5 Å²	47.5	15%	0.152	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-42.5	178.7	-66.3	175.8	0	0	0	114.8	L445 L457 F484 Q489 L491	L445-L505 HydrophobicContact CD1-CD1 4.03Å; L445-L505 HydrophobicContact CD1-CD2 4.45Å; L457-L505 HydrophobicContact CD1-CD2 4.23Å; L457-L505 HydrophobicContact CD2-CD2 4.24Å; F484-L505 HydrophobicContact CD1-CD1 4.21Å; F484-L505 HydrophobicContact CD1-CD2 4.18Å; F484-L505 HydrophobicContact CE1-CD1 4.25Å; F484-L505 HydrophobicContact CE1-CD2 3.71Å; Q489-L505 HydrophobicContact CB-CB 4.44Å; Q489-L505 HydrophobicContact CB-CD1 4.14Å; Q489-L505 WeakPolarHBondContact O-CG 3.49Å; Q489-L505 PolarHBondContact O-N 3.16Å; L491-L505 HydrophobicContact CB-CD2 4.06Å
506	P	87.5	Confident	92.4	Very high	91 Å²	91	49.5 Å²	49.5	59%	0.591	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-38.5	179.8	24.1	-34.1	0	0	0	113.4	S504	S504-P506 WeakPolarHBondContact OG-CD 3.16Å; S504-P506 WeakPolarHBondContact OG-CG 3.13Å
507	D	88.1	Confident	92.3	Very high	102 Å²	102	49.5 Å²	49.5	55%	0.545	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.4	-17.1	-173	-50.4	-53.9	0	0	0	113.2	S504 N509	S504-D507 PolarHBondContact OG-OD2 3.5Å; D507-N509 HydrophobicContact CB-CB 4.22Å; D507-N509 PolarHBondContact O-N 3.32Å
508	L	88.8	Confident	92.2	Very high	44 Å²	44	56.2 Å²	56.2	23%	0.23	30%	0.3	C	S	.	.			trans	55.5	17.1	-171.2	-57.8	173.9	0	0	0	114.3	L457 I472 S504	L457-L508 HydrophobicContact CD2-CD2 3.9Å; I472-L508 HydrophobicContact CD1-CD2 4.21Å; I472-L508 HydrophobicContact CG1-CB 4.31Å; I472-L508 HydrophobicContact CG1-CD2 4.3Å; S504-L508 WeakPolarHBondContact O-CA 3.43Å; S504-L508 PolarHBondContact O-N 2.89Å
509	N	92	Very high	92.2	Very high	106 Å²	106	51.2 Å²	51.2	57%	0.567	29%	0.286	S	S	*	.			trans	-85.8	146.8	177.7	-70.7	-27.6	0	0	0	111.4	F503 S504 D507 V511	F503-N509 WeakPolarHBondContact CA-O 3.3Å; S504-N509 PolarHBondContact N-O 3.19Å; D507-N509 HydrophobicContact CB-CB 4.22Å; D507-N509 PolarHBondContact O-N 3.32Å; N509-V511 PolarHBondContact O-N 2.94Å
510	C	91.2	Very high	92.2	Very high	49 Å²	49	51.4 Å²	51.4	33%	0.331	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	113.5	172.7	-174	0	0	0	0	109.7	M502 F503 T513	M502-C510 CarbonylContact O-C 3.58Å; F503-C510 HydrophobicContact CD1-CB 4.02Å; F503-C510 HydrophobicContact CE1-CB 3.61Å; F503-C510 HydrophobicContact CZ-CB 4.33Å; C510-T513 PolarHBondContact SG-OG1 3.38Å
511	V	91.6	Very high	92.2	Very high	83 Å²	83	51.4 Å²	51.4	50%	0.503	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	-46.8	178.1	-175.3	0	0	0	0	110	M502 N509	M502-V511 PolarHBondContact O-N 3.34Å; N509-V511 PolarHBondContact O-N 2.94Å
512	K	92.2	Very high	92.2	Very high	55 Å²	55	50.7 Å²	50.7	24%	0.239	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	141.1	-175.9	-75.3	174.2	173.1	-174.5	0	110.7	M502 F514 I547 K548 S550	M502-K512 HydrophobicContact CB-CB 4.09Å; M502-K512 PolarHBondContact N-O 3.18Å; M502-K512 PolarHBondContact O-N 2.9Å; M502-K512 HydrophobicContact SD-CB 4.45Å; M502-K512 HydrophobicContact SD-CD 4.44Å; K512-F514 HydrophobicContact CB-CE2 4.41Å; K512-F514 HydrophobicContact CB-CZ 4.38Å; K512-I547 WeakPolarHBondContact CD-O 3.36Å; K512-I547 PolarHBondContact NZ-O 3.46Å; K512-K548 PolarHBondContact NZ-O 2.99Å; K512-S550 VanDerWaalsContact CD-OG 3.32Å; K512-S550 WeakPolarHBondContact CD-OG 3.33Å
513	T	93.8	Very high	92.2	Very high	50 Å²	50	52.3 Å²	52.3	31%	0.307	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	122.5	169.4	-58.6	0	0	0	0	107.4	T499 K501 C510 E515	T499-T513 HydrophobicContact CG2-CG2 4.22Å; K501-T513 HydrophobicContact CG-CG2 4.03Å; C510-T513 PolarHBondContact SG-OG1 3.38Å; T513-E515 HydrophobicContact CG2-CG 3.79Å
514	F	94.6	Very high	92.3	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	107.3	175	-55.7	-85.1	0	0	0	108.4	V500 M502 K512 L533 W545	V500-F514 HydrophobicContact CB-CB 4.19Å; V500-F514 HydrophobicContact CB-CD2 4.06Å; V500-F514 HydrophobicContact CG1-CD2 4.02Å; V500-F514 PolarHBondContact N-O 2.89Å; V500-F514 WeakPolarHBondContact O-CD2 3.45Å; V500-F514 PolarHBondContact O-N 3.37Å; M502-F514 HydrophobicContact CB-CE2 4.14Å; M502-F514 HydrophobicContact CE-CE2 3.92Å; M502-F514 HydrophobicContact CE-CZ 3.92Å; K512-F514 HydrophobicContact CB-CE2 4.41Å; K512-F514 HydrophobicContact CB-CZ 4.38Å; F514-L533 HydrophobicContact CE2-CD1 4.02Å; F514-W545 HydrophobicContact CB-CD2 4.03Å; F514-W545 HydrophobicContact CB-CE3 3.95Å; F514-W545 HydrophobicContact CB-CH2 4.31Å; F514-W545 HydrophobicContact CB-CZ2 4.4Å; F514-W545 HydrophobicContact CB-CZ3 4.08Å; F514-W545 HydrophobicContact CD1-CB 4Å; F514-W545 AromaticContact CD1-CD2 3.96Å; F514-W545 HydrophobicContact CD1-CD2 3.96Å; F514-W545 AromaticContact CD1-CE3 3.71Å; F514-W545 HydrophobicContact CD1-CE3 3.71Å; F514-W545 HydrophobicContact CD1-CG 4.09Å; F514-W545 HydrophobicContact CD1-CZ3 4.48Å; F514-W545 HydrophobicContact CE1-CB 4.05Å; F514-W545 HydrophobicContact CG-CD2 4.26Å; F514-W545 HydrophobicContact CG-CE3 4.25Å; F514-W545 HydrophobicContact CG-CG 4.47Å
515	E	91.1	Very high	92.3	Very high	146 Å²	146	51.7 Å²	51.7	68%	0.682	29%	0.287	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.5	136.4	177.8	-58.6	-170.3	161.9	0	0	109.6	T499 T513 W545	T499-E515 HydrophobicContact CG2-CG 4.25Å; T513-E515 HydrophobicContact CG2-CG 3.79Å; E515-W545 WeakPolarHBondContact O-CH2 3.49Å
516	G	88.7	Confident	92.5	Very high	41 Å²	41	50.7 Å²	50.7	42%	0.423	28%	0.281	S	S	.	.			trans	153.4	-11	178.2	0	0	0	0	0	113.8	K543	G516-K543 PolarHBondContact O-NZ 3.28Å
517	H	91.6	Very high	92.5	Very high	11 Å²	11	46.8 Å²	46.8	5%	0.051	26%	0.255	C	S	.	.			trans	-74.3	136.9	167.7	-70.1	-74.7	0	0	0	110.8	V521 S535 D537 W545	H517-V521 HydrophobicContact CB-CG2 3.99Å; H517-V521 VanDerWaalsContact CD2-CG2 3.41Å; H517-V521 WeakPolarHBondContact CD2-CG2 3.29Å; H517-S535 PolarHBondContact CE1-OG 3.36Å; H517-S535 VanDerWaalsContact CE1-OG 3.24Å; H517-S535 WeakPolarHBondContact NE2-CB 3.31Å; H517-S535 PolarHBondContact NE2-OG 3.44Å; H517-D537 IonicContact ND1-OD2 2.78Å; H517-W545 AromaticContact CD2-CZ2 3.86Å; H517-W545 AromaticContact NE2-CZ2 3.77Å; H517-W545 AromaticContact NE2-NE1 3.77Å
518	E	92.4	Very high	92.2	Very high	160 Å²	160	45.5 Å²	45.5	75%	0.748	25%	0.246	S	C	*	.	S	Bend	trans	-84.4	-25.4	175.8	-62.1	-174.4	174.6	0	0	111.3	R498	R498-E518 WeakPolarHBondContact CD-O 3.26Å
519	T	94.5	Very high	91.8	Very high	39 Å²	39	49.2 Å²	49.2	24%	0.239	27%	0.266	C	S	.	.	S	Bend	trans	-123	176.8	-174.9	79.8	0	0	0	0	112	R498 D537 T538 A539	R498-T519 WeakPolarHBondContact CA-O 3.15Å; R498-T519 WeakPolarHBondContact CB-O 3.33Å; R498-T519 WeakPolarHBondContact CG-O 3.2Å; T519-D537 WeakPolarHBondContact OG1-CB 3.49Å; T519-D537 PolarHBondContact OG1-OD2 3.17Å; T519-D537 VanDerWaalsContact OG1-OD2 3.12Å; T519-T538 WeakPolarHBondContact CB-OG1 3.34Å; T519-T538 PolarHBondContact OG1-N 3.03Å; T519-T538 PolarHBondContact OG1-OG1 2.98Å; T519-A539 HydrophobicContact CG2-CB 3.97Å; T519-A539 PolarHBondContact OG1-N 2.92Å
520	A	95.2	Very high	91.4	Very high	21 Å²	21	44.4 Å²	44.4	17%	0.174	24%	0.241	C	C	.	.			trans	-67.5	136.7	-174.7	0	0	0	0	0	110.9	D537 T538	A520-D537 CarbonylContact O-C 3.58Å; A520-D537 VanDerWaalsContact O-CA 3.25Å; A520-D537 WeakPolarHBondContact O-CA 3.21Å; A520-T538 HydrophobicContact CB-CG2 3.84Å; A520-T538 PolarHBondContact N-OG1 3.21Å; A520-T538 PolarHBondContact O-N 3.32Å; A520-T538 PolarHBondContact O-OG1 2.82Å
521	V	96.5	Very high	91.2	Very high	0 Å²	0	44 Å²	44	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	123.3	177.3	-168.7	0	0	0	0	108.8	A494 S495 V500 H517 G536	A494-V521 HydrophobicContact CB-CB 4.06Å; A494-V521 HydrophobicContact CB-CG1 3.73Å; S495-V521 PolarHBondContact O-N 2.85Å; V500-V521 HydrophobicContact CG2-CB 4.28Å; V500-V521 HydrophobicContact CG2-CG1 3.79Å; V500-V521 HydrophobicContact CG2-CG2 4.11Å; H517-V521 HydrophobicContact CB-CG2 3.99Å; H517-V521 VanDerWaalsContact CD2-CG2 3.41Å; H517-V521 WeakPolarHBondContact CD2-CG2 3.29Å; V521-G536 CarbonylContact C-O 3.59Å; V521-G536 VanDerWaalsContact CG1-O 3.27Å; V521-G536 WeakPolarHBondContact CG1-O 3.35Å
522	L	95.9	Very high	91.1	Very high	7 Å²	7	42.6 Å²	42.6	4%	0.037	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	-35.4	-175.5	-65.4	-178.1	0	0	0	112.8	W480 D481 G536 T538 K562 L563 W564	W480-L522 HydrophobicContact CB-CD2 4.44Å; W480-L522 WeakPolarHBondContact CB-O 3.17Å; W480-L522 HydrophobicContact CD2-CD2 3.84Å; W480-L522 HydrophobicContact CE3-CD2 4.43Å; W480-L522 HydrophobicContact CG-CD2 3.82Å; D481-L522 VanDerWaalsContact CB-O 3.29Å; D481-L522 WeakPolarHBondContact CB-O 3.25Å; L522-G536 PolarHBondContact N-O 3.05Å; L522-T538 HydrophobicContact CD1-CG2 3.75Å; L522-T538 HydrophobicContact CD2-CG2 3.85Å; L522-T538 HydrophobicContact CG-CG2 3.75Å; L522-K562 HydrophobicContact CD1-CB 3.84Å; L522-K562 HydrophobicContact CD1-CG 4.46Å; L522-L563 VanDerWaalsContact CB-O 3.25Å; L522-L563 WeakPolarHBondContact CB-O 3.32Å; L522-L563 VanDerWaalsContact CD1-O 3.25Å; L522-L563 WeakPolarHBondContact CD1-O 3.38Å; L522-W564 HydrophobicContact CD1-CD2 4.26Å; L522-W564 HydrophobicContact CD1-CE3 4.1Å; L522-W564 HydrophobicContact CD1-CZ3 4.3Å; L522-W564 HydrophobicContact CD2-CZ3 4.4Å
523	R	95.2	Very high	91.1	Very high	42 Å²	42	40 Å²	40	16%	0.158	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	147.8	-177.7	-69.9	-62.8	-176.4	122.4	11.3	112.6	N292 D293 D481 S535 G536 W564 L566	N292-R523 PolarHBondContact O-NH2 3.26Å; N292-R523 VanDerWaalsContact O-NH2 3.12Å; D293-R523 VanDerWaalsContact CG-NH2 3.32Å; D293-R523 IonicContact OD1-CZ 3.41Å; D293-R523 IonicContact OD1-NH1 3.46Å; D293-R523 PolarHBondContact OD1-NH1 2.79Å; D293-R523 IonicContact OD1-NH2 2.71Å; D293-R523 PolarHBondContact OD1-NH2 2.82Å; D481-R523 WeakPolarHBondContact OD2-CA 3.38Å; D481-R523 WeakPolarHBondContact OD2-CD 3.39Å; R523-S535 WeakPolarHBondContact O-CA 3.48Å; R523-G536 PolarHBondContact N-O 2.88Å; R523-G536 PolarHBondContact O-N 3.1Å; R523-W564 WeakPolarHBondContact CG-O 3.21Å; R523-W564 PolarHBondContact NE-O 3.47Å; R523-W564 PolarHBondContact NH2-O 3.06Å; R523-L566 HydrophobicContact CB-CB 4.13Å
524	V	95.2	Very high	91.1	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	133	174.9	61.9	0	0	0	0	111.7	D481 R483 A492 A494 V500 L533 L534	D481-V524 HydrophobicContact CB-CG1 4.26Å; D481-V524 PolarHBondContact OD2-N 3.39Å; R483-V524 HydrophobicContact CB-CG1 4.26Å; A492-V524 HydrophobicContact CB-CG1 4.34Å; A492-V524 HydrophobicContact CB-CG2 3.87Å; A494-V524 HydrophobicContact CB-CB 4.09Å; A494-V524 HydrophobicContact CB-CG1 3.97Å; V500-V524 HydrophobicContact CG1-CG2 3.94Å; V524-L533 HydrophobicContact CG2-CD1 3.78Å; V524-L533 HydrophobicContact CG2-CD2 3.76Å; V524-L533 HydrophobicContact CG2-CG 3.74Å; V524-L534 CarbonylContact C-O 3.55Å; V524-L534 WeakPolarHBondContact CA-O 3.16Å
525	L	94	Very high	91.1	Very high	9 Å²	9	37.7 Å²	37.7	5%	0.047	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	145.8	177.1	-65	-179	0	0	0	112	L533 L534 L566 F568 L575	L525-L533 CarbonylContact O-C 3.54Å; L525-L533 WeakPolarHBondContact O-CA 3.43Å; L525-L534 HydrophobicContact CB-CB 4.4Å; L525-L534 PolarHBondContact N-O 3.45Å; L525-L534 PolarHBondContact O-N 3.42Å; L525-L566 HydrophobicContact CD1-CB 4.13Å; L525-L566 HydrophobicContact CD1-CD2 4Å; L525-L566 HydrophobicContact CD1-CG 3.64Å; L525-L566 WeakPolarHBondContact CD1-O 3.38Å; L525-L566 HydrophobicContact CG-CB 4.5Å; L525-L566 HydrophobicContact CG-CD2 4.23Å; L525-L566 HydrophobicContact CG-CG 4.26Å; L525-F568 HydrophobicContact CB-CD2 4.26Å; L525-F568 HydrophobicContact CB-CE2 4.06Å; L525-F568 HydrophobicContact CD1-CD2 3.88Å; L525-F568 HydrophobicContact CD1-CE2 4.18Å; L525-L575 HydrophobicContact CD1-CD1 4.13Å
526	F	92.1	Very high	91.3	Very high	8 Å²	8	30.8 Å²	30.8	4%	0.035	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	140.7	163.5	-71.1	-77.8	0	0	0	110.1	R483 F484 A492 M502 L533 I547 F568	R483-F526 HydrophobicContact CB-CD2 4.21Å; R483-F526 HydrophobicContact CB-CE2 4.39Å; R483-F526 HydrophobicContact CG-CD2 4.34Å; R483-F526 WeakPolarHBondContact O-CE2 2.88Å; F484-F526 WeakPolarHBondContact O-CD2 3.37Å; A492-F526 HydrophobicContact CB-CD2 4.47Å; A492-F526 HydrophobicContact CB-CE1 4.44Å; A492-F526 HydrophobicContact CB-CE2 3.39Å; A492-F526 HydrophobicContact CB-CZ 3.39Å; M502-F526 HydrophobicContact CE-CE1 3.72Å; M502-F526 HydrophobicContact CE-CZ 3.98Å; F526-L533 HydrophobicContact CE1-CD1 3.95Å; F526-L533 HydrophobicContact CZ-CD1 4.17Å; F526-I547 HydrophobicContact CD1-CD1 3.79Å; F526-I547 HydrophobicContact CE1-CD1 3.75Å; F526-F568 WeakPolarHBondContact O-CE2 3.36Å
527	N	87.7	Confident	91.6	Very high	9 Å²	9	28.9 Å²	28.9	5%	0.048	15%	0.148	C	C	.	.			trans	-66	151.5	160.7	-178.9	-52	0	0	0	109.4	L8 N529 G530 Y532 F568 D572	L8-N527 VanDerWaalsContact CD1-ND2 3.28Å; L8-N527 WeakPolarHBondContact CD1-ND2 3.03Å; N527-N529 PolarHBondContact O-N 3.37Å; N527-N529 PolarHBondContact OD1-N 2.98Å; N527-G530 PolarHBondContact O-N 3.18Å; N527-Y532 PolarHBondContact N-O 2.86Å; N527-F568 HydrophobicContact CB-CE2 4.39Å; N527-F568 HydrophobicContact CB-CZ 4.27Å; N527-D572 PolarHBondContact OD1-OD2 3.39Å
528	Q	81.5	Confident	91.8	Very high	76 Å²	76	30.1 Å²	30.1	36%	0.355	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-33.3	177.5	-74	173.1	28.1	0	0	113.4	G530 K570 D572	Q528-G530 PolarHBondContact O-N 3.36Å; Q528-K570 PolarHBondContact NE2-O 3.28Å; Q528-D572 WeakPolarHBondContact CA-OD2 3.35Å; Q528-D572 WeakPolarHBondContact CB-OD2 3.43Å; Q528-D572 HydrophobicContact CG-CB 4.44Å; Q528-D572 VanDerWaalsContact CG-OD1 3.25Å; Q528-D572 WeakPolarHBondContact CG-OD1 3.26Å; Q528-D572 WeakPolarHBondContact CG-OD2 3.45Å; Q528-D572 PolarHBondContact N-OD2 3.06Å; Q528-D572 PolarHBondContact NE2-OD1 2.92Å
529	N	81.6	Confident	91.9	Very high	122 Å²	122	24.7 Å²	24.7	65%	0.652	14%	0.139	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.7	-6.5	176.8	-70.6	-27.8	0	0	0	113.5	N527 S531	N527-N529 PolarHBondContact O-N 3.37Å; N527-N529 PolarHBondContact OD1-N 2.98Å; N529-S531 PolarHBondContact O-N 3.38Å; N529-S531 PolarHBondContact O-OG 3.42Å
530	G	82.2	Confident	91.8	Very high	4 Å²	4	22.8 Å²	22.8	4%	0.041	13%	0.127	C	C	.	.	S	Bend	trans	61.7	13.2	179.3	0	0	0	0	0	114.8	N527 Q528 I547	N527-G530 PolarHBondContact O-N 3.18Å; Q528-G530 PolarHBondContact O-N 3.36Å; G530-I547 WeakPolarHBondContact O-CD1 3.14Å
531	S	87.1	Confident	91.7	Very high	42 Å²	42	23.4 Å²	23.4	29%	0.294	13%	0.127	S	C	.	.	S	Bend	trans	-90.1	-26.8	-177.9	-65.7	0	0	0	0	113	N529 I547	N529-S531 PolarHBondContact O-N 3.38Å; N529-S531 PolarHBondContact O-OG 3.42Å; S531-I547 WeakPolarHBondContact O-CB 3.1Å; S531-I547 PolarHBondContact O-N 3.05Å; S531-I547 VanDerWaalsContact O-N 3.1Å
532	Y	90.2	Very high	91.6	Very high	53 Å²	53	23.5 Å²	23.5	21%	0.208	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	149.7	-177.1	-56.3	-85.5	0	0	0	111	L8 N527 L544 W545 D546 L553	L8-Y532 HydrophobicContact CD1-CD1 4.43Å; L8-Y532 HydrophobicContact CD1-CD2 3.13Å; L8-Y532 HydrophobicContact CD1-CE2 3.63Å; L8-Y532 HydrophobicContact CD1-CG 3.6Å; L8-Y532 HydrophobicContact CD2-CE2 4.37Å; L8-Y532 HydrophobicContact CG-CD2 3.6Å; L8-Y532 HydrophobicContact CG-CE2 3.52Å; L8-Y532 HydrophobicContact CG-CG 4.14Å; N527-Y532 PolarHBondContact N-O 2.86Å; Y532-L544 HydrophobicContact CD1-CD1 4.25Å; Y532-L544 HydrophobicContact CG-CD1 4.24Å; Y532-W545 CarbonylContact C-O 3.6Å; Y532-W545 VanDerWaalsContact CA-O 3.25Å; Y532-W545 WeakPolarHBondContact CA-O 3.3Å; Y532-D546 HydrophobicContact CD1-CB 4.36Å; Y532-D546 HydrophobicContact CE1-CB 4.36Å; Y532-L553 HydrophobicContact CE1-CD2 4.26Å
533	L	92.2	Very high	91.5	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	131.7	176.1	-179.8	151.7	0	0	0	108.9	A492 V500 M502 F514 V524 L525 F526 W545 I547	A492-L533 HydrophobicContact CB-CD1 3.83Å; V500-L533 HydrophobicContact CG1-CD1 4.09Å; V500-L533 HydrophobicContact CG1-CD2 4.07Å; M502-L533 HydrophobicContact CE-CD1 4.19Å; F514-L533 HydrophobicContact CE2-CD1 4.02Å; V524-L533 HydrophobicContact CG2-CD1 3.78Å; V524-L533 HydrophobicContact CG2-CD2 3.76Å; V524-L533 HydrophobicContact CG2-CG 3.74Å; L525-L533 CarbonylContact O-C 3.54Å; L525-L533 WeakPolarHBondContact O-CA 3.43Å; F526-L533 HydrophobicContact CE1-CD1 3.95Å; F526-L533 HydrophobicContact CZ-CD1 4.17Å; L533-W545 HydrophobicContact CB-CB 4.27Å; L533-W545 HydrophobicContact CD2-CB 4.39Å; L533-W545 HydrophobicContact CD2-CG 4.2Å; L533-W545 PolarHBondContact N-O 3.34Å; L533-W545 PolarHBondContact O-N 3.16Å; L533-I547 HydrophobicContact CB-CD1 4.23Å; L533-I547 HydrophobicContact CB-CG1 4.05Å
534	L	93.7	Very high	91.4	Very high	2 Å²	2	22.3 Å²	22.3	1%	0.01	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	140.8	171.6	-71.6	177.3	0	0	0	109.3	F10 V524 L525 I542 K543 L544 L566 F568 L575	F10-L534 HydrophobicContact CE2-CD1 4.2Å; F10-L534 HydrophobicContact CE2-CD2 4.17Å; F10-L534 HydrophobicContact CZ-CD1 4.42Å; V524-L534 CarbonylContact C-O 3.55Å; V524-L534 WeakPolarHBondContact CA-O 3.16Å; L525-L534 HydrophobicContact CB-CB 4.4Å; L525-L534 PolarHBondContact N-O 3.45Å; L525-L534 PolarHBondContact O-N 3.42Å; L534-I542 HydrophobicContact CD2-CG2 4.02Å; L534-K543 WeakPolarHBondContact CA-O 3.31Å; L534-L544 HydrophobicContact CD2-CB 3.91Å; L534-L544 HydrophobicContact CD2-CD1 3.56Å; L534-L544 HydrophobicContact CD2-CG 4.33Å; L534-L544 HydrophobicContact CG-CD1 4.24Å; L534-L566 HydrophobicContact CB-CD2 4.04Å; L534-F568 HydrophobicContact CD1-CE1 3.95Å; L534-F568 HydrophobicContact CD1-CE2 3.84Å; L534-F568 HydrophobicContact CD1-CZ 3.27Å; L534-F568 HydrophobicContact CG-CZ 4.15Å; L534-L575 HydrophobicContact CD1-CD1 3.64Å; L534-L575 HydrophobicContact CD1-CD2 3.64Å; L534-L575 HydrophobicContact CD1-CG 4.27Å
535	S	95	Very high	91.3	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	136.3	178	57.5	0	0	0	0	110.2	H517 R523 I542 K543 W545	H517-S535 PolarHBondContact CE1-OG 3.36Å; H517-S535 VanDerWaalsContact CE1-OG 3.24Å; H517-S535 WeakPolarHBondContact NE2-CB 3.31Å; H517-S535 PolarHBondContact NE2-OG 3.44Å; R523-S535 WeakPolarHBondContact O-CA 3.48Å; S535-I542 CarbonylContact O-C 3.59Å; S535-I542 WeakPolarHBondContact O-CA 3.41Å; S535-K543 PolarHBondContact N-O 3.45Å; S535-K543 PolarHBondContact O-N 2.93Å; S535-K543 PolarHBondContact OG-O 3.06Å; S535-W545 PolarHBondContact OG-NE1 2.85Å
536	G	94.9	Very high	91.1	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	136.4	177.8	0	0	0	0	0	112.4	V521 L522 R523 L541 L563	V521-G536 CarbonylContact C-O 3.59Å; V521-G536 VanDerWaalsContact CG1-O 3.27Å; V521-G536 WeakPolarHBondContact CG1-O 3.35Å; L522-G536 PolarHBondContact N-O 3.05Å; R523-G536 PolarHBondContact N-O 2.88Å; R523-G536 PolarHBondContact O-N 3.1Å; G536-L541 WeakPolarHBondContact CA-O 3.43Å; G536-L563 VanDerWaalsContact CA-CD2 3.45Å
537	D	95	Very high	91	Very high	1 Å²	1	23.9 Å²	23.9	1%	0.005	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	177.4	-175.7	79.6	-2.9	0	0	0	114.2	H517 T519 A520 A539 G540 L541 L563	H517-D537 IonicContact ND1-OD2 2.78Å; T519-D537 WeakPolarHBondContact OG1-CB 3.49Å; T519-D537 PolarHBondContact OG1-OD2 3.17Å; T519-D537 VanDerWaalsContact OG1-OD2 3.12Å; A520-D537 CarbonylContact O-C 3.58Å; A520-D537 VanDerWaalsContact O-CA 3.25Å; A520-D537 WeakPolarHBondContact O-CA 3.21Å; D537-A539 PolarHBondContact O-N 2.87Å; D537-A539 WeakPolarHBondContact OD1-CA 3.13Å; D537-A539 PolarHBondContact OD1-N 3.4Å; D537-G540 PolarHBondContact O-N 3.15Å; D537-G540 PolarHBondContact OD1-N 2.88Å; D537-L541 PolarHBondContact N-O 3.11Å; D537-L541 VanDerWaalsContact N-O 3.15Å; D537-L541 WeakPolarHBondContact OD1-CB 3.29Å; D537-L541 PolarHBondContact OD1-N 3.29Å; D537-L563 WeakPolarHBondContact O-CB 3.41Å; D537-L563 PolarHBondContact O-N 3.42Å
538	T	95.6	Very high	91	Very high	37 Å²	37	31.1 Å²	31.1	23%	0.227	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-11.2	175.9	45.8	0	0	0	0	114.3	T519 A520 L522 G561 K562	T519-T538 WeakPolarHBondContact CB-OG1 3.34Å; T519-T538 PolarHBondContact OG1-N 3.03Å; T519-T538 PolarHBondContact OG1-OG1 2.98Å; A520-T538 HydrophobicContact CB-CG2 3.84Å; A520-T538 PolarHBondContact N-OG1 3.21Å; A520-T538 PolarHBondContact O-N 3.32Å; A520-T538 PolarHBondContact O-OG1 2.82Å; L522-T538 HydrophobicContact CD1-CG2 3.75Å; L522-T538 HydrophobicContact CD2-CG2 3.85Å; L522-T538 HydrophobicContact CG-CG2 3.75Å; T538-G561 CarbonylContact O-C 3.55Å; T538-K562 HydrophobicContact CG2-CD 4.19Å; T538-K562 HydrophobicContact CG2-CG 4.04Å; T538-K562 WeakPolarHBondContact O-CA 3.29Å; T538-K562 WeakPolarHBondContact O-CG 3.49Å; T538-K562 PolarHBondContact O-N 3.15Å
539	A	94.4	Very high	91.4	Very high	46 Å²	46	31.6 Å²	31.6	38%	0.38	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.3	-5.3	176.4	0	0	0	0	0	112.7	T519 D537 L541 G561	T519-A539 HydrophobicContact CG2-CB 3.97Å; T519-A539 PolarHBondContact OG1-N 2.92Å; D537-A539 PolarHBondContact O-N 2.87Å; D537-A539 WeakPolarHBondContact OD1-CA 3.13Å; D537-A539 PolarHBondContact OD1-N 3.4Å; A539-L541 HydrophobicContact CB-CD1 4.47Å; A539-L541 HydrophobicContact CB-CG 4.36Å; A539-G561 CarbonylContact C-O 3.58Å
540	G	92.1	Very high	91.6	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	15%	0.154	C	C	.	.	S	Bend	trans	88.5	14.6	180	0	0	0	0	0	113.5	D537 A558 H559 G561	D537-G540 PolarHBondContact O-N 3.15Å; D537-G540 PolarHBondContact OD1-N 2.88Å; G540-A558 WeakPolarHBondContact O-CB 3.42Å; G540-A558 PolarHBondContact O-N 2.9Å; G540-H559 WeakPolarHBondContact CA-O 3.21Å; G540-H559 PolarHBondContact O-N 3.45Å; G540-H559 VanDerWaalsContact O-N 3.16Å; G540-G561 WeakPolarHBondContact CA-O 3.48Å; G540-G561 PolarHBondContact N-O 3.3Å
541	L	94.5	Very high	92	Very high	34 Å²	34	31.7 Å²	31.7	18%	0.178	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	131.7	177.9	-58.6	174.5	0	0	0	110.9	G536 D537 A539 T555 Y556 E557	G536-L541 WeakPolarHBondContact CA-O 3.43Å; D537-L541 PolarHBondContact N-O 3.11Å; D537-L541 VanDerWaalsContact N-O 3.15Å; D537-L541 WeakPolarHBondContact OD1-CB 3.29Å; D537-L541 PolarHBondContact OD1-N 3.29Å; A539-L541 HydrophobicContact CB-CD1 4.47Å; A539-L541 HydrophobicContact CB-CG 4.36Å; L541-T555 HydrophobicContact CB-CG2 4.16Å; L541-T555 HydrophobicContact CD1-CG2 4.3Å; L541-T555 HydrophobicContact CD2-CG2 4.02Å; L541-T555 HydrophobicContact CG-CG2 4.4Å; L541-Y556 CarbonylContact C-O 3.52Å; L541-Y556 WeakPolarHBondContact CA-O 3.47Å; L541-E557 HydrophobicContact CD2-CB 4.39Å; L541-E557 HydrophobicContact CD2-CG 3.57Å
542	I	94.6	Very high	92.1	Very high	1 Å²	1	31.6 Å²	31.6	1%	0.005	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	115	169.4	-58.8	171.2	0	0	0	108	L534 S535 Y556 A558 L563 L566 W587	L534-I542 HydrophobicContact CD2-CG2 4.02Å; S535-I542 CarbonylContact O-C 3.59Å; S535-I542 WeakPolarHBondContact O-CA 3.41Å; I542-Y556 PolarHBondContact N-O 3.32Å; I542-Y556 PolarHBondContact O-N 2.74Å; I542-A558 HydrophobicContact CD1-CB 3.56Å; I542-A558 HydrophobicContact CG1-CB 3.92Å; I542-L563 HydrophobicContact CD1-CD2 4.24Å; I542-L563 HydrophobicContact CG1-CD2 3.75Å; I542-L566 HydrophobicContact CD1-CD1 3.8Å; I542-L566 HydrophobicContact CG1-CD1 4.42Å; I542-W587 HydrophobicContact CD1-CZ2 4.36Å
543	K	93.4	Very high	92	Very high	23 Å²	23	32.8 Å²	32.8	10%	0.1	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	135.6	175	-64.6	-167.2	-176.6	-161.9	0	111.4	G516 L534 S535 W545 T555	G516-K543 PolarHBondContact O-NZ 3.28Å; L534-K543 WeakPolarHBondContact CA-O 3.31Å; S535-K543 PolarHBondContact N-O 3.45Å; S535-K543 PolarHBondContact O-N 2.93Å; S535-K543 PolarHBondContact OG-O 3.06Å; K543-W545 HydrophobicContact CB-CZ2 4.09Å; K543-W545 HydrophobicContact CD-CZ2 3.89Å; K543-T555 HydrophobicContact CG-CG2 4.02Å
544	L	92.7	Very high	91.8	Very high	1 Å²	1	35.8 Å²	35.8	1%	0.005	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	120.9	174.4	176.7	69.6	0	0	0	109.9	L8 F10 Y532 L534 L553 K554 Y556	L8-L544 HydrophobicContact CB-CD1 4.44Å; L8-L544 HydrophobicContact CB-CD2 3.72Å; L8-L544 WeakPolarHBondContact O-CD2 3.49Å; F10-L544 HydrophobicContact CE2-CD1 4.46Å; Y532-L544 HydrophobicContact CD1-CD1 4.25Å; Y532-L544 HydrophobicContact CG-CD1 4.24Å; L534-L544 HydrophobicContact CD2-CB 3.91Å; L534-L544 HydrophobicContact CD2-CD1 3.56Å; L534-L544 HydrophobicContact CD2-CG 4.33Å; L534-L544 HydrophobicContact CG-CD1 4.24Å; L544-L553 HydrophobicContact CD2-CB 4.4Å; L544-L553 HydrophobicContact CD2-CD2 3.64Å; L544-L553 HydrophobicContact CD2-CG 4.35Å; L544-L553 HydrophobicContact CG-CB 4.45Å; L544-L553 HydrophobicContact CG-CD2 4.35Å; L544-L553 PolarHBondContact O-N 3.21Å; L544-K554 PolarHBondContact N-O 3.13Å; L544-Y556 HydrophobicContact CB-CE2 4.46Å
545	W	92.8	Very high	91.7	Very high	3 Å²	3	38.9 Å²	38.9	1%	0.011	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	134	-178	-55.9	88.3	0	0	0	110.2	F514 E515 H517 Y532 L533 S535 K543 C552	F514-W545 HydrophobicContact CB-CD2 4.03Å; F514-W545 HydrophobicContact CB-CE3 3.95Å; F514-W545 HydrophobicContact CB-CH2 4.31Å; F514-W545 HydrophobicContact CB-CZ2 4.4Å; F514-W545 HydrophobicContact CB-CZ3 4.08Å; F514-W545 HydrophobicContact CD1-CB 4Å; F514-W545 AromaticContact CD1-CD2 3.96Å; F514-W545 HydrophobicContact CD1-CD2 3.96Å; F514-W545 AromaticContact CD1-CE3 3.71Å; F514-W545 HydrophobicContact CD1-CE3 3.71Å; F514-W545 HydrophobicContact CD1-CG 4.09Å; F514-W545 HydrophobicContact CD1-CZ3 4.48Å; F514-W545 HydrophobicContact CE1-CB 4.05Å; F514-W545 HydrophobicContact CG-CD2 4.26Å; F514-W545 HydrophobicContact CG-CE3 4.25Å; F514-W545 HydrophobicContact CG-CG 4.47Å; E515-W545 WeakPolarHBondContact O-CH2 3.49Å; H517-W545 AromaticContact CD2-CZ2 3.86Å; H517-W545 AromaticContact NE2-CZ2 3.77Å; H517-W545 AromaticContact NE2-NE1 3.77Å; Y532-W545 CarbonylContact C-O 3.6Å; Y532-W545 VanDerWaalsContact CA-O 3.25Å; Y532-W545 WeakPolarHBondContact CA-O 3.3Å; L533-W545 HydrophobicContact CB-CB 4.27Å; L533-W545 HydrophobicContact CD2-CB 4.39Å; L533-W545 HydrophobicContact CD2-CG 4.2Å; L533-W545 PolarHBondContact N-O 3.34Å; L533-W545 PolarHBondContact O-N 3.16Å; S535-W545 PolarHBondContact OG-NE1 2.85Å; K543-W545 HydrophobicContact CB-CZ2 4.09Å; K543-W545 HydrophobicContact CD-CZ2 3.89Å; W545-C552 HydrophobicContact CD2-CB 4.37Å; W545-C552 HydrophobicContact CE3-CB 3.86Å; W545-C552 HydrophobicContact CH2-CB 3.87Å; W545-C552 HydrophobicContact CZ2-CB 4.36Å; W545-C552 HydrophobicContact CZ3-CB 3.6Å
546	D	90.5	Very high	91.6	Very high	32 Å²	32	40.3 Å²	40.3	17%	0.171	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82	122.3	163.8	170.3	27.7	0	0	0	109	Y532 K548 T549 S550 V551	Y532-D546 HydrophobicContact CD1-CB 4.36Å; Y532-D546 HydrophobicContact CE1-CB 4.36Å; D546-K548 PolarHBondContact O-N 3.15Å; D546-K548 PolarHBondContact OD1-N 3Å; D546-T549 WeakPolarHBondContact CB-OG1 3.41Å; D546-T549 WeakPolarHBondContact OD2-CB 3.15Å; D546-T549 VanDerWaalsContact OD2-CG2 3.26Å; D546-T549 WeakPolarHBondContact OD2-CG2 3.3Å; D546-T549 PolarHBondContact OD2-N 3.3Å; D546-T549 PolarHBondContact OD2-OG1 2.89Å; D546-S550 WeakPolarHBondContact O-CA 3.38Å; D546-S550 PolarHBondContact O-N 3.11Å; D546-V551 PolarHBondContact N-O 2.87Å
547	I	89.8	Confident	91.4	Very high	15 Å²	15	48.7 Å²	48.7	8%	0.077	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-30.1	-177.6	-68.2	166.9	0	0	0	110.2	M502 K512 F526 G530 S531 L533	M502-I547 HydrophobicContact CE-CD1 4.23Å; M502-I547 HydrophobicContact CE-CG1 4.03Å; M502-I547 HydrophobicContact CE-CG2 3.85Å; M502-I547 HydrophobicContact SD-CG2 4.09Å; K512-I547 WeakPolarHBondContact CD-O 3.36Å; K512-I547 PolarHBondContact NZ-O 3.46Å; F526-I547 HydrophobicContact CD1-CD1 3.79Å; F526-I547 HydrophobicContact CE1-CD1 3.75Å; G530-I547 WeakPolarHBondContact O-CD1 3.14Å; S531-I547 WeakPolarHBondContact O-CB 3.1Å; S531-I547 PolarHBondContact O-N 3.05Å; S531-I547 VanDerWaalsContact O-N 3.1Å; L533-I547 HydrophobicContact CB-CD1 4.23Å; L533-I547 HydrophobicContact CB-CG1 4.05Å
548	K	88.2	Confident	91	Very high	161 Å²	161	49.4 Å²	49.4	70%	0.7	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	-51.1	-177.5	-68.7	179.8	-177.9	172.6	0	112.3	K512 D546	K512-K548 PolarHBondContact NZ-O 2.99Å; D546-K548 PolarHBondContact O-N 3.15Å; D546-K548 PolarHBondContact OD1-N 3Å
549	T	88.1	Confident	90.8	Very high	87 Å²	87	48.2 Å²	48.2	53%	0.534	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-16.5	-177	56.4	0	0	0	0	113.9	D546 V551	D546-T549 WeakPolarHBondContact CB-OG1 3.41Å; D546-T549 WeakPolarHBondContact OD2-CB 3.15Å; D546-T549 VanDerWaalsContact OD2-CG2 3.26Å; D546-T549 WeakPolarHBondContact OD2-CG2 3.3Å; D546-T549 PolarHBondContact OD2-N 3.3Å; D546-T549 PolarHBondContact OD2-OG1 2.89Å; T549-V551 PolarHBondContact O-N 2.67Å
550	S	87.5	Confident	90.5	Very high	40 Å²	40	54.6 Å²	54.6	28%	0.28	28%	0.282	S	S	.	.			trans	61.2	17.7	-172.3	-49.8	0	0	0	0	114.2	K512 D546	K512-S550 VanDerWaalsContact CD-OG 3.32Å; K512-S550 WeakPolarHBondContact CD-OG 3.33Å; D546-S550 WeakPolarHBondContact O-CA 3.38Å; D546-S550 PolarHBondContact O-N 3.11Å
551	V	89.2	Confident	90.4	Very high	87 Å²	87	55.4 Å²	55.4	53%	0.527	29%	0.29	S	S	.	.			trans	-97.7	143.4	-178.8	178.1	0	0	0	0	110.2	D546 T549 L553	D546-V551 PolarHBondContact N-O 2.87Å; T549-V551 PolarHBondContact O-N 2.67Å; V551-L553 PolarHBondContact O-N 3.44Å
552	C	89.3	Confident	90.4	Very high	41 Å²	41	57 Å²	57	28%	0.277	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	112.8	169	-179.4	0	0	0	0	109.3	W545	W545-C552 HydrophobicContact CD2-CB 4.37Å; W545-C552 HydrophobicContact CE3-CB 3.86Å; W545-C552 HydrophobicContact CH2-CB 3.87Å; W545-C552 HydrophobicContact CZ2-CB 4.36Å; W545-C552 HydrophobicContact CZ3-CB 3.6Å
553	L	88.5	Confident	90.5	Very high	77 Å²	77	57 Å²	57	40%	0.403	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	-46.6	-179.3	177.8	63.9	0	0	0	111.3	Y532 L544 V551	Y532-L553 HydrophobicContact CE1-CD2 4.26Å; L544-L553 HydrophobicContact CD2-CB 4.4Å; L544-L553 HydrophobicContact CD2-CD2 3.64Å; L544-L553 HydrophobicContact CD2-CG 4.35Å; L544-L553 HydrophobicContact CG-CB 4.45Å; L544-L553 HydrophobicContact CG-CD2 4.35Å; L544-L553 PolarHBondContact O-N 3.21Å; V551-L553 PolarHBondContact O-N 3.44Å
554	K	88.5	Confident	90.5	Very high	63 Å²	63	59 Å²	59	27%	0.274	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	149.2	-179.4	-73.3	-170.9	179.8	-152.1	0	111.1	E9 L544 Y556	E9-K554 HydrophobicContact CG-CD 4.35Å; E9-K554 IonicContact OE1-NZ 2.86Å; E9-K554 PolarHBondContact OE1-NZ 3.3Å; E9-K554 IonicContact OE2-NZ 3.97Å; E9-K554 PolarHBondContact OE2-NZ 2.61Å; L544-K554 PolarHBondContact N-O 3.13Å; K554-Y556 HydrophobicContact CB-CE2 4.04Å; K554-Y556 WeakPolarHBondContact CD-OH 3.15Å
555	T	91.9	Very high	90.6	Very high	68 Å²	68	59 Å²	59	42%	0.417	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	129.9	170.2	-55.3	0	0	0	0	107.5	L541 K543	L541-T555 HydrophobicContact CB-CG2 4.16Å; L541-T555 HydrophobicContact CD1-CG2 4.3Å; L541-T555 HydrophobicContact CD2-CG2 4.02Å; L541-T555 HydrophobicContact CG-CG2 4.4Å; K543-T555 HydrophobicContact CG-CG2 4.02Å
556	Y	92.2	Very high	90.6	Very high	30 Å²	30	59 Å²	59	12%	0.118	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	126.7	176.2	-60.9	-78.6	0	0	0	109.4	E9 F10 L541 I542 L544 K554 A558 W587	E9-Y556 WeakPolarHBondContact CA-OH 3.44Å; F10-Y556 HydrophobicContact CB-CE1 4.41Å; F10-Y556 HydrophobicContact CB-CE2 4.46Å; F10-Y556 HydrophobicContact CD2-CE2 4.1Å; F10-Y556 PolarHBondContact N-OH 3.42Å; F10-Y556 VanDerWaalsContact O-CE1 3.28Å; F10-Y556 WeakPolarHBondContact O-CE1 3.45Å; L541-Y556 CarbonylContact C-O 3.52Å; L541-Y556 WeakPolarHBondContact CA-O 3.47Å; I542-Y556 PolarHBondContact N-O 3.32Å; I542-Y556 PolarHBondContact O-N 2.74Å; L544-Y556 HydrophobicContact CB-CE2 4.46Å; K554-Y556 HydrophobicContact CB-CE2 4.04Å; K554-Y556 WeakPolarHBondContact CD-OH 3.15Å; Y556-A558 PolarHBondContact O-N 3.41Å; Y556-W587 HydrophobicContact CD1-CZ3 4.03Å; Y556-W587 HydrophobicContact CG-CZ3 4.3Å
557	E	90.8	Very high	90.7	Very high	176 Å²	176	58.8 Å²	58.8	82%	0.822	30%	0.301	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.9	103.9	166.4	-71.8	170.6	-170.5	0	0	107.6	L541	L541-E557 HydrophobicContact CD2-CB 4.39Å; L541-E557 HydrophobicContact CD2-CG 3.57Å
558	A	86.9	Confident	90.8	Very high	15 Å²	15	59 Å²	59	12%	0.124	30%	0.302	C	S	.	.			trans	-100.2	-49.1	-176.1	0	0	0	0	0	111	G540 I542 Y556 L585 W587	G540-A558 WeakPolarHBondContact O-CB 3.42Å; G540-A558 PolarHBondContact O-N 2.9Å; I542-A558 HydrophobicContact CD1-CB 3.56Å; I542-A558 HydrophobicContact CG1-CB 3.92Å; Y556-A558 PolarHBondContact O-N 3.41Å; A558-L585 HydrophobicContact CB-CD1 4.2Å; A558-L585 WeakPolarHBondContact O-CD1 3.3Å; A558-W587 HydrophobicContact CB-CH2 3.99Å; A558-W587 HydrophobicContact CB-CZ2 3.43Å; A558-W587 VanDerWaalsContact CB-CZ2 3.43Å
559	H	90.8	Very high	90.7	Very high	13 Å²	13	51.6 Å²	51.6	6%	0.06	27%	0.27	C	S	.	.			trans	-132.8	155.9	-169.7	-66	-86	0	0	0	112.1	G540 G561 L563 S577 D581 A583	G540-H559 WeakPolarHBondContact CA-O 3.21Å; G540-H559 PolarHBondContact O-N 3.45Å; G540-H559 VanDerWaalsContact O-N 3.16Å; H559-G561 VanDerWaalsContact C-N 3.28Å; H559-G561 PolarHBondContact O-N 3.32Å; H559-L563 WeakPolarHBondContact CD2-CD1 3.44Å; H559-S577 WeakPolarHBondContact NE2-CB 3.25Å; H559-S577 PolarHBondContact NE2-OG 2.73Å; H559-D581 WeakPolarHBondContact CA-OD2 3.21Å; H559-D581 WeakPolarHBondContact CB-OD2 3.14Å; H559-D581 IonicContact CG-OD1 3.07Å; H559-D581 IonicContact CG-OD2 3.8Å; H559-D581 IonicContact ND1-OD1 3.64Å; H559-D581 PolarHBondContact ND1-OD1 2.83Å; H559-D581 IonicContact ND1-OD2 3.54Å; H559-D581 PolarHBondContact ND1-OD2 3.27Å; H559-D581 VanDerWaalsContact ND1-OD2 3.15Å; H559-A583 PolarHBondContact CE1-O 3.37Å
560	E	88.4	Confident	90.2	Very high	179 Å²	179	49.8 Å²	49.8	84%	0.836	26%	0.255	S	S	*	.	S	Bend	trans	-92.6	54	174	-65.3	-178.5	177.6	0	0	110.6	D581	E560-D581 PolarHBondContact N-OD2 2.95Å
561	G	90.4	Very high	89.5	Confident	17 Å²	17	54.2 Å²	54.2	18%	0.175	27%	0.269	C	S	.	.	S	Bend	trans	159.8	-166.7	-176	0	0	0	0	0	113.4	T538 A539 G540 H559 L563	T538-G561 CarbonylContact O-C 3.55Å; A539-G561 CarbonylContact C-O 3.58Å; G540-G561 WeakPolarHBondContact CA-O 3.48Å; G540-G561 PolarHBondContact N-O 3.3Å; H559-G561 VanDerWaalsContact C-N 3.28Å; H559-G561 PolarHBondContact O-N 3.32Å; G561-L563 PolarHBondContact O-N 3.24Å
562	K	94.3	Very high	88.6	Confident	68 Å²	68	51.1 Å²	51.1	30%	0.296	25%	0.249	S	C	.	.			trans	-64.2	127.6	-175.4	-63.5	-177.2	-154.5	88.1	0	111.8	L522 T538 W564 G579 E580	L522-K562 HydrophobicContact CD1-CB 3.84Å; L522-K562 HydrophobicContact CD1-CG 4.46Å; T538-K562 HydrophobicContact CG2-CD 4.19Å; T538-K562 HydrophobicContact CG2-CG 4.04Å; T538-K562 WeakPolarHBondContact O-CA 3.29Å; T538-K562 WeakPolarHBondContact O-CG 3.49Å; T538-K562 PolarHBondContact O-N 3.15Å; K562-W564 HydrophobicContact CB-CZ2 4.39Å; K562-W564 HydrophobicContact CD-CH2 4.4Å; K562-W564 HydrophobicContact CD-CZ2 3.72Å; K562-W564 PolarHBondContact O-N 3.24Å; K562-G579 CarbonylContact O-C 3.56Å; K562-G579 VanDerWaalsContact O-CA 3.3Å; K562-G579 WeakPolarHBondContact O-CA 3.08Å; K562-E580 HydrophobicContact CB-CB 4.24Å; K562-E580 WeakPolarHBondContact CB-OE2 3.31Å; K562-E580 WeakPolarHBondContact CD-OE2 3.42Å; K562-E580 WeakPolarHBondContact CG-OE2 3.4Å; K562-E580 PolarHBondContact N-OE2 3.05Å; K562-E580 VanDerWaalsContact NZ-CD 3.26Å; K562-E580 IonicContact NZ-OE1 3.42Å; K562-E580 PolarHBondContact NZ-OE1 2.94Å; K562-E580 IonicContact NZ-OE2 2.66Å; K562-E580 PolarHBondContact NZ-OE2 2.8Å; K562-E580 PolarHBondContact O-N 2.98Å
563	L	95.8	Very high	88.1	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	102	171.6	-170.7	80	0	0	0	110.7	L522 G536 D537 I542 H559 G561 L566 G578	L522-L563 VanDerWaalsContact CB-O 3.25Å; L522-L563 WeakPolarHBondContact CB-O 3.32Å; L522-L563 VanDerWaalsContact CD1-O 3.25Å; L522-L563 WeakPolarHBondContact CD1-O 3.38Å; G536-L563 VanDerWaalsContact CA-CD2 3.45Å; D537-L563 WeakPolarHBondContact O-CB 3.41Å; D537-L563 PolarHBondContact O-N 3.42Å; I542-L563 HydrophobicContact CD1-CD2 4.24Å; I542-L563 HydrophobicContact CG1-CD2 3.75Å; H559-L563 WeakPolarHBondContact CD2-CD1 3.44Å; G561-L563 PolarHBondContact O-N 3.24Å; L563-L566 HydrophobicContact CD2-CB 4.26Å; L563-L566 HydrophobicContact CD2-CD1 4.24Å; L563-L566 HydrophobicContact CD2-CD2 4.47Å; L563-G578 WeakPolarHBondContact CD1-O 3.39Å
564	W	95.1	Very high	88	Confident	67 Å²	67	53.4 Å²	53.4	25%	0.254	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	-30.8	-179.5	-70.2	110.6	0	0	0	113.5	V291 W480 L522 R523 K562 G578	V291-W564 WeakPolarHBondContact O-CB 2.93Å; W480-W564 HydrophobicContact CZ3-CZ3 4.35Å; L522-W564 HydrophobicContact CD1-CD2 4.26Å; L522-W564 HydrophobicContact CD1-CE3 4.1Å; L522-W564 HydrophobicContact CD1-CZ3 4.3Å; L522-W564 HydrophobicContact CD2-CZ3 4.4Å; R523-W564 WeakPolarHBondContact CG-O 3.21Å; R523-W564 PolarHBondContact NE-O 3.47Å; R523-W564 PolarHBondContact NH2-O 3.06Å; K562-W564 HydrophobicContact CB-CZ2 4.39Å; K562-W564 HydrophobicContact CD-CH2 4.4Å; K562-W564 HydrophobicContact CD-CZ2 3.72Å; K562-W564 PolarHBondContact O-N 3.24Å; W564-G578 PolarHBondContact N-O 3.39Å
565	A	93.3	Very high	88.1	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	133.9	-171.8	0	0	0	0	0	111.4	V291 V294 S577 G578	V291-A565 HydrophobicContact CG1-CB 4Å; V294-A565 HydrophobicContact CB-CB 4.13Å; V294-A565 HydrophobicContact CG2-CB 3.7Å; A565-S577 WeakPolarHBondContact O-CA 3.32Å; A565-G578 PolarHBondContact N-O 2.95Å; A565-G578 PolarHBondContact O-N 3.06Å
566	L	94	Very high	88.2	Confident	3 Å²	3	47.5 Å²	47.5	2%	0.016	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	124.2	174.2	-168.1	66.8	0	0	0	107.5	R523 L525 L534 I542 L563 L575 I576	R523-L566 HydrophobicContact CB-CB 4.13Å; L525-L566 HydrophobicContact CD1-CB 4.13Å; L525-L566 HydrophobicContact CD1-CD2 4Å; L525-L566 HydrophobicContact CD1-CG 3.64Å; L525-L566 WeakPolarHBondContact CD1-O 3.38Å; L525-L566 HydrophobicContact CG-CB 4.5Å; L525-L566 HydrophobicContact CG-CD2 4.23Å; L525-L566 HydrophobicContact CG-CG 4.26Å; L534-L566 HydrophobicContact CB-CD2 4.04Å; I542-L566 HydrophobicContact CD1-CD1 3.8Å; I542-L566 HydrophobicContact CG1-CD1 4.42Å; L563-L566 HydrophobicContact CD2-CB 4.26Å; L563-L566 HydrophobicContact CD2-CD1 4.24Å; L563-L566 HydrophobicContact CD2-CD2 4.47Å; L566-L575 HydrophobicContact CD1-CD1 3.74Å; L566-L575 HydrophobicContact CD1-CD2 4.11Å; L566-L575 HydrophobicContact CD1-CG 4.01Å; L566-L575 HydrophobicContact CG-CD1 4.02Å; L566-I576 WeakPolarHBondContact CA-O 3.16Å
567	E	92.7	Very high	88.3	Confident	28 Å²	28	46.1 Å²	46.1	13%	0.131	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	143.6	175.5	-177.6	161.8	142	0	0	112.8	V294 A295 S296 I576	V294-E567 WeakPolarHBondContact O-CB 3.49Å; A295-E567 WeakPolarHBondContact CA-OE2 3.34Å; S296-E567 PolarHBondContact N-OE1 2.98Å; S296-E567 PolarHBondContact OG-OE1 3.49Å; E567-I576 PolarHBondContact N-O 3.34Å; E567-I576 PolarHBondContact O-N 3.2Å
568	F	90.7	Very high	88.5	Confident	20 Å²	20	37.7 Å²	37.7	9%	0.088	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	141.8	168	-76.7	-71.6	0	0	0	111.7	F10 S296 L525 F526 N527 L534 L575	F10-F568 HydrophobicContact CE1-CE1 4.19Å; F10-F568 AromaticContact CZ-CE1 3.9Å; F10-F568 HydrophobicContact CZ-CE1 3.9Å; F10-F568 HydrophobicContact CZ-CZ 4.31Å; S296-F568 PolarHBondContact OG-O 3.33Å; S296-F568 VanDerWaalsContact OG-O 3.04Å; L525-F568 HydrophobicContact CB-CD2 4.26Å; L525-F568 HydrophobicContact CB-CE2 4.06Å; L525-F568 HydrophobicContact CD1-CD2 3.88Å; L525-F568 HydrophobicContact CD1-CE2 4.18Å; F526-F568 WeakPolarHBondContact O-CE2 3.36Å; N527-F568 HydrophobicContact CB-CE2 4.39Å; N527-F568 HydrophobicContact CB-CZ 4.27Å; L534-F568 HydrophobicContact CD1-CE1 3.95Å; L534-F568 HydrophobicContact CD1-CE2 3.84Å; L534-F568 HydrophobicContact CD1-CZ 3.27Å; L534-F568 HydrophobicContact CG-CZ 4.15Å; F568-L575 HydrophobicContact CD1-CB 4.18Å; F568-L575 HydrophobicContact CD1-CD1 3.95Å; F568-L575 HydrophobicContact CE1-CB 4.22Å; F568-L575 HydrophobicContact CE1-CD1 3.94Å; F568-L575 HydrophobicContact CG-CD1 4.25Å; F568-L575 HydrophobicContact CZ-CD1 4.24Å
569	S	86	Confident	88.8	Confident	5 Å²	5	37 Å²	37	4%	0.035	17%	0.171	C	C	.	.			trans	-64.1	158.3	165.6	-177.2	0	0	0	0	111.5	D299 K571 D572 N574	D299-S569 PolarHBondContact OD1-OG 2.77Å; S569-K571 VanDerWaalsContact C-N 3.27Å; S569-K571 PolarHBondContact O-N 3.46Å; S569-K571 VanDerWaalsContact O-N 3.16Å; S569-D572 WeakPolarHBondContact O-CA 3.39Å; S569-D572 PolarHBondContact O-N 2.93Å; S569-N574 VanDerWaalsContact CB-O 3.26Å; S569-N574 WeakPolarHBondContact CB-O 3.49Å; S569-N574 PolarHBondContact N-O 3.02Å
570	K	78.6	Confident	88.9	Confident	49 Å²	49	39.9 Å²	39.9	21%	0.213	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-33.7	-173.9	-72.2	-173	170.2	178.6	0	114.2	L297 P337 S340 T341 Q528	L297-K570 WeakPolarHBondContact O-CE 3.49Å; L297-K570 PolarHBondContact O-NZ 3.36Å; P337-K570 PolarHBondContact O-NZ 2.87Å; S340-K570 VanDerWaalsContact C-NZ 3.32Å; S340-K570 PolarHBondContact O-NZ 3.17Å; T341-K570 HydrophobicContact CG2-CD 4.38Å; Q528-K570 PolarHBondContact NE2-O 3.28Å
571	K	72.5	Confident	89	Confident	133 Å²	133	33.5 Å²	33.5	58%	0.578	16%	0.156	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.9	8.1	174.8	-70.1	-169.9	-172.2	132.4	0	114.6	D299 S569 K573	D299-K571 PolarHBondContact OD1-N 3.17Å; D299-K571 WeakPolarHBondContact OD2-CD 3.34Å; D299-K571 WeakPolarHBondContact OD2-CE 3.49Å; D299-K571 WeakPolarHBondContact OD2-CG 3.27Å; D299-K571 IonicContact OD2-NZ 3.96Å; D299-K571 PolarHBondContact OD2-NZ 3.37Å; S569-K571 VanDerWaalsContact C-N 3.27Å; S569-K571 PolarHBondContact O-N 3.46Å; S569-K571 VanDerWaalsContact O-N 3.16Å; K571-K573 HydrophobicContact CB-CG 4.31Å; K571-K573 PolarHBondContact O-N 2.8Å
572	D	69.4	Low	88.9	Confident	21 Å²	21	32.7 Å²	32.7	11%	0.112	15%	0.148	C	C	.	.	S	Bend	trans	57.8	3.5	-176.6	-91.2	22	0	0	0	116.3	N527 Q528 S569 N574	N527-D572 PolarHBondContact OD1-OD2 3.39Å; Q528-D572 WeakPolarHBondContact CA-OD2 3.35Å; Q528-D572 WeakPolarHBondContact CB-OD2 3.43Å; Q528-D572 HydrophobicContact CG-CB 4.44Å; Q528-D572 VanDerWaalsContact CG-OD1 3.25Å; Q528-D572 WeakPolarHBondContact CG-OD1 3.26Å; Q528-D572 WeakPolarHBondContact CG-OD2 3.45Å; Q528-D572 PolarHBondContact N-OD2 3.06Å; Q528-D572 PolarHBondContact NE2-OD1 2.92Å; S569-D572 WeakPolarHBondContact O-CA 3.39Å; S569-D572 PolarHBondContact O-N 2.93Å; D572-N574 VanDerWaalsContact C-N 3.33Å
573	K	78.4	Confident	88.8	Confident	136 Å²	136	29.5 Å²	29.5	59%	0.591	13%	0.134	S	C	*	.	S	Bend	trans	-70.9	-33.2	179.2	-66	-170.5	176.5	-170.2	0	112.6	K571 K588 D589	K571-K573 HydrophobicContact CB-CG 4.31Å; K571-K573 PolarHBondContact O-N 2.8Å; K573-K588 WeakPolarHBondContact O-CA 3.23Å; K573-D589 PolarHBondContact O-N 2.8Å
574	N	87.8	Confident	88.7	Confident	31 Å²	31	29.5 Å²	29.5	17%	0.166	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	136.9	-175.6	-60.5	-8.4	0	0	0	109.9	S569 D572 I586 W587	S569-N574 VanDerWaalsContact CB-O 3.26Å; S569-N574 WeakPolarHBondContact CB-O 3.49Å; S569-N574 PolarHBondContact N-O 3.02Å; D572-N574 VanDerWaalsContact C-N 3.33Å; N574-I586 HydrophobicContact CB-CG2 4.13Å; N574-W587 CarbonylContact C-O 3.57Å; N574-W587 WeakPolarHBondContact CA-O 3.25Å
575	L	90.7	Very high	88.6	Confident	2 Å²	2	26.7 Å²	26.7	1%	0.01	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	138.5	169.7	171	78.4	0	0	0	107.3	F10 L525 L534 L566 F568 I586 W587	F10-L575 HydrophobicContact CD1-CB 4.46Å; F10-L575 HydrophobicContact CE1-CB 4.39Å; L525-L575 HydrophobicContact CD1-CD1 4.13Å; L534-L575 HydrophobicContact CD1-CD1 3.64Å; L534-L575 HydrophobicContact CD1-CD2 3.64Å; L534-L575 HydrophobicContact CD1-CG 4.27Å; L566-L575 HydrophobicContact CD1-CD1 3.74Å; L566-L575 HydrophobicContact CD1-CD2 4.11Å; L566-L575 HydrophobicContact CD1-CG 4.01Å; L566-L575 HydrophobicContact CG-CD1 4.02Å; F568-L575 HydrophobicContact CD1-CB 4.18Å; F568-L575 HydrophobicContact CD1-CD1 3.95Å; F568-L575 HydrophobicContact CE1-CB 4.22Å; F568-L575 HydrophobicContact CE1-CD1 3.94Å; F568-L575 HydrophobicContact CG-CD1 4.25Å; F568-L575 HydrophobicContact CZ-CD1 4.24Å; L575-I586 CarbonylContact O-C 3.55Å; L575-I586 WeakPolarHBondContact O-CA 3.45Å; L575-W587 HydrophobicContact CB-CB 4.12Å; L575-W587 HydrophobicContact CD2-CB 4.45Å; L575-W587 HydrophobicContact CD2-CG 4.28Å; L575-W587 PolarHBondContact N-O 2.88Å; L575-W587 PolarHBondContact O-N 2.76Å
576	I	93.6	Very high	88.5	Confident	5 Å²	5	26.8 Å²	26.8	3%	0.026	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	130.3	178.9	-48.9	172.8	0	0	0	108	V294 F302 L566 E567 L585	V294-I576 HydrophobicContact CG1-CB 4.06Å; V294-I576 HydrophobicContact CG1-CD1 4.34Å; V294-I576 HydrophobicContact CG1-CG2 3.72Å; F302-I576 HydrophobicContact CB-CD1 3.64Å; F302-I576 HydrophobicContact CD1-CD1 4.15Å; F302-I576 HydrophobicContact CD2-CD1 4.23Å; F302-I576 HydrophobicContact CD2-CG2 4.44Å; F302-I576 HydrophobicContact CE2-CG2 4.46Å; F302-I576 HydrophobicContact CG-CD1 3.76Å; L566-I576 WeakPolarHBondContact CA-O 3.16Å; E567-I576 PolarHBondContact N-O 3.34Å; E567-I576 PolarHBondContact O-N 3.2Å; I576-L585 WeakPolarHBondContact CA-O 3.24Å
577	S	94.5	Very high	88.4	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	145.3	177.2	70.4	0	0	0	0	111.1	H559 A565 L584 L585 W587	H559-S577 WeakPolarHBondContact NE2-CB 3.25Å; H559-S577 PolarHBondContact NE2-OG 2.73Å; A565-S577 WeakPolarHBondContact O-CA 3.32Å; S577-L584 WeakPolarHBondContact O-CA 2.95Å; S577-L585 PolarHBondContact N-O 3.01Å; S577-L585 PolarHBondContact O-N 2.75Å; S577-L585 WeakPolarHBondContact OG-CB 3.42Å; S577-W587 PolarHBondContact OG-NE1 3.31Å
578	G	94.5	Very high	88.2	Confident	0 Å²	0	29.7 Å²	29.7	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	139	178.5	0	0	0	0	0	112	L563 W564 A565 A583	L563-G578 WeakPolarHBondContact CD1-O 3.39Å; W564-G578 PolarHBondContact N-O 3.39Å; A565-G578 PolarHBondContact N-O 2.95Å; A565-G578 PolarHBondContact O-N 3.06Å; G578-A583 WeakPolarHBondContact CA-O 3.46Å
579	G	92.5	Very high	87.9	Confident	0 Å²	0	30.6 Å²	30.6	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	-178.8	-172.1	0	0	0	0	0	115.6	V291 K562 D581 G582 A583	V291-G579 PolarHBondContact N-O 3.08Å; V291-G579 VanDerWaalsContact N-O 3.09Å; K562-G579 CarbonylContact O-C 3.56Å; K562-G579 VanDerWaalsContact O-CA 3.3Å; K562-G579 WeakPolarHBondContact O-CA 3.08Å; G579-D581 VanDerWaalsContact C-N 3.26Å; G579-G582 PolarHBondContact O-N 2.92Å; G579-A583 PolarHBondContact N-O 3.05Å
580	E	93.5	Very high	87.8	Confident	73 Å²	73	31.5 Å²	31.5	34%	0.341	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-24.5	172.9	-172.1	168.7	-156.5	0	0	113	I290 K562 G582	I290-E580 HydrophobicContact CD1-CG 4.27Å; I290-E580 HydrophobicContact CG1-CG 4.15Å; K562-E580 HydrophobicContact CB-CB 4.24Å; K562-E580 WeakPolarHBondContact CB-OE2 3.31Å; K562-E580 WeakPolarHBondContact CD-OE2 3.42Å; K562-E580 WeakPolarHBondContact CG-OE2 3.4Å; K562-E580 PolarHBondContact N-OE2 3.05Å; K562-E580 VanDerWaalsContact NZ-CD 3.26Å; K562-E580 IonicContact NZ-OE1 3.42Å; K562-E580 PolarHBondContact NZ-OE1 2.94Å; K562-E580 IonicContact NZ-OE2 2.66Å; K562-E580 PolarHBondContact NZ-OE2 2.8Å; K562-E580 PolarHBondContact O-N 2.98Å; E580-G582 PolarHBondContact O-N 2.63Å
581	D	90.3	Very high	87.7	Confident	45 Å²	45	29.9 Å²	29.9	24%	0.241	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-9.3	172.8	60.4	-3.1	0	0	0	113.7	P18 H559 E560 G579 A583	P18-D581 WeakPolarHBondContact CG-O 3.35Å; H559-D581 WeakPolarHBondContact CA-OD2 3.21Å; H559-D581 WeakPolarHBondContact CB-OD2 3.14Å; H559-D581 IonicContact CG-OD1 3.07Å; H559-D581 IonicContact CG-OD2 3.8Å; H559-D581 IonicContact ND1-OD1 3.64Å; H559-D581 PolarHBondContact ND1-OD1 2.83Å; H559-D581 IonicContact ND1-OD2 3.54Å; H559-D581 PolarHBondContact ND1-OD2 3.27Å; H559-D581 VanDerWaalsContact ND1-OD2 3.15Å; E560-D581 PolarHBondContact N-OD2 2.95Å; G579-D581 VanDerWaalsContact C-N 3.26Å; D581-A583 PolarHBondContact O-N 3.46Å; D581-A583 WeakPolarHBondContact OD1-CB 3.43Å; D581-A583 PolarHBondContact OD1-N 3.45Å; D581-A583 WeakPolarHBondContact OD2-CB 3.3Å
582	G	89.8	Confident	87.9	Confident	1 Å²	1	30 Å²	30	1%	0.01	14%	0.144	C	C	.	.			trans	71.5	9.6	-175.2	0	0	0	0	0	114.5	N288 S289 G579 E580	N288-G582 WeakPolarHBondContact CB-O 3.22Å; N288-G582 PolarHBondContact ND2-O 2.78Å; S289-G582 WeakPolarHBondContact O-CA 3.45Å; G579-G582 PolarHBondContact O-N 2.92Å; E580-G582 PolarHBondContact O-N 2.63Å
583	A	91.2	Very high	88.4	Confident	1 Å²	1	32.9 Å²	32.9	1%	0.008	16%	0.16	C	C	.	.			trans	-75.4	138.4	171.6	0	0	0	0	0	110.2	F16 L17 H559 G578 G579 D581	F16-A583 WeakPolarHBondContact O-CA 3.33Å; L17-A583 HydrophobicContact CD2-CB 3.52Å; H559-A583 PolarHBondContact CE1-O 3.37Å; G578-A583 WeakPolarHBondContact CA-O 3.46Å; G579-A583 PolarHBondContact N-O 3.05Å; D581-A583 PolarHBondContact O-N 3.46Å; D581-A583 WeakPolarHBondContact OD1-CB 3.43Å; D581-A583 PolarHBondContact OD1-N 3.45Å; D581-A583 WeakPolarHBondContact OD2-CB 3.3Å
584	L	93	Very high	88.6	Confident	0 Å²	0	28.1 Å²	28.1	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	118.4	167	-69.9	161.4	0	0	0	108.2	F16 V291 V294 F302 V304 Y314 S577	F16-L584 HydrophobicContact CB-CB 4.15Å; F16-L584 HydrophobicContact CD2-CB 4.35Å; F16-L584 PolarHBondContact N-O 3.08Å; F16-L584 PolarHBondContact O-N 3.36Å; V291-L584 HydrophobicContact CB-CD2 4.42Å; V291-L584 HydrophobicContact CG1-CD2 3.9Å; V291-L584 HydrophobicContact CG2-CD2 3.78Å; V291-L584 HydrophobicContact CG2-CG 4Å; V294-L584 HydrophobicContact CG2-CD2 3.94Å; F302-L584 HydrophobicContact CE2-CD1 4.37Å; V304-L584 HydrophobicContact CG1-CD1 4.2Å; V304-L584 HydrophobicContact CG1-CD2 3.92Å; V304-L584 HydrophobicContact CG2-CD1 3.9Å; V304-L584 HydrophobicContact CG2-CD2 4.02Å; Y314-L584 HydrophobicContact CD2-CD1 4.31Å; Y314-L584 HydrophobicContact CE2-CD1 3.75Å; S577-L584 WeakPolarHBondContact O-CA 2.95Å
585	L	93.4	Very high	88.2	Confident	8 Å²	8	28.3 Å²	28.3	4%	0.042	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	133.7	-178.8	-58.2	175.1	0	0	0	110.1	V12 R15 A558 I576 S577 W587	V12-L585 HydrophobicContact CG1-CD2 4.3Å; R15-L585 HydrophobicContact CB-CD2 3.96Å; R15-L585 HydrophobicContact CG-CD2 3.65Å; A558-L585 HydrophobicContact CB-CD1 4.2Å; A558-L585 WeakPolarHBondContact O-CD1 3.3Å; I576-L585 WeakPolarHBondContact CA-O 3.24Å; S577-L585 PolarHBondContact N-O 3.01Å; S577-L585 PolarHBondContact O-N 2.75Å; S577-L585 WeakPolarHBondContact OG-CB 3.42Å; L585-W587 HydrophobicContact CB-CZ2 4.23Å; L585-W587 HydrophobicContact CD1-CH2 4.49Å; L585-W587 HydrophobicContact CD1-CZ2 3.62Å
586	I	92.3	Very high	88	Confident	1 Å²	1	33.6 Å²	33.6	1%	0.005	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	123.3	172.2	-53.8	-177.8	0	0	0	107.3	T13 H14 F16 F302 V316 N574 L575	T13-I586 PolarHBondContact N-O 2.9Å; T13-I586 PolarHBondContact OG1-O 2.82Å; T13-I586 VanDerWaalsContact OG1-O 3.06Å; H14-I586 HydrophobicContact CB-CB 4.09Å; H14-I586 HydrophobicContact CB-CD1 4.23Å; H14-I586 HydrophobicContact CB-CG1 4.32Å; H14-I586 PolarHBondContact N-O 2.82Å; H14-I586 PolarHBondContact O-N 3.08Å; F16-I586 HydrophobicContact CE2-CD1 3.81Å; F16-I586 HydrophobicContact CE2-CG1 4.43Å; F302-I586 HydrophobicContact CD1-CD1 4.49Å; F302-I586 HydrophobicContact CE1-CD1 3.74Å; F302-I586 HydrophobicContact CZ-CD1 4.15Å; V316-I586 HydrophobicContact CB-CD1 4.17Å; V316-I586 HydrophobicContact CG1-CD1 3.71Å; V316-I586 HydrophobicContact CG2-CD1 3.97Å; N574-I586 HydrophobicContact CB-CG2 4.13Å; L575-I586 CarbonylContact O-C 3.55Å; L575-I586 WeakPolarHBondContact O-CA 3.45Å
587	W	90.9	Very high	87.7	Confident	12 Å²	12	38.2 Å²	38.2	5%	0.045	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	133.7	-179.5	-47.4	73.2	0	0	0	108.7	F10 A11 V12 I542 Y556 A558 N574 L575 S577 L585	F10-W587 HydrophobicContact CB-CB 4.14Å; F10-W587 HydrophobicContact CB-CE3 4.25Å; F10-W587 HydrophobicContact CD1-CB 4.49Å; A11-W587 CarbonylContact O-C 3.56Å; A11-W587 VanDerWaalsContact O-CA 3.26Å; A11-W587 WeakPolarHBondContact O-CA 3.32Å; V12-W587 HydrophobicContact CB-CE3 4.43Å; V12-W587 HydrophobicContact CG2-CD2 3.83Å; V12-W587 HydrophobicContact CG2-CE3 3.41Å; V12-W587 VanDerWaalsContact CG2-CE3 3.41Å; V12-W587 HydrophobicContact CG2-CH2 3.44Å; V12-W587 VanDerWaalsContact CG2-CH2 3.44Å; V12-W587 HydrophobicContact CG2-CZ2 3.85Å; V12-W587 HydrophobicContact CG2-CZ3 3.22Å; I542-W587 HydrophobicContact CD1-CZ2 4.36Å; Y556-W587 HydrophobicContact CD1-CZ3 4.03Å; Y556-W587 HydrophobicContact CG-CZ3 4.3Å; A558-W587 HydrophobicContact CB-CH2 3.99Å; A558-W587 HydrophobicContact CB-CZ2 3.43Å; A558-W587 VanDerWaalsContact CB-CZ2 3.43Å; N574-W587 CarbonylContact C-O 3.57Å; N574-W587 WeakPolarHBondContact CA-O 3.25Å; L575-W587 HydrophobicContact CB-CB 4.12Å; L575-W587 HydrophobicContact CD2-CB 4.45Å; L575-W587 HydrophobicContact CD2-CG 4.28Å; L575-W587 PolarHBondContact N-O 2.88Å; L575-W587 PolarHBondContact O-N 2.76Å; S577-W587 PolarHBondContact OG-NE1 3.31Å; L585-W587 HydrophobicContact CB-CZ2 4.23Å; L585-W587 HydrophobicContact CD1-CH2 4.49Å; L585-W587 HydrophobicContact CD1-CZ2 3.62Å
588	K	88.9	Confident	87.2	Confident	81 Å²	81	44.2 Å²	44.2	35%	0.352	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	140.8	171.6	-176	-171.8	173.3	-152.1	0	109.6	F10 A11 T13 K573 V590 D593	F10-K588 WeakPolarHBondContact CA-O 3.26Å; A11-K588 PolarHBondContact N-O 3.25Å; A11-K588 PolarHBondContact O-N 2.8Å; T13-K588 HydrophobicContact CG2-CB 3.3Å; T13-K588 HydrophobicContact CG2-CD 4.06Å; T13-K588 HydrophobicContact CG2-CG 4.3Å; K573-K588 WeakPolarHBondContact O-CA 3.23Å; K588-V590 PolarHBondContact O-N 3.42Å; K588-D593 IonicContact NZ-OD2 3.69Å
589	D	83.9	Confident	86.9	Confident	38 Å²	38	48 Å²	48	20%	0.203	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	113.9	167.8	-170.2	-14.3	0	0	0	109.7	L8 F10 K573 T591	L8-D589 WeakPolarHBondContact CD2-OD2 3.46Å; F10-D589 HydrophobicContact CD1-CB 4.26Å; F10-D589 HydrophobicContact CE1-CB 4.03Å; K573-D589 PolarHBondContact O-N 2.8Å; D589-T591 WeakPolarHBondContact OD1-CB 3.39Å; D589-T591 WeakPolarHBondContact OD1-CG2 3.25Å; D589-T591 PolarHBondContact OD1-N 3.3Å; D589-T591 PolarHBondContact OD1-OG1 2.83Å
590	V	83.6	Confident	86.9	Confident	25 Å²	25	53.9 Å²	53.9	15%	0.152	26%	0.26	C	S	.	.			trans	-107.7	14.1	-179.3	-69.5	0	0	0	0	112.4	E9 A11 K588 E592 D593 I594	E9-V590 HydrophobicContact CB-CG2 4.22Å; E9-V590 VanDerWaalsContact O-CG2 3.23Å; E9-V590 WeakPolarHBondContact O-CG2 3.32Å; E9-V590 PolarHBondContact O-N 3.24Å; A11-V590 HydrophobicContact CB-CB 4.4Å; A11-V590 HydrophobicContact CB-CG1 3.76Å; A11-V590 HydrophobicContact CB-CG2 3.73Å; K588-V590 PolarHBondContact O-N 3.42Å; V590-E592 PolarHBondContact O-N 2.91Å; V590-D593 PolarHBondContact O-N 2.78Å; V590-I594 HydrophobicContact CB-CD1 4.25Å; V590-I594 HydrophobicContact CB-CG1 4.49Å; V590-I594 HydrophobicContact CG2-CD1 3.66Å; V590-I594 HydrophobicContact CG2-CG1 4.41Å; V590-I594 WeakPolarHBondContact O-CB 3.39Å; V590-I594 VanDerWaalsContact O-CG1 3.28Å; V590-I594 WeakPolarHBondContact O-CG1 3.19Å; V590-I594 PolarHBondContact O-N 3.1Å
591	T	78.2	Confident	86.7	Confident	14 Å²	14	56.2 Å²	56.2	9%	0.086	27%	0.27	C	S	.	.	H	α-helix	trans	-60.1	-46.2	-176.1	49.5	0	0	0	0	113.4	L8 E9 D589 A595	L8-T591 HydrophobicContact CB-CG2 4.2Å; L8-T591 HydrophobicContact CD2-CG2 3.82Å; E9-T591 HydrophobicContact CB-CG2 4.02Å; E9-T591 HydrophobicContact CG-CG2 4.44Å; D589-T591 WeakPolarHBondContact OD1-CB 3.39Å; D589-T591 WeakPolarHBondContact OD1-CG2 3.25Å; D589-T591 PolarHBondContact OD1-N 3.3Å; D589-T591 PolarHBondContact OD1-OG1 2.83Å; T591-A595 VanDerWaalsContact O-CB 3.3Å; T591-A595 WeakPolarHBondContact O-CB 3.13Å; T591-A595 PolarHBondContact O-N 3.44Å
592	E	76.1	Confident	86.6	Confident	135 Å²	135	61.2 Å²	61.2	63%	0.631	29%	0.285	S	S	*	.	H	α-helix	trans	-66.1	-42.9	-179.7	-60.1	-169.2	151	0	0	110.6	V590 I594 A595 I596	V590-E592 PolarHBondContact O-N 2.91Å; E592-I594 PolarHBondContact O-N 2.87Å; E592-A595 PolarHBondContact O-N 3.1Å; E592-I596 WeakPolarHBondContact O-CD1 3.43Å; E592-I596 WeakPolarHBondContact O-CG1 3.27Å; E592-I596 PolarHBondContact O-N 2.9Å
593	D	80.5	Confident	86.7	Confident	83 Å²	83	65.8 Å²	65.8	44%	0.444	31%	0.306	S	S	.	.	H	α-helix	trans	-62	-46.6	179.8	-65.9	-26.8	0	0	0	111	K588 V590 A595 I596 E597	K588-D593 IonicContact NZ-OD2 3.69Å; V590-D593 PolarHBondContact O-N 2.78Å; D593-A595 PolarHBondContact O-N 2.95Å; D593-I596 PolarHBondContact O-N 3.15Å; D593-E597 PolarHBondContact O-N 2.99Å
594	I	81.7	Confident	86.7	Confident	36 Å²	36	69.6 Å²	69.6	19%	0.185	32%	0.324	C	S	.	.	H	α-helix	trans	-66.7	-38.4	177.8	-67.5	172.4	0	0	0	111.3	E9 V590 E592 I596 E597 R598	E9-I594 HydrophobicContact CB-CD1 4.15Å; E9-I594 HydrophobicContact CG-CD1 4.47Å; E9-I594 WeakPolarHBondContact OE2-CD1 3.45Å; V590-I594 HydrophobicContact CB-CD1 4.25Å; V590-I594 HydrophobicContact CB-CG1 4.49Å; V590-I594 HydrophobicContact CG2-CD1 3.66Å; V590-I594 HydrophobicContact CG2-CG1 4.41Å; V590-I594 WeakPolarHBondContact O-CB 3.39Å; V590-I594 VanDerWaalsContact O-CG1 3.28Å; V590-I594 WeakPolarHBondContact O-CG1 3.19Å; V590-I594 PolarHBondContact O-N 3.1Å; E592-I594 PolarHBondContact O-N 2.87Å; I594-I596 VanDerWaalsContact C-N 3.34Å; I594-E597 PolarHBondContact O-N 3.22Å; I594-R598 HydrophobicContact CG2-CG 4.43Å; I594-R598 VanDerWaalsContact CG2-NH2 3.34Å; I594-R598 WeakPolarHBondContact O-CB 3.35Å; I594-R598 VanDerWaalsContact O-CG 3.31Å; I594-R598 WeakPolarHBondContact O-CG 3.33Å; I594-R598 PolarHBondContact O-N 2.99Å
595	A	80.3	Confident	86.4	Confident	34 Å²	34	71.2 Å²	71.2	28%	0.281	34%	0.337	S	S	.	.	H	α-helix	trans	-62.4	-42.4	176.1	0	0	0	0	0	111.7	V6 T591 E592 D593 E599	V6-A595 HydrophobicContact CG1-CB 4.36Å; V6-A595 HydrophobicContact CG2-CB 3.96Å; T591-A595 VanDerWaalsContact O-CB 3.3Å; T591-A595 WeakPolarHBondContact O-CB 3.13Å; T591-A595 PolarHBondContact O-N 3.44Å; E592-A595 PolarHBondContact O-N 3.1Å; D593-A595 PolarHBondContact O-N 2.95Å; A595-E599 WeakPolarHBondContact O-CB 3.38Å; A595-E599 PolarHBondContact O-N 3.36Å
596	I	85.6	Confident	86.4	Confident	114 Å²	114	74.3 Å²	74.3	59%	0.585	35%	0.353	S	S	*	.	H	α-helix	trans	-64.9	-44.1	177.4	-67.7	162	0	0	0	110.6	E592 D593 I594 E599 K600	E592-I596 WeakPolarHBondContact O-CD1 3.43Å; E592-I596 WeakPolarHBondContact O-CG1 3.27Å; E592-I596 PolarHBondContact O-N 2.9Å; D593-I596 PolarHBondContact O-N 3.15Å; I594-I596 VanDerWaalsContact C-N 3.34Å; I596-E599 PolarHBondContact O-N 3.45Å; I596-K600 WeakPolarHBondContact O-CB 3.38Å; I596-K600 PolarHBondContact O-N 3.03Å
597	E	86.6	Confident	86.3	Confident	101 Å²	101	79.6 Å²	79.6	47%	0.472	38%	0.377	S	S	.	.	H	α-helix	trans	-64.6	-42.4	179.3	-165.5	-169.2	162.5	0	0	112.2	D593 I594 E599 K600 K601	D593-E597 PolarHBondContact O-N 2.99Å; I594-E597 PolarHBondContact O-N 3.22Å; E597-E599 VanDerWaalsContact C-N 3.35Å; E597-K600 PolarHBondContact O-N 2.65Å; E597-K601 WeakPolarHBondContact O-CG 3.48Å; E597-K601 PolarHBondContact O-N 3.46Å; E597-K601 WeakPolarHBondContact OE1-CE 3.41Å; E597-K601 IonicContact OE1-NZ 2.77Å; E597-K601 PolarHBondContact OE1-NZ 3.17Å
598	R	84.5	Confident	86.2	Confident	127 Å²	127	83.1 Å²	83.1	48%	0.479	39%	0.394	S	S	.	.	H	α-helix	trans	-62.1	-43.6	175.8	-73.3	176.8	-171.8	161	9	111.4	E9 I594 K601 R602	E9-R598 IonicContact OE1-NH2 3.34Å; E9-R598 PolarHBondContact OE1-NH2 2.89Å; E9-R598 VanDerWaalsContact OE1-NH2 3.08Å; I594-R598 HydrophobicContact CG2-CG 4.43Å; I594-R598 VanDerWaalsContact CG2-NH2 3.34Å; I594-R598 WeakPolarHBondContact O-CB 3.35Å; I594-R598 VanDerWaalsContact O-CG 3.31Å; I594-R598 WeakPolarHBondContact O-CG 3.33Å; I594-R598 PolarHBondContact O-N 2.99Å; R598-K601 PolarHBondContact O-N 3.11Å; R598-R602 WeakPolarHBondContact O-CB 3.39Å; R598-R602 PolarHBondContact O-N 2.9Å
599	E	87.9	Confident	86.1	Confident	80 Å²	80	82.5 Å²	82.5	37%	0.374	40%	0.395	S	S	.	.	H	α-helix	trans	-65.6	-40.1	177.7	-176.2	56.9	-156.7	0	0	111.4	A595 I596 E597 R602 Q603	A595-E599 WeakPolarHBondContact O-CB 3.38Å; A595-E599 PolarHBondContact O-N 3.36Å; I596-E599 PolarHBondContact O-N 3.45Å; E597-E599 VanDerWaalsContact C-N 3.35Å; E599-R602 WeakPolarHBondContact O-CB 3.39Å; E599-R602 PolarHBondContact O-N 2.62Å; E599-Q603 VanDerWaalsContact O-CG 3.3Å; E599-Q603 WeakPolarHBondContact O-CG 3.38Å; E599-Q603 PolarHBondContact O-N 3.41Å; E599-Q603 PolarHBondContact OE1-NE2 2.76Å
600	K	92.1	Very high	86.5	Confident	123 Å²	123	86 Å²	86	54%	0.535	41%	0.41	S	S	.	.	H	α-helix	trans	-60.5	-50.1	174.7	-174.1	-176.3	175.9	-170.8	0	112.1	I596 E597 R602 Q603 E604	I596-K600 WeakPolarHBondContact O-CB 3.38Å; I596-K600 PolarHBondContact O-N 3.03Å; E597-K600 PolarHBondContact O-N 2.65Å; K600-R602 VanDerWaalsContact C-N 3.25Å; K600-R602 PolarHBondContact O-N 2.82Å; K600-Q603 PolarHBondContact O-N 3.41Å; K600-Q603 VanDerWaalsContact O-N 3.11Å; K600-E604 WeakPolarHBondContact CE-OE1 3.23Å; K600-E604 WeakPolarHBondContact O-CG 3.48Å; K600-E604 PolarHBondContact O-N 3.04Å
601	K	89	Confident	86.8	Confident	122 Å²	122	88 Å²	88	53%	0.53	42%	0.422	S	S	.	.	H	α-helix	trans	-59.2	-38.4	176.6	-73.4	176.9	-176.2	166.9	0	111.7	E597 R598 A605	E597-K601 WeakPolarHBondContact O-CG 3.48Å; E597-K601 PolarHBondContact O-N 3.46Å; E597-K601 WeakPolarHBondContact OE1-CE 3.41Å; E597-K601 IonicContact OE1-NZ 2.77Å; E597-K601 PolarHBondContact OE1-NZ 3.17Å; R598-K601 PolarHBondContact O-N 3.11Å; K601-A605 WeakPolarHBondContact O-CB 3.37Å; K601-A605 PolarHBondContact O-N 2.79Å
602	R	89.4	Confident	87.4	Confident	150 Å²	150	87.9 Å²	87.9	57%	0.566	42%	0.421	S	S	*	.	H	α-helix	trans	-64.9	-44	175.2	-173.6	-175.6	-176.8	179.6	4	111.6	R598 E599 K600 A605 I606	R598-R602 WeakPolarHBondContact O-CB 3.39Å; R598-R602 PolarHBondContact O-N 2.9Å; E599-R602 WeakPolarHBondContact O-CB 3.39Å; E599-R602 PolarHBondContact O-N 2.62Å; K600-R602 VanDerWaalsContact C-N 3.25Å; K600-R602 PolarHBondContact O-N 2.82Å; R602-A605 PolarHBondContact O-N 3.19Å; R602-I606 HydrophobicContact CG-CD1 3.93Å; R602-I606 VanDerWaalsContact O-CG1 3.24Å; R602-I606 WeakPolarHBondContact O-CG1 3.43Å; R602-I606 PolarHBondContact O-N 3Å
603	Q	91.7	Very high	88	Confident	96 Å²	96	84.1 Å²	84.1	45%	0.449	41%	0.41	S	S	.	.	H	α-helix	trans	-64	-42.3	177.4	-73.5	175.9	10.8	0	0	111.7	E599 K600 A605 I606 Q607	E599-Q603 VanDerWaalsContact O-CG 3.3Å; E599-Q603 WeakPolarHBondContact O-CG 3.38Å; E599-Q603 PolarHBondContact O-N 3.41Å; E599-Q603 PolarHBondContact OE1-NE2 2.76Å; K600-Q603 PolarHBondContact O-N 3.41Å; K600-Q603 VanDerWaalsContact O-N 3.11Å; Q603-A605 PolarHBondContact O-N 3.08Å; Q603-I606 PolarHBondContact O-N 3.29Å; Q603-Q607 WeakPolarHBondContact O-CB 3.42Å; Q603-Q607 VanDerWaalsContact O-CG 3.25Å; Q603-Q607 WeakPolarHBondContact O-CG 3.22Å; Q603-Q607 PolarHBondContact O-N 3.36Å
604	E	90.9	Very high	88.6	Confident	82 Å²	82	84 Å²	84	38%	0.383	41%	0.409	S	S	.	.	H	α-helix	trans	-60.5	-44.6	174.4	-71.5	171.5	-179.7	0	0	111.5	K600 Q607 Q608	K600-E604 WeakPolarHBondContact CE-OE1 3.23Å; K600-E604 WeakPolarHBondContact O-CG 3.48Å; K600-E604 PolarHBondContact O-N 3.04Å; E604-Q607 PolarHBondContact O-N 2.99Å; E604-Q608 VanDerWaalsContact O-CG 3.31Å; E604-Q608 WeakPolarHBondContact O-CG 3.35Å; E604-Q608 PolarHBondContact O-N 3.49Å
605	A	87.6	Confident	89.1	Confident	33 Å²	33	83.4 Å²	83.4	27%	0.273	41%	0.406	S	S	.	.	H	α-helix	trans	-62.8	-42.6	175.6	0	0	0	0	0	112.2	K601 R602 Q603 Q607 Q608 D609	K601-A605 WeakPolarHBondContact O-CB 3.37Å; K601-A605 PolarHBondContact O-N 2.79Å; R602-A605 PolarHBondContact O-N 3.19Å; Q603-A605 PolarHBondContact O-N 3.08Å; A605-Q607 VanDerWaalsContact C-N 3.35Å; A605-Q608 PolarHBondContact O-N 3.38Å; A605-D609 PolarHBondContact O-N 2.66Å
606	I	91.6	Very high	89.4	Confident	73 Å²	73	82.7 Å²	82.7	37%	0.374	40%	0.397	S	S	.	.	H	α-helix	trans	-63.6	-41.6	176.1	-69.5	165.4	0	0	0	110.7	R602 Q603 D609 Q610	R602-I606 HydrophobicContact CG-CD1 3.93Å; R602-I606 VanDerWaalsContact O-CG1 3.24Å; R602-I606 WeakPolarHBondContact O-CG1 3.43Å; R602-I606 PolarHBondContact O-N 3Å; Q603-I606 PolarHBondContact O-N 3.29Å; I606-D609 PolarHBondContact O-N 3.23Å; I606-Q610 HydrophobicContact CG2-CG 4.41Å; I606-Q610 WeakPolarHBondContact O-CB 3.45Å; I606-Q610 VanDerWaalsContact O-CG 3.25Å; I606-Q610 WeakPolarHBondContact O-CG 3.4Å; I606-Q610 PolarHBondContact O-N 2.89Å
607	Q	90.8	Very high	89.5	Confident	112 Å²	112	84 Å²	84	52%	0.523	40%	0.401	S	S	.	.	H	α-helix	trans	-63.7	-41.1	176.4	-74.3	173.3	11.3	0	0	111.5	Q603 E604 A605 Q610 T611	Q603-Q607 WeakPolarHBondContact O-CB 3.42Å; Q603-Q607 VanDerWaalsContact O-CG 3.25Å; Q603-Q607 WeakPolarHBondContact O-CG 3.22Å; Q603-Q607 PolarHBondContact O-N 3.36Å; E604-Q607 PolarHBondContact O-N 2.99Å; A605-Q607 VanDerWaalsContact C-N 3.35Å; Q607-Q610 WeakPolarHBondContact O-CB 2.96Å; Q607-Q610 PolarHBondContact O-N 2.71Å; Q607-T611 WeakPolarHBondContact O-CG2 3.47Å; Q607-T611 PolarHBondContact O-N 3.42Å; Q607-T611 PolarHBondContact O-OG1 2.99Å
608	Q	89.3	Confident	89.6	Confident	86 Å²	86	84.9 Å²	84.9	40%	0.402	41%	0.405	S	S	.	.	H	α-helix	trans	-64.1	-39.7	174.9	-73	172.7	-5.4	0	0	112.2	E604 A605 Q610 T611 L612 L631	E604-Q608 VanDerWaalsContact O-CG 3.31Å; E604-Q608 WeakPolarHBondContact O-CG 3.35Å; E604-Q608 PolarHBondContact O-N 3.49Å; A605-Q608 PolarHBondContact O-N 3.38Å; Q608-Q610 VanDerWaalsContact C-N 3.34Å; Q608-T611 WeakPolarHBondContact CA-OG1 3.27Å; Q608-T611 PolarHBondContact O-N 3.47Å; Q608-T611 PolarHBondContact O-OG1 3.22Å; Q608-L612 WeakPolarHBondContact O-CB 3.41Å; Q608-L612 PolarHBondContact O-N 3.39Å; Q608-L631 HydrophobicContact CB-CD1 4.02Å; Q608-L631 HydrophobicContact CB-CD2 4.25Å; Q608-L631 HydrophobicContact CG-CD2 4.4Å
609	D	87.8	Confident	89.6	Confident	69 Å²	69	85.4 Å²	85.4	37%	0.369	41%	0.411	S	S	.	.	H	α-helix	trans	-67.9	-36.1	174.7	-73.9	-21.9	0	0	0	111.5	A605 I606 S613	A605-D609 PolarHBondContact O-N 2.66Å; I606-D609 PolarHBondContact O-N 3.23Å; D609-S613 WeakPolarHBondContact O-CB 3.31Å; D609-S613 PolarHBondContact O-N 3.01Å
610	Q	90.3	Very high	89.6	Confident	111 Å²	111	87.3 Å²	87.3	52%	0.519	42%	0.415	S	S	.	.	H	α-helix	trans	-66.1	-44.8	173.4	-75	174.7	5.9	0	0	111.9	I606 Q607 Q608 L612 S613 N614	I606-Q610 HydrophobicContact CG2-CG 4.41Å; I606-Q610 WeakPolarHBondContact O-CB 3.45Å; I606-Q610 VanDerWaalsContact O-CG 3.25Å; I606-Q610 WeakPolarHBondContact O-CG 3.4Å; I606-Q610 PolarHBondContact O-N 2.89Å; Q607-Q610 WeakPolarHBondContact O-CB 2.96Å; Q607-Q610 PolarHBondContact O-N 2.71Å; Q608-Q610 VanDerWaalsContact C-N 3.34Å; Q610-L612 VanDerWaalsContact C-N 3.33Å; Q610-L612 PolarHBondContact O-N 3.02Å; Q610-S613 PolarHBondContact O-N 3.33Å; Q610-N614 WeakPolarHBondContact O-CB 3.47Å; Q610-N614 PolarHBondContact O-N 3.22Å; Q610-N614 PolarHBondContact O-ND2 3.49Å
611	T	91.7	Very high	89.2	Confident	66 Å²	66	82.4 Å²	82.4	41%	0.405	39%	0.393	S	S	.	.	H	α-helix	trans	-63.9	-41.3	176.7	56.5	0	0	0	0	111	Q607 Q608 S613 N614 L615	Q607-T611 WeakPolarHBondContact O-CG2 3.47Å; Q607-T611 PolarHBondContact O-N 3.42Å; Q607-T611 PolarHBondContact O-OG1 2.99Å; Q608-T611 WeakPolarHBondContact CA-OG1 3.27Å; Q608-T611 PolarHBondContact O-N 3.47Å; Q608-T611 PolarHBondContact O-OG1 3.22Å; T611-S613 PolarHBondContact O-N 3.48Å; T611-N614 PolarHBondContact O-N 3.1Å; T611-L615 WeakPolarHBondContact O-CB 3.28Å; T611-L615 VanDerWaalsContact O-CG 3.28Å; T611-L615 WeakPolarHBondContact O-CG 3.36Å; T611-L615 PolarHBondContact O-N 3.14Å
612	L	90.3	Very high	88.9	Confident	13 Å²	13	79.7 Å²	79.7	7%	0.068	39%	0.387	C	S	.	.	H	α-helix	trans	-59.2	-46	173.3	-180	61.3	0	0	0	111.9	Q608 Q610 L615 M616 A624 L627 A628 A636 L640	Q608-L612 WeakPolarHBondContact O-CB 3.41Å; Q608-L612 PolarHBondContact O-N 3.39Å; Q610-L612 VanDerWaalsContact C-N 3.33Å; Q610-L612 PolarHBondContact O-N 3.02Å; L612-L615 PolarHBondContact O-N 2.92Å; L612-M616 VanDerWaalsContact O-CB 3.29Å; L612-M616 WeakPolarHBondContact O-CB 3.37Å; L612-M616 WeakPolarHBondContact O-CG 3.28Å; L612-M616 PolarHBondContact O-N 3.31Å; L612-A624 HydrophobicContact CD1-CB 4.04Å; L612-A624 VanDerWaalsContact CD1-O 3.27Å; L612-A624 WeakPolarHBondContact CD1-O 3.5Å; L612-L627 HydrophobicContact CB-CD2 3.97Å; L612-L627 HydrophobicContact CD1-CB 4.49Å; L612-L627 HydrophobicContact CD1-CD2 4.38Å; L612-A628 HydrophobicContact CD1-CB 3.96Å; L612-A628 HydrophobicContact CD2-CB 4.24Å; L612-A636 HydrophobicContact CD2-CB 3.91Å; L612-L640 HydrophobicContact CD1-CD1 4.5Å
613	S	88.5	Confident	88.8	Confident	56 Å²	56	76.8 Å²	76.8	39%	0.392	38%	0.379	S	S	.	.	H	α-helix	trans	-63.5	-40.8	176.9	-170.6	0	0	0	0	112.4	D609 Q610 T611 M616 Q617	D609-S613 WeakPolarHBondContact O-CB 3.31Å; D609-S613 PolarHBondContact O-N 3.01Å; Q610-S613 PolarHBondContact O-N 3.33Å; T611-S613 PolarHBondContact O-N 3.48Å; S613-M616 CarbonylContact O-C 3.51Å; S613-M616 VanDerWaalsContact O-CB 3.27Å; S613-M616 WeakPolarHBondContact O-CB 3.41Å; S613-M616 PolarHBondContact O-N 3.12Å; S613-Q617 WeakPolarHBondContact O-CG 3.2Å; S613-Q617 PolarHBondContact O-N 3.34Å
614	N	93.3	Very high	88.7	Confident	81 Å²	81	72.2 Å²	72.2	43%	0.433	36%	0.358	S	S	.	.	H	α-helix	trans	-65.2	-45.4	177.3	-71.1	-18.5	0	0	0	111.5	Q610 T611 M616 Q617 Q618	Q610-N614 WeakPolarHBondContact O-CB 3.47Å; Q610-N614 PolarHBondContact O-N 3.22Å; Q610-N614 PolarHBondContact O-ND2 3.49Å; T611-N614 PolarHBondContact O-N 3.1Å; N614-M616 PolarHBondContact O-N 2.99Å; N614-Q617 PolarHBondContact O-N 3.05Å; N614-Q618 WeakPolarHBondContact O-CB 3.35Å; N614-Q618 VanDerWaalsContact O-CG 3.31Å; N614-Q618 WeakPolarHBondContact O-CG 3.25Å; N614-Q618 PolarHBondContact O-N 3.13Å
615	L	91	Very high	88.6	Confident	23 Å²	23	68.7 Å²	68.7	12%	0.12	34%	0.341	C	S	.	.	H	α-helix	trans	-61.1	-37.2	174.5	-69.3	171	0	0	0	111.3	T611 L612 Q618 K619 R620 E623 A624 L627	T611-L615 WeakPolarHBondContact O-CB 3.28Å; T611-L615 VanDerWaalsContact O-CG 3.28Å; T611-L615 WeakPolarHBondContact O-CG 3.36Å; T611-L615 PolarHBondContact O-N 3.14Å; L612-L615 PolarHBondContact O-N 2.92Å; L615-Q618 PolarHBondContact O-N 3.38Å; L615-K619 PolarHBondContact O-N 3.27Å; L615-R620 HydrophobicContact CD2-CB 4.03Å; L615-R620 PolarHBondContact O-N 3.18Å; L615-E623 HydrophobicContact CD1-CB 4.2Å; L615-E623 HydrophobicContact CD2-CB 4.36Å; L615-A624 HydrophobicContact CB-CB 3.84Å; L615-L627 HydrophobicContact CD1-CD2 4.07Å
616	M	86.6	Confident	88.6	Confident	19 Å²	19	69.5 Å²	69.5	9%	0.094	34%	0.343	C	S	.	.	H	α-helix	trans	-64.6	-36.8	174.5	-89	-69.9	-105.9	0	0	113.9	L612 S613 N614 A624 D639 L640	L612-M616 VanDerWaalsContact O-CB 3.29Å; L612-M616 WeakPolarHBondContact O-CB 3.37Å; L612-M616 WeakPolarHBondContact O-CG 3.28Å; L612-M616 PolarHBondContact O-N 3.31Å; S613-M616 CarbonylContact O-C 3.51Å; S613-M616 VanDerWaalsContact O-CB 3.27Å; S613-M616 WeakPolarHBondContact O-CB 3.41Å; S613-M616 PolarHBondContact O-N 3.12Å; N614-M616 PolarHBondContact O-N 2.99Å; M616-A624 HydrophobicContact CG-CB 4.3Å; M616-D639 HydrophobicContact CE-CB 4.4Å; M616-L640 HydrophobicContact CE-CB 4.32Å; M616-L640 HydrophobicContact CE-CD2 3.97Å; M616-L640 HydrophobicContact CE-CG 3.65Å; M616-L640 HydrophobicContact CG-CD2 4.1Å; M616-L640 HydrophobicContact CG-CG 4.31Å; M616-L640 HydrophobicContact SD-CB 4.45Å; M616-L640 HydrophobicContact SD-CD1 4.46Å; M616-L640 HydrophobicContact SD-CD2 3.07Å; M616-L640 WeakPolarHBondContact SD-CD2 3.46Å; M616-L640 HydrophobicContact SD-CG 3.42Å; M616-L640 WeakPolarHBondContact SD-CG 3.31Å
617	Q	88.1	Confident	88.5	Confident	140 Å²	140	68.1 Å²	68.1	65%	0.654	34%	0.336	S	S	*	.	H	α-helix	trans	-75.9	-39	175.6	-72.3	-179.2	5.3	0	0	112.1	S613 N614 K619	S613-Q617 WeakPolarHBondContact O-CG 3.2Å; S613-Q617 PolarHBondContact O-N 3.34Å; N614-Q617 PolarHBondContact O-N 3.05Å; Q617-K619 PolarHBondContact O-N 2.9Å; Q617-K619 VanDerWaalsContact O-N 3.12Å
618	Q	89.5	Confident	88.5	Confident	121 Å²	121	62.8 Å²	62.8	57%	0.565	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.8	0.9	176.3	-69.4	177	4.9	0	0	113.5	N614 L615 R620	N614-Q618 WeakPolarHBondContact O-CB 3.35Å; N614-Q618 VanDerWaalsContact O-CG 3.31Å; N614-Q618 WeakPolarHBondContact O-CG 3.25Å; N614-Q618 PolarHBondContact O-N 3.13Å; L615-Q618 PolarHBondContact O-N 3.38Å; Q618-R620 HydrophobicContact CB-CG 4.22Å; Q618-R620 PolarHBondContact O-N 3.42Å; Q618-R620 VanDerWaalsContact O-N 3.15Å
619	K	84.3	Confident	88.5	Confident	138 Å²	138	58.8 Å²	58.8	60%	0.6	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.6	24.5	-175.5	-55.2	-175.7	176.9	-174.4	0	113.4	L615 Q617 Y621	L615-K619 PolarHBondContact O-N 3.27Å; Q617-K619 PolarHBondContact O-N 2.9Å; Q617-K619 VanDerWaalsContact O-N 3.12Å; K619-Y621 HydrophobicContact CB-CD2 4.45Å; K619-Y621 HydrophobicContact CB-CE1 4.5Å; K619-Y621 HydrophobicContact CB-CE2 3.75Å; K619-Y621 HydrophobicContact CG-CE2 4.42Å; K619-Y621 WeakPolarHBondContact O-CD2 3.49Å; K619-Y621 WeakPolarHBondContact O-CE2 3.15Å; K619-Y621 PolarHBondContact O-N 3.21Å
620	R	87.1	Confident	88.6	Confident	120 Å²	120	59.6 Å²	59.6	45%	0.453	30%	0.3	S	S	.	.			trans	-83.1	64.3	174	-71.5	178.9	75.2	176.1	8	110	L615 Q618 V622 E623 A624	L615-R620 HydrophobicContact CD2-CB 4.03Å; L615-R620 PolarHBondContact O-N 3.18Å; Q618-R620 HydrophobicContact CB-CG 4.22Å; Q618-R620 PolarHBondContact O-N 3.42Å; Q618-R620 VanDerWaalsContact O-N 3.15Å; R620-V622 VanDerWaalsContact C-N 3.34Å; R620-V622 PolarHBondContact O-N 3.12Å; R620-E623 VanDerWaalsContact CZ-CD 3.47Å; R620-E623 IonicContact CZ-OE1 3.94Å; R620-E623 VanDerWaalsContact CZ-OE1 3.29Å; R620-E623 IonicContact CZ-OE2 3.41Å; R620-E623 IonicContact NE-OE1 2.77Å; R620-E623 PolarHBondContact NE-OE1 3.38Å; R620-E623 IonicContact NE-OE2 3.89Å; R620-E623 PolarHBondContact NE-OE2 2.86Å; R620-E623 IonicContact NH1-OE2 3.52Å; R620-E623 IonicContact NH2-OE1 2.77Å; R620-E623 PolarHBondContact NH2-OE1 3.36Å; R620-E623 IonicContact NH2-OE2 3.9Å; R620-E623 PolarHBondContact NH2-OE2 3.17Å; R620-E623 PolarHBondContact O-N 3.06Å; R620-A624 WeakPolarHBondContact O-CB 3.28Å; R620-A624 PolarHBondContact O-N 3.41Å; R620-A624 VanDerWaalsContact O-N 3.11Å
621	Y	84.2	Confident	88.5	Confident	19 Å²	19	56 Å²	56	8%	0.075	28%	0.284	C	S	.	.	H	α-helix	trans	-66.5	-31.1	-167.2	-54.6	-72.1	0	0	0	114.3	K619 F625 L640 R643 M644 E647	K619-Y621 HydrophobicContact CB-CD2 4.45Å; K619-Y621 HydrophobicContact CB-CE1 4.5Å; K619-Y621 HydrophobicContact CB-CE2 3.75Å; K619-Y621 HydrophobicContact CG-CE2 4.42Å; K619-Y621 WeakPolarHBondContact O-CD2 3.49Å; K619-Y621 WeakPolarHBondContact O-CE2 3.15Å; K619-Y621 PolarHBondContact O-N 3.21Å; Y621-F625 WeakPolarHBondContact O-CB 3.5Å; Y621-F625 PolarHBondContact O-N 2.78Å; Y621-L640 HydrophobicContact CD1-CD2 4.03Å; Y621-R643 HydrophobicContact CE1-CB 4.05Å; Y621-M644 WeakPolarHBondContact CB-SD 3.37Å; Y621-M644 HydrophobicContact CD1-CG 4.33Å; Y621-M644 HydrophobicContact CD1-SD 4.08Å; Y621-M644 HydrophobicContact CD2-CE 4.1Å; Y621-M644 HydrophobicContact CD2-SD 3.31Å; Y621-M644 WeakPolarHBondContact CD2-SD 3.33Å; Y621-M644 HydrophobicContact CE2-SD 4Å; Y621-M644 HydrophobicContact CG-CE 3.82Å; Y621-M644 HydrophobicContact CG-CG 4.13Å; Y621-M644 HydrophobicContact CG-SD 3.34Å; Y621-E647 VanDerWaalsContact CE2-CD 3.44Å; Y621-E647 WeakPolarHBondContact CE2-OE1 3.23Å; Y621-E647 WeakPolarHBondContact CE2-OE2 3.29Å; Y621-E647 VanDerWaalsContact CZ-OE1 3.3Å; Y621-E647 PolarHBondContact OH-OE1 3.31Å
622	V	83.5	Confident	88.3	Confident	66 Å²	66	61.8 Å²	61.8	40%	0.4	30%	0.299	S	S	.	.	H	α-helix	trans	-64.2	-47.9	-179.5	-178.1	0	0	0	0	110.9	R620 F625 V626 T658	R620-V622 VanDerWaalsContact C-N 3.34Å; R620-V622 PolarHBondContact O-N 3.12Å; V622-F625 WeakPolarHBondContact O-CB 3.12Å; V622-F625 PolarHBondContact O-N 2.82Å; V622-V626 WeakPolarHBondContact O-CG2 3.32Å; V622-V626 PolarHBondContact O-N 3.33Å; V622-T658 HydrophobicContact CG2-CG2 3.82Å
623	E	86.8	Confident	88.3	Confident	88 Å²	88	66.7 Å²	66.7	41%	0.411	32%	0.316	S	S	.	.	H	α-helix	trans	-69.3	-41.1	179.1	-69.6	168.4	-148.9	0	0	111.8	L615 R620 F625 V626 L627	L615-E623 HydrophobicContact CD1-CB 4.2Å; L615-E623 HydrophobicContact CD2-CB 4.36Å; R620-E623 VanDerWaalsContact CZ-CD 3.47Å; R620-E623 IonicContact CZ-OE1 3.94Å; R620-E623 VanDerWaalsContact CZ-OE1 3.29Å; R620-E623 IonicContact CZ-OE2 3.41Å; R620-E623 IonicContact NE-OE1 2.77Å; R620-E623 PolarHBondContact NE-OE1 3.38Å; R620-E623 IonicContact NE-OE2 3.89Å; R620-E623 PolarHBondContact NE-OE2 2.86Å; R620-E623 IonicContact NH1-OE2 3.52Å; R620-E623 IonicContact NH2-OE1 2.77Å; R620-E623 PolarHBondContact NH2-OE1 3.36Å; R620-E623 IonicContact NH2-OE2 3.9Å; R620-E623 PolarHBondContact NH2-OE2 3.17Å; R620-E623 PolarHBondContact O-N 3.06Å; E623-F625 PolarHBondContact O-N 3.44Å; E623-V626 PolarHBondContact O-N 3.1Å; E623-L627 WeakPolarHBondContact O-CB 3.44Å; E623-L627 PolarHBondContact O-N 3.08Å
624	A	89.5	Confident	88.3	Confident	0 Å²	0	65.5 Å²	65.5	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-59.7	-38.2	172.9	0	0	0	0	0	111.5	L612 L615 M616 R620 A628 L640	L612-A624 HydrophobicContact CD1-CB 4.04Å; L612-A624 VanDerWaalsContact CD1-O 3.27Å; L612-A624 WeakPolarHBondContact CD1-O 3.5Å; L615-A624 HydrophobicContact CB-CB 3.84Å; M616-A624 HydrophobicContact CG-CB 4.3Å; R620-A624 WeakPolarHBondContact O-CB 3.28Å; R620-A624 PolarHBondContact O-N 3.41Å; R620-A624 VanDerWaalsContact O-N 3.11Å; A624-A628 WeakPolarHBondContact O-CB 3.23Å; A624-A628 PolarHBondContact O-N 3.37Å; A624-L640 HydrophobicContact CB-CD1 4.11Å; A624-L640 HydrophobicContact CB-CD2 3.64Å; A624-L640 HydrophobicContact CB-CG 4.47Å; A624-L640 WeakPolarHBondContact O-CD1 3.5Å
625	F	88	Confident	88.1	Confident	8 Å²	8	71.9 Å²	71.9	4%	0.035	33%	0.325	C	S	.	.	H	α-helix	trans	-66.8	-46.3	178	-162.8	-102.1	0	0	0	112.2	Y621 V622 E623 A628 L629 L640 L641 L659 L662 L670	Y621-F625 WeakPolarHBondContact O-CB 3.5Å; Y621-F625 PolarHBondContact O-N 2.78Å; V622-F625 WeakPolarHBondContact O-CB 3.12Å; V622-F625 PolarHBondContact O-N 2.82Å; E623-F625 PolarHBondContact O-N 3.44Å; F625-A628 PolarHBondContact O-N 2.81Å; F625-L629 HydrophobicContact CD1-CD1 3.66Å; F625-L629 HydrophobicContact CD1-CG 4.5Å; F625-L629 HydrophobicContact CE1-CD1 3.53Å; F625-L629 HydrophobicContact CE1-CG 4.41Å; F625-L629 HydrophobicContact CZ-CD1 4.33Å; F625-L629 VanDerWaalsContact O-CG 3.31Å; F625-L629 WeakPolarHBondContact O-CG 3.47Å; F625-L629 PolarHBondContact O-N 3.01Å; F625-L640 HydrophobicContact CD2-CB 4.28Å; F625-L640 HydrophobicContact CD2-CD1 4.35Å; F625-L641 HydrophobicContact CE2-CD1 4.36Å; F625-L641 HydrophobicContact CE2-CD2 3.92Å; F625-L641 HydrophobicContact CE2-CG 3.93Å; F625-L641 HydrophobicContact CZ-CD2 4.35Å; F625-L659 HydrophobicContact CE1-CD2 4.12Å; F625-L659 HydrophobicContact CZ-CD2 4.26Å; F625-L662 HydrophobicContact CD1-CD1 3.84Å; F625-L662 HydrophobicContact CD1-CD2 4.33Å; F625-L662 HydrophobicContact CE1-CD1 3.47Å; F625-L662 VanDerWaalsContact CE1-CD1 3.47Å; F625-L670 HydrophobicContact CE1-CD1 4.42Å; F625-L670 HydrophobicContact CE1-CD2 4.4Å; F625-L670 HydrophobicContact CZ-CD1 3.72Å; F625-L670 HydrophobicContact CZ-CD2 4.19Å
626	V	87.7	Confident	87.9	Confident	51 Å²	51	72.1 Å²	72.1	31%	0.309	33%	0.33	S	S	.	.	H	α-helix	trans	-60.7	-49.1	174.5	173.2	0	0	0	0	110.5	V622 E623 A628 L629 T630 L662	V622-V626 WeakPolarHBondContact O-CG2 3.32Å; V622-V626 PolarHBondContact O-N 3.33Å; E623-V626 PolarHBondContact O-N 3.1Å; V626-A628 PolarHBondContact O-N 2.84Å; V626-L629 PolarHBondContact O-N 2.88Å; V626-T630 PolarHBondContact O-N 2.79Å; V626-T630 PolarHBondContact O-OG1 2.84Å; V626-L662 HydrophobicContact CG2-CD2 3.8Å
627	L	89.3	Confident	88.1	Confident	43 Å²	43	71.2 Å²	71.2	23%	0.225	33%	0.326	C	S	.	.	H	α-helix	trans	-60.3	-44.5	179.5	-176.8	63	0	0	0	111.9	L612 L615 E623 L629 T630 L631	L612-L627 HydrophobicContact CB-CD2 3.97Å; L612-L627 HydrophobicContact CD1-CB 4.49Å; L612-L627 HydrophobicContact CD1-CD2 4.38Å; L615-L627 HydrophobicContact CD1-CD2 4.07Å; E623-L627 WeakPolarHBondContact O-CB 3.44Å; E623-L627 PolarHBondContact O-N 3.08Å; L627-L629 VanDerWaalsContact C-N 3.3Å; L627-L629 PolarHBondContact O-N 2.8Å; L627-T630 PolarHBondContact O-N 3.16Å; L627-L631 HydrophobicContact CD1-CD1 4.21Å; L627-L631 HydrophobicContact CD1-CG 4.29Å; L627-L631 HydrophobicContact CG-CD1 4.03Å; L627-L631 HydrophobicContact CG-CG 4.47Å; L627-L631 VanDerWaalsContact O-CG 3.29Å; L627-L631 WeakPolarHBondContact O-CG 3.47Å; L627-L631 PolarHBondContact O-N 2.82Å
628	A	91.2	Very high	88.2	Confident	0 Å²	0	65 Å²	65	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-64.7	-33.2	179.1	0	0	0	0	0	113	L612 A624 F625 V626 R632 R633 A636 T637 L640	L612-A628 HydrophobicContact CD1-CB 3.96Å; L612-A628 HydrophobicContact CD2-CB 4.24Å; A624-A628 WeakPolarHBondContact O-CB 3.23Å; A624-A628 PolarHBondContact O-N 3.37Å; F625-A628 PolarHBondContact O-N 2.81Å; V626-A628 PolarHBondContact O-N 2.84Å; A628-R632 PolarHBondContact O-N 3.17Å; A628-R633 PolarHBondContact O-N 2.99Å; A628-A636 HydrophobicContact CB-CB 4.48Å; A628-T637 HydrophobicContact CB-CG2 3.48Å; A628-T637 VanDerWaalsContact CB-CG2 3.48Å; A628-L640 HydrophobicContact CB-CD1 3.9Å
629	L	89.9	Confident	88.1	Confident	2 Å²	2	62.6 Å²	62.6	1%	0.01	29%	0.288	C	S	.	.	H	α-helix	trans	-69.4	-44	172.9	-72.9	169.1	0	0	0	111.5	F625 V626 L627 L631 R632 T637 L662 H666 T669 L670 F673	F625-L629 HydrophobicContact CD1-CD1 3.66Å; F625-L629 HydrophobicContact CD1-CG 4.5Å; F625-L629 HydrophobicContact CE1-CD1 3.53Å; F625-L629 HydrophobicContact CE1-CG 4.41Å; F625-L629 HydrophobicContact CZ-CD1 4.33Å; F625-L629 VanDerWaalsContact O-CG 3.31Å; F625-L629 WeakPolarHBondContact O-CG 3.47Å; F625-L629 PolarHBondContact O-N 3.01Å; V626-L629 PolarHBondContact O-N 2.88Å; L627-L629 VanDerWaalsContact C-N 3.3Å; L627-L629 PolarHBondContact O-N 2.8Å; L629-L631 VanDerWaalsContact C-N 3.31Å; L629-L631 PolarHBondContact O-N 3.31Å; L629-R632 WeakPolarHBondContact O-CA 3.49Å; L629-R632 PolarHBondContact O-N 2.83Å; L629-T637 HydrophobicContact CD2-CG2 4.1Å; L629-T637 HydrophobicContact CG-CG2 4.14Å; L629-L662 HydrophobicContact CD1-CD1 4.24Å; L629-L662 HydrophobicContact CD1-CD2 4.29Å; L629-H666 HydrophobicContact CD1-CB 3.99Å; L629-T669 HydrophobicContact CD2-CG2 4.31Å; L629-L670 HydrophobicContact CD2-CB 4.1Å; L629-L670 HydrophobicContact CD2-CD1 4.12Å; L629-F673 HydrophobicContact CD2-CD2 4.03Å; L629-F673 HydrophobicContact CD2-CE2 3.83Å
630	T	89	Confident	88.3	Confident	87 Å²	87	56.1 Å²	56.1	53%	0.534	26%	0.26	S	S	.	.	H	α-helix	trans	-60.1	-41.1	176	-55.2	0	0	0	0	111.9	V626 L627 R632 H666	V626-T630 PolarHBondContact O-N 2.79Å; V626-T630 PolarHBondContact O-OG1 2.84Å; L627-T630 PolarHBondContact O-N 3.16Å; T630-R632 PolarHBondContact O-N 2.8Å; T630-H666 PolarHBondContact OG1-CE1 2.83Å
631	L	88.2	Confident	88.3	Confident	36 Å²	36	50.6 Å²	50.6	19%	0.188	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.7	1.3	176.7	-62.4	176.7	0	0	0	113.9	Q608 L627 L629 R633	Q608-L631 HydrophobicContact CB-CD1 4.02Å; Q608-L631 HydrophobicContact CB-CD2 4.25Å; Q608-L631 HydrophobicContact CG-CD2 4.4Å; L627-L631 HydrophobicContact CD1-CD1 4.21Å; L627-L631 HydrophobicContact CD1-CG 4.29Å; L627-L631 HydrophobicContact CG-CD1 4.03Å; L627-L631 HydrophobicContact CG-CG 4.47Å; L627-L631 VanDerWaalsContact O-CG 3.29Å; L627-L631 WeakPolarHBondContact O-CG 3.47Å; L627-L631 PolarHBondContact O-N 2.82Å; L629-L631 VanDerWaalsContact C-N 3.31Å; L629-L631 PolarHBondContact O-N 3.31Å; L631-R633 HydrophobicContact CB-CG 3.78Å; L631-R633 PolarHBondContact O-N 2.8Å
632	R	89.3	Confident	88.5	Confident	186 Å²	186	54.4 Å²	54.4	70%	0.702	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.2	51.3	-173	-67.8	-174.1	172.7	164.1	0.1	114	A628 L629 T630 P634 T669 F673	A628-R632 PolarHBondContact O-N 3.17Å; L629-R632 WeakPolarHBondContact O-CA 3.49Å; L629-R632 PolarHBondContact O-N 2.83Å; T630-R632 PolarHBondContact O-N 2.8Å; R632-P634 VanDerWaalsContact O-CD 3.25Å; R632-P634 WeakPolarHBondContact O-CD 3.4Å; R632-T669 HydrophobicContact CG-CG2 4.11Å; R632-F673 VanDerWaalsContact C-CZ 3.46Å; R632-F673 HydrophobicContact CB-CZ 4.22Å
633	R	88.6	Confident	88.6	Confident	117 Å²	117	57 Å²	57	44%	0.442	26%	0.256	S	S	.	.			trans	-105.8	95.9	-177.5	-60.9	-58.3	-164.4	-174.1	1.9	112.8	A628 L631 R635 A636 T637	A628-R633 PolarHBondContact O-N 2.99Å; L631-R633 HydrophobicContact CB-CG 3.78Å; L631-R633 PolarHBondContact O-N 2.8Å; R633-R635 PolarHBondContact O-N 2.8Å; R633-A636 HydrophobicContact CB-CB 4.04Å; R633-A636 PolarHBondContact O-N 2.95Å; R633-T637 PolarHBondContact O-N 3.27Å; R633-T637 PolarHBondContact O-OG1 3Å
634	P	89.1	Confident	88.5	Confident	31 Å²	31	53.2 Å²	53.2	20%	0.201	24%	0.238	C	C	.	.	H	α-helix	trans	-67.5	-32.5	-175	23.4	-33.1	0	0	0	114.5	R632 T637 L638 F673 E676 W677	R632-P634 VanDerWaalsContact O-CD 3.25Å; R632-P634 WeakPolarHBondContact O-CD 3.4Å; P634-T637 WeakPolarHBondContact CA-OG1 3.41Å; P634-T637 PolarHBondContact O-OG1 3.31Å; P634-L638 WeakPolarHBondContact O-CB 3.31Å; P634-L638 PolarHBondContact O-N 2.83Å; P634-F673 HydrophobicContact CB-CB 4.38Å; P634-F673 HydrophobicContact CB-CD1 3.71Å; P634-F673 HydrophobicContact CB-CD2 4.38Å; P634-F673 HydrophobicContact CB-CE1 4.01Å; P634-F673 HydrophobicContact CB-CG 3.92Å; P634-F673 HydrophobicContact CB-CZ 4.43Å; P634-F673 HydrophobicContact CG-CD1 4.4Å; P634-F673 HydrophobicContact CG-CE1 4.31Å; P634-E676 WeakPolarHBondContact CB-OE2 3.48Å; P634-E676 WeakPolarHBondContact CG-OE2 3.45Å; P634-W677 WeakPolarHBondContact O-CZ2 3.47Å; P634-W677 PolarHBondContact O-NE1 3.46Å
635	R	89.2	Confident	88.2	Confident	215 Å²	215	55.5 Å²	55.5	81%	0.811	25%	0.252	S	S	*	.	H	α-helix	trans	-72.3	-42.4	178.9	-68.2	-175.8	-175.3	164.7	2.1	112	R633 L638 D639	R633-R635 PolarHBondContact O-N 2.8Å; R635-L638 PolarHBondContact O-N 3.05Å; R635-D639 PolarHBondContact O-N 3.24Å
636	A	87.4	Confident	88	Confident	27 Å²	27	62.2 Å²	62.2	22%	0.223	29%	0.288	C	S	.	.	H	α-helix	trans	-67	-40.5	-179.6	0	0	0	0	0	111.9	L612 A628 R633 L638 D639 L640	L612-A636 HydrophobicContact CD2-CB 3.91Å; A628-A636 HydrophobicContact CB-CB 4.48Å; R633-A636 HydrophobicContact CB-CB 4.04Å; R633-A636 PolarHBondContact O-N 2.95Å; A636-L638 VanDerWaalsContact C-N 3.32Å; A636-L638 PolarHBondContact O-N 3.25Å; A636-D639 PolarHBondContact O-N 2.97Å; A636-L640 WeakPolarHBondContact O-CB 3.14Å; A636-L640 WeakPolarHBondContact O-CG 3.42Å; A636-L640 PolarHBondContact O-N 2.95Å
637	T	89.8	Confident	87.5	Confident	0 Å²	0	62 Å²	62	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-63.5	-36.8	173	47	0	0	0	0	112.2	A628 L629 R633 P634 L640 L641 F673 W677	A628-T637 HydrophobicContact CB-CG2 3.48Å; A628-T637 VanDerWaalsContact CB-CG2 3.48Å; L629-T637 HydrophobicContact CD2-CG2 4.1Å; L629-T637 HydrophobicContact CG-CG2 4.14Å; R633-T637 PolarHBondContact O-N 3.27Å; R633-T637 PolarHBondContact O-OG1 3Å; P634-T637 WeakPolarHBondContact CA-OG1 3.41Å; P634-T637 PolarHBondContact O-OG1 3.31Å; T637-L640 WeakPolarHBondContact O-CB 3.46Å; T637-L641 WeakPolarHBondContact O-CG 3.2Å; T637-L641 PolarHBondContact O-N 2.77Å; T637-F673 HydrophobicContact CG2-CD2 4.28Å; T637-F673 HydrophobicContact CG2-CE2 4.05Å; T637-W677 VanDerWaalsContact OG1-CZ2 3.29Å; T637-W677 WeakPolarHBondContact OG1-CZ2 3.31Å
638	L	89.6	Confident	86.3	Confident	11 Å²	11	69.7 Å²	69.7	6%	0.058	32%	0.319	C	S	.	.	H	α-helix	trans	-67.5	-44	174.6	-170.3	149.5	0	0	0	112.5	P634 R635 A636 L640 L641 R642 W677 T683	P634-L638 WeakPolarHBondContact O-CB 3.31Å; P634-L638 PolarHBondContact O-N 2.83Å; R635-L638 PolarHBondContact O-N 3.05Å; A636-L638 VanDerWaalsContact C-N 3.32Å; A636-L638 PolarHBondContact O-N 3.25Å; L638-L640 VanDerWaalsContact C-N 3.29Å; L638-L640 PolarHBondContact O-N 2.87Å; L638-L641 WeakPolarHBondContact O-CB 3.17Å; L638-L641 PolarHBondContact O-N 2.65Å; L638-L641 VanDerWaalsContact O-N 3.15Å; L638-R642 HydrophobicContact CD2-CG 4Å; L638-R642 PolarHBondContact O-N 2.91Å; L638-W677 HydrophobicContact CB-CD2 4.47Å; L638-W677 HydrophobicContact CB-CH2 4.3Å; L638-W677 HydrophobicContact CB-CZ2 3.77Å; L638-W677 HydrophobicContact CD1-CB 4.44Å; L638-W677 HydrophobicContact CD1-CD2 3.76Å; L638-W677 HydrophobicContact CD1-CE3 4.44Å; L638-W677 HydrophobicContact CD1-CG 3.69Å; L638-W677 HydrophobicContact CG-CD2 4.48Å; L638-T683 HydrophobicContact CD1-CG2 3.49Å; L638-T683 VanDerWaalsContact CD1-CG2 3.49Å; L638-T683 HydrophobicContact CD2-CG2 4.4Å
639	D	88.6	Confident	85.5	Confident	69 Å²	69	72.8 Å²	72.8	37%	0.369	35%	0.35	S	S	.	.	H	α-helix	trans	-65.9	-34.8	177.8	-73.3	-24.3	0	0	0	111.7	M616 R635 A636 R642 R643	M616-D639 HydrophobicContact CE-CB 4.4Å; R635-D639 PolarHBondContact O-N 3.24Å; A636-D639 PolarHBondContact O-N 2.97Å; D639-R642 PolarHBondContact O-N 3.47Å; D639-R642 IonicContact OD1-NH1 3Å; D639-R642 PolarHBondContact OD1-NH1 3.33Å; D639-R643 WeakPolarHBondContact O-CG 3.34Å; D639-R643 PolarHBondContact O-N 2.88Å
640	L	88.2	Confident	84.8	Confident	2 Å²	2	77.1 Å²	77.1	1%	0.01	37%	0.373	C	S	.	.	H	α-helix	trans	-56.1	-50.5	167.5	-89.2	160.7	0	0	0	111.5	L612 M616 Y621 A624 F625 A628 A636 T637 L638 R642 R643 M644	L612-L640 HydrophobicContact CD1-CD1 4.5Å; M616-L640 HydrophobicContact CE-CB 4.32Å; M616-L640 HydrophobicContact CE-CD2 3.97Å; M616-L640 HydrophobicContact CE-CG 3.65Å; M616-L640 HydrophobicContact CG-CD2 4.1Å; M616-L640 HydrophobicContact CG-CG 4.31Å; M616-L640 HydrophobicContact SD-CB 4.45Å; M616-L640 HydrophobicContact SD-CD1 4.46Å; M616-L640 HydrophobicContact SD-CD2 3.07Å; M616-L640 WeakPolarHBondContact SD-CD2 3.46Å; M616-L640 HydrophobicContact SD-CG 3.42Å; M616-L640 WeakPolarHBondContact SD-CG 3.31Å; Y621-L640 HydrophobicContact CD1-CD2 4.03Å; A624-L640 HydrophobicContact CB-CD1 4.11Å; A624-L640 HydrophobicContact CB-CD2 3.64Å; A624-L640 HydrophobicContact CB-CG 4.47Å; A624-L640 WeakPolarHBondContact O-CD1 3.5Å; F625-L640 HydrophobicContact CD2-CB 4.28Å; F625-L640 HydrophobicContact CD2-CD1 4.35Å; A628-L640 HydrophobicContact CB-CD1 3.9Å; A636-L640 WeakPolarHBondContact O-CB 3.14Å; A636-L640 WeakPolarHBondContact O-CG 3.42Å; A636-L640 PolarHBondContact O-N 2.95Å; T637-L640 WeakPolarHBondContact O-CB 3.46Å; L638-L640 VanDerWaalsContact C-N 3.29Å; L638-L640 PolarHBondContact O-N 2.87Å; L640-R642 PolarHBondContact O-N 2.95Å; L640-R643 PolarHBondContact O-N 3.4Å; L640-M644 WeakPolarHBondContact O-CG 3.24Å; L640-M644 PolarHBondContact O-N 2.82Å
641	L	87.8	Confident	84.2	Confident	4 Å²	4	74.8 Å²	74.8	2%	0.021	36%	0.359	C	S	.	.	H	α-helix	trans	-62.5	-41	177.7	-71.3	168.6	0	0	0	112.1	F625 T637 L638 M644 T645 I655 W677 F686 I690	F625-L641 HydrophobicContact CE2-CD1 4.36Å; F625-L641 HydrophobicContact CE2-CD2 3.92Å; F625-L641 HydrophobicContact CE2-CG 3.93Å; F625-L641 HydrophobicContact CZ-CD2 4.35Å; T637-L641 WeakPolarHBondContact O-CG 3.2Å; T637-L641 PolarHBondContact O-N 2.77Å; L638-L641 WeakPolarHBondContact O-CB 3.17Å; L638-L641 PolarHBondContact O-N 2.65Å; L638-L641 VanDerWaalsContact O-N 3.15Å; L641-M644 WeakPolarHBondContact O-CB 3.02Å; L641-M644 PolarHBondContact O-N 2.88Å; L641-T645 WeakPolarHBondContact O-CG2 3.45Å; L641-T645 PolarHBondContact O-N 2.75Å; L641-T645 PolarHBondContact O-OG1 2.68Å; L641-I655 HydrophobicContact CD2-CD1 4.4Å; L641-I655 HydrophobicContact CD2-CG1 4.42Å; L641-I655 HydrophobicContact CD2-CG2 4.08Å; L641-W677 HydrophobicContact CD1-CH2 3.72Å; L641-W677 HydrophobicContact CD1-CZ3 3.45Å; L641-W677 VanDerWaalsContact CD1-CZ3 3.45Å; L641-F686 HydrophobicContact CB-CD1 3.76Å; L641-F686 HydrophobicContact CB-CE1 4Å; L641-F686 HydrophobicContact CD1-CD1 4.49Å; L641-I690 HydrophobicContact CD1-CD1 4Å
642	R	88.1	Confident	83.7	Confident	99 Å²	99	78.1 Å²	78.1	37%	0.374	38%	0.377	S	S	.	.	H	α-helix	trans	-59.4	-47.4	174.5	-77.8	178.3	173.5	160.9	0.6	111.7	L638 D639 L640 M644 T645 L646 F686	L638-R642 HydrophobicContact CD2-CG 4Å; L638-R642 PolarHBondContact O-N 2.91Å; D639-R642 PolarHBondContact O-N 3.47Å; D639-R642 IonicContact OD1-NH1 3Å; D639-R642 PolarHBondContact OD1-NH1 3.33Å; L640-R642 PolarHBondContact O-N 2.95Å; R642-M644 VanDerWaalsContact C-N 3.33Å; R642-M644 PolarHBondContact O-N 2.97Å; R642-T645 WeakPolarHBondContact CA-OG1 3.38Å; R642-T645 PolarHBondContact O-N 2.91Å; R642-T645 VanDerWaalsContact O-N 3.12Å; R642-T645 PolarHBondContact O-OG1 2.75Å; R642-L646 WeakPolarHBondContact O-CD1 3.3Å; R642-L646 PolarHBondContact O-N 3.41Å; R642-F686 HydrophobicContact CB-CZ 4.3Å; R642-F686 HydrophobicContact CG-CE1 4.3Å; R642-F686 HydrophobicContact CG-CE2 3.73Å; R642-F686 HydrophobicContact CG-CZ 3.48Å; R642-F686 VanDerWaalsContact CG-CZ 3.48Å
643	R	85.8	Confident	83.2	Confident	122 Å²	122	77.6 Å²	77.6	46%	0.46	38%	0.375	S	S	.	.	H	α-helix	trans	-63.1	-40.3	177.9	-72	-175.1	-175.8	178.1	1	112	Y621 D639 L640 T645 L646	Y621-R643 HydrophobicContact CE1-CB 4.05Å; D639-R643 WeakPolarHBondContact O-CG 3.34Å; D639-R643 PolarHBondContact O-N 2.88Å; L640-R643 PolarHBondContact O-N 3.4Å; R643-T645 VanDerWaalsContact C-N 3.25Å; R643-T645 PolarHBondContact O-N 2.91Å; R643-L646 PolarHBondContact O-N 3.12Å; R643-L646 VanDerWaalsContact O-N 3.13Å
644	M	83.6	Confident	82.6	Confident	7 Å²	7	76.2 Å²	76.2	3%	0.034	37%	0.372	C	S	.	.	H	α-helix	trans	-60.7	-33.8	173.6	-69.4	-77.1	-127.5	0	0	112.8	Y621 L640 L641 R642 K654 I655 T658	Y621-M644 WeakPolarHBondContact CB-SD 3.37Å; Y621-M644 HydrophobicContact CD1-CG 4.33Å; Y621-M644 HydrophobicContact CD1-SD 4.08Å; Y621-M644 HydrophobicContact CD2-CE 4.1Å; Y621-M644 HydrophobicContact CD2-SD 3.31Å; Y621-M644 WeakPolarHBondContact CD2-SD 3.33Å; Y621-M644 HydrophobicContact CE2-SD 4Å; Y621-M644 HydrophobicContact CG-CE 3.82Å; Y621-M644 HydrophobicContact CG-CG 4.13Å; Y621-M644 HydrophobicContact CG-SD 3.34Å; L640-M644 WeakPolarHBondContact O-CG 3.24Å; L640-M644 PolarHBondContact O-N 2.82Å; L641-M644 WeakPolarHBondContact O-CB 3.02Å; L641-M644 PolarHBondContact O-N 2.88Å; R642-M644 VanDerWaalsContact C-N 3.33Å; R642-M644 PolarHBondContact O-N 2.97Å; M644-K654 HydrophobicContact SD-CD 4.42Å; M644-I655 HydrophobicContact CB-CD1 4.36Å; M644-I655 HydrophobicContact CB-CG1 4.14Å; M644-T658 HydrophobicContact CE-CG2 3.78Å
645	T	83.8	Confident	82.3	Confident	48 Å²	48	74.7 Å²	74.7	29%	0.294	36%	0.363	S	S	.	.	H	α-helix	trans	-75.5	-20.4	175.6	54.1	0	0	0	0	114.9	L641 R642 R643 P651 I655 F686	L641-T645 WeakPolarHBondContact O-CG2 3.45Å; L641-T645 PolarHBondContact O-N 2.75Å; L641-T645 PolarHBondContact O-OG1 2.68Å; R642-T645 WeakPolarHBondContact CA-OG1 3.38Å; R642-T645 PolarHBondContact O-N 2.91Å; R642-T645 VanDerWaalsContact O-N 3.12Å; R642-T645 PolarHBondContact O-OG1 2.75Å; R643-T645 VanDerWaalsContact C-N 3.25Å; R643-T645 PolarHBondContact O-N 2.91Å; T645-P651 HydrophobicContact CG2-CB 4.43Å; T645-I655 HydrophobicContact CG2-CD1 3.65Å; T645-F686 HydrophobicContact CG2-CE1 3.72Å; T645-F686 HydrophobicContact CG2-CZ 4.42Å
646	L	83.9	Confident	81.9	Confident	149 Å²	149	65.6 Å²	65.6	78%	0.78	33%	0.332	S	S	*	.	H	α-helix	trans	-85.7	-12.9	-179.8	-96.6	77.6	0	0	0	113.5	R642 R643	R642-L646 WeakPolarHBondContact O-CD1 3.3Å; R642-L646 PolarHBondContact O-N 3.41Å; R643-L646 PolarHBondContact O-N 3.12Å; R643-L646 VanDerWaalsContact O-N 3.13Å
647	E	78.1	Confident	81.6	Confident	47 Å²	47	68.3 Å²	68.3	22%	0.22	34%	0.342	C	S	.	.	S	Bend	trans	-74.5	146.6	-180	-70.3	-164.4	148.2	0	0	113	Y621 G649 K654	Y621-E647 VanDerWaalsContact CE2-CD 3.44Å; Y621-E647 WeakPolarHBondContact CE2-OE1 3.23Å; Y621-E647 WeakPolarHBondContact CE2-OE2 3.29Å; Y621-E647 VanDerWaalsContact CZ-OE1 3.3Å; Y621-E647 PolarHBondContact OH-OE1 3.31Å; E647-G649 PolarHBondContact O-N 2.94Å; E647-K654 IonicContact OE2-NZ 3.94Å; E647-K654 PolarHBondContact OE2-NZ 3.39Å
648	E	63.3	Low	81.1	Confident	205 Å²	205	68.9 Å²	68.9	96%	0.958	35%	0.345	S	S	*	.	S	Bend	trans	-64.1	125.9	178.1	-65	-178.5	169.7	0	0	111.4
649	G	73.8	Confident	80.7	Confident	64 Å²	64	68.5 Å²	68.5	66%	0.66	34%	0.343	S	S	*	.	S	Bend	trans	137.9	-157.7	-180	0	0	0	0	0	113.1	E647 P651	E647-G649 PolarHBondContact O-N 2.94Å; G649-P651 WeakPolarHBondContact O-CD 3.42Å
650	D	76.7	Confident	80.3	Confident	94 Å²	94	70.5 Å²	70.5	50%	0.503	35%	0.35	S	S	.	.			trans	-88.9	89.2	168.9	-79	-30.4	0	0	0	109.8	L652 R653 K654	D650-L652 PolarHBondContact O-N 3.42Å; D650-R653 HydrophobicContact CB-CB 3.95Å; D650-R653 HydrophobicContact CB-CG 3.97Å; D650-R653 PolarHBondContact O-N 3.37Å; D650-R653 VanDerWaalsContact O-N 3.14Å; D650-R653 WeakPolarHBondContact OD2-CD 3.47Å; D650-R653 IonicContact OD2-CZ 2.75Å; D650-R653 IonicContact OD2-NE 2.56Å; D650-R653 IonicContact OD2-NH1 3.57Å; D650-R653 PolarHBondContact OD2-NH1 3.37Å; D650-K654 PolarHBondContact O-N 2.86Å
651	P	75.2	Confident	80	Confident	37 Å²	37	77.8 Å²	77.8	24%	0.24	38%	0.382	C	S	.	.	H	α-helix	trans	-60	-35.5	-176.5	23.3	-35.3	0	0	0	112.5	T645 G649 R653 K654 I655	T645-P651 HydrophobicContact CG2-CB 4.43Å; G649-P651 WeakPolarHBondContact O-CD 3.42Å; P651-R653 PolarHBondContact O-N 3.3Å; P651-K654 PolarHBondContact O-N 2.9Å; P651-I655 WeakPolarHBondContact O-CG1 3.36Å; P651-I655 PolarHBondContact O-N 2.64Å
652	L	77.3	Confident	79.7	Confident	107 Å²	107	78.1 Å²	78.1	56%	0.56	38%	0.384	S	S	*	.	H	α-helix	trans	-60.5	-44.3	178.2	-70.2	165.1	0	0	0	111.5	D650 S656 L689	D650-L652 PolarHBondContact O-N 3.42Å; L652-S656 PolarHBondContact O-N 3.18Å; L652-S656 PolarHBondContact O-OG 3.26Å; L652-S656 VanDerWaalsContact O-OG 3.05Å; L652-L689 HydrophobicContact CD2-CD1 3.38Å; L652-L689 HydrophobicContact CD2-CD2 4.07Å; L652-L689 HydrophobicContact CD2-CG 4.36Å
653	R	78.7	Confident	79.5	Confident	174 Å²	174	76.8 Å²	76.8	66%	0.657	39%	0.388	S	S	*	.	H	α-helix	trans	-66.3	-42.5	178.2	-72.8	-175.2	173.5	159.9	-11.4	111.4	D650 P651 I655 S656 I657	D650-R653 HydrophobicContact CB-CB 3.95Å; D650-R653 HydrophobicContact CB-CG 3.97Å; D650-R653 PolarHBondContact O-N 3.37Å; D650-R653 VanDerWaalsContact O-N 3.14Å; D650-R653 WeakPolarHBondContact OD2-CD 3.47Å; D650-R653 IonicContact OD2-CZ 2.75Å; D650-R653 IonicContact OD2-NE 2.56Å; D650-R653 IonicContact OD2-NH1 3.57Å; D650-R653 PolarHBondContact OD2-NH1 3.37Å; P651-R653 PolarHBondContact O-N 3.3Å; R653-I655 PolarHBondContact O-N 3.46Å; R653-S656 PolarHBondContact O-N 3.41Å; R653-I657 VanDerWaalsContact O-CG1 3.28Å; R653-I657 WeakPolarHBondContact O-CG1 3.47Å; R653-I657 PolarHBondContact O-N 3.16Å
654	K	77.7	Confident	79.1	Confident	88 Å²	88	73.9 Å²	73.9	38%	0.383	39%	0.386	S	S	.	.	H	α-helix	trans	-61.4	-45.1	178.7	-166.7	172.9	-175.9	173.2	0	111.5	M644 E647 D650 P651 I657 T658	M644-K654 HydrophobicContact SD-CD 4.42Å; E647-K654 IonicContact OE2-NZ 3.94Å; E647-K654 PolarHBondContact OE2-NZ 3.39Å; D650-K654 PolarHBondContact O-N 2.86Å; P651-K654 PolarHBondContact O-N 2.9Å; K654-I657 PolarHBondContact O-N 3.18Å; K654-T658 WeakPolarHBondContact O-CG2 3.28Å; K654-T658 PolarHBondContact O-N 2.8Å; K654-T658 PolarHBondContact O-OG1 3.29Å
655	I	81.7	Confident	79.1	Confident	0 Å²	0	80.5 Å²	80.5	0%	0	42%	0.417	C	S	.	.	H	α-helix	trans	-62.7	-46.8	175.9	-67	167.3	0	0	0	110.4	L641 M644 T645 P651 R653 I657 T658 L659 L689	L641-I655 HydrophobicContact CD2-CD1 4.4Å; L641-I655 HydrophobicContact CD2-CG1 4.42Å; L641-I655 HydrophobicContact CD2-CG2 4.08Å; M644-I655 HydrophobicContact CB-CD1 4.36Å; M644-I655 HydrophobicContact CB-CG1 4.14Å; T645-I655 HydrophobicContact CG2-CD1 3.65Å; P651-I655 WeakPolarHBondContact O-CG1 3.36Å; P651-I655 PolarHBondContact O-N 2.64Å; R653-I655 PolarHBondContact O-N 3.46Å; I655-I657 VanDerWaalsContact C-N 3.34Å; I655-I657 PolarHBondContact O-N 3.34Å; I655-T658 WeakPolarHBondContact CA-OG1 3.36Å; I655-T658 PolarHBondContact O-N 3.42Å; I655-T658 VanDerWaalsContact O-N 3.12Å; I655-T658 PolarHBondContact O-OG1 3.33Å; I655-L659 HydrophobicContact CG2-CD1 3.82Å; I655-L659 HydrophobicContact CG2-CG 4.21Å; I655-L659 VanDerWaalsContact O-CG 3.3Å; I655-L659 WeakPolarHBondContact O-CG 3.1Å; I655-L659 PolarHBondContact O-N 3.29Å; I655-L689 HydrophobicContact CB-CD2 4.37Å; I655-L689 HydrophobicContact CD1-CD2 3.76Å; I655-L689 HydrophobicContact CG2-CD2 3.91Å; I655-L689 HydrophobicContact CG2-CG 4.49Å
656	S	80.3	Confident	79.2	Confident	23 Å²	23	79.8 Å²	79.8	16%	0.161	41%	0.411	C	S	.	.	H	α-helix	trans	-56.2	-45.8	176.6	-64.5	0	0	0	0	112.1	L652 R653 T658 L659 E660 N693	L652-S656 PolarHBondContact O-N 3.18Å; L652-S656 PolarHBondContact O-OG 3.26Å; L652-S656 VanDerWaalsContact O-OG 3.05Å; R653-S656 PolarHBondContact O-N 3.41Å; S656-T658 VanDerWaalsContact C-N 3.35Å; S656-T658 PolarHBondContact O-N 3.13Å; S656-L659 PolarHBondContact O-N 2.81Å; S656-E660 VanDerWaalsContact O-CG 3.31Å; S656-E660 WeakPolarHBondContact O-CG 3.44Å; S656-E660 PolarHBondContact O-N 3.49Å; S656-N693 PolarHBondContact OG-ND2 3.46Å; S656-N693 PolarHBondContact OG-OD1 3.13Å
657	I	81.4	Confident	79.2	Confident	84 Å²	84	72.8 Å²	72.8	43%	0.431	37%	0.374	S	S	.	.	H	α-helix	trans	-62.6	-39.7	176.5	-65.5	162.5	0	0	0	111.7	R653 K654 I655 L659 E660 K661	R653-I657 VanDerWaalsContact O-CG1 3.28Å; R653-I657 WeakPolarHBondContact O-CG1 3.47Å; R653-I657 PolarHBondContact O-N 3.16Å; K654-I657 PolarHBondContact O-N 3.18Å; I655-I657 VanDerWaalsContact C-N 3.34Å; I655-I657 PolarHBondContact O-N 3.34Å; I657-L659 VanDerWaalsContact C-N 3.33Å; I657-E660 PolarHBondContact O-N 3.27Å; I657-K661 PolarHBondContact O-N 3.15Å
658	T	79.1	Confident	79.5	Confident	12 Å²	12	72.9 Å²	72.9	7%	0.074	37%	0.374	C	S	.	.	H	α-helix	trans	-66.1	-37.2	176.3	56	0	0	0	0	112.4	V622 M644 K654 I655 S656 K661 L662	V622-T658 HydrophobicContact CG2-CG2 3.82Å; M644-T658 HydrophobicContact CE-CG2 3.78Å; K654-T658 WeakPolarHBondContact O-CG2 3.28Å; K654-T658 PolarHBondContact O-N 2.8Å; K654-T658 PolarHBondContact O-OG1 3.29Å; I655-T658 WeakPolarHBondContact CA-OG1 3.36Å; I655-T658 PolarHBondContact O-N 3.42Å; I655-T658 VanDerWaalsContact O-N 3.12Å; I655-T658 PolarHBondContact O-OG1 3.33Å; S656-T658 VanDerWaalsContact C-N 3.35Å; S656-T658 PolarHBondContact O-N 3.13Å; T658-K661 PolarHBondContact O-N 2.9Å; T658-L662 WeakPolarHBondContact O-CG 3.48Å
659	L	81.6	Confident	80.6	Confident	4 Å²	4	64.1 Å²	64.1	2%	0.021	33%	0.334	C	S	.	.	H	α-helix	trans	-70.9	-34.1	176.5	-65.6	174.4	0	0	0	111.7	F625 I655 S656 I657 K661 L662 M667 L670 N693 R697	F625-L659 HydrophobicContact CE1-CD2 4.12Å; F625-L659 HydrophobicContact CZ-CD2 4.26Å; I655-L659 HydrophobicContact CG2-CD1 3.82Å; I655-L659 HydrophobicContact CG2-CG 4.21Å; I655-L659 VanDerWaalsContact O-CG 3.3Å; I655-L659 WeakPolarHBondContact O-CG 3.1Å; I655-L659 PolarHBondContact O-N 3.29Å; S656-L659 PolarHBondContact O-N 2.81Å; I657-L659 VanDerWaalsContact C-N 3.33Å; L659-K661 VanDerWaalsContact C-N 3.26Å; L659-K661 PolarHBondContact O-N 2.82Å; L659-L662 HydrophobicContact CD2-CD1 3.86Å; L659-L662 PolarHBondContact O-N 3.1Å; L659-M667 HydrophobicContact CD2-SD 4.46Å; L659-L670 HydrophobicContact CD2-CD2 3.31Å; L659-N693 HydrophobicContact CD1-CB 3.88Å; L659-N693 WeakPolarHBondContact CD1-ND2 3.24Å; L659-R697 PolarHBondContact O-NH1 2.99Å
660	E	79.7	Confident	81.3	Confident	111 Å²	111	61 Å²	61	52%	0.519	30%	0.303	S	S	.	.	H	α-helix	trans	-60.3	-34.8	174.1	-77.8	168.2	-165.4	0	0	112.4	S656 I657 L662 R697	S656-E660 VanDerWaalsContact O-CG 3.31Å; S656-E660 WeakPolarHBondContact O-CG 3.44Å; S656-E660 PolarHBondContact O-N 3.49Å; I657-E660 PolarHBondContact O-N 3.27Å; E660-L662 VanDerWaalsContact C-N 3.31Å; E660-L662 PolarHBondContact O-N 3.27Å; E660-R697 PolarHBondContact O-NH1 3.09Å; E660-R697 PolarHBondContact O-NH2 3.37Å
661	K	82.1	Confident	81.9	Confident	155 Å²	155	57.5 Å²	57.5	67%	0.674	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.7	-10.2	-179.8	-69.1	-179.7	-179.3	-175.4	0	114.6	I657 T658 L659	I657-K661 PolarHBondContact O-N 3.15Å; T658-K661 PolarHBondContact O-N 2.9Å; L659-K661 VanDerWaalsContact C-N 3.26Å; L659-K661 PolarHBondContact O-N 2.82Å
662	L	82.6	Confident	82.5	Confident	10 Å²	10	57.9 Å²	57.9	5%	0.052	29%	0.287	C	S	.	.	S	Bend	trans	-83	143.3	-174.7	-68	165.6	0	0	0	112.9	F625 V626 L629 T658 L659 E660 H666 M667	F625-L662 HydrophobicContact CD1-CD1 3.84Å; F625-L662 HydrophobicContact CD1-CD2 4.33Å; F625-L662 HydrophobicContact CE1-CD1 3.47Å; F625-L662 VanDerWaalsContact CE1-CD1 3.47Å; V626-L662 HydrophobicContact CG2-CD2 3.8Å; L629-L662 HydrophobicContact CD1-CD1 4.24Å; L629-L662 HydrophobicContact CD1-CD2 4.29Å; T658-L662 WeakPolarHBondContact O-CG 3.48Å; L659-L662 HydrophobicContact CD2-CD1 3.86Å; L659-L662 PolarHBondContact O-N 3.1Å; E660-L662 VanDerWaalsContact C-N 3.31Å; E660-L662 PolarHBondContact O-N 3.27Å; L662-H666 HydrophobicContact CB-CB 4.48Å; L662-H666 HydrophobicContact CD2-CB 4.33Å; L662-M667 HydrophobicContact CB-CG 4.32Å; L662-M667 HydrophobicContact CB-SD 4.29Å; L662-M667 HydrophobicContact CD1-SD 4.32Å
663	P	82.6	Confident	83.2	Confident	71 Å²	71	53.2 Å²	53.2	46%	0.461	26%	0.263	S	S	.	.			trans	-69.9	162.1	169.2	31	-35.2	0	0	0	111.9	E665 H666 M667	P663-E665 PolarHBondContact O-N 2.84Å; P663-H666 HydrophobicContact CG-CB 4.17Å; P663-H666 WeakPolarHBondContact CG-CD2 3.41Å; P663-H666 PolarHBondContact O-N 3.2Å; P663-M667 PolarHBondContact O-N 3.19Å
664	S	78.9	Confident	83.7	Confident	62 Å²	62	45 Å²	45	43%	0.434	23%	0.231	S	C	.	.	H	α-helix	trans	-59.8	-36.5	-176.3	48.5	0	0	0	0	114.3	H666 M667 Q668	S664-H666 PolarHBondContact O-N 3.25Å; S664-M667 WeakPolarHBondContact O-CB 3.38Å; S664-M667 PolarHBondContact O-N 3.44Å; S664-Q668 PolarHBondContact O-N 3.39Å
665	E	82.1	Confident	84.3	Confident	146 Å²	146	42.1 Å²	42.1	68%	0.682	22%	0.22	S	C	*	.	H	α-helix	trans	-63.9	-41.4	178.9	-62.7	-175.1	171.5	0	0	112.9	P663 M667 Q668 T669	P663-E665 PolarHBondContact O-N 2.84Å; E665-M667 VanDerWaalsContact C-N 3.31Å; E665-Q668 PolarHBondContact O-N 2.56Å; E665-T669 PolarHBondContact O-N 3.11Å; E665-T669 VanDerWaalsContact O-N 3.12Å; E665-T669 PolarHBondContact O-OG1 2.79Å; E665-T669 VanDerWaalsContact O-OG1 3.13Å
666	H	86.5	Confident	84.6	Confident	33 Å²	33	47.3 Å²	47.3	15%	0.153	24%	0.244	C	C	.	.	H	α-helix	trans	-67.5	-34.2	175.1	-74.8	-29.5	0	0	0	111.4	L629 T630 L662 P663 S664 T669 L670	L629-H666 HydrophobicContact CD1-CB 3.99Å; T630-H666 PolarHBondContact OG1-CE1 2.83Å; L662-H666 HydrophobicContact CB-CB 4.48Å; L662-H666 HydrophobicContact CD2-CB 4.33Å; P663-H666 HydrophobicContact CG-CB 4.17Å; P663-H666 WeakPolarHBondContact CG-CD2 3.41Å; P663-H666 PolarHBondContact O-N 3.2Å; S664-H666 PolarHBondContact O-N 3.25Å; H666-T669 PolarHBondContact O-N 3.22Å; H666-L670 VanDerWaalsContact O-CB 3.3Å; H666-L670 WeakPolarHBondContact O-CB 3.49Å; H666-L670 PolarHBondContact O-N 2.8Å
667	M	84.4	Confident	85.2	Confident	2 Å²	2	46.9 Å²	46.9	1%	0.01	24%	0.239	C	C	.	.	H	α-helix	trans	-65.3	-39.2	173.6	-69.2	-65.7	-83.4	0	0	112.1	L659 L662 P663 S664 E665 L670 I671 V694 Y698 W706	L659-M667 HydrophobicContact CD2-SD 4.46Å; L662-M667 HydrophobicContact CB-CG 4.32Å; L662-M667 HydrophobicContact CB-SD 4.29Å; L662-M667 HydrophobicContact CD1-SD 4.32Å; P663-M667 PolarHBondContact O-N 3.19Å; S664-M667 WeakPolarHBondContact O-CB 3.38Å; S664-M667 PolarHBondContact O-N 3.44Å; E665-M667 VanDerWaalsContact C-N 3.31Å; M667-L670 PolarHBondContact O-N 3.31Å; M667-L670 HydrophobicContact SD-CD2 4.35Å; M667-I671 WeakPolarHBondContact O-CG1 3.39Å; M667-I671 PolarHBondContact O-N 3.24Å; M667-V694 HydrophobicContact CE-CG2 3.66Å; M667-Y698 HydrophobicContact CE-CE2 3.83Å; M667-W706 HydrophobicContact CB-CZ2 4.49Å
668	Q	83.3	Confident	85.6	Confident	49 Å²	49	42.9 Å²	42.9	23%	0.229	22%	0.219	C	C	.	.	H	α-helix	trans	-63.2	-45.9	174.4	-171.6	-170.1	4	0	0	111.8	S664 E665 L670 I671 S672 P707 L712	S664-Q668 PolarHBondContact O-N 3.39Å; E665-Q668 PolarHBondContact O-N 2.56Å; Q668-L670 PolarHBondContact O-N 3.34Å; Q668-I671 PolarHBondContact O-N 3.28Å; Q668-S672 PolarHBondContact O-N 3.29Å; Q668-S672 VanDerWaalsContact O-N 3.08Å; Q668-P707 PolarHBondContact NE2-O 2.83Å; Q668-L712 HydrophobicContact CG-CD1 4.19Å
669	T	87.5	Confident	86.1	Confident	20 Å²	20	46.1 Å²	46.1	12%	0.123	24%	0.238	C	C	.	.	H	α-helix	trans	-63.1	-34.3	176.2	-53.7	0	0	0	0	111.4	L629 R632 E665 H666 S672 F673	L629-T669 HydrophobicContact CD2-CG2 4.31Å; R632-T669 HydrophobicContact CG-CG2 4.11Å; E665-T669 PolarHBondContact O-N 3.11Å; E665-T669 VanDerWaalsContact O-N 3.12Å; E665-T669 PolarHBondContact O-OG1 2.79Å; E665-T669 VanDerWaalsContact O-OG1 3.13Å; H666-T669 PolarHBondContact O-N 3.22Å; T669-S672 PolarHBondContact O-N 3.33Å; T669-S672 PolarHBondContact O-OG 3.24Å; T669-F673 HydrophobicContact CG2-CE1 4.16Å; T669-F673 HydrophobicContact CG2-CE2 3.94Å; T669-F673 HydrophobicContact CG2-CZ 3.68Å; T669-F673 VanDerWaalsContact O-CG 3.3Å; T669-F673 WeakPolarHBondContact O-CG 3.47Å; T669-F673 PolarHBondContact O-N 3.28Å; T669-F673 VanDerWaalsContact O-N 3.17Å
670	L	88.8	Confident	86.5	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-69.7	-34.3	176.2	-173.1	66.8	0	0	0	112.2	F625 L629 L659 H666 M667 Q668 F673 A674 W677 I690	F625-L670 HydrophobicContact CE1-CD1 4.42Å; F625-L670 HydrophobicContact CE1-CD2 4.4Å; F625-L670 HydrophobicContact CZ-CD1 3.72Å; F625-L670 HydrophobicContact CZ-CD2 4.19Å; L629-L670 HydrophobicContact CD2-CB 4.1Å; L629-L670 HydrophobicContact CD2-CD1 4.12Å; L659-L670 HydrophobicContact CD2-CD2 3.31Å; H666-L670 VanDerWaalsContact O-CB 3.3Å; H666-L670 WeakPolarHBondContact O-CB 3.49Å; H666-L670 PolarHBondContact O-N 2.8Å; M667-L670 PolarHBondContact O-N 3.31Å; M667-L670 HydrophobicContact SD-CD2 4.35Å; Q668-L670 PolarHBondContact O-N 3.34Å; L670-F673 PolarHBondContact O-N 2.78Å; L670-A674 WeakPolarHBondContact O-CB 3.29Å; L670-A674 PolarHBondContact O-N 3Å; L670-W677 HydrophobicContact CD1-CH2 4.18Å; L670-W677 HydrophobicContact CD1-CZ3 4.42Å; L670-I690 HydrophobicContact CD1-CD1 3.72Å; L670-I690 HydrophobicContact CD2-CD1 4.05Å; L670-I690 HydrophobicContact CD2-CG1 4.05Å; L670-I690 HydrophobicContact CD2-CG2 3.78Å; L670-I690 HydrophobicContact CG-CD1 3.81Å; L670-I690 HydrophobicContact CG-CG1 4.3Å; L670-I690 HydrophobicContact CG-CG2 3.9Å
671	I	88.9	Confident	86.8	Confident	20 Å²	20	45.6 Å²	45.6	10%	0.103	25%	0.247	C	C	.	.	H	α-helix	trans	-68.4	-40.3	174.6	-70.8	166.9	0	0	0	111.1	M667 Q668 F673 A674 I675 V694 W706 L712	M667-I671 WeakPolarHBondContact O-CG1 3.39Å; M667-I671 PolarHBondContact O-N 3.24Å; Q668-I671 PolarHBondContact O-N 3.28Å; I671-F673 PolarHBondContact O-N 3.25Å; I671-A674 WeakPolarHBondContact O-CB 3.39Å; I671-A674 PolarHBondContact O-N 2.87Å; I671-A674 VanDerWaalsContact O-N 3.08Å; I671-I675 WeakPolarHBondContact O-CG1 3.5Å; I671-I675 PolarHBondContact O-N 3.13Å; I671-V694 HydrophobicContact CD1-CG1 4.24Å; I671-V694 HydrophobicContact CD1-CG2 4.2Å; I671-V694 HydrophobicContact CG1-CG2 4.36Å; I671-W706 HydrophobicContact CD1-CE3 3.97Å; I671-W706 HydrophobicContact CD1-CH2 3.8Å; I671-W706 HydrophobicContact CD1-CZ3 3.14Å; I671-L712 HydrophobicContact CG2-CB 4.21Å; I671-L712 HydrophobicContact CG2-CD1 4.41Å
672	S	88.1	Confident	87	Confident	44 Å²	44	48.1 Å²	48.1	31%	0.308	25%	0.253	S	S	.	.	H	α-helix	trans	-61.2	-37.4	174.2	66.9	0	0	0	0	111.6	Q668 T669 I675 E676	Q668-S672 PolarHBondContact O-N 3.29Å; Q668-S672 VanDerWaalsContact O-N 3.08Å; T669-S672 PolarHBondContact O-N 3.33Å; T669-S672 PolarHBondContact O-OG 3.24Å; S672-I675 PolarHBondContact O-N 2.58Å; S672-E676 PolarHBondContact O-N 3.26Å
673	F	91.2	Very high	87.2	Confident	10 Å²	10	48.5 Å²	48.5	4%	0.044	26%	0.255	C	S	.	.	H	α-helix	trans	-67.7	-38	171.6	-61.6	-15.3	0	0	0	113.1	L629 R632 P634 T637 T669 L670 I671 I675 E676 W677	L629-F673 HydrophobicContact CD2-CD2 4.03Å; L629-F673 HydrophobicContact CD2-CE2 3.83Å; R632-F673 VanDerWaalsContact C-CZ 3.46Å; R632-F673 HydrophobicContact CB-CZ 4.22Å; P634-F673 HydrophobicContact CB-CB 4.38Å; P634-F673 HydrophobicContact CB-CD1 3.71Å; P634-F673 HydrophobicContact CB-CD2 4.38Å; P634-F673 HydrophobicContact CB-CE1 4.01Å; P634-F673 HydrophobicContact CB-CG 3.92Å; P634-F673 HydrophobicContact CB-CZ 4.43Å; P634-F673 HydrophobicContact CG-CD1 4.4Å; P634-F673 HydrophobicContact CG-CE1 4.31Å; T637-F673 HydrophobicContact CG2-CD2 4.28Å; T637-F673 HydrophobicContact CG2-CE2 4.05Å; T669-F673 HydrophobicContact CG2-CE1 4.16Å; T669-F673 HydrophobicContact CG2-CE2 3.94Å; T669-F673 HydrophobicContact CG2-CZ 3.68Å; T669-F673 VanDerWaalsContact O-CG 3.3Å; T669-F673 WeakPolarHBondContact O-CG 3.47Å; T669-F673 PolarHBondContact O-N 3.28Å; T669-F673 VanDerWaalsContact O-N 3.17Å; L670-F673 PolarHBondContact O-N 2.78Å; I671-F673 PolarHBondContact O-N 3.25Å; F673-I675 PolarHBondContact O-N 3.43Å; F673-E676 PolarHBondContact O-N 3.24Å; F673-W677 HydrophobicContact CB-CD2 4.46Å; F673-W677 HydrophobicContact CB-CH2 4.05Å; F673-W677 HydrophobicContact CB-CZ2 3.65Å; F673-W677 HydrophobicContact CD2-CZ2 4.34Å; F673-W677 HydrophobicContact CG-CZ2 4.34Å; F673-W677 PolarHBondContact O-N 3.18Å
674	A	89.9	Confident	87.5	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-61.1	-34.5	176.2	0	0	0	0	0	111.8	L670 I671 W677 N678 A687 I690	L670-A674 WeakPolarHBondContact O-CB 3.29Å; L670-A674 PolarHBondContact O-N 3Å; I671-A674 WeakPolarHBondContact O-CB 3.39Å; I671-A674 PolarHBondContact O-N 2.87Å; I671-A674 VanDerWaalsContact O-N 3.08Å; A674-W677 PolarHBondContact O-N 3.2Å; A674-N678 VanDerWaalsContact O-CB 3.26Å; A674-N678 WeakPolarHBondContact O-CB 3.43Å; A674-N678 PolarHBondContact O-N 3.4Å; A674-A687 HydrophobicContact CB-CB 4.11Å; A674-A687 WeakPolarHBondContact O-CB 3.37Å; A674-I690 HydrophobicContact CB-CG2 4.46Å
675	I	89.2	Confident	87.9	Confident	29 Å²	29	48.7 Å²	48.7	15%	0.149	24%	0.244	C	C	.	.	H	α-helix	trans	-61	-49.7	173.6	-65.6	165.2	0	0	0	110.3	I671 S672 F673 W677 N678 L712 D715 L716	I671-I675 WeakPolarHBondContact O-CG1 3.5Å; I671-I675 PolarHBondContact O-N 3.13Å; S672-I675 PolarHBondContact O-N 2.58Å; F673-I675 PolarHBondContact O-N 3.43Å; I675-W677 VanDerWaalsContact C-N 3.3Å; I675-W677 PolarHBondContact O-N 3.01Å; I675-N678 PolarHBondContact O-N 2.72Å; I675-L712 HydrophobicContact CD1-CB 4.1Å; I675-L712 HydrophobicContact CD1-CD2 3.43Å; I675-L712 VanDerWaalsContact CD1-CD2 3.43Å; I675-L712 HydrophobicContact CD1-CG 4.38Å; I675-L712 WeakPolarHBondContact CD1-O 3.43Å; I675-D715 HydrophobicContact CD1-CB 4.13Å; I675-D715 HydrophobicContact CG2-CB 3.98Å; I675-L716 HydrophobicContact CG1-CB 4.48Å; I675-L716 HydrophobicContact CG1-CD1 4.22Å
676	E	89.3	Confident	88.3	Confident	108 Å²	108	43 Å²	43	51%	0.505	22%	0.217	S	C	.	.	H	α-helix	trans	-59	-42.6	176.9	-66.3	-176.1	179.6	0	0	111.6	P634 S672 F673 N678 T679	P634-E676 WeakPolarHBondContact CB-OE2 3.48Å; P634-E676 WeakPolarHBondContact CG-OE2 3.45Å; S672-E676 PolarHBondContact O-N 3.26Å; F673-E676 PolarHBondContact O-N 3.24Å; E676-N678 PolarHBondContact O-N 2.84Å; E676-T679 PolarHBondContact O-N 2.82Å; E676-T679 PolarHBondContact O-OG1 2.95Å
677	W	92	Very high	88.4	Confident	14 Å²	14	41.5 Å²	41.5	5%	0.053	21%	0.21	C	C	.	.	H	α-helix	trans	-73.3	-26	-178.4	-58.2	-15	0	0	0	113.8	P634 T637 L638 L641 L670 F673 A674 I675 T679 S680 T683 C684 F686 A687 I690	P634-W677 WeakPolarHBondContact O-CZ2 3.47Å; P634-W677 PolarHBondContact O-NE1 3.46Å; T637-W677 VanDerWaalsContact OG1-CZ2 3.29Å; T637-W677 WeakPolarHBondContact OG1-CZ2 3.31Å; L638-W677 HydrophobicContact CB-CD2 4.47Å; L638-W677 HydrophobicContact CB-CH2 4.3Å; L638-W677 HydrophobicContact CB-CZ2 3.77Å; L638-W677 HydrophobicContact CD1-CB 4.44Å; L638-W677 HydrophobicContact CD1-CD2 3.76Å; L638-W677 HydrophobicContact CD1-CE3 4.44Å; L638-W677 HydrophobicContact CD1-CG 3.69Å; L638-W677 HydrophobicContact CG-CD2 4.48Å; L641-W677 HydrophobicContact CD1-CH2 3.72Å; L641-W677 HydrophobicContact CD1-CZ3 3.45Å; L641-W677 VanDerWaalsContact CD1-CZ3 3.45Å; L670-W677 HydrophobicContact CD1-CH2 4.18Å; L670-W677 HydrophobicContact CD1-CZ3 4.42Å; F673-W677 HydrophobicContact CB-CD2 4.46Å; F673-W677 HydrophobicContact CB-CH2 4.05Å; F673-W677 HydrophobicContact CB-CZ2 3.65Å; F673-W677 HydrophobicContact CD2-CZ2 4.34Å; F673-W677 HydrophobicContact CG-CZ2 4.34Å; F673-W677 PolarHBondContact O-N 3.18Å; A674-W677 PolarHBondContact O-N 3.2Å; I675-W677 VanDerWaalsContact C-N 3.3Å; I675-W677 PolarHBondContact O-N 3.01Å; W677-T679 PolarHBondContact O-N 3.35Å; W677-S680 PolarHBondContact O-N 3.35Å; W677-T683 CarbonylContact O-C 3.52Å; W677-T683 PolarHBondContact O-OG1 3.03Å; W677-C684 PolarHBondContact O-N 2.95Å; W677-F686 HydrophobicContact CE3-CB 4.31Å; W677-A687 HydrophobicContact CB-CB 4.18Å; W677-I690 HydrophobicContact CE3-CD1 4.06Å; W677-I690 HydrophobicContact CH2-CD1 4.36Å; W677-I690 HydrophobicContact CZ3-CD1 3.4Å; W677-I690 VanDerWaalsContact CZ3-CD1 3.4Å
678	N	90.8	Very high	88.7	Confident	1 Å²	1	44.2 Å²	44.2	1%	0.005	22%	0.223	C	C	.	.	H	α-helix	trans	-71.3	-21.2	179.6	-160.5	27.3	0	0	0	112.3	A674 I675 E676 S680 A687 Q688 L716 Y719 T720 H723	A674-N678 VanDerWaalsContact O-CB 3.26Å; A674-N678 WeakPolarHBondContact O-CB 3.43Å; A674-N678 PolarHBondContact O-N 3.4Å; I675-N678 PolarHBondContact O-N 2.72Å; E676-N678 PolarHBondContact O-N 2.84Å; N678-S680 PolarHBondContact O-N 3.18Å; N678-A687 HydrophobicContact CB-CB 4.02Å; N678-Q688 PolarHBondContact OD1-NE2 2.89Å; N678-Q688 VanDerWaalsContact OD1-NE2 3.13Å; N678-L716 HydrophobicContact CB-CD1 4.4Å; N678-L716 PolarHBondContact ND2-O 3.31Å; N678-Y719 VanDerWaalsContact ND2-CB 3.3Å; N678-Y719 WeakPolarHBondContact ND2-CB 3.48Å; N678-T720 PolarHBondContact ND2-N 2.81Å; N678-H723 PolarHBondContact O-NE2 2.9Å; N678-H723 PolarHBondContact OD1-CD2 3.26Å; N678-H723 VanDerWaalsContact OD1-CD2 3.3Å
679	T	89.6	Confident	88.8	Confident	79 Å²	79	43.1 Å²	43.1	49%	0.485	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-26.2	176	66.8	0	0	0	0	113.1	E676 W677 Y719	E676-T679 PolarHBondContact O-N 2.82Å; E676-T679 PolarHBondContact O-OG1 2.95Å; W677-T679 PolarHBondContact O-N 3.35Å; T679-Y719 HydrophobicContact CG2-CD2 4.5Å; T679-Y719 HydrophobicContact CG2-CE2 4.04Å
680	S	88.8	Confident	88.9	Confident	47 Å²	47	42.2 Å²	42.2	33%	0.329	21%	0.212	S	C	.	.	S	Bend	trans	-109.6	132.6	-178.1	172.1	0	0	0	0	112	W677 N678 R682 T683 C684	W677-S680 PolarHBondContact O-N 3.35Å; N678-S680 PolarHBondContact O-N 3.18Å; S680-R682 PolarHBondContact O-N 3.03Å; S680-R682 PolarHBondContact OG-N 3.11Å; S680-T683 WeakPolarHBondContact CB-OG1 3.34Å; S680-T683 PolarHBondContact O-N 3.2Å; S680-T683 PolarHBondContact O-OG1 3.15Å; S680-C684 WeakPolarHBondContact O-CB 3.19Å; S680-C684 PolarHBondContact O-N 3.27Å
681	S	85.3	Confident	88.9	Confident	57 Å²	57	43.3 Å²	43.3	40%	0.399	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-24.9	178.7	60.8	0	0	0	0	114
682	R	86.5	Confident	88.8	Confident	209 Å²	209	44.3 Å²	44.3	79%	0.789	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.7	-24.5	179.9	-64.6	-177.2	-179.2	175.1	0.3	113.3	S680	S680-R682 PolarHBondContact O-N 3.03Å; S680-R682 PolarHBondContact OG-N 3.11Å
683	T	88.5	Confident	88.7	Confident	17 Å²	17	43.1 Å²	43.1	10%	0.104	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.9	-11.9	-174.4	50.2	0	0	0	0	112.6	L638 W677 S680 H685 F686 A687	L638-T683 HydrophobicContact CD1-CG2 3.49Å; L638-T683 VanDerWaalsContact CD1-CG2 3.49Å; L638-T683 HydrophobicContact CD2-CG2 4.4Å; W677-T683 CarbonylContact O-C 3.52Å; W677-T683 PolarHBondContact O-OG1 3.03Å; S680-T683 WeakPolarHBondContact CB-OG1 3.34Å; S680-T683 PolarHBondContact O-N 3.2Å; S680-T683 PolarHBondContact O-OG1 3.15Å; T683-H685 PolarHBondContact O-N 2.99Å; T683-F686 PolarHBondContact O-N 3.09Å; T683-A687 PolarHBondContact O-N 2.81Å
684	C	88.6	Confident	88.4	Confident	6 Å²	6	43.1 Å²	43.1	4%	0.041	22%	0.218	C	C	.	.	H	α-helix	trans	-49.5	-41.1	176.4	173.3	0	0	0	0	113.2	W677 S680 F686 A687 Q688 H723	W677-C684 PolarHBondContact O-N 2.95Å; S680-C684 WeakPolarHBondContact O-CB 3.19Å; S680-C684 PolarHBondContact O-N 3.27Å; C684-F686 VanDerWaalsContact C-N 3.26Å; C684-F686 PolarHBondContact O-N 3.47Å; C684-A687 WeakPolarHBondContact O-CB 3.24Å; C684-A687 PolarHBondContact O-N 2.94Å; C684-Q688 WeakPolarHBondContact O-CG 3.09Å; C684-Q688 PolarHBondContact O-N 3.03Å; C684-H723 PolarHBondContact SG-CD2 3.17Å
685	H	87.5	Confident	88.2	Confident	132 Å²	132	49.2 Å²	49.2	61%	0.611	25%	0.25	S	C	*	.	H	α-helix	trans	-57.5	-36.8	179.8	-58	-63.7	0	0	0	113.3	T683 L689	T683-H685 PolarHBondContact O-N 2.99Å; H685-L689 VanDerWaalsContact O-CB 3.3Å; H685-L689 WeakPolarHBondContact O-CB 3.36Å; H685-L689 PolarHBondContact O-N 3.11Å
686	F	89.4	Confident	88	Confident	27 Å²	27	56.1 Å²	56.1	12%	0.118	28%	0.279	C	S	.	.	H	α-helix	trans	-71.7	-40.6	175.9	-64.4	-75.3	0	0	0	111.8	L641 R642 T645 W677 T683 C684 L689 I690	L641-F686 HydrophobicContact CB-CD1 3.76Å; L641-F686 HydrophobicContact CB-CE1 4Å; L641-F686 HydrophobicContact CD1-CD1 4.49Å; R642-F686 HydrophobicContact CB-CZ 4.3Å; R642-F686 HydrophobicContact CG-CE1 4.3Å; R642-F686 HydrophobicContact CG-CE2 3.73Å; R642-F686 HydrophobicContact CG-CZ 3.48Å; R642-F686 VanDerWaalsContact CG-CZ 3.48Å; T645-F686 HydrophobicContact CG2-CE1 3.72Å; T645-F686 HydrophobicContact CG2-CZ 4.42Å; W677-F686 HydrophobicContact CE3-CB 4.31Å; T683-F686 PolarHBondContact O-N 3.09Å; C684-F686 VanDerWaalsContact C-N 3.26Å; C684-F686 PolarHBondContact O-N 3.47Å; F686-L689 PolarHBondContact O-N 2.82Å; F686-I690 WeakPolarHBondContact O-CG1 3.42Å; F686-I690 PolarHBondContact O-N 3.11Å
687	A	89.6	Confident	87.7	Confident	0 Å²	0	56 Å²	56	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-59.8	-50.1	173.5	0	0	0	0	0	110.9	A674 W677 N678 T683 C684 L689 I690 I691	A674-A687 HydrophobicContact CB-CB 4.11Å; A674-A687 WeakPolarHBondContact O-CB 3.37Å; W677-A687 HydrophobicContact CB-CB 4.18Å; N678-A687 HydrophobicContact CB-CB 4.02Å; T683-A687 PolarHBondContact O-N 2.81Å; C684-A687 WeakPolarHBondContact O-CB 3.24Å; C684-A687 PolarHBondContact O-N 2.94Å; A687-L689 VanDerWaalsContact C-N 3.32Å; A687-L689 PolarHBondContact O-N 3.02Å; A687-I690 PolarHBondContact O-N 3.19Å; A687-I691 HydrophobicContact CB-CD1 4.44Å; A687-I691 WeakPolarHBondContact O-CD1 3.5Å; A687-I691 WeakPolarHBondContact O-CG1 3.34Å; A687-I691 PolarHBondContact O-N 3.18Å
688	Q	89.1	Confident	87.4	Confident	60 Å²	60	57 Å²	57	28%	0.28	28%	0.278	S	S	.	.	H	α-helix	trans	-63.4	-35.3	178.1	-62.3	-54.2	-34.3	0	0	112.6	N678 C684 I691 S692 T720	N678-Q688 PolarHBondContact OD1-NE2 2.89Å; N678-Q688 VanDerWaalsContact OD1-NE2 3.13Å; C684-Q688 WeakPolarHBondContact O-CG 3.09Å; C684-Q688 PolarHBondContact O-N 3.03Å; Q688-I691 PolarHBondContact O-N 3.17Å; Q688-S692 VanDerWaalsContact O-CB 3.26Å; Q688-S692 WeakPolarHBondContact O-CB 3.5Å; Q688-S692 PolarHBondContact O-N 3.1Å; Q688-S692 PolarHBondContact O-OG 3.32Å; Q688-T720 VanDerWaalsContact NE2-CG2 3.26Å
689	L	86.5	Confident	87.2	Confident	25 Å²	25	60.1 Å²	60.1	13%	0.131	30%	0.297	C	S	.	.	H	α-helix	trans	-60.9	-47	173.3	179.8	61.1	0	0	0	111.2	L652 I655 H685 F686 A687 S692 N693	L652-L689 HydrophobicContact CD2-CD1 3.38Å; L652-L689 HydrophobicContact CD2-CD2 4.07Å; L652-L689 HydrophobicContact CD2-CG 4.36Å; I655-L689 HydrophobicContact CB-CD2 4.37Å; I655-L689 HydrophobicContact CD1-CD2 3.76Å; I655-L689 HydrophobicContact CG2-CD2 3.91Å; I655-L689 HydrophobicContact CG2-CG 4.49Å; H685-L689 VanDerWaalsContact O-CB 3.3Å; H685-L689 WeakPolarHBondContact O-CB 3.36Å; H685-L689 PolarHBondContact O-N 3.11Å; F686-L689 PolarHBondContact O-N 2.82Å; A687-L689 VanDerWaalsContact C-N 3.32Å; A687-L689 PolarHBondContact O-N 3.02Å; L689-S692 PolarHBondContact O-N 2.82Å; L689-S692 PolarHBondContact O-OG 2.81Å; L689-N693 PolarHBondContact O-N 2.95Å; L689-N693 PolarHBondContact O-ND2 3.48Å; L689-N693 VanDerWaalsContact O-ND2 3.1Å
690	I	88.7	Confident	87	Confident	2 Å²	2	61.9 Å²	61.9	1%	0.01	31%	0.31	C	S	.	.	H	α-helix	trans	-62.5	-48.8	177.1	-69.9	162.1	0	0	0	110.5	L641 L670 A674 W677 F686 A687 S692 N693 V694	L641-I690 HydrophobicContact CD1-CD1 4Å; L670-I690 HydrophobicContact CD1-CD1 3.72Å; L670-I690 HydrophobicContact CD2-CD1 4.05Å; L670-I690 HydrophobicContact CD2-CG1 4.05Å; L670-I690 HydrophobicContact CD2-CG2 3.78Å; L670-I690 HydrophobicContact CG-CD1 3.81Å; L670-I690 HydrophobicContact CG-CG1 4.3Å; L670-I690 HydrophobicContact CG-CG2 3.9Å; A674-I690 HydrophobicContact CB-CG2 4.46Å; W677-I690 HydrophobicContact CE3-CD1 4.06Å; W677-I690 HydrophobicContact CH2-CD1 4.36Å; W677-I690 HydrophobicContact CZ3-CD1 3.4Å; W677-I690 VanDerWaalsContact CZ3-CD1 3.4Å; F686-I690 WeakPolarHBondContact O-CG1 3.42Å; F686-I690 PolarHBondContact O-N 3.11Å; A687-I690 PolarHBondContact O-N 3.19Å; I690-S692 VanDerWaalsContact C-N 3.3Å; I690-S692 PolarHBondContact O-N 3.01Å; I690-N693 PolarHBondContact O-N 2.62Å; I690-N693 VanDerWaalsContact O-N 3.12Å; I690-V694 HydrophobicContact CG2-CG2 4.26Å; I690-V694 VanDerWaalsContact O-CG2 3.32Å; I690-V694 WeakPolarHBondContact O-CG2 3.43Å; I690-V694 PolarHBondContact O-N 2.93Å
691	I	88.4	Confident	86.9	Confident	22 Å²	22	67.1 Å²	67.1	11%	0.113	33%	0.329	C	S	.	.	H	α-helix	trans	-58.3	-44.8	179.3	-63.6	154.6	0	0	0	110.1	A687 Q688 N693 V694 L695 L716 T720	A687-I691 HydrophobicContact CB-CD1 4.44Å; A687-I691 WeakPolarHBondContact O-CD1 3.5Å; A687-I691 WeakPolarHBondContact O-CG1 3.34Å; A687-I691 PolarHBondContact O-N 3.18Å; Q688-I691 PolarHBondContact O-N 3.17Å; I691-N693 VanDerWaalsContact C-N 3.32Å; I691-N693 PolarHBondContact O-N 3.21Å; I691-V694 PolarHBondContact O-N 3.2Å; I691-L695 HydrophobicContact CG2-CD1 3.85Å; I691-L695 HydrophobicContact CG2-CG 4.28Å; I691-L695 WeakPolarHBondContact O-CB 3.41Å; I691-L695 VanDerWaalsContact O-CG 3.27Å; I691-L695 WeakPolarHBondContact O-CG 3.49Å; I691-L695 PolarHBondContact O-N 2.84Å; I691-L716 HydrophobicContact CD1-CD1 3.44Å; I691-L716 VanDerWaalsContact CD1-CD1 3.44Å; I691-L716 HydrophobicContact CD1-CD2 3.61Å; I691-L716 HydrophobicContact CD1-CG 3.89Å; I691-L716 HydrophobicContact CG1-CD1 4.19Å; I691-L716 HydrophobicContact CG1-CD2 3.74Å; I691-L716 HydrophobicContact CG2-CD2 4.19Å; I691-T720 HydrophobicContact CD1-CG2 4.32Å
692	S	87.5	Confident	86.9	Confident	42 Å²	42	68.2 Å²	68.2	29%	0.294	33%	0.327	S	S	.	.	H	α-helix	trans	-63.4	-35.5	178.4	76.8	0	0	0	0	113	Q688 L689 I690 K696	Q688-S692 VanDerWaalsContact O-CB 3.26Å; Q688-S692 WeakPolarHBondContact O-CB 3.5Å; Q688-S692 PolarHBondContact O-N 3.1Å; Q688-S692 PolarHBondContact O-OG 3.32Å; L689-S692 PolarHBondContact O-N 2.82Å; L689-S692 PolarHBondContact O-OG 2.81Å; I690-S692 VanDerWaalsContact C-N 3.3Å; I690-S692 PolarHBondContact O-N 3.01Å; S692-K696 WeakPolarHBondContact O-CB 3.5Å; S692-K696 VanDerWaalsContact O-CG 3.25Å; S692-K696 WeakPolarHBondContact O-CG 3.18Å; S692-K696 PolarHBondContact O-N 3.13Å; S692-K696 VanDerWaalsContact O-N 3.13Å
693	N	85.5	Confident	86.8	Confident	18 Å²	18	59.2 Å²	59.2	10%	0.096	30%	0.296	C	S	.	.	H	α-helix	trans	-73.8	-38.7	176.1	-77.1	-46	0	0	0	111.6	S656 L659 L689 I690 I691 K696 R697	S656-N693 PolarHBondContact OG-ND2 3.46Å; S656-N693 PolarHBondContact OG-OD1 3.13Å; L659-N693 HydrophobicContact CD1-CB 3.88Å; L659-N693 WeakPolarHBondContact CD1-ND2 3.24Å; L689-N693 PolarHBondContact O-N 2.95Å; L689-N693 PolarHBondContact O-ND2 3.48Å; L689-N693 VanDerWaalsContact O-ND2 3.1Å; I690-N693 PolarHBondContact O-N 2.62Å; I690-N693 VanDerWaalsContact O-N 3.12Å; I691-N693 VanDerWaalsContact C-N 3.32Å; I691-N693 PolarHBondContact O-N 3.21Å; N693-K696 PolarHBondContact O-N 3.3Å; N693-R697 WeakPolarHBondContact O-CB 3.04Å; N693-R697 PolarHBondContact O-N 3.45Å; N693-R697 VanDerWaalsContact O-N 3.15Å
694	V	85.2	Confident	86.6	Confident	10 Å²	10	63.7 Å²	63.7	6%	0.061	32%	0.319	C	S	.	.	H	α-helix	trans	-60.8	-48.7	173.5	171.8	0	0	0	0	110.2	M667 I671 I690 I691 K696 R697 Y698 V703 W706	M667-V694 HydrophobicContact CE-CG2 3.66Å; I671-V694 HydrophobicContact CD1-CG1 4.24Å; I671-V694 HydrophobicContact CD1-CG2 4.2Å; I671-V694 HydrophobicContact CG1-CG2 4.36Å; I690-V694 HydrophobicContact CG2-CG2 4.26Å; I690-V694 VanDerWaalsContact O-CG2 3.32Å; I690-V694 WeakPolarHBondContact O-CG2 3.43Å; I690-V694 PolarHBondContact O-N 2.93Å; I691-V694 PolarHBondContact O-N 3.2Å; V694-K696 VanDerWaalsContact C-N 3.3Å; V694-K696 PolarHBondContact O-N 3.4Å; V694-R697 PolarHBondContact O-N 2.92Å; V694-R697 VanDerWaalsContact O-N 3.15Å; V694-Y698 HydrophobicContact CG1-CD2 4.17Å; V694-Y698 PolarHBondContact O-N 3.01Å; V694-V703 HydrophobicContact CG1-CG2 4.46Å; V694-W706 HydrophobicContact CG1-CH2 4.02Å; V694-W706 HydrophobicContact CG1-CZ3 4.29Å
695	L	85.2	Confident	86.5	Confident	128 Å²	128	71.1 Å²	71.1	67%	0.67	35%	0.353	S	S	*	.	H	α-helix	trans	-66.1	-27.8	-179.7	-70	174.2	0	0	0	113.8	I691	I691-L695 HydrophobicContact CG2-CD1 3.85Å; I691-L695 HydrophobicContact CG2-CG 4.28Å; I691-L695 WeakPolarHBondContact O-CB 3.41Å; I691-L695 VanDerWaalsContact O-CG 3.27Å; I691-L695 WeakPolarHBondContact O-CG 3.49Å; I691-L695 PolarHBondContact O-N 2.84Å
696	K	85.9	Confident	86.4	Confident	174 Å²	174	66.4 Å²	66.4	76%	0.757	33%	0.329	S	S	*	.	H	α-helix	trans	-77.3	-27.2	174.1	-77.7	174.4	-178.7	178.9	0	112.9	S692 N693 V694	S692-K696 WeakPolarHBondContact O-CB 3.5Å; S692-K696 VanDerWaalsContact O-CG 3.25Å; S692-K696 WeakPolarHBondContact O-CG 3.18Å; S692-K696 PolarHBondContact O-N 3.13Å; S692-K696 VanDerWaalsContact O-N 3.13Å; N693-K696 PolarHBondContact O-N 3.3Å; V694-K696 VanDerWaalsContact C-N 3.3Å; V694-K696 PolarHBondContact O-N 3.4Å
697	R	82.8	Confident	85.9	Confident	107 Å²	107	69 Å²	69	40%	0.404	35%	0.349	S	S	.	.	H	α-helix	trans	-96.4	-44.1	-171.7	-177.3	176.8	-177.9	-176.3	7.4	113.1	L659 E660 N693 V694	L659-R697 PolarHBondContact O-NH1 2.99Å; E660-R697 PolarHBondContact O-NH1 3.09Å; E660-R697 PolarHBondContact O-NH2 3.37Å; N693-R697 WeakPolarHBondContact O-CB 3.04Å; N693-R697 PolarHBondContact O-N 3.45Å; N693-R697 VanDerWaalsContact O-N 3.15Å; V694-R697 PolarHBondContact O-N 2.92Å; V694-R697 VanDerWaalsContact O-N 3.15Å
698	Y	85.2	Confident	85.5	Confident	35 Å²	35	74.5 Å²	74.5	14%	0.137	38%	0.379	C	S	.	.	S	Bend	trans	-103.7	136.6	-173.4	-65.6	-80.9	0	0	0	110.5	M667 V694 E702 V703 W706	M667-Y698 HydrophobicContact CE-CE2 3.83Å; V694-Y698 HydrophobicContact CG1-CD2 4.17Å; V694-Y698 PolarHBondContact O-N 3.01Å; Y698-E702 VanDerWaalsContact CA-OE2 3.3Å; Y698-E702 WeakPolarHBondContact CA-OE2 3.37Å; Y698-E702 HydrophobicContact CD1-CB 4.2Å; Y698-E702 WeakPolarHBondContact CD1-OE2 3.45Å; Y698-V703 HydrophobicContact CG-CG2 4.48Å; Y698-W706 HydrophobicContact CD1-CZ2 4.23Å; Y698-W706 HydrophobicContact CD2-CH2 4.08Å; Y698-W706 HydrophobicContact CD2-CZ2 4.14Å; Y698-W706 HydrophobicContact CE1-CZ2 4.17Å; Y698-W706 HydrophobicContact CE2-CH2 4.23Å; Y698-W706 HydrophobicContact CE2-CZ2 4.06Å; Y698-W706 HydrophobicContact CG-CH2 4.4Å; Y698-W706 HydrophobicContact CG-CZ2 4.21Å
699	T	87.8	Confident	85.2	Confident	66 Å²	66	71.9 Å²	71.9	41%	0.405	37%	0.367	S	S	.	.			trans	-69.4	154.5	169.5	66.2	0	0	0	0	109.7	E701 E702 V703	T699-E701 PolarHBondContact O-N 3.29Å; T699-E701 VanDerWaalsContact O-N 3.11Å; T699-E702 PolarHBondContact N-OE2 2.84Å; T699-E702 VanDerWaalsContact N-OE2 3.09Å; T699-E702 PolarHBondContact O-N 2.84Å; T699-E702 VanDerWaalsContact O-N 3.1Å; T699-E702 WeakPolarHBondContact OG1-CG 3.44Å; T699-E702 PolarHBondContact OG1-N 3.02Å; T699-V703 PolarHBondContact O-N 2.78Å
700	P	84.4	Confident	85.1	Confident	116 Å²	116	78.7 Å²	78.7	75%	0.753	40%	0.396	S	S	*	.	H	α-helix	trans	-54.3	-30.1	174.3	-26.7	35.1	0	0	0	113.3	L704	P700-L704 PolarHBondContact O-N 2.84Å
701	E	87.1	Confident	85	Confident	156 Å²	156	82.3 Å²	82.3	73%	0.729	42%	0.418	S	S	*	.	H	α-helix	trans	-69.3	-42.6	177.6	-62.8	-178.5	177.8	0	0	112.1	T699 L704	T699-E701 PolarHBondContact O-N 3.29Å; T699-E701 VanDerWaalsContact O-N 3.11Å; E701-L704 WeakPolarHBondContact O-CB 3.3Å; E701-L704 PolarHBondContact O-N 3.39Å
702	E	85.6	Confident	84.8	Confident	80 Å²	80	82.3 Å²	82.3	37%	0.374	42%	0.418	S	S	.	.	H	α-helix	trans	-65.7	-40.8	177	-72.1	168.9	172.3	0	0	112.3	Y698 T699 L704 Q705	Y698-E702 VanDerWaalsContact CA-OE2 3.3Å; Y698-E702 WeakPolarHBondContact CA-OE2 3.37Å; Y698-E702 HydrophobicContact CD1-CB 4.2Å; Y698-E702 WeakPolarHBondContact CD1-OE2 3.45Å; T699-E702 PolarHBondContact N-OE2 2.84Å; T699-E702 VanDerWaalsContact N-OE2 3.09Å; T699-E702 PolarHBondContact O-N 2.84Å; T699-E702 VanDerWaalsContact O-N 3.1Å; T699-E702 WeakPolarHBondContact OG1-CG 3.44Å; T699-E702 PolarHBondContact OG1-N 3.02Å; E702-L704 VanDerWaalsContact C-N 3.26Å; E702-L704 PolarHBondContact O-N 2.95Å; E702-Q705 WeakPolarHBondContact O-CB 3.46Å; E702-Q705 PolarHBondContact O-N 3.29Å
703	V	84.2	Confident	84.7	Confident	20 Å²	20	83.9 Å²	83.9	12%	0.121	42%	0.422	C	S	.	.	H	α-helix	trans	-64.2	-34.9	177.4	177.2	0	0	0	0	111	V694 Y698 T699 Q705 W706 A709 I713	V694-V703 HydrophobicContact CG1-CG2 4.46Å; Y698-V703 HydrophobicContact CG-CG2 4.48Å; T699-V703 PolarHBondContact O-N 2.78Å; V703-Q705 PolarHBondContact O-N 2.86Å; V703-W706 HydrophobicContact CB-CZ3 4.44Å; V703-W706 HydrophobicContact CG1-CE3 3.91Å; V703-W706 HydrophobicContact CG1-CZ3 3.91Å; V703-W706 HydrophobicContact CG2-CH2 4.29Å; V703-W706 HydrophobicContact CG2-CZ3 4.18Å; V703-W706 PolarHBondContact O-N 2.79Å; V703-A709 WeakPolarHBondContact O-CB 3.33Å; V703-I713 HydrophobicContact CG1-CD1 4.04Å
704	L	85	Confident	84.8	Confident	112 Å²	112	84.7 Å²	84.7	59%	0.586	44%	0.435	S	S	*	.	H	α-helix	trans	-65.5	-23.5	178.4	-152.5	83.9	0	0	0	112.8	P700 E701 E702 W706	P700-L704 PolarHBondContact O-N 2.84Å; E701-L704 WeakPolarHBondContact O-CB 3.3Å; E701-L704 PolarHBondContact O-N 3.39Å; E702-L704 VanDerWaalsContact C-N 3.26Å; E702-L704 PolarHBondContact O-N 2.95Å; L704-W706 VanDerWaalsContact C-N 3.26Å; L704-W706 PolarHBondContact O-N 2.83Å
705	Q	86	Confident	84.9	Confident	162 Å²	162	88.7 Å²	88.7	76%	0.757	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.9	-13.6	177.4	-63.8	178.1	1.6	0	0	113.1	E702 V703	E702-Q705 WeakPolarHBondContact O-CB 3.46Å; E702-Q705 PolarHBondContact O-N 3.29Å; V703-Q705 PolarHBondContact O-N 2.86Å
706	W	84.4	Confident	85.1	Confident	32 Å²	32	83.7 Å²	83.7	12%	0.121	43%	0.43	C	S	.	.	S	Bend	trans	-72.3	145.2	-179.6	-66.6	-15.1	0	0	0	113	M667 I671 V694 Y698 V703 L704 N708 A709	M667-W706 HydrophobicContact CB-CZ2 4.49Å; I671-W706 HydrophobicContact CD1-CE3 3.97Å; I671-W706 HydrophobicContact CD1-CH2 3.8Å; I671-W706 HydrophobicContact CD1-CZ3 3.14Å; V694-W706 HydrophobicContact CG1-CH2 4.02Å; V694-W706 HydrophobicContact CG1-CZ3 4.29Å; Y698-W706 HydrophobicContact CD1-CZ2 4.23Å; Y698-W706 HydrophobicContact CD2-CH2 4.08Å; Y698-W706 HydrophobicContact CD2-CZ2 4.14Å; Y698-W706 HydrophobicContact CE1-CZ2 4.17Å; Y698-W706 HydrophobicContact CE2-CH2 4.23Å; Y698-W706 HydrophobicContact CE2-CZ2 4.06Å; Y698-W706 HydrophobicContact CG-CH2 4.4Å; Y698-W706 HydrophobicContact CG-CZ2 4.21Å; V703-W706 HydrophobicContact CB-CZ3 4.44Å; V703-W706 HydrophobicContact CG1-CE3 3.91Å; V703-W706 HydrophobicContact CG1-CZ3 3.91Å; V703-W706 HydrophobicContact CG2-CH2 4.29Å; V703-W706 HydrophobicContact CG2-CZ3 4.18Å; V703-W706 PolarHBondContact O-N 2.79Å; L704-W706 VanDerWaalsContact C-N 3.26Å; L704-W706 PolarHBondContact O-N 2.83Å; W706-N708 PolarHBondContact O-N 3.36Å; W706-A709 HydrophobicContact CB-CB 4.25Å; W706-A709 WeakPolarHBondContact O-CB 3.35Å; W706-A709 PolarHBondContact O-N 3.46Å
707	P	78.8	Confident	85.2	Confident	82 Å²	82	79.6 Å²	79.6	53%	0.532	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	129	171.6	-13.1	24.2	0	0	0	109.4	Q668 A709	Q668-P707 PolarHBondContact NE2-O 2.83Å; P707-A709 VanDerWaalsContact C-N 3.29Å; P707-A709 PolarHBondContact O-N 3.15Å
708	N	82.6	Confident	85.6	Confident	116 Å²	116	77.5 Å²	77.5	62%	0.62	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.3	23.2	178.3	-56.7	-18.7	0	0	0	115.6	W706 K710 T711 L712	W706-N708 PolarHBondContact O-N 3.36Å; N708-K710 VanDerWaalsContact C-N 3.29Å; N708-K710 PolarHBondContact O-N 2.9Å; N708-T711 PolarHBondContact O-N 3.35Å; N708-T711 PolarHBondContact O-OG1 3.21Å; N708-L712 WeakPolarHBondContact O-CG 3.12Å; N708-L712 PolarHBondContact O-N 2.9Å; N708-L712 VanDerWaalsContact O-N 3.1Å
709	A	82	Confident	85.8	Confident	5 Å²	5	79.8 Å²	79.8	4%	0.041	43%	0.425	C	S	.	.	H	α-helix	trans	-54	-42.8	178.9	0	0	0	0	0	113.5	V703 W706 P707 T711 L712 I713	V703-A709 WeakPolarHBondContact O-CB 3.33Å; W706-A709 HydrophobicContact CB-CB 4.25Å; W706-A709 WeakPolarHBondContact O-CB 3.35Å; W706-A709 PolarHBondContact O-N 3.46Å; P707-A709 VanDerWaalsContact C-N 3.29Å; P707-A709 PolarHBondContact O-N 3.15Å; A709-T711 PolarHBondContact O-N 3.04Å; A709-L712 PolarHBondContact O-N 2.81Å; A709-I713 WeakPolarHBondContact O-CB 3.2Å; A709-I713 WeakPolarHBondContact O-CD1 3.42Å; A709-I713 VanDerWaalsContact O-CG1 3.23Å; A709-I713 WeakPolarHBondContact O-CG1 3.46Å; A709-I713 PolarHBondContact O-N 2.88Å
710	K	84.9	Confident	85.9	Confident	167 Å²	167	78 Å²	78	73%	0.726	41%	0.414	S	S	*	.	H	α-helix	trans	-62.2	-42.1	-179.2	-69.7	-176.8	-179.8	178.3	0	112.9	N708 G714	N708-K710 VanDerWaalsContact C-N 3.29Å; N708-K710 PolarHBondContact O-N 2.9Å; K710-G714 PolarHBondContact O-N 3.31Å
711	T	87.3	Confident	86.3	Confident	79 Å²	79	76.5 Å²	76.5	49%	0.485	40%	0.399	S	S	.	.	H	α-helix	trans	-71.3	-44.5	179.7	58.3	0	0	0	0	110.4	N708 A709 I713 G714 D715	N708-T711 PolarHBondContact O-N 3.35Å; N708-T711 PolarHBondContact O-OG1 3.21Å; A709-T711 PolarHBondContact O-N 3.04Å; T711-I713 VanDerWaalsContact C-N 3.33Å; T711-I713 PolarHBondContact O-N 3.42Å; T711-G714 PolarHBondContact O-N 3.13Å; T711-G714 VanDerWaalsContact O-N 3.15Å; T711-D715 VanDerWaalsContact O-CG 3.27Å; T711-D715 PolarHBondContact O-N 3.04Å
712	L	84.4	Confident	86.4	Confident	21 Å²	21	76.5 Å²	76.5	11%	0.11	39%	0.392	C	S	.	.	H	α-helix	trans	-58.1	-43.5	177.3	-68.2	169.7	0	0	0	112.2	Q668 I671 I675 N708 A709 L716	Q668-L712 HydrophobicContact CG-CD1 4.19Å; I671-L712 HydrophobicContact CG2-CB 4.21Å; I671-L712 HydrophobicContact CG2-CD1 4.41Å; I675-L712 HydrophobicContact CD1-CB 4.1Å; I675-L712 HydrophobicContact CD1-CD2 3.43Å; I675-L712 VanDerWaalsContact CD1-CD2 3.43Å; I675-L712 HydrophobicContact CD1-CG 4.38Å; I675-L712 WeakPolarHBondContact CD1-O 3.43Å; N708-L712 WeakPolarHBondContact O-CG 3.12Å; N708-L712 PolarHBondContact O-N 2.9Å; N708-L712 VanDerWaalsContact O-N 3.1Å; A709-L712 PolarHBondContact O-N 2.81Å; L712-L716 WeakPolarHBondContact O-CB 3.44Å; L712-L716 PolarHBondContact O-N 2.97Å
713	I	85.1	Confident	86.6	Confident	75 Å²	75	74 Å²	74	39%	0.385	38%	0.381	S	S	.	.	H	α-helix	trans	-68.7	-41.9	177	-66.5	166.4	0	0	0	110.8	V703 A709 T711 D715 L716 L717	V703-I713 HydrophobicContact CG1-CD1 4.04Å; A709-I713 WeakPolarHBondContact O-CB 3.2Å; A709-I713 WeakPolarHBondContact O-CD1 3.42Å; A709-I713 VanDerWaalsContact O-CG1 3.23Å; A709-I713 WeakPolarHBondContact O-CG1 3.46Å; A709-I713 PolarHBondContact O-N 2.88Å; T711-I713 VanDerWaalsContact C-N 3.33Å; T711-I713 PolarHBondContact O-N 3.42Å; I713-D715 VanDerWaalsContact C-N 3.34Å; I713-D715 PolarHBondContact O-N 2.6Å; I713-L716 PolarHBondContact O-N 3.4Å; I713-L717 HydrophobicContact CG2-CD1 4.26Å; I713-L717 HydrophobicContact CG2-CG 4.48Å; I713-L717 WeakPolarHBondContact O-CG 3.42Å; I713-L717 PolarHBondContact O-N 2.8Å
714	G	86.2	Confident	87	Confident	35 Å²	35	79.7 Å²	79.7	36%	0.361	40%	0.404	S	S	.	.	H	α-helix	trans	-57.6	-44.4	176.2	0	0	0	0	0	112.7	K710 T711 L716 P718	K710-G714 PolarHBondContact O-N 3.31Å; T711-G714 PolarHBondContact O-N 3.13Å; T711-G714 VanDerWaalsContact O-N 3.15Å; G714-L716 VanDerWaalsContact C-N 3.29Å; G714-L716 PolarHBondContact O-N 3.2Å; G714-P718 WeakPolarHBondContact O-CD 3.31Å
715	D	88.4	Confident	87.3	Confident	94 Å²	94	79 Å²	79	50%	0.503	40%	0.398	S	S	.	.	H	α-helix	trans	-70.4	-26.8	-179.6	-66.3	-24.1	0	0	0	112.7	I675 T711 I713	I675-D715 HydrophobicContact CD1-CB 4.13Å; I675-D715 HydrophobicContact CG2-CB 3.98Å; T711-D715 VanDerWaalsContact O-CG 3.27Å; T711-D715 PolarHBondContact O-N 3.04Å; I713-D715 VanDerWaalsContact C-N 3.34Å; I713-D715 PolarHBondContact O-N 2.6Å
716	L	88.7	Confident	87.5	Confident	24 Å²	24	76.9 Å²	76.9	13%	0.126	38%	0.383	C	S	.	.	H	α-helix	trans	-77.2	-35.9	-179.3	-169.8	73.5	0	0	0	113	I675 N678 I691 L712 I713 G714 T720	I675-L716 HydrophobicContact CG1-CB 4.48Å; I675-L716 HydrophobicContact CG1-CD1 4.22Å; N678-L716 HydrophobicContact CB-CD1 4.4Å; N678-L716 PolarHBondContact ND2-O 3.31Å; I691-L716 HydrophobicContact CD1-CD1 3.44Å; I691-L716 VanDerWaalsContact CD1-CD1 3.44Å; I691-L716 HydrophobicContact CD1-CD2 3.61Å; I691-L716 HydrophobicContact CD1-CG 3.89Å; I691-L716 HydrophobicContact CG1-CD1 4.19Å; I691-L716 HydrophobicContact CG1-CD2 3.74Å; I691-L716 HydrophobicContact CG2-CD2 4.19Å; L712-L716 WeakPolarHBondContact O-CB 3.44Å; L712-L716 PolarHBondContact O-N 2.97Å; I713-L716 PolarHBondContact O-N 3.4Å; G714-L716 VanDerWaalsContact C-N 3.29Å; G714-L716 PolarHBondContact O-N 3.2Å; L716-T720 HydrophobicContact CD1-CG2 4.46Å; L716-T720 HydrophobicContact CD2-CG2 4.39Å; L716-T720 HydrophobicContact CG-CG2 3.89Å; L716-T720 WeakPolarHBondContact O-CG2 3.36Å; L716-T720 PolarHBondContact O-N 3.13Å; L716-T720 PolarHBondContact O-OG1 3.38Å
717	L	88.3	Confident	87.7	Confident	87 Å²	87	80.3 Å²	80.3	46%	0.455	40%	0.403	S	S	.	.	H	α-helix	trans	-59.6	-45.9	-171.3	-80.9	168.2	0	0	0	115.6	I713 Y719 T720 I721	I713-L717 HydrophobicContact CG2-CD1 4.26Å; I713-L717 HydrophobicContact CG2-CG 4.48Å; I713-L717 WeakPolarHBondContact O-CG 3.42Å; I713-L717 PolarHBondContact O-N 2.8Å; L717-Y719 VanDerWaalsContact C-N 3.3Å; L717-Y719 PolarHBondContact O-N 3.36Å; L717-T720 WeakPolarHBondContact CA-OG1 3.45Å; L717-T720 PolarHBondContact O-N 3Å; L717-T720 PolarHBondContact O-OG1 2.97Å; L717-I721 WeakPolarHBondContact O-CD1 3.14Å; L717-I721 VanDerWaalsContact O-CG1 3.27Å; L717-I721 WeakPolarHBondContact O-CG1 3.35Å; L717-I721 PolarHBondContact O-N 3.37Å
718	P	90.3	Very high	88.4	Confident	64 Å²	64	78.2 Å²	78.2	42%	0.416	39%	0.39	S	S	.	.	H	α-helix	trans	-61.4	-38.9	-174.8	-25.7	34.2	0	0	0	113	G714 R722	G714-P718 WeakPolarHBondContact O-CD 3.31Å; P718-R722 WeakPolarHBondContact O-CG 3.3Å; P718-R722 PolarHBondContact O-N 3.39Å
719	Y	90.5	Very high	88.9	Confident	83 Å²	83	80.1 Å²	80.1	33%	0.325	39%	0.389	S	S	.	.	H	α-helix	trans	-80.5	-37.6	-179.7	-71.1	-76.9	0	0	0	111.9	N678 T679 L717 I721 R722 H723	N678-Y719 VanDerWaalsContact ND2-CB 3.3Å; N678-Y719 WeakPolarHBondContact ND2-CB 3.48Å; T679-Y719 HydrophobicContact CG2-CD2 4.5Å; T679-Y719 HydrophobicContact CG2-CE2 4.04Å; L717-Y719 VanDerWaalsContact C-N 3.3Å; L717-Y719 PolarHBondContact O-N 3.36Å; Y719-I721 VanDerWaalsContact C-N 3.31Å; Y719-I721 PolarHBondContact O-N 3.12Å; Y719-R722 PolarHBondContact O-N 3.1Å; Y719-H723 PolarHBondContact O-CD2 2.75Å; Y719-H723 PolarHBondContact O-N 2.79Å
720	T	89.9	Confident	89.3	Confident	28 Å²	28	84.8 Å²	84.8	17%	0.172	41%	0.408	C	S	.	.	H	α-helix	trans	-59.1	-43.2	173.9	52.6	0	0	0	0	111.2	N678 Q688 I691 L716 L717 H723 F724	N678-T720 PolarHBondContact ND2-N 2.81Å; Q688-T720 VanDerWaalsContact NE2-CG2 3.26Å; I691-T720 HydrophobicContact CD1-CG2 4.32Å; L716-T720 HydrophobicContact CD1-CG2 4.46Å; L716-T720 HydrophobicContact CD2-CG2 4.39Å; L716-T720 HydrophobicContact CG-CG2 3.89Å; L716-T720 WeakPolarHBondContact O-CG2 3.36Å; L716-T720 PolarHBondContact O-N 3.13Å; L716-T720 PolarHBondContact O-OG1 3.38Å; L717-T720 WeakPolarHBondContact CA-OG1 3.45Å; L717-T720 PolarHBondContact O-N 3Å; L717-T720 PolarHBondContact O-OG1 2.97Å; T720-H723 PolarHBondContact O-N 2.9Å; T720-F724 WeakPolarHBondContact O-CB 3.35Å; T720-F724 PolarHBondContact O-N 2.67Å
721	I	92	Very high	89.7	Confident	85 Å²	85	86.6 Å²	86.6	44%	0.436	41%	0.41	S	S	.	.	H	α-helix	trans	-62	-48.1	178.1	-67.2	165.9	0	0	0	110.8	L717 Y719 H723 F724 E725	L717-I721 WeakPolarHBondContact O-CD1 3.14Å; L717-I721 VanDerWaalsContact O-CG1 3.27Å; L717-I721 WeakPolarHBondContact O-CG1 3.35Å; L717-I721 PolarHBondContact O-N 3.37Å; Y719-I721 VanDerWaalsContact C-N 3.31Å; Y719-I721 PolarHBondContact O-N 3.12Å; I721-H723 VanDerWaalsContact C-N 3.33Å; I721-H723 PolarHBondContact O-N 2.94Å; I721-F724 WeakPolarHBondContact O-CB 3.08Å; I721-F724 PolarHBondContact O-N 2.63Å; I721-F724 VanDerWaalsContact O-N 3.15Å; I721-E725 PolarHBondContact O-N 2.87Å
722	R	90.8	Very high	90	Very high	155 Å²	155	88.7 Å²	88.7	59%	0.585	42%	0.415	S	S	*	.	H	α-helix	trans	-60.1	-42	177.9	-74.1	176.8	-174.1	171.7	3	112.6	P718 Y719 F724 R726	P718-R722 WeakPolarHBondContact O-CG 3.3Å; P718-R722 PolarHBondContact O-N 3.39Å; Y719-R722 PolarHBondContact O-N 3.1Å; R722-F724 VanDerWaalsContact C-N 3.35Å; R722-R726 WeakPolarHBondContact O-CB 3.5Å; R722-R726 PolarHBondContact O-N 2.98Å
723	H	89.8	Confident	90.4	Very high	28 Å²	28	92.4 Å²	92.4	13%	0.13	44%	0.435	C	S	.	.	H	α-helix	trans	-69.9	-34.3	177.3	-67.1	-57.6	0	0	0	111.8	N678 C684 Y719 T720 I721 R726 L727	N678-H723 PolarHBondContact O-NE2 2.9Å; N678-H723 PolarHBondContact OD1-CD2 3.26Å; N678-H723 VanDerWaalsContact OD1-CD2 3.3Å; C684-H723 PolarHBondContact SG-CD2 3.17Å; Y719-H723 PolarHBondContact O-CD2 2.75Å; Y719-H723 PolarHBondContact O-N 2.79Å; T720-H723 PolarHBondContact O-N 2.9Å; I721-H723 VanDerWaalsContact C-N 3.33Å; I721-H723 PolarHBondContact O-N 2.94Å; H723-R726 PolarHBondContact O-N 2.93Å; H723-L727 WeakPolarHBondContact O-CB 3.38Å; H723-L727 WeakPolarHBondContact O-CG 3.26Å; H723-L727 PolarHBondContact O-N 2.86Å
724	F	90.7	Very high	90.8	Very high	140 Å²	140	92.2 Å²	92.2	61%	0.614	44%	0.437	S	S	*	.	H	α-helix	trans	-64.6	-48.4	173.6	179.8	-99.5	0	0	0	111.9	T720 I721 R722 R726 L727 S728	T720-F724 WeakPolarHBondContact O-CB 3.35Å; T720-F724 PolarHBondContact O-N 2.67Å; I721-F724 WeakPolarHBondContact O-CB 3.08Å; I721-F724 PolarHBondContact O-N 2.63Å; I721-F724 VanDerWaalsContact O-N 3.15Å; R722-F724 VanDerWaalsContact C-N 3.35Å; F724-R726 VanDerWaalsContact C-N 3.28Å; F724-R726 PolarHBondContact O-N 2.97Å; F724-L727 PolarHBondContact O-N 2.85Å; F724-L727 VanDerWaalsContact O-N 3.16Å; F724-S728 PolarHBondContact O-N 2.89Å; F724-S728 PolarHBondContact O-OG 2.75Å; F724-S728 VanDerWaalsContact O-OG 3.11Å
725	E	92.6	Very high	91	Very high	96 Å²	96	93.2 Å²	93.2	45%	0.449	44%	0.442	S	S	.	.	H	α-helix	trans	-57.9	-42.2	174.4	-72.8	178.2	-174	0	0	111.8	I721 S728 R729	I721-E725 PolarHBondContact O-N 2.87Å; E725-S728 PolarHBondContact O-N 3.47Å; E725-R729 WeakPolarHBondContact O-CG 3.48Å; E725-R729 PolarHBondContact O-N 2.87Å
726	R	90.4	Very high	91.1	Very high	119 Å²	119	92.4 Å²	92.4	45%	0.449	44%	0.443	S	S	.	.	H	α-helix	trans	-61.8	-43.7	176	-175.7	179.2	-179.1	-173.2	-1.2	112	R722 H723 F724 F730	R722-R726 WeakPolarHBondContact O-CB 3.5Å; R722-R726 PolarHBondContact O-N 2.98Å; H723-R726 PolarHBondContact O-N 2.93Å; F724-R726 VanDerWaalsContact C-N 3.28Å; F724-R726 PolarHBondContact O-N 2.97Å; R726-F730 HydrophobicContact CG-CD2 4.04Å; R726-F730 HydrophobicContact CG-CE2 3.6Å; R726-F730 HydrophobicContact CG-CZ 4.26Å; R726-F730 VanDerWaalsContact O-CD2 3.28Å; R726-F730 WeakPolarHBondContact O-CD2 3.09Å; R726-F730 WeakPolarHBondContact O-CG 3.29Å; R726-F730 PolarHBondContact O-N 2.89Å; R726-F730 VanDerWaalsContact O-N 3.11Å
727	L	89.1	Confident	91.2	Very high	104 Å²	104	96.3 Å²	96.3	55%	0.545	46%	0.461	S	S	.	.	H	α-helix	trans	-65.7	-38.4	176.3	-78.1	165.5	0	0	0	112.1	H723 F724 F730 R731	H723-L727 WeakPolarHBondContact O-CB 3.38Å; H723-L727 WeakPolarHBondContact O-CG 3.26Å; H723-L727 PolarHBondContact O-N 2.86Å; F724-L727 PolarHBondContact O-N 2.85Å; F724-L727 VanDerWaalsContact O-N 3.16Å; L727-F730 PolarHBondContact O-N 3.06Å; L727-R731 WeakPolarHBondContact O-CB 3.49Å; L727-R731 PolarHBondContact O-N 3.11Å
728	S	91.5	Very high	91.3	Very high	38 Å²	38	96.2 Å²	96.2	27%	0.266	46%	0.461	S	S	.	.	H	α-helix	trans	-62.9	-44.8	176.5	-64.9	0	0	0	0	111.8	F724 E725 F730 R731 E732	F724-S728 PolarHBondContact O-N 2.89Å; F724-S728 PolarHBondContact O-OG 2.75Å; F724-S728 VanDerWaalsContact O-OG 3.11Å; E725-S728 PolarHBondContact O-N 3.47Å; S728-F730 PolarHBondContact O-N 2.73Å; S728-R731 WeakPolarHBondContact O-CB 3.41Å; S728-R731 PolarHBondContact O-N 2.62Å; S728-R731 VanDerWaalsContact O-N 3.16Å; S728-E732 WeakPolarHBondContact O-CG 3.14Å; S728-E732 PolarHBondContact O-N 2.79Å
729	R	93.1	Very high	91.1	Very high	156 Å²	156	100 Å²	100	59%	0.589	47%	0.472	S	S	*	.	H	α-helix	trans	-60.2	-46	173.5	-68.8	-179.9	-164.5	162.1	8.6	112	E725 R731 E732 D733	E725-R729 WeakPolarHBondContact O-CG 3.48Å; E725-R729 PolarHBondContact O-N 2.87Å; R729-R731 VanDerWaalsContact C-N 3.26Å; R729-R731 PolarHBondContact O-N 2.77Å; R729-E732 WeakPolarHBondContact O-CB 3.27Å; R729-E732 PolarHBondContact O-N 3.16Å; R729-E732 VanDerWaalsContact O-N 3.17Å; R729-D733 VanDerWaalsContact O-CG 3.29Å; R729-D733 PolarHBondContact O-N 2.77Å
730	F	91.3	Very high	91	Very high	103 Å²	103	100.3 Å²	100.3	45%	0.452	48%	0.478	S	S	.	.	H	α-helix	trans	-63	-33.2	176.1	-72	-40.9	0	0	0	113	R726 L727 S728 V734	R726-F730 HydrophobicContact CG-CD2 4.04Å; R726-F730 HydrophobicContact CG-CE2 3.6Å; R726-F730 HydrophobicContact CG-CZ 4.26Å; R726-F730 VanDerWaalsContact O-CD2 3.28Å; R726-F730 WeakPolarHBondContact O-CD2 3.09Å; R726-F730 WeakPolarHBondContact O-CG 3.29Å; R726-F730 PolarHBondContact O-N 2.89Å; R726-F730 VanDerWaalsContact O-N 3.11Å; L727-F730 PolarHBondContact O-N 3.06Å; S728-F730 PolarHBondContact O-N 2.73Å; F730-V734 WeakPolarHBondContact O-CB 3.11Å; F730-V734 WeakPolarHBondContact O-CG2 3.34Å; F730-V734 PolarHBondContact O-N 2.95Å
731	R	93.2	Very high	90.6	Very high	204 Å²	204	102.2 Å²	102.2	77%	0.77	49%	0.492	S	S	*	.	H	α-helix	trans	-67.2	-41	174.9	-176.9	-179.8	177.1	172.5	-0.6	111.5	L727 S728 R729 V734 A735	L727-R731 WeakPolarHBondContact O-CB 3.49Å; L727-R731 PolarHBondContact O-N 3.11Å; S728-R731 WeakPolarHBondContact O-CB 3.41Å; S728-R731 PolarHBondContact O-N 2.62Å; S728-R731 VanDerWaalsContact O-N 3.16Å; R729-R731 VanDerWaalsContact C-N 3.26Å; R729-R731 PolarHBondContact O-N 2.77Å; R731-V734 PolarHBondContact O-N 3.14Å; R731-A735 WeakPolarHBondContact O-CB 3.43Å; R731-A735 PolarHBondContact O-N 3.22Å
732	E	93	Very high	90.3	Very high	123 Å²	123	105 Å²	105	58%	0.575	50%	0.5	S	S	*	.	H	α-helix	trans	-62.5	-47.6	173.7	-70.5	167.2	-168.8	0	0	110.8	S728 R729 V734 A735 C736	S728-E732 WeakPolarHBondContact O-CG 3.14Å; S728-E732 PolarHBondContact O-N 2.79Å; R729-E732 WeakPolarHBondContact O-CB 3.27Å; R729-E732 PolarHBondContact O-N 3.16Å; R729-E732 VanDerWaalsContact O-N 3.17Å; E732-V734 VanDerWaalsContact C-N 3.34Å; E732-V734 PolarHBondContact O-N 2.84Å; E732-A735 WeakPolarHBondContact O-CB 3.19Å; E732-A735 PolarHBondContact O-N 3.37Å; E732-A735 VanDerWaalsContact O-N 3.1Å; E732-C736 WeakPolarHBondContact O-CB 3.46Å; E732-C736 PolarHBondContact O-N 2.78Å; E732-C736 PolarHBondContact O-SG 2.87Å
733	D	92.7	Very high	89.8	Confident	99 Å²	99	99.7 Å²	99.7	53%	0.529	49%	0.487	S	S	.	.	H	α-helix	trans	-58.3	-44.5	176.8	-68	-25.2	0	0	0	111.7	R729 C736 M737	R729-D733 VanDerWaalsContact O-CG 3.29Å; R729-D733 PolarHBondContact O-N 2.77Å; D733-C736 PolarHBondContact O-N 3.18Å; D733-M737 VanDerWaalsContact O-CB 3.28Å; D733-M737 WeakPolarHBondContact O-CB 3.25Å; D733-M737 PolarHBondContact O-N 2.86Å
734	V	94.2	Very high	89.2	Confident	71 Å²	71	103.5 Å²	103.5	43%	0.43	51%	0.507	S	S	.	.	H	α-helix	trans	-66.9	-36.7	176.7	169.7	0	0	0	0	111.5	F730 R731 E732 N738	F730-V734 WeakPolarHBondContact O-CB 3.11Å; F730-V734 WeakPolarHBondContact O-CG2 3.34Å; F730-V734 PolarHBondContact O-N 2.95Å; R731-V734 PolarHBondContact O-N 3.14Å; E732-V734 VanDerWaalsContact C-N 3.34Å; E732-V734 PolarHBondContact O-N 2.84Å; V734-N738 VanDerWaalsContact O-CB 3.28Å; V734-N738 WeakPolarHBondContact O-CB 3.1Å; V734-N738 VanDerWaalsContact O-CG 3.3Å; V734-N738 PolarHBondContact O-N 2.84Å; V734-N738 PolarHBondContact O-ND2 2.86Å; V734-N738 VanDerWaalsContact O-ND2 3.11Å
735	A	91	Very high	88	Confident	56 Å²	56	106.7 Å²	106.7	46%	0.463	52%	0.515	S	S	.	.	H	α-helix	trans	-67.9	-43.3	175.6	0	0	0	0	0	111.7	R731 E732 N738 F739	R731-A735 WeakPolarHBondContact O-CB 3.43Å; R731-A735 PolarHBondContact O-N 3.22Å; E732-A735 WeakPolarHBondContact O-CB 3.19Å; E732-A735 PolarHBondContact O-N 3.37Å; E732-A735 VanDerWaalsContact O-N 3.1Å; A735-N738 PolarHBondContact O-N 3.06Å; A735-F739 WeakPolarHBondContact O-CB 3.16Å; A735-F739 PolarHBondContact O-N 3.03Å
736	C	90.7	Very high	86.3	Confident	77 Å²	77	109.9 Å²	109.9	52%	0.52	53%	0.527	S	S	.	.	H	α-helix	trans	-61	-45.9	173.1	-75.2	0	0	0	0	111.2	E732 D733 N738 F739 I740	E732-C736 WeakPolarHBondContact O-CB 3.46Å; E732-C736 PolarHBondContact O-N 2.78Å; E732-C736 PolarHBondContact O-SG 2.87Å; D733-C736 PolarHBondContact O-N 3.18Å; C736-N738 PolarHBondContact O-N 3.33Å; C736-F739 WeakPolarHBondContact O-CB 3.49Å; C736-F739 PolarHBondContact O-N 2.92Å; C736-I740 VanDerWaalsContact O-CG1 3.28Å; C736-I740 WeakPolarHBondContact O-CG1 2.77Å; C736-I740 PolarHBondContact O-N 3.19Å
737	M	90.6	Very high	84.5	Confident	106 Å²	106	106.8 Å²	106.8	52%	0.522	52%	0.524	S	S	.	.	H	α-helix	trans	-61.5	-44.6	175.6	-175	175.4	63.1	0	0	111.4	D733 F739 I740 C741	D733-M737 VanDerWaalsContact O-CB 3.28Å; D733-M737 WeakPolarHBondContact O-CB 3.25Å; D733-M737 PolarHBondContact O-N 2.86Å; M737-F739 VanDerWaalsContact C-N 3.3Å; M737-F739 PolarHBondContact O-N 2.83Å; M737-I740 PolarHBondContact O-N 2.86Å; M737-C741 WeakPolarHBondContact O-CB 2.92Å; M737-C741 PolarHBondContact O-N 3.19Å; M737-C741 PolarHBondContact O-SG 3.36Å
738	N	88.8	Confident	82.9	Confident	85 Å²	85	106.4 Å²	106.4	46%	0.455	53%	0.526	S	S	.	.	H	α-helix	trans	-61.8	-38.1	174.7	-83.2	-39.5	0	0	0	112.3	V734 A735 C736 K742	V734-N738 VanDerWaalsContact O-CB 3.28Å; V734-N738 WeakPolarHBondContact O-CB 3.1Å; V734-N738 VanDerWaalsContact O-CG 3.3Å; V734-N738 PolarHBondContact O-N 2.84Å; V734-N738 PolarHBondContact O-ND2 2.86Å; V734-N738 VanDerWaalsContact O-ND2 3.11Å; A735-N738 PolarHBondContact O-N 3.06Å; C736-N738 PolarHBondContact O-N 3.33Å; N738-K742 WeakPolarHBondContact O-CB 3.21Å; N738-K742 WeakPolarHBondContact O-CG 3.46Å; N738-K742 PolarHBondContact O-N 3.12Å
739	F	88	Confident	81	Confident	144 Å²	144	112.4 Å²	112.4	63%	0.632	55%	0.547	S	S	*	.	H	α-helix	trans	-65.6	-46	175	179.4	-96.3	0	0	0	111.2	A735 C736 M737 C741 K742 S743	A735-F739 WeakPolarHBondContact O-CB 3.16Å; A735-F739 PolarHBondContact O-N 3.03Å; C736-F739 WeakPolarHBondContact O-CB 3.49Å; C736-F739 PolarHBondContact O-N 2.92Å; M737-F739 VanDerWaalsContact C-N 3.3Å; M737-F739 PolarHBondContact O-N 2.83Å; F739-C741 PolarHBondContact O-N 3.1Å; F739-K742 CarbonylContact O-C 3.6Å; F739-K742 PolarHBondContact O-N 3.21Å; F739-K742 VanDerWaalsContact O-N 3.12Å; F739-S743 WeakPolarHBondContact O-CB 3.06Å; F739-S743 PolarHBondContact O-N 2.96Å; F739-S743 PolarHBondContact O-OG 3.24Å
740	I	86.9	Confident	78.9	Confident	89 Å²	89	111.2 Å²	111.2	46%	0.456	55%	0.552	S	S	.	*	H	α-helix	trans	-60	-45.2	175.1	-68	164.8	0	0	0	110.6	C736 M737 K742 S743 M744	C736-I740 VanDerWaalsContact O-CG1 3.28Å; C736-I740 WeakPolarHBondContact O-CG1 2.77Å; C736-I740 PolarHBondContact O-N 3.19Å; M737-I740 PolarHBondContact O-N 2.86Å; I740-K742 VanDerWaalsContact C-N 3.27Å; I740-K742 PolarHBondContact O-N 2.84Å; I740-S743 WeakPolarHBondContact CA-OG 3.48Å; I740-S743 PolarHBondContact O-N 2.88Å; I740-S743 PolarHBondContact O-OG 2.97Å; I740-M744 HydrophobicContact CG2-CE 3.62Å; I740-M744 HydrophobicContact CG2-CG 4.45Å; I740-M744 WeakPolarHBondContact O-CB 3.44Å; I740-M744 WeakPolarHBondContact O-CG 3.45Å; I740-M744 PolarHBondContact O-N 2.75Å
741	C	82.8	Confident	77	Confident	68 Å²	68	111.4 Å²	111.4	46%	0.459	56%	0.557	S	S	.	*	H	α-helix	trans	-62	-34.7	175.7	-72.4	0	0	0	0	112.2	M737 F739	M737-C741 WeakPolarHBondContact O-CB 2.92Å; M737-C741 PolarHBondContact O-N 3.19Å; M737-C741 PolarHBondContact O-SG 3.36Å; F739-C741 PolarHBondContact O-N 3.1Å
742	K	84.4	Confident	75.1	Confident	143 Å²	143	106.1 Å²	106.1	62%	0.622	55%	0.547	S	S	*	.	H	α-helix	trans	-76.4	-39.6	174.9	-76.7	179	-179.8	-178.4	0	112.8	N738 F739 I740 R745 F746	N738-K742 WeakPolarHBondContact O-CB 3.21Å; N738-K742 WeakPolarHBondContact O-CG 3.46Å; N738-K742 PolarHBondContact O-N 3.12Å; F739-K742 CarbonylContact O-C 3.6Å; F739-K742 PolarHBondContact O-N 3.21Å; F739-K742 VanDerWaalsContact O-N 3.12Å; I740-K742 VanDerWaalsContact C-N 3.27Å; I740-K742 PolarHBondContact O-N 2.84Å; K742-R745 WeakPolarHBondContact O-CB 3.34Å; K742-R745 PolarHBondContact O-N 3.22Å; K742-F746 PolarHBondContact O-N 3.47Å
743	S	81.5	Confident	72.8	Confident	44 Å²	44	108.2 Å²	108.2	31%	0.308	56%	0.557	S	S	.	*	H	α-helix	trans	-73.3	-35.6	-179	66.3	0	0	0	0	111.9	F739 I740 R745 F746 S747	F739-S743 WeakPolarHBondContact O-CB 3.06Å; F739-S743 PolarHBondContact O-N 2.96Å; F739-S743 PolarHBondContact O-OG 3.24Å; I740-S743 WeakPolarHBondContact CA-OG 3.48Å; I740-S743 PolarHBondContact O-N 2.88Å; I740-S743 PolarHBondContact O-OG 2.97Å; S743-R745 PolarHBondContact O-N 3.31Å; S743-F746 CarbonylContact O-C 3.55Å; S743-F746 WeakPolarHBondContact O-CA 3.22Å; S743-F746 PolarHBondContact O-N 2.96Å; S743-S747 PolarHBondContact O-N 3.08Å; S743-S747 PolarHBondContact O-OG 3.47Å
744	M	76.9	Confident	70.4	Confident	109 Å²	109	108.5 Å²	108.5	54%	0.537	57%	0.566	S	S	.	*	H	α-helix	trans	-58.8	-33.5	169	-78.9	-153.6	-100.8	0	0	111.9	I740 F746 S747 V748	I740-M744 HydrophobicContact CG2-CE 3.62Å; I740-M744 HydrophobicContact CG2-CG 4.45Å; I740-M744 WeakPolarHBondContact O-CB 3.44Å; I740-M744 WeakPolarHBondContact O-CG 3.45Å; I740-M744 PolarHBondContact O-N 2.75Å; M744-F746 VanDerWaalsContact C-N 3.26Å; M744-F746 PolarHBondContact O-N 2.82Å; M744-S747 WeakPolarHBondContact CA-OG 3.38Å; M744-S747 PolarHBondContact O-OG 2.9Å; M744-V748 WeakPolarHBondContact O-CB 3.4Å; M744-V748 WeakPolarHBondContact O-CG2 3.28Å; M744-V748 PolarHBondContact O-N 3.31Å
745	R	65.1	Low	68	Low	207 Å²	207	117.5 Å²	117.5	78%	0.781	59%	0.594	S	S	*	*	H	α-helix	trans	-67	-24.8	172.3	-73.4	-179.7	175.3	-176	-1	113.4	K742 S743	K742-R745 WeakPolarHBondContact O-CB 3.34Å; K742-R745 PolarHBondContact O-N 3.22Å; S743-R745 PolarHBondContact O-N 3.31Å
746	F	56.4	Low	66.9	Low	162 Å²	162	120.6 Å²	120.6	71%	0.711	60%	0.601	S	S	*	*	H	α-helix	trans	-89.8	-37.9	176.4	-87.1	-82	0	0	0	113.5	K742 S743 M744 V748 F749	K742-F746 PolarHBondContact O-N 3.47Å; S743-F746 CarbonylContact O-C 3.55Å; S743-F746 WeakPolarHBondContact O-CA 3.22Å; S743-F746 PolarHBondContact O-N 2.96Å; M744-F746 VanDerWaalsContact C-N 3.26Å; M744-F746 PolarHBondContact O-N 2.82Å; F746-V748 VanDerWaalsContact C-N 3.33Å; F746-V748 PolarHBondContact O-N 3.22Å; F746-F749 VanDerWaalsContact O-CB 3.3Å; F746-F749 WeakPolarHBondContact O-CB 3.49Å; F746-F749 PolarHBondContact O-N 3.33Å; F746-F749 VanDerWaalsContact O-N 3.08Å
747	S	52.6	Low	65.6	Low	55 Å²	55	122.8 Å²	122.8	39%	0.385	61%	0.605	S	S	.	*	H	α-helix	trans	-71.7	-28.3	179.7	57.2	0	0	0	0	112.9	S743 M744 F749 L750 I751	S743-S747 PolarHBondContact O-N 3.08Å; S743-S747 PolarHBondContact O-OG 3.47Å; M744-S747 WeakPolarHBondContact CA-OG 3.38Å; M744-S747 PolarHBondContact O-OG 2.9Å; S747-F749 PolarHBondContact O-N 3.07Å; S747-L750 PolarHBondContact O-N 2.8Å; S747-L750 VanDerWaalsContact O-N 3.08Å; S747-I751 PolarHBondContact O-N 3.32Å
748	V	55.4	Low	64.2	Low	95 Å²	95	123.8 Å²	123.8	58%	0.576	61%	0.61	S	S	*	*	H	α-helix	trans	-57.9	-26.1	168.7	170.4	0	0	0	0	111.5	M744 F746	M744-V748 WeakPolarHBondContact O-CB 3.4Å; M744-V748 WeakPolarHBondContact O-CG2 3.28Å; M744-V748 PolarHBondContact O-N 3.31Å; F746-V748 VanDerWaalsContact C-N 3.33Å; F746-V748 PolarHBondContact O-N 3.22Å
749	F	52.2	Low	62.8	Low	164 Å²	164	126.1 Å²	126.1	72%	0.719	62%	0.619	S	S	*	*	H	α-helix	trans	-80.2	-22.6	176.4	-112.6	-82.1	0	0	0	114.6	F746 S747 T752	F746-F749 VanDerWaalsContact O-CB 3.3Å; F746-F749 WeakPolarHBondContact O-CB 3.49Å; F746-F749 PolarHBondContact O-N 3.33Å; F746-F749 VanDerWaalsContact O-N 3.08Å; S747-F749 PolarHBondContact O-N 3.07Å; F749-T752 PolarHBondContact O-OG1 3.23Å
750	L	48.3	Very low	61.2	Low	132 Å²	132	124.9 Å²	124.9	69%	0.691	62%	0.618	S	S	*	*	H	α-helix	trans	-89.4	-33.4	-178.8	-114.9	146	0	0	0	112	S747 T752 Q753	S747-L750 PolarHBondContact O-N 2.8Å; S747-L750 VanDerWaalsContact O-N 3.08Å; L750-T752 PolarHBondContact O-N 3.42Å; L750-Q753 PolarHBondContact O-N 3.05Å
751	I	53.1	Low	59.5	Low	107 Å²	107	127.3 Å²	127.3	55%	0.549	63%	0.629	S	S	.	*	H	α-helix	trans	-65.6	-24.4	175.8	-63.5	167.7	0	0	0	111.1	S747 Q753	S747-I751 PolarHBondContact O-N 3.32Å; I751-Q753 VanDerWaalsContact C-N 3.29Å; I751-Q753 PolarHBondContact O-N 3.15Å
752	T	52.2	Low	57.8	Low	92 Å²	92	131.6 Å²	131.6	56%	0.564	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.9	-7.3	177.1	47.4	0	0	0	0	114.9	F749 L750	F749-T752 PolarHBondContact O-OG1 3.23Å; L750-T752 PolarHBondContact O-N 3.42Å
753	Q	44.9	Very low	55.8	Low	168 Å²	168	130.7 Å²	130.7	79%	0.785	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.6	-9.4	178.9	-90.1	-166.7	-16	0	0	115.2	L750 I751	L750-Q753 PolarHBondContact O-N 3.05Å; I751-Q753 VanDerWaalsContact C-N 3.29Å; I751-Q753 PolarHBondContact O-N 3.15Å
754	S	43	Very low	53.7	Low	104 Å²	104	137.9 Å²	137.9	73%	0.727	67%	0.67	S	S	*	*			trans	-98.3	9.1	176.1	65.1	0	0	0	0	114.2
755	Y	43.8	Very low	51.5	Low	260 Å²	260	140.5 Å²	140.5	100%	1.02	68%	0.682	S	S	*	*			trans	-107.4	0	162.8	-81.6	-81.1	0	0	0	108.4

Retrieved 755 of 755 residues in 239.4 ms (Link to these results)

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