A0A087XSM0_POEFO Loading...

Interleukin-17 receptor D

AlphaFold DB , UniProt , Accession A0A087XSM0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 683 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	56.7	Low	59.9	Low	107 Å²	107	99.4 Å²	99.4	53%	0.527	50%	0.497	S	S	.	.				0	-33.2	0	-151.7	170.3	-155.9	0	0	113.9	L73 K74 L79 Y83 L88	M1-L73 HydrophobicContact CG-CD2 4.11Å; M1-L73 WeakPolarHBondContact O-CA 3.43Å; M1-K74 PolarHBondContact O-N 3.36Å; M1-L79 HydrophobicContact CE-CD2 3.35Å; M1-L79 HydrophobicContact SD-CD2 4.06Å; M1-Y83 HydrophobicContact CE-CD1 3.95Å; M1-Y83 HydrophobicContact CE-CE1 3.63Å; M1-L88 HydrophobicContact SD-CD2 4.34Å
2	L	59.2	Low	60.4	Low	15 Å²	15	99.9 Å²	99.9	8%	0.079	51%	0.513	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	149.3	-173.4	-62.6	160.5	0	0	0	113	L71 I72 L73 K74 L88	L2-L71 HydrophobicContact CB-CB 4.14Å; L2-L71 HydrophobicContact CB-CD2 4.22Å; L2-L71 HydrophobicContact CD1-CB 3.97Å; L2-L71 HydrophobicContact CD1-CD2 3.58Å; L2-L71 HydrophobicContact CD1-CG 4.43Å; L2-L71 HydrophobicContact CD2-CB 4.03Å; L2-L71 HydrophobicContact CG-CB 4.25Å; L2-L71 HydrophobicContact CG-CD2 4.43Å; L2-I72 CarbonylContact C-O 3.28Å; L2-I72 WeakPolarHBondContact CA-O 3.25Å; L2-L73 HydrophobicContact CD2-CD2 3.57Å; L2-L73 HydrophobicContact CD2-CG 4.09Å; L2-K74 WeakPolarHBondContact O-CE 2.9Å; L2-L88 HydrophobicContact CD1-CD2 4.36Å
3	R	64	Low	61.4	Low	180 Å²	180	102 Å²	102	68%	0.679	53%	0.525	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114	139.5	172.4	-178.6	178.2	-179	174.8	1.2	108.4	I72 K74	R3-I72 PolarHBondContact N-O 3.12Å; R3-I72 PolarHBondContact O-N 2.81Å; R3-K74 HydrophobicContact CB-CG 4.31Å
4	Y	62.3	Low	62.5	Low	98 Å²	98	95.1 Å²	95.1	38%	0.384	49%	0.492	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	144.9	-170.8	-57.9	-86.6	0	0	0	112.3	H70 L71 Q91	Y4-H70 CarbonylContact C-O 3.51Å; Y4-H70 WeakPolarHBondContact CA-O 3.42Å; Y4-L71 HydrophobicContact CD1-CD2 4.3Å; Y4-L71 HydrophobicContact CD1-CG 4.19Å; Y4-L71 HydrophobicContact CE1-CD2 3.63Å; Y4-L71 HydrophobicContact CE1-CG 4.02Å; Y4-Q91 HydrophobicContact CD1-CG 4.03Å; Y4-Q91 HydrophobicContact CE1-CB 4.12Å; Y4-Q91 HydrophobicContact CE1-CG 3.46Å; Y4-Q91 VanDerWaalsContact CE1-CG 3.46Å; Y4-Q91 HydrophobicContact CE2-CG 4.21Å
5	S	60.3	Low	63.7	Low	47 Å²	47	101.2 Å²	101.2	33%	0.329	51%	0.513	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	162.5	172.6	-164.2	0	0	0	0	110.9	H70	S5-H70 PolarHBondContact N-O 3.07Å; S5-H70 WeakPolarHBondContact O-CB 3.31Å; S5-H70 PolarHBondContact O-N 3.17Å
6	Y	62.3	Low	64.8	Low	195 Å²	195	100.2 Å²	100.2	77%	0.765	51%	0.505	S	S	*	.			trans	-77.3	151.7	172.4	-67.1	-80.5	0	0	0	110.5	S8	Y6-S8 PolarHBondContact O-N 3.46Å
7	C	66.5	Low	65.8	Low	50 Å²	50	99.2 Å²	99.2	34%	0.338	51%	0.506	S	S	.	.	S	Bend	trans	-79.4	45.7	-178.4	-61	0	0	0	0	113.6	C68	C7-C68 HydrophobicContact CB-CB 3.56Å; C7-C68 WeakPolarHBondContact CB-SG 3.33Å; C7-C68 WeakPolarHBondContact SG-CB 3.32Å; C7-C68 CovalentContact SG-SG 2.01Å; C7-C68 PolarHBondContact SG-SG 2.91Å
8	S	53.2	Low	66.9	Low	101 Å²	101	94 Å²	94	71%	0.706	48%	0.479	S	S	*	.			trans	-100.3	9.3	-178.4	53.8	0	0	0	0	114.1	Y6	Y6-S8 PolarHBondContact O-N 3.46Å
9	L	55.9	Low	67.9	Low	89 Å²	89	93.6 Å²	93.6	47%	0.466	48%	0.475	S	S	.	.			trans	-119.3	110.4	-173.5	-77.4	151.7	0	0	0	111.3	Y11 R55	L9-Y11 HydrophobicContact CB-CD2 3.91Å; L9-Y11 HydrophobicContact CB-CE2 3.7Å; L9-Y11 HydrophobicContact CD1-CE2 4.31Å; L9-Y11 PolarHBondContact O-N 3.11Å; L9-Y11 VanDerWaalsContact O-N 3.13Å; L9-R55 PolarHBondContact O-NH2 3.04Å
10	S	57.1	Low	69	Low	120 Å²	120	93.2 Å²	93.2	84%	0.839	47%	0.471	S	S	*	.			trans	-65.1	109.6	161.8	65.8	0	0	0	0	107.9
11	Y	61.7	Low	70.1	Confident	91 Å²	91	89.7 Å²	89.7	36%	0.357	45%	0.454	S	S	.	.	P	Polyproline II helix	trans	-86.5	146	172.9	-91.1	-106.8	0	0	0	108.9	L9 H70 F109	L9-Y11 HydrophobicContact CB-CD2 3.91Å; L9-Y11 HydrophobicContact CB-CE2 3.7Å; L9-Y11 HydrophobicContact CD1-CE2 4.31Å; L9-Y11 PolarHBondContact O-N 3.11Å; L9-Y11 VanDerWaalsContact O-N 3.13Å; Y11-H70 AromaticContact CD2-CE1 3.84Å; Y11-H70 AromaticContact CE2-CE1 3.48Å; Y11-H70 VanDerWaalsContact CE2-CE1 3.48Å; Y11-H70 WeakPolarHBondContact CE2-CE1 3.46Å; Y11-F109 HydrophobicContact CD1-CD2 4.47Å; Y11-F109 HydrophobicContact CE1-CE2 4.49Å
12	P	66.2	Low	71.6	Confident	106 Å²	106	86.8 Å²	86.8	69%	0.688	45%	0.445	S	S	*	.	P	Polyproline II helix	trans	-57.9	141.9	174	24.3	-32.7	0	0	0	110.2	G14	P12-G14 PolarHBondContact O-N 2.72Å
13	L	72.3	Confident	73.2	Confident	127 Å²	127	91.9 Å²	91.9	67%	0.665	47%	0.472	S	S	*	.	P	Polyproline II helix	trans	-52.2	137.2	175.7	-75.8	159	0	0	0	110.3
14	G	77.3	Confident	74.6	Confident	6 Å²	6	85.3 Å²	85.3	6%	0.062	45%	0.452	C	S	.	.	P	Polyproline II helix	trans	-68.1	155.2	175.1	0	0	0	0	0	111.4	P12 S111 L112	P12-G14 PolarHBondContact O-N 2.72Å; G14-S111 PolarHBondContact N-O 2.8Å; G14-L112 WeakPolarHBondContact O-CA 3.5Å; G14-L112 WeakPolarHBondContact O-CB 3.27Å; G14-L112 WeakPolarHBondContact O-CD1 3.44Å
15	K	80.3	Confident	76.2	Confident	186 Å²	186	82.6 Å²	82.6	81%	0.809	45%	0.447	S	S	*	.	S	Bend	trans	-89	-10	174.5	-63.1	-176	179.7	-177.5	0	113.1
16	H	81.9	Confident	77.8	Confident	85 Å²	85	82.8 Å²	82.8	39%	0.394	44%	0.442	S	S	.	.	S	Bend	trans	-118.7	146.6	-171.3	-55	97.3	0	0	0	110.6	H50 L112	H16-H50 HydrophobicContact CB-CB 4.04Å; H16-H50 AromaticContact CD2-CD2 3.72Å; H16-H50 AromaticContact CD2-CE1 3.82Å; H16-H50 AromaticContact CD2-NE2 3.57Å; H16-H50 AromaticContact CE1-CD2 3.29Å; H16-H50 PolarHBondContact CE1-CD2 3.45Å; H16-H50 AromaticContact CE1-NE2 3.69Å; H16-H50 AromaticContact CG-CD2 3.51Å; H16-H50 AromaticContact CG-CG 3.51Å; H16-H50 AromaticContact CG-ND1 3.84Å; H16-H50 AromaticContact CG-NE2 3.84Å; H16-H50 AromaticContact ND1-CD2 3.24Å; H16-H50 PolarHBondContact ND1-CD2 2.87Å; H16-H50 AromaticContact ND1-CG 3.51Å; H16-H50 AromaticContact ND1-NE2 3.91Å; H16-H50 AromaticContact NE2-CD2 3.62Å; H16-H50 AromaticContact NE2-NE2 3.51Å; H16-L112 WeakPolarHBondContact O-CB 3.01Å; H16-L112 PolarHBondContact O-N 3.44Å; H16-L112 VanDerWaalsContact O-N 3.1Å
17	V	82.1	Confident	79.4	Confident	84 Å²	84	75.9 Å²	75.9	51%	0.509	42%	0.422	S	S	.	.			trans	-79.1	124.4	170.9	179.8	0	0	0	0	108	L112 M113	V17-L112 HydrophobicContact CG2-CD2 4.11Å; V17-M113 HydrophobicContact CB-CE 4.43Å; V17-M113 HydrophobicContact CG1-CE 3.67Å; V17-M113 HydrophobicContact CG1-CG 4.47Å; V17-M113 HydrophobicContact CG2-CE 3.94Å
18	I	84.9	Confident	80.7	Confident	5 Å²	5	75.2 Å²	75.2	3%	0.026	41%	0.414	C	S	.	.			trans	-115	130.1	176	-56.3	161	0	0	0	107.3	I51 P108 P110	I18-I51 HydrophobicContact CD1-CG2 3.59Å; I18-I51 HydrophobicContact CG1-CG2 4.04Å; I18-I51 HydrophobicContact CG2-CG2 3.89Å; I18-P108 HydrophobicContact CB-CG 4.21Å; I18-P108 HydrophobicContact CD1-CB 4.46Å; I18-P108 HydrophobicContact CG2-CB 3.87Å; I18-P108 HydrophobicContact CG2-CG 3.6Å; I18-P110 WeakPolarHBondContact CD1-O 3.45Å
19	H	86.8	Confident	82.6	Confident	87 Å²	87	71.5 Å²	71.5	40%	0.403	39%	0.386	S	S	.	.	P	Polyproline II helix	trans	-77.2	161	179.2	-169.5	-77	0	0	0	111.4	S44 L46	H19-S44 WeakPolarHBondContact CB-OG 3.44Å; H19-L46 HydrophobicContact CB-CB 3.88Å; H19-L46 HydrophobicContact CB-CD1 4.39Å; H19-L46 PolarHBondContact N-O 2.68Å
20	E	89.1	Confident	84.2	Confident	84 Å²	84	67.6 Å²	67.6	39%	0.393	37%	0.367	S	S	.	.	P	Polyproline II helix	trans	-59.7	150.6	176.5	58.2	178.8	-150.9	0	0	113.4	S44 F118 P119	E20-S44 VanDerWaalsContact O-CB 3.3Å; E20-S44 WeakPolarHBondContact O-CB 3.35Å; E20-F118 HydrophobicContact CB-CD1 4.36Å; E20-P119 HydrophobicContact CB-CG 4.43Å; E20-P119 WeakPolarHBondContact OE2-CD 3.44Å; E20-P119 WeakPolarHBondContact OE2-CG 3.24Å
21	V	91.4	Very high	85.6	Confident	21 Å²	21	62.3 Å²	62.3	13%	0.127	33%	0.33	C	S	.	.	P	Polyproline II helix	trans	-67.9	158.2	174.3	-61	0	0	0	0	111.2	V24 W41 S42 F54 V106	V21-V24 HydrophobicContact CG2-CG2 3.8Å; V21-W41 HydrophobicContact CB-CB 4.33Å; V21-W41 HydrophobicContact CB-CG 4.49Å; V21-W41 HydrophobicContact CG1-CG 4.49Å; V21-W41 HydrophobicContact CG2-CB 4.31Å; V21-S42 WeakPolarHBondContact CB-O 3.5Å; V21-F54 HydrophobicContact CG1-CD1 4.13Å; V21-F54 HydrophobicContact CG1-CE1 3.78Å; V21-V106 HydrophobicContact CG1-CG1 3.95Å; V21-V106 HydrophobicContact CG2-CB 3.82Å; V21-V106 HydrophobicContact CG2-CG1 4.08Å
22	S	89.9	Confident	86.5	Confident	46 Å²	46	63.9 Å²	63.9	32%	0.322	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	166.9	179.2	58.9	0	0	0	0	111.5	V24 S42	S22-V24 VanDerWaalsContact C-N 3.32Å; S22-V24 PolarHBondContact O-N 3.43Å; S22-S42 PolarHBondContact N-O 3.15Å; S22-S42 PolarHBondContact O-N 2.88Å
23	N	91.4	Very high	87.4	Confident	122 Å²	122	63.1 Å²	63.1	65%	0.652	33%	0.334	S	S	*	.	E	Extended strand (participates in β ladder)	trans	53.8	44.2	174	-59	-19.9	0	0	0	113.8	S25	N23-S25 PolarHBondContact O-N 3.21Å
24	V	94.1	Very high	88.1	Confident	42 Å²	42	60.4 Å²	60.4	26%	0.255	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	122.9	175.5	-174.8	0	0	0	0	109	V21 S22 F26 V39 H40 W41	V21-V24 HydrophobicContact CG2-CG2 3.8Å; S22-V24 VanDerWaalsContact C-N 3.32Å; S22-V24 PolarHBondContact O-N 3.43Å; V24-F26 HydrophobicContact CG1-CE1 4.06Å; V24-F26 HydrophobicContact CG1-CZ 3.91Å; V24-V39 HydrophobicContact CG1-CG1 4.21Å; V24-H40 CarbonylContact C-O 3.55Å; V24-H40 VanDerWaalsContact CA-O 3.22Å; V24-H40 WeakPolarHBondContact CA-O 3.23Å; V24-W41 HydrophobicContact CG2-CB 4.22Å
25	S	95.1	Very high	88.8	Confident	40 Å²	40	60.2 Å²	60.2	28%	0.28	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	161.7	179.3	50.2	0	0	0	0	110.7	N23 H40 K87	N23-S25 PolarHBondContact O-N 3.21Å; S25-H40 PolarHBondContact N-O 3.34Å; S25-H40 PolarHBondContact O-N 3.32Å; S25-K87 PolarHBondContact OG-NZ 2.97Å
26	F	95.4	Very high	89.4	Confident	52 Å²	52	51.3 Å²	51.3	23%	0.228	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	137.6	-172.5	-49.8	-73.2	0	0	0	110.5	V24 V37 V38 V39 V104 L123	V24-F26 HydrophobicContact CG1-CE1 4.06Å; V24-F26 HydrophobicContact CG1-CZ 3.91Å; F26-V37 HydrophobicContact CB-CG1 4.02Å; F26-V37 HydrophobicContact CD1-CG1 4.14Å; F26-V37 HydrophobicContact CG-CG1 4.5Å; F26-V38 WeakPolarHBondContact CA-O 3.37Å; F26-V39 HydrophobicContact CD1-CG1 4.38Å; F26-V39 HydrophobicContact CD1-CG2 4.21Å; F26-V39 HydrophobicContact CE1-CG1 4.12Å; F26-V39 HydrophobicContact CE1-CG2 4.32Å; F26-V104 HydrophobicContact CE1-CB 4.16Å; F26-V104 HydrophobicContact CE1-CG1 4.29Å; F26-V104 HydrophobicContact CE1-CG2 4.13Å; F26-L123 HydrophobicContact CD1-CB 4.27Å; F26-L123 HydrophobicContact CD1-CD2 3.43Å; F26-L123 VanDerWaalsContact CD1-CD2 3.43Å; F26-L123 HydrophobicContact CD1-CG 4.49Å; F26-L123 HydrophobicContact CD2-CB 3.78Å; F26-L123 HydrophobicContact CD2-CD2 4.46Å; F26-L123 HydrophobicContact CE1-CB 4.25Å; F26-L123 HydrophobicContact CE1-CD2 3.47Å; F26-L123 VanDerWaalsContact CE1-CD2 3.47Å; F26-L123 HydrophobicContact CE2-CB 3.76Å; F26-L123 HydrophobicContact CE2-CD2 4.49Å; F26-L123 HydrophobicContact CG-CB 4.03Å; F26-L123 HydrophobicContact CG-CD2 3.95Å; F26-L123 HydrophobicContact CZ-CB 4Å; F26-L123 HydrophobicContact CZ-CD2 4.02Å
27	S	95	Very high	90	Very high	50 Å²	50	47.3 Å²	47.3	35%	0.35	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	123.3	168	-71.4	0	0	0	0	109.3	V37 V38 H40	S27-V37 WeakPolarHBondContact O-CA 3.33Å; S27-V38 PolarHBondContact N-O 3.46Å; S27-V38 PolarHBondContact O-N 2.68Å; S27-H40 WeakPolarHBondContact CB-NE2 3.44Å; S27-H40 PolarHBondContact OG-NE2 3.18Å
28	H	93.7	Very high	90.6	Very high	36 Å²	36	44.1 Å²	44.1	17%	0.167	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	131.4	-178.7	-62.3	-92.6	0	0	0	110.2	R124 L131	H28-R124 PolarHBondContact CE1-O 2.67Å; H28-L131 HydrophobicContact CB-CD2 3.98Å
29	L	93	Very high	91.1	Very high	22 Å²	22	43.9 Å²	43.9	12%	0.115	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	158.9	-178.6	-53.2	176.7	0	0	0	109.4	A36 V38 P92 C666 K667 P668	L29-A36 HydrophobicContact CB-CB 4.22Å; L29-A36 PolarHBondContact N-O 3.2Å; L29-A36 PolarHBondContact O-N 3.29Å; L29-A36 VanDerWaalsContact O-O 3.08Å; L29-V38 HydrophobicContact CD1-CG2 3.64Å; L29-V38 HydrophobicContact CG-CG2 4.48Å; L29-P92 HydrophobicContact CD1-CB 4.15Å; L29-P92 HydrophobicContact CD1-CG 3.94Å; L29-C666 HydrophobicContact CB-CB 4.15Å; L29-C666 HydrophobicContact CD1-CB 4.08Å; L29-K667 WeakPolarHBondContact CA-O 3.33Å; L29-P668 HydrophobicContact CD2-CB 3.94Å
30	A	89.3	Confident	91.6	Very high	8 Å²	8	40.8 Å²	40.8	7%	0.066	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	126.4	165.2	0	0	0	0	0	109.4	L131 L132 C666 K667	A30-L131 HydrophobicContact CB-CB 4.18Å; A30-L132 HydrophobicContact CB-CD2 3.48Å; A30-L132 VanDerWaalsContact CB-CD2 3.48Å; A30-L132 HydrophobicContact CB-CG 4.05Å; A30-C666 CarbonylContact O-C 3.54Å; A30-C666 VanDerWaalsContact O-CA 3.22Å; A30-C666 WeakPolarHBondContact O-CA 3.36Å; A30-K667 PolarHBondContact N-O 3.1Å; A30-K667 VanDerWaalsContact N-O 3.11Å; A30-K667 PolarHBondContact O-N 2.95Å
31	C	85.9	Confident	91.8	Very high	9 Å²	9	36.8 Å²	36.8	6%	0.061	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	108.2	170.3	-52.2	0	0	0	0	107.2	D33 Q34 A36 C666	C31-D33 PolarHBondContact O-N 2.74Å; C31-D33 VanDerWaalsContact O-N 3.09Å; C31-Q34 PolarHBondContact N-O 3.16Å; C31-Q34 PolarHBondContact O-N 2.98Å; C31-A36 HydrophobicContact CB-CB 4.38Å; C31-A36 WeakPolarHBondContact SG-CB 3.44Å; C31-C666 HydrophobicContact CB-CB 4.15Å; C31-C666 WeakPolarHBondContact CB-SG 3.25Å; C31-C666 WeakPolarHBondContact SG-CB 3.45Å; C31-C666 CovalentContact SG-SG 2.02Å; C31-C666 PolarHBondContact SG-SG 3.21Å
32	D	82.4	Confident	91.8	Very high	124 Å²	124	36.1 Å²	36.1	66%	0.663	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.4	-109	-177.1	-54.4	-46.3	0	0	0	112.7
33	D	83.9	Confident	91.8	Very high	89 Å²	89	34 Å²	34	48%	0.476	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.3	10.5	-178.8	66.5	-19.6	0	0	0	113.5	C31 F98 V138	C31-D33 PolarHBondContact O-N 2.74Å; C31-D33 VanDerWaalsContact O-N 3.09Å; D33-F98 WeakPolarHBondContact O-CE2 3.29Å; D33-V138 HydrophobicContact CB-CG1 3.85Å; D33-V138 HydrophobicContact CB-CG2 3.96Å
34	Q	87.6	Confident	91.6	Very high	71 Å²	71	28.9 Å²	28.9	33%	0.332	16%	0.16	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	152.6	-172	-70.9	163.8	14.8	0	0	112.5	C31 S95	C31-Q34 PolarHBondContact N-O 3.16Å; C31-Q34 PolarHBondContact O-N 2.98Å; Q34-S95 PolarHBondContact OE1-OG 2.89Å
35	A	91.1	Very high	91.1	Very high	1 Å²	1	29 Å²	29	1%	0.008	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	148.1	170.3	0	0	0	0	0	109.8	L96 F98 T125 L131	A35-L96 HydrophobicContact CB-CB 4.09Å; A35-L96 WeakPolarHBondContact CB-O 3.42Å; A35-L96 PolarHBondContact N-O 3.5Å; A35-L96 WeakPolarHBondContact O-CB 3.29Å; A35-L96 PolarHBondContact O-N 3.06Å; A35-F98 HydrophobicContact CB-CD1 3.73Å; A35-F98 HydrophobicContact CB-CE1 3.81Å; A35-F98 HydrophobicContact CB-CG 4.43Å; A35-T125 HydrophobicContact CB-CG2 4.32Å; A35-L131 HydrophobicContact CB-CD1 4.2Å
36	A	93.4	Very high	90.6	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	153	170.5	0	0	0	0	0	111.6	L29 C31 P92 F93	L29-A36 HydrophobicContact CB-CB 4.22Å; L29-A36 PolarHBondContact N-O 3.2Å; L29-A36 PolarHBondContact O-N 3.29Å; L29-A36 VanDerWaalsContact O-O 3.08Å; C31-A36 HydrophobicContact CB-CB 4.38Å; C31-A36 WeakPolarHBondContact SG-CB 3.44Å; A36-P92 HydrophobicContact CB-CB 4.4Å; A36-F93 CarbonylContact C-O 3.58Å; A36-F93 WeakPolarHBondContact CA-O 3.46Å; A36-F93 VanDerWaalsContact CB-O 3.29Å; A36-F93 WeakPolarHBondContact CB-O 3.33Å
37	V	94.4	Very high	89.9	Confident	0 Å²	0	30.3 Å²	30.3	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	134.7	-178.7	174.7	0	0	0	0	110.9	F26 S27 P92 F93 L96 L123 T125	F26-V37 HydrophobicContact CB-CG1 4.02Å; F26-V37 HydrophobicContact CD1-CG1 4.14Å; F26-V37 HydrophobicContact CG-CG1 4.5Å; S27-V37 WeakPolarHBondContact O-CA 3.33Å; V37-P92 WeakPolarHBondContact O-CA 3.35Å; V37-F93 PolarHBondContact N-O 3.08Å; V37-F93 PolarHBondContact O-N 3.44Å; V37-L96 HydrophobicContact CB-CD1 3.93Å; V37-L96 HydrophobicContact CG2-CD1 3.79Å; V37-L123 HydrophobicContact CG1-CD2 4.03Å; V37-L123 HydrophobicContact CG2-CD1 4.1Å; V37-T125 HydrophobicContact CG2-CG2 4.14Å
38	V	95.1	Very high	89.4	Confident	18 Å²	18	28 Å²	28	11%	0.109	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	126.9	165.4	-179.2	0	0	0	0	108.5	F26 S27 L29 H40 S90 P92	F26-V38 WeakPolarHBondContact CA-O 3.37Å; S27-V38 PolarHBondContact N-O 3.46Å; S27-V38 PolarHBondContact O-N 2.68Å; L29-V38 HydrophobicContact CD1-CG2 3.64Å; L29-V38 HydrophobicContact CG-CG2 4.48Å; V38-H40 VanDerWaalsContact CG1-CE1 3.42Å; V38-H40 WeakPolarHBondContact CG1-CE1 3.35Å; V38-S90 WeakPolarHBondContact CG1-O 3.35Å; V38-P92 HydrophobicContact CG2-CB 4.1Å; V38-P92 HydrophobicContact CG2-CG 3.78Å
39	V	96.1	Very high	88.8	Confident	0 Å²	0	29.5 Å²	29.5	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	131.2	176.1	-175.1	0	0	0	0	108.1	V24 F26 W41 V56 S89 S90 F93 V104 V106	V24-V39 HydrophobicContact CG1-CG1 4.21Å; F26-V39 HydrophobicContact CD1-CG1 4.38Å; F26-V39 HydrophobicContact CD1-CG2 4.21Å; F26-V39 HydrophobicContact CE1-CG1 4.12Å; F26-V39 HydrophobicContact CE1-CG2 4.32Å; V39-W41 HydrophobicContact CG1-CE3 4.17Å; V39-W41 VanDerWaalsContact O-CZ3 3.29Å; V39-W41 WeakPolarHBondContact O-CZ3 3.33Å; V39-V56 HydrophobicContact CB-CG1 4.17Å; V39-V56 HydrophobicContact CG1-CG1 4.29Å; V39-V56 HydrophobicContact CG2-CG1 4.03Å; V39-S89 CarbonylContact O-C 3.55Å; V39-S89 WeakPolarHBondContact O-CA 3.36Å; V39-S90 PolarHBondContact N-OG 3.29Å; V39-S90 PolarHBondContact O-N 2.89Å; V39-F93 HydrophobicContact CG2-CD2 4.14Å; V39-F93 HydrophobicContact CG2-CE2 3.94Å; V39-V104 HydrophobicContact CG1-CG1 3.88Å; V39-V104 HydrophobicContact CG2-CG1 3.85Å; V39-V104 HydrophobicContact CG2-CG2 4.39Å; V39-V106 HydrophobicContact CG1-CG2 4.11Å
40	H	95.6	Very high	88.4	Confident	22 Å²	22	31.4 Å²	31.4	10%	0.102	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	144.5	176.1	-55.1	-79.4	0	0	0	111	V24 S25 S27 V38 K87 L88 S89	V24-H40 CarbonylContact C-O 3.55Å; V24-H40 VanDerWaalsContact CA-O 3.22Å; V24-H40 WeakPolarHBondContact CA-O 3.23Å; S25-H40 PolarHBondContact N-O 3.34Å; S25-H40 PolarHBondContact O-N 3.32Å; S27-H40 WeakPolarHBondContact CB-NE2 3.44Å; S27-H40 PolarHBondContact OG-NE2 3.18Å; V38-H40 VanDerWaalsContact CG1-CE1 3.42Å; V38-H40 WeakPolarHBondContact CG1-CE1 3.35Å; H40-K87 HydrophobicContact CB-CD 4.22Å; H40-K87 HydrophobicContact CB-CG 4.05Å; H40-L88 CarbonylContact C-O 3.48Å; H40-L88 WeakPolarHBondContact CA-O 3.42Å; H40-S89 PolarHBondContact CE1-OG 3.48Å; H40-S89 WeakPolarHBondContact ND1-CB 3.23Å; H40-S89 PolarHBondContact ND1-OG 2.74Å
41	W	94.8	Very high	88.3	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	165	178.6	65.7	97.9	0	0	0	111.6	V21 V24 V39 F54 V56 L71 L88 V106	V21-W41 HydrophobicContact CB-CB 4.33Å; V21-W41 HydrophobicContact CB-CG 4.49Å; V21-W41 HydrophobicContact CG1-CG 4.49Å; V21-W41 HydrophobicContact CG2-CB 4.31Å; V24-W41 HydrophobicContact CG2-CB 4.22Å; V39-W41 HydrophobicContact CG1-CE3 4.17Å; V39-W41 VanDerWaalsContact O-CZ3 3.29Å; V39-W41 WeakPolarHBondContact O-CZ3 3.33Å; W41-F54 AromaticContact CE2-CG 3.97Å; W41-F54 HydrophobicContact CZ2-CB 3.78Å; W41-F54 AromaticContact CZ2-CD2 3.98Å; W41-F54 HydrophobicContact CZ2-CD2 3.98Å; W41-F54 AromaticContact CZ2-CG 3.84Å; W41-F54 HydrophobicContact CZ2-CG 3.84Å; W41-F54 AromaticContact NE1-CD1 3.47Å; W41-F54 AromaticContact NE1-CD2 3.79Å; W41-F54 AromaticContact NE1-CE1 3.56Å; W41-F54 AromaticContact NE1-CE2 3.9Å; W41-F54 AromaticContact NE1-CG 3.58Å; W41-F54 AromaticContact NE1-CZ 3.77Å; W41-V56 HydrophobicContact CH2-CG2 3.73Å; W41-V56 HydrophobicContact CZ2-CG2 4.4Å; W41-V56 HydrophobicContact CZ3-CG2 3.81Å; W41-L71 HydrophobicContact CH2-CD1 4.24Å; W41-L71 HydrophobicContact CH2-CD2 4.13Å; W41-L88 HydrophobicContact CD2-CB 4.09Å; W41-L88 HydrophobicContact CG-CB 4.45Å; W41-L88 HydrophobicContact CZ2-CB 3.85Å; W41-L88 PolarHBondContact N-O 3.34Å; W41-L88 PolarHBondContact O-N 3.16Å; W41-V106 HydrophobicContact CD2-CG1 3.92Å; W41-V106 HydrophobicContact CE3-CG1 4.46Å; W41-V106 HydrophobicContact CE3-CG2 4.41Å; W41-V106 HydrophobicContact CG-CG1 4.04Å; W41-V106 HydrophobicContact CZ2-CG1 4.47Å
42	S	91.6	Very high	88.3	Confident	7 Å²	7	37.1 Å²	37.1	5%	0.049	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	136.2	168.5	-57.6	0	0	0	0	109.4	V21 S22	V21-S42 WeakPolarHBondContact CB-O 3.5Å; S22-S42 PolarHBondContact N-O 3.15Å; S22-S42 PolarHBondContact O-N 2.88Å
43	A	88.5	Confident	88.6	Confident	2 Å²	2	31.2 Å²	31.2	2%	0.017	16%	0.16	C	C	.	.			trans	-67.7	143.6	177.3	0	0	0	0	0	110.7	I48 F54 L88	A43-I48 HydrophobicContact CB-CD1 3.52Å; A43-I48 HydrophobicContact CB-CG1 4.03Å; A43-F54 HydrophobicContact CB-CZ 3.83Å; A43-L88 HydrophobicContact CB-CD1 4.37Å
44	S	86.8	Confident	88.9	Confident	13 Å²	13	27.1 Å²	27.1	9%	0.091	14%	0.138	C	C	.	.			trans	-64.7	140.6	172.1	-171.5	0	0	0	0	110.2	H19 E20 L46 I48	H19-S44 WeakPolarHBondContact CB-OG 3.44Å; E20-S44 VanDerWaalsContact O-CB 3.3Å; E20-S44 WeakPolarHBondContact O-CB 3.35Å; S44-L46 PolarHBondContact O-N 3.21Å; S44-L46 PolarHBondContact OG-N 3.21Å; S44-I48 VanDerWaalsContact O-CB 3.28Å; S44-I48 WeakPolarHBondContact O-CB 3.4Å
45	P	83.7	Confident	89.1	Confident	46 Å²	46	25 Å²	25	30%	0.299	13%	0.127	S	C	.	.	S	Bend	trans	-66.4	-15.5	170.6	25.7	-33.2	0	0	0	113.9	Y81 R84	P45-Y81 HydrophobicContact CB-CD2 3.54Å; P45-Y81 HydrophobicContact CB-CE2 3.34Å; P45-Y81 HydrophobicContact CG-CE2 4.33Å; P45-R84 HydrophobicContact CB-CB 4.26Å
46	L	84.9	Confident	89.2	Confident	109 Å²	109	24.9 Å²	24.9	57%	0.571	13%	0.127	S	C	*	.	S	Bend	trans	-93.3	110.1	-176.5	-61.6	176.9	0	0	0	111	H19 S44	H19-L46 HydrophobicContact CB-CB 3.88Å; H19-L46 HydrophobicContact CB-CD1 4.39Å; H19-L46 PolarHBondContact N-O 2.68Å; S44-L46 PolarHBondContact O-N 3.21Å; S44-L46 PolarHBondContact OG-N 3.21Å
47	G	81.2	Confident	89.1	Confident	10 Å²	10	26.6 Å²	26.6	10%	0.103	13%	0.133	C	C	.	.	S	Bend	trans	82.6	11.8	179.3	0	0	0	0	0	114.2	E49 H50 I51	G47-E49 VanDerWaalsContact C-N 3.27Å; G47-E49 PolarHBondContact O-N 3.13Å; G47-H50 PolarHBondContact O-N 3.43Å; G47-I51 WeakPolarHBondContact O-CG2 3.38Å
48	I	83.8	Confident	89	Confident	1 Å²	1	26.7 Å²	26.7	1%	0.005	13%	0.134	C	C	.	.	G	3₁₀ helix	trans	-61.6	-34.3	-177.8	-163.5	173.9	0	0	0	112.8	A43 S44 H50 I51 L79	A43-I48 HydrophobicContact CB-CD1 3.52Å; A43-I48 HydrophobicContact CB-CG1 4.03Å; S44-I48 VanDerWaalsContact O-CB 3.28Å; S44-I48 WeakPolarHBondContact O-CB 3.4Å; I48-H50 PolarHBondContact O-N 2.91Å; I48-H50 VanDerWaalsContact O-N 3.17Å; I48-I51 HydrophobicContact CG1-CD1 3.97Å; I48-I51 VanDerWaalsContact O-CG1 3.29Å; I48-I51 WeakPolarHBondContact O-CG1 3.42Å; I48-I51 PolarHBondContact O-N 3.35Å; I48-L79 CarbonylContact C-O 3.33Å; I48-L79 VanDerWaalsContact C-O 3.28Å; I48-L79 HydrophobicContact CD1-CB 3.95Å; I48-L79 HydrophobicContact CG1-CB 3.64Å; I48-L79 HydrophobicContact CG1-CD1 4.44Å; I48-L79 WeakPolarHBondContact CG2-O 3.14Å
49	E	82.8	Confident	88.7	Confident	67 Å²	67	27.4 Å²	27.4	31%	0.313	14%	0.136	S	C	.	.	G	3₁₀ helix	trans	-65.9	-18.2	179.8	64.1	-74.8	168.9	0	0	113.2	G47 Q78 L79	G47-E49 VanDerWaalsContact C-N 3.27Å; G47-E49 PolarHBondContact O-N 3.13Å; E49-Q78 HydrophobicContact CB-CB 4.48Å; E49-Q78 WeakPolarHBondContact O-CB 2.91Å; E49-Q78 VanDerWaalsContact O-CD 3.3Å; E49-Q78 WeakPolarHBondContact O-CG 3.23Å; E49-L79 VanDerWaalsContact CA-O 3.27Å; E49-L79 WeakPolarHBondContact CA-O 3.4Å; E49-L79 PolarHBondContact N-O 2.75Å
50	H	84.1	Confident	88.1	Confident	62 Å²	62	29.1 Å²	29.1	29%	0.287	15%	0.145	S	C	.	.	G	3₁₀ helix	trans	-95	-8	-179.1	-58.3	104.3	0	0	0	113.3	H16 G47 I48	H16-H50 HydrophobicContact CB-CB 4.04Å; H16-H50 AromaticContact CD2-CD2 3.72Å; H16-H50 AromaticContact CD2-CE1 3.82Å; H16-H50 AromaticContact CD2-NE2 3.57Å; H16-H50 AromaticContact CE1-CD2 3.29Å; H16-H50 PolarHBondContact CE1-CD2 3.45Å; H16-H50 AromaticContact CE1-NE2 3.69Å; H16-H50 AromaticContact CG-CD2 3.51Å; H16-H50 AromaticContact CG-CG 3.51Å; H16-H50 AromaticContact CG-ND1 3.84Å; H16-H50 AromaticContact CG-NE2 3.84Å; H16-H50 AromaticContact ND1-CD2 3.24Å; H16-H50 PolarHBondContact ND1-CD2 2.87Å; H16-H50 AromaticContact ND1-CG 3.51Å; H16-H50 AromaticContact ND1-NE2 3.91Å; H16-H50 AromaticContact NE2-CD2 3.62Å; H16-H50 AromaticContact NE2-NE2 3.51Å; G47-H50 PolarHBondContact O-N 3.43Å; I48-H50 PolarHBondContact O-N 2.91Å; I48-H50 VanDerWaalsContact O-N 3.17Å
51	I	86.4	Confident	87	Confident	8 Å²	8	35.6 Å²	35.6	4%	0.041	17%	0.173	C	C	.	.			trans	-84.8	139.4	-173	85.1	-169.9	0	0	0	111.4	I18 G47 I48 F54 L73 L79 P108	I18-I51 HydrophobicContact CD1-CG2 3.59Å; I18-I51 HydrophobicContact CG1-CG2 4.04Å; I18-I51 HydrophobicContact CG2-CG2 3.89Å; G47-I51 WeakPolarHBondContact O-CG2 3.38Å; I48-I51 HydrophobicContact CG1-CD1 3.97Å; I48-I51 VanDerWaalsContact O-CG1 3.29Å; I48-I51 WeakPolarHBondContact O-CG1 3.42Å; I48-I51 PolarHBondContact O-N 3.35Å; I51-F54 HydrophobicContact CD1-CE1 4.04Å; I51-F54 HydrophobicContact CD1-CE2 3.71Å; I51-F54 HydrophobicContact CD1-CZ 3.27Å; I51-F54 HydrophobicContact CG1-CZ 4.5Å; I51-L73 HydrophobicContact CG1-CD1 4.39Å; I51-L79 HydrophobicContact CD1-CD1 3.64Å; I51-L79 HydrophobicContact CG1-CD1 3.9Å; I51-P108 HydrophobicContact CG2-CB 4.35Å
52	K	86.1	Confident	85.6	Confident	130 Å²	130	40.3 Å²	40.3	57%	0.565	20%	0.198	S	C	*	.			trans	-101.6	-13.7	173.6	-65.4	-174.4	176.9	-176.6	0	112.2	L73 F109	K52-L73 WeakPolarHBondContact O-CG 3.25Å; K52-L73 PolarHBondContact O-N 3.25Å; K52-F109 HydrophobicContact CB-CD2 4.32Å; K52-F109 HydrophobicContact CB-CE2 3.88Å; K52-F109 PolarHBondContact N-O 2.82Å
53	G	88.8	Confident	84.1	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	166	-165.2	179.9	0	0	0	0	0	113.6	L71 F109	G53-L71 CarbonylContact C-O 3.54Å; G53-L71 WeakPolarHBondContact CA-O 3.44Å; G53-F109 PolarHBondContact N-O 3.17Å; G53-F109 WeakPolarHBondContact O-CD1 3.34Å; G53-F109 PolarHBondContact O-N 3.15Å
54	F	90.9	Very high	82.8	Confident	3 Å²	3	52 Å²	52	1%	0.013	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	147	-179.1	-58.6	-92.3	0	0	0	111.4	V21 W41 A43 I51 L71 L79 L88 V106 V107 P108	V21-F54 HydrophobicContact CG1-CD1 4.13Å; V21-F54 HydrophobicContact CG1-CE1 3.78Å; W41-F54 AromaticContact CE2-CG 3.97Å; W41-F54 HydrophobicContact CZ2-CB 3.78Å; W41-F54 AromaticContact CZ2-CD2 3.98Å; W41-F54 HydrophobicContact CZ2-CD2 3.98Å; W41-F54 AromaticContact CZ2-CG 3.84Å; W41-F54 HydrophobicContact CZ2-CG 3.84Å; W41-F54 AromaticContact NE1-CD1 3.47Å; W41-F54 AromaticContact NE1-CD2 3.79Å; W41-F54 AromaticContact NE1-CE1 3.56Å; W41-F54 AromaticContact NE1-CE2 3.9Å; W41-F54 AromaticContact NE1-CG 3.58Å; W41-F54 AromaticContact NE1-CZ 3.77Å; A43-F54 HydrophobicContact CB-CZ 3.83Å; I51-F54 HydrophobicContact CD1-CE1 4.04Å; I51-F54 HydrophobicContact CD1-CE2 3.71Å; I51-F54 HydrophobicContact CD1-CZ 3.27Å; I51-F54 HydrophobicContact CG1-CZ 4.5Å; F54-L71 PolarHBondContact N-O 3.13Å; F54-L71 PolarHBondContact O-N 3.29Å; F54-L79 HydrophobicContact CE2-CD1 4.33Å; F54-L88 HydrophobicContact CD2-CD1 4.07Å; F54-L88 HydrophobicContact CE2-CD1 3.36Å; F54-L88 HydrophobicContact CZ-CD1 3.76Å; F54-V106 HydrophobicContact CB-CG1 4.36Å; F54-V106 HydrophobicContact CD1-CG1 4.04Å; F54-V107 CarbonylContact C-O 3.57Å; F54-V107 WeakPolarHBondContact CA-O 3.41Å; F54-P108 HydrophobicContact CD1-CB 3.99Å; F54-P108 HydrophobicContact CE1-CB 3.92Å
55	R	91.1	Very high	81.8	Confident	25 Å²	25	52.9 Å²	52.9	9%	0.094	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	132.3	165.5	-64.1	176	-172.4	165.6	-6.5	108.5	L9 Y57 Q69 V106 V107 F109 E115	L9-R55 PolarHBondContact O-NH2 3.04Å; R55-Y57 HydrophobicContact CB-CD2 4.5Å; R55-Y57 HydrophobicContact CB-CE2 3.84Å; R55-Y57 WeakPolarHBondContact CD-OH 3.33Å; R55-Q69 WeakPolarHBondContact CA-O 3.26Å; R55-V106 CarbonylContact O-C 3.6Å; R55-V106 WeakPolarHBondContact O-CA 3.45Å; R55-V107 HydrophobicContact CB-CB 4.39Å; R55-V107 PolarHBondContact N-O 3.29Å; R55-V107 PolarHBondContact O-N 3.04Å; R55-F109 HydrophobicContact CG-CD1 4.08Å; R55-F109 HydrophobicContact CG-CE1 4.48Å; R55-E115 IonicContact CZ-OE1 2.95Å; R55-E115 IonicContact NH1-OE1 2.67Å; R55-E115 PolarHBondContact NH1-OE1 3Å
56	V	93.5	Very high	81.7	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	113.9	176.7	-173.6	0	0	0	0	107.1	V39 W41 C68 Q69 L71 F93 V104 R105 V106	V39-V56 HydrophobicContact CB-CG1 4.17Å; V39-V56 HydrophobicContact CG1-CG1 4.29Å; V39-V56 HydrophobicContact CG2-CG1 4.03Å; W41-V56 HydrophobicContact CH2-CG2 3.73Å; W41-V56 HydrophobicContact CZ2-CG2 4.4Å; W41-V56 HydrophobicContact CZ3-CG2 3.81Å; V56-C68 WeakPolarHBondContact O-CA 3.25Å; V56-Q69 PolarHBondContact N-O 3.12Å; V56-Q69 PolarHBondContact O-N 3.31Å; V56-L71 HydrophobicContact CG2-CD1 3.86Å; V56-F93 HydrophobicContact CB-CE2 4.22Å; V56-F93 HydrophobicContact CB-CZ 3.89Å; V56-F93 HydrophobicContact CG1-CE2 3.66Å; V56-F93 HydrophobicContact CG1-CZ 3.64Å; V56-F93 WeakPolarHBondContact O-CZ 3.31Å; V56-V104 HydrophobicContact CG1-CG1 4Å; V56-R105 WeakPolarHBondContact CA-O 3.19Å; V56-V106 HydrophobicContact CG1-CG2 4.26Å; V56-V106 HydrophobicContact CG2-CG1 4.31Å; V56-V106 HydrophobicContact CG2-CG2 4.25Å
57	Y	91	Very high	81.8	Confident	36 Å²	36	54 Å²	54	14%	0.141	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	135.3	174.6	-60.3	-81.6	0	0	0	108.7	R55 C68 V104 R105 V107 E115	R55-Y57 HydrophobicContact CB-CD2 4.5Å; R55-Y57 HydrophobicContact CB-CE2 3.84Å; R55-Y57 WeakPolarHBondContact CD-OH 3.33Å; Y57-C68 HydrophobicContact CD1-CB 3.77Å; Y57-C68 WeakPolarHBondContact CD1-SG 3.45Å; Y57-C68 HydrophobicContact CE1-CB 4Å; Y57-C68 WeakPolarHBondContact CE1-SG 3.37Å; Y57-V104 CarbonylContact O-C 3.52Å; Y57-V104 VanDerWaalsContact O-CA 3.23Å; Y57-V104 WeakPolarHBondContact O-CA 3.32Å; Y57-R105 PolarHBondContact N-O 3.02Å; Y57-R105 PolarHBondContact O-N 2.88Å; Y57-V107 HydrophobicContact CD2-CG2 4.04Å; Y57-V107 HydrophobicContact CE2-CB 4.3Å; Y57-V107 HydrophobicContact CE2-CG2 3.85Å; Y57-E115 PolarHBondContact OH-OE1 3.26Å; Y57-E115 PolarHBondContact OH-OE2 3.39Å
58	L	91.9	Very high	82.2	Confident	1 Å²	1	55.2 Å²	55.2	1%	0.005	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	120.3	172.3	-175.8	150.2	0	0	0	107.6	Q67 F93 L96 Y102 M103 V104	L58-Q67 PolarHBondContact N-O 2.96Å; L58-Q67 PolarHBondContact O-N 3.21Å; L58-F93 HydrophobicContact CB-CD1 3.93Å; L58-F93 HydrophobicContact CB-CE1 3.92Å; L58-F93 HydrophobicContact CB-CG 4.32Å; L58-F93 HydrophobicContact CB-CZ 4.32Å; L58-F93 HydrophobicContact CD1-CB 3.86Å; L58-F93 HydrophobicContact CD1-CD1 4.22Å; L58-F93 HydrophobicContact CD1-CD2 4.09Å; L58-F93 HydrophobicContact CD1-CG 3.8Å; L58-L96 HydrophobicContact CD1-CD1 4.1Å; L58-L96 HydrophobicContact CD1-CD2 4.37Å; L58-L96 HydrophobicContact CD2-CD2 3.56Å; L58-Y102 HydrophobicContact CD2-CD1 3.45Å; L58-Y102 VanDerWaalsContact CD2-CD1 3.45Å; L58-Y102 HydrophobicContact CD2-CE1 3.9Å; L58-Y102 HydrophobicContact CD2-CG 4.1Å; L58-Y102 HydrophobicContact CG-CD1 4.3Å; L58-M103 WeakPolarHBondContact CA-O 3.48Å; L58-V104 HydrophobicContact CB-CG2 4.34Å; L58-V104 HydrophobicContact CD1-CG2 4Å; L58-V104 HydrophobicContact CG-CG2 4.07Å
59	E	88.7	Confident	82.5	Confident	33 Å²	33	56.3 Å²	56.3	15%	0.154	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	130.8	-174.7	-50.4	-168.2	159.1	0	0	110	K66 M103	E59-K66 HydrophobicContact CB-CG 4.32Å; E59-K66 HydrophobicContact CG-CB 4.48Å; E59-K66 HydrophobicContact CG-CD 4.3Å; E59-K66 HydrophobicContact CG-CG 3.91Å; E59-K66 WeakPolarHBondContact OE1-CD 3.3Å; E59-K66 WeakPolarHBondContact OE1-CE 3.43Å; E59-K66 IonicContact OE1-NZ 3.76Å; E59-K66 PolarHBondContact OE1-NZ 3.09Å; E59-K66 IonicContact OE2-NZ 2.79Å; E59-K66 PolarHBondContact OE2-NZ 3.49Å; E59-K66 VanDerWaalsContact OE2-NZ 3.15Å; E59-M103 HydrophobicContact CB-CE 3.98Å; E59-M103 HydrophobicContact CG-CE 4.03Å; E59-M103 PolarHBondContact N-O 3.47Å; E59-M103 PolarHBondContact O-N 3.43Å; E59-M103 WeakPolarHBondContact OE2-CE 3.43Å
60	D	84.9	Confident	82.8	Confident	37 Å²	37	53.2 Å²	53.2	20%	0.198	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	165.3	165.6	-173.9	10	0	0	0	110.1	N62 Y102	D60-N62 PolarHBondContact O-N 2.91Å; D60-N62 PolarHBondContact OD2-ND2 2.92Å; D60-Y102 HydrophobicContact CB-CD1 4.04Å; D60-Y102 HydrophobicContact CB-CE1 3.77Å
61	K	71.5	Confident	83	Confident	158 Å²	158	50.2 Å²	50.2	69%	0.687	26%	0.256	S	S	*	.	S	Bend	trans	-55.9	-26	167.1	-71.8	179.2	-175.8	160.8	0	112	D101	K61-D101 IonicContact NZ-OD2 3.6Å; K61-D101 PolarHBondContact NZ-OD2 3.49Å
62	N	66.1	Low	83.1	Confident	98 Å²	98	52 Å²	52	52%	0.524	27%	0.265	S	S	.	.	S	Bend	trans	-85.1	129.6	173.4	-58.6	-54.3	0	0	0	110.7	D60 D64 G65	D60-N62 PolarHBondContact O-N 2.91Å; D60-N62 PolarHBondContact OD2-ND2 2.92Å; N62-D64 PolarHBondContact O-N 3.12Å; N62-D64 VanDerWaalsContact O-N 3.1Å; N62-G65 PolarHBondContact O-N 2.64Å
63	P	60	Low	83	Confident	97 Å²	97	46.8 Å²	46.8	63%	0.63	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-16.7	-172.2	25.5	-34	0	0	0	114.8
64	D	59.9	Low	82.2	Confident	158 Å²	158	53.8 Å²	53.8	85%	0.845	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82	-14.9	-179	-60.3	-40.9	0	0	0	113.5	N62 K66	N62-D64 PolarHBondContact O-N 3.12Å; N62-D64 VanDerWaalsContact O-N 3.1Å; D64-K66 VanDerWaalsContact C-N 3.33Å; D64-K66 PolarHBondContact O-N 2.86Å
65	G	66.1	Low	81	Confident	31 Å²	31	60.1 Å²	60.1	32%	0.32	30%	0.303	S	S	.	.			trans	-89.2	29.3	-174.1	0	0	0	0	0	115.4	N62 Q67	N62-G65 PolarHBondContact O-N 2.64Å; G65-Q67 PolarHBondContact O-N 2.99Å
66	K	81.4	Confident	79.3	Confident	122 Å²	122	64.9 Å²	64.9	53%	0.53	34%	0.337	S	S	.	.			trans	-83.3	112.1	-175.7	-62.5	-171.1	177.2	-137.6	0	111.7	E59 D64	E59-K66 HydrophobicContact CB-CG 4.32Å; E59-K66 HydrophobicContact CG-CB 4.48Å; E59-K66 HydrophobicContact CG-CD 4.3Å; E59-K66 HydrophobicContact CG-CG 3.91Å; E59-K66 WeakPolarHBondContact OE1-CD 3.3Å; E59-K66 WeakPolarHBondContact OE1-CE 3.43Å; E59-K66 IonicContact OE1-NZ 3.76Å; E59-K66 PolarHBondContact OE1-NZ 3.09Å; E59-K66 IonicContact OE2-NZ 2.79Å; E59-K66 PolarHBondContact OE2-NZ 3.49Å; E59-K66 VanDerWaalsContact OE2-NZ 3.15Å; D64-K66 VanDerWaalsContact C-N 3.33Å; D64-K66 PolarHBondContact O-N 2.86Å
67	Q	88	Confident	77.6	Confident	57 Å²	57	75.3 Å²	75.3	27%	0.266	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	143.8	171.3	-63.7	-176.5	-23.3	0	0	110.3	L58 G65 F93 S94	L58-Q67 PolarHBondContact N-O 2.96Å; L58-Q67 PolarHBondContact O-N 3.21Å; G65-Q67 PolarHBondContact O-N 2.99Å; Q67-F93 HydrophobicContact CB-CD1 3.8Å; Q67-F93 HydrophobicContact CB-CE1 4.04Å; Q67-S94 PolarHBondContact NE2-O 3.29Å
68	C	89.1	Confident	76.3	Confident	36 Å²	36	79.6 Å²	79.6	24%	0.243	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	134.7	178.7	-178.4	0	0	0	0	112	C7 V56 Y57	C7-C68 HydrophobicContact CB-CB 3.56Å; C7-C68 WeakPolarHBondContact CB-SG 3.33Å; C7-C68 WeakPolarHBondContact SG-CB 3.32Å; C7-C68 CovalentContact SG-SG 2.01Å; C7-C68 PolarHBondContact SG-SG 2.91Å; V56-C68 WeakPolarHBondContact O-CA 3.25Å; Y57-C68 HydrophobicContact CD1-CB 3.77Å; Y57-C68 WeakPolarHBondContact CD1-SG 3.45Å; Y57-C68 HydrophobicContact CE1-CB 4Å; Y57-C68 WeakPolarHBondContact CE1-SG 3.37Å
69	Q	90.9	Very high	75.4	Confident	24 Å²	24	79.7 Å²	79.7	11%	0.112	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	131.2	173.9	-66.6	-179.4	31.2	0	0	110.3	R55 V56 L71 Q91 F93	R55-Q69 WeakPolarHBondContact CA-O 3.26Å; V56-Q69 PolarHBondContact N-O 3.12Å; V56-Q69 PolarHBondContact O-N 3.31Å; Q69-L71 HydrophobicContact CB-CD1 4.05Å; Q69-Q91 PolarHBondContact NE2-O 3.29Å; Q69-Q91 PolarHBondContact OE1-O 2.96Å; Q69-F93 HydrophobicContact CB-CE1 4.37Å; Q69-F93 HydrophobicContact CB-CZ 4Å; Q69-F93 HydrophobicContact CG-CD1 4.36Å; Q69-F93 HydrophobicContact CG-CE1 3.65Å; Q69-F93 HydrophobicContact CG-CE2 4.33Å; Q69-F93 HydrophobicContact CG-CZ 3.62Å; Q69-F93 VanDerWaalsContact NE2-CD2 3.33Å; Q69-F93 VanDerWaalsContact NE2-CE2 3.32Å
70	H	89	Confident	74.7	Confident	1 Å²	1	82 Å²	82	1%	0.005	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	113.8	177.2	-163.7	175.2	0	0	0	109.8	Y4 S5 Y11 F109	Y4-H70 CarbonylContact C-O 3.51Å; Y4-H70 WeakPolarHBondContact CA-O 3.42Å; S5-H70 PolarHBondContact N-O 3.07Å; S5-H70 WeakPolarHBondContact O-CB 3.31Å; S5-H70 PolarHBondContact O-N 3.17Å; Y11-H70 AromaticContact CD2-CE1 3.84Å; Y11-H70 AromaticContact CE2-CE1 3.48Å; Y11-H70 VanDerWaalsContact CE2-CE1 3.48Å; Y11-H70 WeakPolarHBondContact CE2-CE1 3.46Å; H70-F109 AromaticContact CD2-CE1 3.26Å; H70-F109 WeakPolarHBondContact CD2-CE1 3.2Å; H70-F109 AromaticContact CD2-CZ 3.55Å; H70-F109 AromaticContact NE2-CD1 3.67Å; H70-F109 AromaticContact NE2-CE1 3.08Å; H70-F109 WeakPolarHBondContact NE2-CE1 3.47Å; H70-F109 AromaticContact NE2-CE2 3.55Å; H70-F109 AromaticContact NE2-CZ 3.04Å; H70-F109 WeakPolarHBondContact NE2-CZ 3.44Å
71	L	88.6	Confident	74.3	Confident	0 Å²	0	86.3 Å²	86.3	0%	0	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	115.4	-176.2	-62.4	97.3	0	0	0	110.7	L2 Y4 W41 G53 F54 V56 Q69	L2-L71 HydrophobicContact CB-CB 4.14Å; L2-L71 HydrophobicContact CB-CD2 4.22Å; L2-L71 HydrophobicContact CD1-CB 3.97Å; L2-L71 HydrophobicContact CD1-CD2 3.58Å; L2-L71 HydrophobicContact CD1-CG 4.43Å; L2-L71 HydrophobicContact CD2-CB 4.03Å; L2-L71 HydrophobicContact CG-CB 4.25Å; L2-L71 HydrophobicContact CG-CD2 4.43Å; Y4-L71 HydrophobicContact CD1-CD2 4.3Å; Y4-L71 HydrophobicContact CD1-CG 4.19Å; Y4-L71 HydrophobicContact CE1-CD2 3.63Å; Y4-L71 HydrophobicContact CE1-CG 4.02Å; W41-L71 HydrophobicContact CH2-CD1 4.24Å; W41-L71 HydrophobicContact CH2-CD2 4.13Å; G53-L71 CarbonylContact C-O 3.54Å; G53-L71 WeakPolarHBondContact CA-O 3.44Å; F54-L71 PolarHBondContact N-O 3.13Å; F54-L71 PolarHBondContact O-N 3.29Å; V56-L71 HydrophobicContact CG2-CD1 3.86Å; Q69-L71 HydrophobicContact CB-CD1 4.05Å
72	I	87.3	Confident	74.6	Confident	44 Å²	44	82.5 Å²	82.5	23%	0.226	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	135.6	-176	-55.7	166.3	0	0	0	110	L2 R3 K74 F109	L2-I72 CarbonylContact C-O 3.28Å; L2-I72 WeakPolarHBondContact CA-O 3.25Å; R3-I72 PolarHBondContact N-O 3.12Å; R3-I72 PolarHBondContact O-N 2.81Å; I72-K74 PolarHBondContact O-N 3.07Å; I72-F109 HydrophobicContact CG1-CZ 4Å
73	L	84.1	Confident	75	Confident	21 Å²	21	81.9 Å²	81.9	11%	0.11	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	129.5	177.4	-63	165.1	0	0	0	111.5	M1 L2 I51 K52 L79	M1-L73 HydrophobicContact CG-CD2 4.11Å; M1-L73 WeakPolarHBondContact O-CA 3.43Å; L2-L73 HydrophobicContact CD2-CD2 3.57Å; L2-L73 HydrophobicContact CD2-CG 4.09Å; I51-L73 HydrophobicContact CG1-CD1 4.39Å; K52-L73 WeakPolarHBondContact O-CG 3.25Å; K52-L73 PolarHBondContact O-N 3.25Å; L73-L79 HydrophobicContact CD1-CD1 3.7Å; L73-L79 HydrophobicContact CD1-CG 3.82Å; L73-L79 HydrophobicContact CD2-CD1 3.82Å; L73-L79 HydrophobicContact CD2-CD2 4.43Å; L73-L79 HydrophobicContact CD2-CG 4.08Å; L73-L79 HydrophobicContact CG-CD1 4.38Å
74	K	73.1	Confident	75.8	Confident	147 Å²	147	83.4 Å²	83.4	64%	0.639	40%	0.404	S	S	*	.	S	Bend	trans	-66.7	-34.4	-176.5	-74.4	-171.4	179.7	-172.7	0	113	M1 L2 R3 I72	M1-K74 PolarHBondContact O-N 3.36Å; L2-K74 WeakPolarHBondContact O-CE 2.9Å; R3-K74 HydrophobicContact CB-CG 4.31Å; I72-K74 PolarHBondContact O-N 3.07Å
75	E	64	Low	76.6	Confident	137 Å²	137	80.5 Å²	80.5	64%	0.64	40%	0.395	S	S	*	.	S	Bend	trans	-117.4	122	173.9	-78.1	165.3	-135.6	0	0	108.2	R77	E75-R77 PolarHBondContact O-N 2.87Å
76	P	56.9	Low	77.5	Confident	125 Å²	125	81.4 Å²	81.4	81%	0.812	40%	0.395	S	S	*	.			trans	-71.7	14.2	179.8	30.5	-35.3	0	0	0	113.2	Q78	P76-Q78 PolarHBondContact O-N 3.19Å
77	R	56.8	Low	77.9	Confident	219 Å²	219	81.4 Å²	81.4	83%	0.826	40%	0.395	S	S	*	.	S	Bend	trans	-69.6	88.7	166.4	-67.7	-169.1	-165.5	-141.1	4.8	106.8	E75 L79	E75-R77 PolarHBondContact O-N 2.87Å; R77-L79 PolarHBondContact O-N 3.38Å
78	Q	64.9	Low	78	Confident	125 Å²	125	79.1 Å²	79.1	58%	0.584	39%	0.385	S	S	*	.			trans	-19	122.5	175.2	-62.9	174	-15	0	0	112.1	E49 P76 N80	E49-Q78 HydrophobicContact CB-CB 4.48Å; E49-Q78 WeakPolarHBondContact O-CB 2.91Å; E49-Q78 VanDerWaalsContact O-CD 3.3Å; E49-Q78 WeakPolarHBondContact O-CG 3.23Å; P76-Q78 PolarHBondContact O-N 3.19Å; Q78-N80 PolarHBondContact O-N 3.27Å
79	L	71.8	Confident	78.2	Confident	3 Å²	3	79.6 Å²	79.6	2%	0.016	39%	0.388	C	S	.	.			trans	-53.3	113.8	168	-76.7	167.8	0	0	0	107	M1 I48 E49 I51 F54 L73 R77 Y83	M1-L79 HydrophobicContact CE-CD2 3.35Å; M1-L79 HydrophobicContact SD-CD2 4.06Å; I48-L79 CarbonylContact C-O 3.33Å; I48-L79 VanDerWaalsContact C-O 3.28Å; I48-L79 HydrophobicContact CD1-CB 3.95Å; I48-L79 HydrophobicContact CG1-CB 3.64Å; I48-L79 HydrophobicContact CG1-CD1 4.44Å; I48-L79 WeakPolarHBondContact CG2-O 3.14Å; E49-L79 VanDerWaalsContact CA-O 3.27Å; E49-L79 WeakPolarHBondContact CA-O 3.4Å; E49-L79 PolarHBondContact N-O 2.75Å; I51-L79 HydrophobicContact CD1-CD1 3.64Å; I51-L79 HydrophobicContact CG1-CD1 3.9Å; F54-L79 HydrophobicContact CE2-CD1 4.33Å; L73-L79 HydrophobicContact CD1-CD1 3.7Å; L73-L79 HydrophobicContact CD1-CG 3.82Å; L73-L79 HydrophobicContact CD2-CD1 3.82Å; L73-L79 HydrophobicContact CD2-CD2 4.43Å; L73-L79 HydrophobicContact CD2-CG 4.08Å; L73-L79 HydrophobicContact CG-CD1 4.38Å; R77-L79 PolarHBondContact O-N 3.38Å; L79-Y83 HydrophobicContact CD2-CD1 4.08Å; L79-Y83 HydrophobicContact CD2-CD2 3.9Å; L79-Y83 HydrophobicContact CD2-CG 3.65Å
80	N	73.3	Confident	78.3	Confident	81 Å²	81	78.8 Å²	78.8	43%	0.433	39%	0.385	S	S	.	.			trans	-89.7	175.4	177.2	68.2	11.9	0	0	0	109.9	Q78 S82 Y83	Q78-N80 PolarHBondContact O-N 3.27Å; N80-S82 PolarHBondContact O-N 3.4Å; N80-S82 VanDerWaalsContact OD1-CB 3.27Å; N80-S82 WeakPolarHBondContact OD1-CB 3.29Å; N80-S82 PolarHBondContact OD1-N 3.29Å; N80-S82 PolarHBondContact OD1-OG 2.9Å; N80-Y83 PolarHBondContact O-N 3.49Å; N80-Y83 WeakPolarHBondContact OD1-CD2 3.39Å; N80-Y83 WeakPolarHBondContact OD1-CE2 3.25Å
81	Y	77.8	Confident	78.4	Confident	128 Å²	128	83 Å²	83	50%	0.502	41%	0.405	S	S	.	.	G	3₁₀ helix	trans	-54.4	-23.8	178.5	-172.5	-94.4	0	0	0	114.3	P45 Y83 R84	P45-Y81 HydrophobicContact CB-CD2 3.54Å; P45-Y81 HydrophobicContact CB-CE2 3.34Å; P45-Y81 HydrophobicContact CG-CE2 4.33Å; Y81-Y83 PolarHBondContact O-N 2.8Å; Y81-R84 WeakPolarHBondContact O-CB 3.13Å; Y81-R84 WeakPolarHBondContact O-CG 2.95Å; Y81-R84 PolarHBondContact O-N 3.46Å; Y81-R84 VanDerWaalsContact O-N 3.13Å; Y81-R84 PolarHBondContact OH-NH1 2.88Å
82	S	77.3	Confident	78.5	Confident	78 Å²	78	85.5 Å²	85.5	55%	0.545	42%	0.421	S	S	.	.	G	3₁₀ helix	trans	-64.6	-21.1	178.7	78.9	0	0	0	0	113.1	N80 R84	N80-S82 PolarHBondContact O-N 3.4Å; N80-S82 VanDerWaalsContact OD1-CB 3.27Å; N80-S82 WeakPolarHBondContact OD1-CB 3.29Å; N80-S82 PolarHBondContact OD1-N 3.29Å; N80-S82 PolarHBondContact OD1-OG 2.9Å; S82-R84 VanDerWaalsContact C-N 3.33Å; S82-R84 PolarHBondContact O-N 2.75Å
83	Y	75.7	Confident	78.7	Confident	85 Å²	85	83.7 Å²	83.7	33%	0.333	41%	0.412	S	S	.	.	G	3₁₀ helix	trans	-87.5	7.1	177.3	-63.5	-83.3	0	0	0	114	M1 L79 N80 Y81 S85 T86	M1-Y83 HydrophobicContact CE-CD1 3.95Å; M1-Y83 HydrophobicContact CE-CE1 3.63Å; L79-Y83 HydrophobicContact CD2-CD1 4.08Å; L79-Y83 HydrophobicContact CD2-CD2 3.9Å; L79-Y83 HydrophobicContact CD2-CG 3.65Å; N80-Y83 PolarHBondContact O-N 3.49Å; N80-Y83 WeakPolarHBondContact OD1-CD2 3.39Å; N80-Y83 WeakPolarHBondContact OD1-CE2 3.25Å; Y81-Y83 PolarHBondContact O-N 2.8Å; Y83-S85 PolarHBondContact O-N 3.01Å; Y83-S85 VanDerWaalsContact O-N 3.09Å; Y83-T86 HydrophobicContact CD1-CG2 4.39Å; Y83-T86 WeakPolarHBondContact CD1-OG1 3.09Å; Y83-T86 WeakPolarHBondContact O-CB 3.38Å; Y83-T86 PolarHBondContact O-N 2.83Å
84	R	75.1	Confident	79	Confident	130 Å²	130	85.2 Å²	85.2	49%	0.491	42%	0.424	S	S	.	.	G	3₁₀ helix	trans	-54.9	-29.8	-179.8	70.1	-179	-178.7	167.2	4.3	114.1	P45 Y81 S82	P45-R84 HydrophobicContact CB-CB 4.26Å; Y81-R84 WeakPolarHBondContact O-CB 3.13Å; Y81-R84 WeakPolarHBondContact O-CG 2.95Å; Y81-R84 PolarHBondContact O-N 3.46Å; Y81-R84 VanDerWaalsContact O-N 3.13Å; Y81-R84 PolarHBondContact OH-NH1 2.88Å; S82-R84 VanDerWaalsContact C-N 3.33Å; S82-R84 PolarHBondContact O-N 2.75Å
85	S	77.9	Confident	79.7	Confident	96 Å²	96	81.5 Å²	81.5	67%	0.671	42%	0.417	S	S	*	.	G	3₁₀ helix	trans	-103.8	3.2	179.7	54.2	0	0	0	0	113.3	Y83 K87	Y83-S85 PolarHBondContact O-N 3.01Å; Y83-S85 VanDerWaalsContact O-N 3.09Å; S85-K87 PolarHBondContact O-N 2.85Å
86	T	85.1	Confident	80.9	Confident	50 Å²	50	75.2 Å²	75.2	31%	0.307	39%	0.387	S	S	.	.			trans	-75.6	117.8	179.2	-60.3	0	0	0	0	109.6	Y83 L88	Y83-T86 HydrophobicContact CD1-CG2 4.39Å; Y83-T86 WeakPolarHBondContact CD1-OG1 3.09Å; Y83-T86 WeakPolarHBondContact O-CB 3.38Å; Y83-T86 PolarHBondContact O-N 2.83Å; T86-L88 HydrophobicContact CG2-CD2 4.5Å; T86-L88 PolarHBondContact O-N 3.24Å
87	K	89	Confident	82.5	Confident	122 Å²	122	72.3 Å²	72.3	53%	0.53	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	111.5	174.8	-168.1	171.5	-178	174.5	0	109.6	S25 H40 S85	S25-K87 PolarHBondContact OG-NZ 2.97Å; H40-K87 HydrophobicContact CB-CD 4.22Å; H40-K87 HydrophobicContact CB-CG 4.05Å; S85-K87 PolarHBondContact O-N 2.85Å
88	L	89.8	Confident	84.1	Confident	10 Å²	10	62.3 Å²	62.3	5%	0.052	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	151.7	172.8	-61.7	169.8	0	0	0	109.2	M1 L2 H40 W41 A43 F54 T86	M1-L88 HydrophobicContact SD-CD2 4.34Å; L2-L88 HydrophobicContact CD1-CD2 4.36Å; H40-L88 CarbonylContact C-O 3.48Å; H40-L88 WeakPolarHBondContact CA-O 3.42Å; W41-L88 HydrophobicContact CD2-CB 4.09Å; W41-L88 HydrophobicContact CG-CB 4.45Å; W41-L88 HydrophobicContact CZ2-CB 3.85Å; W41-L88 PolarHBondContact N-O 3.34Å; W41-L88 PolarHBondContact O-N 3.16Å; A43-L88 HydrophobicContact CB-CD1 4.37Å; F54-L88 HydrophobicContact CD2-CD1 4.07Å; F54-L88 HydrophobicContact CE2-CD1 3.36Å; F54-L88 HydrophobicContact CZ-CD1 3.76Å; T86-L88 HydrophobicContact CG2-CD2 4.5Å; T86-L88 PolarHBondContact O-N 3.24Å
89	S	93.2	Very high	85.2	Confident	45 Å²	45	60 Å²	60	32%	0.315	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	142.4	-174.2	-49.8	0	0	0	0	111.2	V39 H40	V39-S89 CarbonylContact O-C 3.55Å; V39-S89 WeakPolarHBondContact O-CA 3.36Å; H40-S89 PolarHBondContact CE1-OG 3.48Å; H40-S89 WeakPolarHBondContact ND1-CB 3.23Å; H40-S89 PolarHBondContact ND1-OG 2.74Å
90	S	93.4	Very high	86.1	Confident	8 Å²	8	61.4 Å²	61.4	6%	0.056	33%	0.33	C	S	.	.	P	Polyproline II helix	trans	-75.4	171.8	169.4	73	0	0	0	0	111.3	V38 V39	V38-S90 WeakPolarHBondContact CG1-O 3.35Å; V39-S90 PolarHBondContact N-OG 3.29Å; V39-S90 PolarHBondContact O-N 2.89Å
91	Q	91.2	Very high	86.9	Confident	90 Å²	90	60.5 Å²	60.5	42%	0.421	33%	0.326	S	S	.	.	P	Polyproline II helix	trans	-72.6	158.9	155.2	-86.1	174.4	-11.7	0	0	109.5	Y4 Q69 F93	Y4-Q91 HydrophobicContact CD1-CG 4.03Å; Y4-Q91 HydrophobicContact CE1-CB 4.12Å; Y4-Q91 HydrophobicContact CE1-CG 3.46Å; Y4-Q91 VanDerWaalsContact CE1-CG 3.46Å; Y4-Q91 HydrophobicContact CE2-CG 4.21Å; Q69-Q91 PolarHBondContact NE2-O 3.29Å; Q69-Q91 PolarHBondContact OE1-O 2.96Å; Q91-F93 PolarHBondContact O-N 2.83Å
92	P	91.8	Very high	87.6	Confident	52 Å²	52	55 Å²	55	34%	0.338	30%	0.304	S	S	.	.	P	Polyproline II helix	trans	-55.5	123	172.5	-23	33	0	0	0	110.4	L29 A36 V37 V38 S94	L29-P92 HydrophobicContact CD1-CB 4.15Å; L29-P92 HydrophobicContact CD1-CG 3.94Å; A36-P92 HydrophobicContact CB-CB 4.4Å; V37-P92 WeakPolarHBondContact O-CA 3.35Å; V38-P92 HydrophobicContact CG2-CB 4.1Å; V38-P92 HydrophobicContact CG2-CG 3.78Å; P92-S94 PolarHBondContact O-N 3.5Å
93	F	91.4	Very high	88.3	Confident	5 Å²	5	53.3 Å²	53.3	2%	0.022	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	103.4	161.9	-72.3	-88.2	0	0	0	106.9	A36 V37 V39 V56 L58 Q67 Q69 Q91 L96	A36-F93 CarbonylContact C-O 3.58Å; A36-F93 WeakPolarHBondContact CA-O 3.46Å; A36-F93 VanDerWaalsContact CB-O 3.29Å; A36-F93 WeakPolarHBondContact CB-O 3.33Å; V37-F93 PolarHBondContact N-O 3.08Å; V37-F93 PolarHBondContact O-N 3.44Å; V39-F93 HydrophobicContact CG2-CD2 4.14Å; V39-F93 HydrophobicContact CG2-CE2 3.94Å; V56-F93 HydrophobicContact CB-CE2 4.22Å; V56-F93 HydrophobicContact CB-CZ 3.89Å; V56-F93 HydrophobicContact CG1-CE2 3.66Å; V56-F93 HydrophobicContact CG1-CZ 3.64Å; V56-F93 WeakPolarHBondContact O-CZ 3.31Å; L58-F93 HydrophobicContact CB-CD1 3.93Å; L58-F93 HydrophobicContact CB-CE1 3.92Å; L58-F93 HydrophobicContact CB-CG 4.32Å; L58-F93 HydrophobicContact CB-CZ 4.32Å; L58-F93 HydrophobicContact CD1-CB 3.86Å; L58-F93 HydrophobicContact CD1-CD1 4.22Å; L58-F93 HydrophobicContact CD1-CD2 4.09Å; L58-F93 HydrophobicContact CD1-CG 3.8Å; Q67-F93 HydrophobicContact CB-CD1 3.8Å; Q67-F93 HydrophobicContact CB-CE1 4.04Å; Q69-F93 HydrophobicContact CB-CE1 4.37Å; Q69-F93 HydrophobicContact CB-CZ 4Å; Q69-F93 HydrophobicContact CG-CD1 4.36Å; Q69-F93 HydrophobicContact CG-CE1 3.65Å; Q69-F93 HydrophobicContact CG-CE2 4.33Å; Q69-F93 HydrophobicContact CG-CZ 3.62Å; Q69-F93 VanDerWaalsContact NE2-CD2 3.33Å; Q69-F93 VanDerWaalsContact NE2-CE2 3.32Å; Q91-F93 PolarHBondContact O-N 2.83Å; F93-L96 HydrophobicContact CB-CD1 4.24Å; F93-L96 WeakPolarHBondContact O-CD1 3.39Å
94	S	89.6	Confident	89.2	Confident	54 Å²	54	49.3 Å²	49.3	38%	0.378	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	171.4	177.8	60.6	0	0	0	0	111.4	Q67 P92 L96	Q67-S94 PolarHBondContact NE2-O 3.29Å; P92-S94 PolarHBondContact O-N 3.5Å; S94-L96 VanDerWaalsContact C-N 3.32Å; S94-L96 PolarHBondContact O-N 2.8Å
95	S	87.5	Confident	90	Very high	68 Å²	68	45.2 Å²	45.2	48%	0.476	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	64.9	35.8	176.7	-47.1	0	0	0	0	114.4	Q34	Q34-S95 PolarHBondContact OE1-OG 2.89Å
96	L	89.9	Confident	90.8	Very high	5 Å²	5	41 Å²	41	3%	0.026	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	151.5	170.1	-50.5	-179.8	0	0	0	109.8	A35 V37 L58 F93 S94 Y102 T125	A35-L96 HydrophobicContact CB-CB 4.09Å; A35-L96 WeakPolarHBondContact CB-O 3.42Å; A35-L96 PolarHBondContact N-O 3.5Å; A35-L96 WeakPolarHBondContact O-CB 3.29Å; A35-L96 PolarHBondContact O-N 3.06Å; V37-L96 HydrophobicContact CB-CD1 3.93Å; V37-L96 HydrophobicContact CG2-CD1 3.79Å; L58-L96 HydrophobicContact CD1-CD1 4.1Å; L58-L96 HydrophobicContact CD1-CD2 4.37Å; L58-L96 HydrophobicContact CD2-CD2 3.56Å; F93-L96 HydrophobicContact CB-CD1 4.24Å; F93-L96 WeakPolarHBondContact O-CD1 3.39Å; S94-L96 VanDerWaalsContact C-N 3.32Å; S94-L96 PolarHBondContact O-N 2.8Å; L96-Y102 WeakPolarHBondContact CA-OH 3.32Å; L96-Y102 HydrophobicContact CB-CE2 4.11Å; L96-Y102 HydrophobicContact CD2-CE1 3.96Å; L96-Y102 HydrophobicContact CD2-CE2 4.49Å; L96-T125 HydrophobicContact CB-CG2 4.2Å; L96-T125 HydrophobicContact CD1-CG2 4.23Å
97	T	89.4	Confident	91.1	Very high	65 Å²	65	38.8 Å²	38.8	40%	0.399	21%	0.214	S	C	.	.	P	Polyproline II helix	trans	-83.7	146	174.6	50.8	0	0	0	0	110.2	T100 Y102 T125	T97-T100 WeakPolarHBondContact CB-OG1 3.44Å; T97-T100 WeakPolarHBondContact OG1-CB 3.11Å; T97-T100 WeakPolarHBondContact OG1-CG2 3.44Å; T97-T100 PolarHBondContact OG1-OG1 3.3Å; T97-Y102 PolarHBondContact N-OH 3.39Å; T97-Y102 PolarHBondContact OG1-OH 3.2Å; T97-T125 WeakPolarHBondContact O-CB 3.34Å; T97-T125 PolarHBondContact O-OG1 2.97Å
98	F	90.7	Very high	91.2	Very high	9 Å²	9	33.1 Å²	33.1	4%	0.039	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.4	152	174.5	-59.5	-72.3	0	0	0	111.2	D33 A35 T100 C128 L131 L132 V138 F142	D33-F98 WeakPolarHBondContact O-CE2 3.29Å; A35-F98 HydrophobicContact CB-CD1 3.73Å; A35-F98 HydrophobicContact CB-CE1 3.81Å; A35-F98 HydrophobicContact CB-CG 4.43Å; F98-T100 PolarHBondContact O-N 2.89Å; F98-T100 VanDerWaalsContact O-N 3.15Å; F98-T100 PolarHBondContact O-OG1 3.45Å; F98-C128 HydrophobicContact CB-CB 4.3Å; F98-C128 HydrophobicContact CD1-CB 4.01Å; F98-C128 HydrophobicContact CD2-CB 3.84Å; F98-C128 HydrophobicContact CE1-CB 4.31Å; F98-C128 HydrophobicContact CE2-CB 4.14Å; F98-C128 HydrophobicContact CG-CB 3.78Å; F98-C128 HydrophobicContact CZ-CB 4.38Å; F98-L131 HydrophobicContact CD1-CD1 3.96Å; F98-L131 HydrophobicContact CE1-CB 4.35Å; F98-L131 HydrophobicContact CE1-CD1 3.85Å; F98-L132 HydrophobicContact CZ-CD1 3.85Å; F98-V138 HydrophobicContact CE2-CG1 4.25Å; F98-F142 AromaticContact CD2-CD2 3.97Å; F98-F142 HydrophobicContact CD2-CD2 3.97Å; F98-F142 AromaticContact CD2-CE2 3.68Å; F98-F142 HydrophobicContact CD2-CE2 3.68Å; F98-F142 HydrophobicContact CD2-CZ 4.05Å; F98-F142 HydrophobicContact CE2-CE2 4.15Å
99	D	89.2	Confident	91.1	Very high	75 Å²	75	33 Å²	33	40%	0.401	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.5	37.2	174.5	-161.6	35.1	0	0	0	114.7	R124 T125 N126	D99-R124 IonicContact OD1-CZ 3Å; D99-R124 IonicContact OD1-NE 3.31Å; D99-R124 PolarHBondContact OD1-NE 3.14Å; D99-R124 IonicContact OD1-NH2 3.62Å; D99-R124 PolarHBondContact OD1-NH2 3.23Å; D99-R124 IonicContact OD2-NH2 2.7Å; D99-R124 PolarHBondContact OD2-NH2 2.63Å; D99-T125 WeakPolarHBondContact CA-O 3.18Å; D99-T125 PolarHBondContact N-O 3.44Å; D99-T125 PolarHBondContact N-OG1 3.22Å; D99-T125 VanDerWaalsContact N-OG1 3.15Å; D99-N126 PolarHBondContact N-O 3.08Å
100	T	89.3	Confident	90.8	Very high	33 Å²	33	32.1 Å²	32.1	20%	0.202	18%	0.181	C	C	.	.			trans	-122.6	140.8	-173.1	-57.4	0	0	0	0	111.4	T97 F98 Y102 R124 T125	T97-T100 WeakPolarHBondContact CB-OG1 3.44Å; T97-T100 WeakPolarHBondContact OG1-CB 3.11Å; T97-T100 WeakPolarHBondContact OG1-CG2 3.44Å; T97-T100 PolarHBondContact OG1-OG1 3.3Å; F98-T100 PolarHBondContact O-N 2.89Å; F98-T100 VanDerWaalsContact O-N 3.15Å; F98-T100 PolarHBondContact O-OG1 3.45Å; T100-Y102 HydrophobicContact CG2-CD2 4.43Å; T100-Y102 HydrophobicContact CG2-CE2 3.84Å; T100-Y102 WeakPolarHBondContact O-CD2 3.41Å; T100-R124 CarbonylContact O-C 3.53Å; T100-R124 WeakPolarHBondContact O-CA 3.34Å; T100-T125 PolarHBondContact N-OG1 3.49Å; T100-T125 PolarHBondContact O-N 3.21Å; T100-T125 PolarHBondContact O-OG1 2.8Å
101	D	91.5	Very high	90.3	Very high	62 Å²	62	32.2 Å²	32.2	33%	0.332	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	130.5	178.4	-56.1	-47.3	0	0	0	111.2	K61 L123	K61-D101 IonicContact NZ-OD2 3.6Å; K61-D101 PolarHBondContact NZ-OD2 3.49Å; D101-L123 CarbonylContact C-O 3.48Å; D101-L123 WeakPolarHBondContact CA-O 3.38Å
102	Y	91.9	Very high	90	Very high	12 Å²	12	32 Å²	32	5%	0.047	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	148.6	175.8	-68.4	-88.2	0	0	0	111.6	L58 D60 L96 T97 T100 L123 T125	L58-Y102 HydrophobicContact CD2-CD1 3.45Å; L58-Y102 VanDerWaalsContact CD2-CD1 3.45Å; L58-Y102 HydrophobicContact CD2-CE1 3.9Å; L58-Y102 HydrophobicContact CD2-CG 4.1Å; L58-Y102 HydrophobicContact CG-CD1 4.3Å; D60-Y102 HydrophobicContact CB-CD1 4.04Å; D60-Y102 HydrophobicContact CB-CE1 3.77Å; L96-Y102 WeakPolarHBondContact CA-OH 3.32Å; L96-Y102 HydrophobicContact CB-CE2 4.11Å; L96-Y102 HydrophobicContact CD2-CE1 3.96Å; L96-Y102 HydrophobicContact CD2-CE2 4.49Å; T97-Y102 PolarHBondContact N-OH 3.39Å; T97-Y102 PolarHBondContact OG1-OH 3.2Å; T100-Y102 HydrophobicContact CG2-CD2 4.43Å; T100-Y102 HydrophobicContact CG2-CE2 3.84Å; T100-Y102 WeakPolarHBondContact O-CD2 3.41Å; Y102-L123 HydrophobicContact CD2-CD1 4.25Å; Y102-L123 PolarHBondContact N-O 2.78Å; Y102-L123 PolarHBondContact O-N 3.21Å; Y102-T125 HydrophobicContact CD2-CG2 3.82Å; Y102-T125 HydrophobicContact CE2-CG2 3.66Å
103	M	92.4	Very high	89.6	Confident	43 Å²	43	32.6 Å²	32.6	21%	0.212	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	125.9	170.4	-175.7	-172.9	59.4	0	0	109.5	L58 E59 P120 F122	L58-M103 WeakPolarHBondContact CA-O 3.48Å; E59-M103 HydrophobicContact CB-CE 3.98Å; E59-M103 HydrophobicContact CG-CE 4.03Å; E59-M103 PolarHBondContact N-O 3.47Å; E59-M103 PolarHBondContact O-N 3.43Å; E59-M103 WeakPolarHBondContact OE2-CE 3.43Å; M103-P120 HydrophobicContact CG-CB 3.49Å; M103-P120 VanDerWaalsContact CG-CB 3.49Å; M103-P120 HydrophobicContact SD-CB 3.68Å; M103-P120 HydrophobicContact SD-CG 4.26Å; M103-F122 HydrophobicContact CB-CD1 4.29Å; M103-F122 HydrophobicContact CB-CE1 4.16Å; M103-F122 HydrophobicContact CG-CD1 4.35Å; M103-F122 HydrophobicContact CG-CE1 3.94Å
104	V	93.9	Very high	89.3	Confident	1 Å²	1	37.7 Å²	37.7	1%	0.006	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	135	176.8	175.9	0	0	0	0	110.5	F26 V39 V56 Y57 L58 V106 P120 S121 L123	F26-V104 HydrophobicContact CE1-CB 4.16Å; F26-V104 HydrophobicContact CE1-CG1 4.29Å; F26-V104 HydrophobicContact CE1-CG2 4.13Å; V39-V104 HydrophobicContact CG1-CG1 3.88Å; V39-V104 HydrophobicContact CG2-CG1 3.85Å; V39-V104 HydrophobicContact CG2-CG2 4.39Å; V56-V104 HydrophobicContact CG1-CG1 4Å; Y57-V104 CarbonylContact O-C 3.52Å; Y57-V104 VanDerWaalsContact O-CA 3.23Å; Y57-V104 WeakPolarHBondContact O-CA 3.32Å; L58-V104 HydrophobicContact CB-CG2 4.34Å; L58-V104 HydrophobicContact CD1-CG2 4Å; L58-V104 HydrophobicContact CG-CG2 4.07Å; V104-V106 HydrophobicContact CG1-CG2 4.47Å; V104-P120 CarbonylContact O-C 3.55Å; V104-P120 WeakPolarHBondContact O-CA 3.29Å; V104-S121 PolarHBondContact N-O 3.12Å; V104-S121 PolarHBondContact O-N 3.22Å; V104-L123 HydrophobicContact CG2-CD2 3.4Å; V104-L123 HydrophobicContact CG2-CG 4.41Å
105	R	92.8	Very high	89	Confident	44 Å²	44	38.6 Å²	38.6	17%	0.166	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	125.6	174.9	-171.5	-179.4	-72.8	98.6	4.4	110.5	V56 Y57 V107 E115 F118	V56-R105 WeakPolarHBondContact CA-O 3.19Å; Y57-R105 PolarHBondContact N-O 3.02Å; Y57-R105 PolarHBondContact O-N 2.88Å; R105-V107 HydrophobicContact CG-CG2 3.85Å; R105-E115 WeakPolarHBondContact CD-O 3.42Å; R105-F118 WeakPolarHBondContact CD-O 3.46Å; R105-F118 HydrophobicContact CG-CB 4.43Å; R105-F118 PolarHBondContact NE-O 3.14Å
106	V	94.1	Very high	88.9	Confident	7 Å²	7	40.2 Å²	40.2	4%	0.042	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	115.1	177.4	-176	0	0	0	0	108.9	V21 V39 W41 F54 R55 V56 V104	V21-V106 HydrophobicContact CG1-CG1 3.95Å; V21-V106 HydrophobicContact CG2-CB 3.82Å; V21-V106 HydrophobicContact CG2-CG1 4.08Å; V39-V106 HydrophobicContact CG1-CG2 4.11Å; W41-V106 HydrophobicContact CD2-CG1 3.92Å; W41-V106 HydrophobicContact CE3-CG1 4.46Å; W41-V106 HydrophobicContact CE3-CG2 4.41Å; W41-V106 HydrophobicContact CG-CG1 4.04Å; W41-V106 HydrophobicContact CZ2-CG1 4.47Å; F54-V106 HydrophobicContact CB-CG1 4.36Å; F54-V106 HydrophobicContact CD1-CG1 4.04Å; R55-V106 CarbonylContact O-C 3.6Å; R55-V106 WeakPolarHBondContact O-CA 3.45Å; V56-V106 HydrophobicContact CG1-CG2 4.26Å; V56-V106 HydrophobicContact CG2-CG1 4.31Å; V56-V106 HydrophobicContact CG2-CG2 4.25Å; V104-V106 HydrophobicContact CG1-CG2 4.47Å
107	V	91.9	Very high	88.7	Confident	5 Å²	5	45.4 Å²	45.4	3%	0.03	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	113.6	-173.8	-179.9	0	0	0	0	109.8	F54 R55 Y57 R105 E115 F118	F54-V107 CarbonylContact C-O 3.57Å; F54-V107 WeakPolarHBondContact CA-O 3.41Å; R55-V107 HydrophobicContact CB-CB 4.39Å; R55-V107 PolarHBondContact N-O 3.29Å; R55-V107 PolarHBondContact O-N 3.04Å; Y57-V107 HydrophobicContact CD2-CG2 4.04Å; Y57-V107 HydrophobicContact CE2-CB 4.3Å; Y57-V107 HydrophobicContact CE2-CG2 3.85Å; R105-V107 HydrophobicContact CG-CG2 3.85Å; V107-E115 HydrophobicContact CG1-CB 4.41Å; V107-E115 HydrophobicContact CG1-CG 4.13Å; V107-E115 HydrophobicContact CG2-CB 4.27Å; V107-F118 HydrophobicContact CB-CD2 4.34Å; V107-F118 HydrophobicContact CG1-CD2 3.78Å; V107-F118 HydrophobicContact CG1-CE2 3.84Å; V107-F118 HydrophobicContact CG2-CB 4.38Å; V107-F118 HydrophobicContact CG2-CD2 4.15Å
108	P	90.6	Very high	88.8	Confident	2 Å²	2	42.4 Å²	42.4	1%	0.013	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	145.2	171.9	29.8	-33.1	0	0	0	110.9	I18 I51 F54 F118	I18-P108 HydrophobicContact CB-CG 4.21Å; I18-P108 HydrophobicContact CD1-CB 4.46Å; I18-P108 HydrophobicContact CG2-CB 3.87Å; I18-P108 HydrophobicContact CG2-CG 3.6Å; I51-P108 HydrophobicContact CG2-CB 4.35Å; F54-P108 HydrophobicContact CD1-CB 3.99Å; F54-P108 HydrophobicContact CE1-CB 3.92Å; P108-F118 VanDerWaalsContact CD-CE1 3.5Å; P108-F118 HydrophobicContact CG-CD1 4.31Å; P108-F118 HydrophobicContact CG-CE1 3.56Å; P108-F118 HydrophobicContact CG-CZ 3.7Å
109	F	87.6	Confident	88.7	Confident	7 Å²	7	45.1 Å²	45.1	3%	0.031	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	152.7	176.3	75.1	-88.7	0	0	0	112.2	Y11 K52 G53 R55 H70 I72	Y11-F109 HydrophobicContact CD1-CD2 4.47Å; Y11-F109 HydrophobicContact CE1-CE2 4.49Å; K52-F109 HydrophobicContact CB-CD2 4.32Å; K52-F109 HydrophobicContact CB-CE2 3.88Å; K52-F109 PolarHBondContact N-O 2.82Å; G53-F109 PolarHBondContact N-O 3.17Å; G53-F109 WeakPolarHBondContact O-CD1 3.34Å; G53-F109 PolarHBondContact O-N 3.15Å; R55-F109 HydrophobicContact CG-CD1 4.08Å; R55-F109 HydrophobicContact CG-CE1 4.48Å; H70-F109 AromaticContact CD2-CE1 3.26Å; H70-F109 WeakPolarHBondContact CD2-CE1 3.2Å; H70-F109 AromaticContact CD2-CZ 3.55Å; H70-F109 AromaticContact NE2-CD1 3.67Å; H70-F109 AromaticContact NE2-CE1 3.08Å; H70-F109 WeakPolarHBondContact NE2-CE1 3.47Å; H70-F109 AromaticContact NE2-CE2 3.55Å; H70-F109 AromaticContact NE2-CZ 3.04Å; H70-F109 WeakPolarHBondContact NE2-CZ 3.44Å; I72-F109 HydrophobicContact CG1-CZ 4Å
110	P	87.1	Confident	88.9	Confident	27 Å²	27	43.8 Å²	43.8	18%	0.175	24%	0.238	C	C	.	.	S	Bend	cis	-79.8	129.6	-5	33.4	-34	0	0	0	111.7	I18	I18-P110 WeakPolarHBondContact CD1-O 3.45Å
111	S	83.4	Confident	89.2	Confident	10 Å²	10	43.9 Å²	43.9	7%	0.07	24%	0.24	C	C	.	.			trans	-110.6	146.1	177.6	-175.3	0	0	0	0	111.3	G14 M113	G14-S111 PolarHBondContact N-O 2.8Å; S111-M113 VanDerWaalsContact C-N 3.27Å; S111-M113 PolarHBondContact OG-N 3.43Å
112	L	84	Confident	89.3	Confident	87 Å²	87	48.1 Å²	48.1	46%	0.455	26%	0.255	S	S	.	.	S	Bend	trans	-69.7	-28.6	166.8	-176.7	67.3	0	0	0	111.5	G14 H16 V17	G14-L112 WeakPolarHBondContact O-CA 3.5Å; G14-L112 WeakPolarHBondContact O-CB 3.27Å; G14-L112 WeakPolarHBondContact O-CD1 3.44Å; H16-L112 WeakPolarHBondContact O-CB 3.01Å; H16-L112 PolarHBondContact O-N 3.44Å; H16-L112 VanDerWaalsContact O-N 3.1Å; V17-L112 HydrophobicContact CG2-CD2 4.11Å
113	M	83.6	Confident	89.3	Confident	63 Å²	63	48 Å²	48	31%	0.31	26%	0.256	S	S	.	.	S	Bend	trans	-80.1	144.1	-178.5	-60.5	-59.5	-174.3	0	0	111.3	V17 S111 F117 F118	V17-M113 HydrophobicContact CB-CE 4.43Å; V17-M113 HydrophobicContact CG1-CE 3.67Å; V17-M113 HydrophobicContact CG1-CG 4.47Å; V17-M113 HydrophobicContact CG2-CE 3.94Å; S111-M113 VanDerWaalsContact C-N 3.27Å; S111-M113 PolarHBondContact OG-N 3.43Å; M113-F117 HydrophobicContact CB-CB 3.96Å; M113-F117 HydrophobicContact CB-CD1 3.87Å; M113-F117 HydrophobicContact CB-CG 3.95Å; M113-F117 HydrophobicContact CG-CD1 3.92Å; M113-F117 HydrophobicContact CG-CE1 4.18Å; M113-F117 HydrophobicContact CG-CG 4.17Å; M113-F118 HydrophobicContact CB-CE2 4.37Å; M113-F118 HydrophobicContact CB-CZ 4.39Å
114	N	84.2	Confident	89.4	Confident	112 Å²	112	52.3 Å²	52.3	60%	0.599	27%	0.269	S	S	*	.			trans	-62.2	154.1	173.4	-74	-25.5	0	0	0	111.3	S116 F117	N114-S116 PolarHBondContact O-N 3Å; N114-S116 VanDerWaalsContact O-N 3.14Å; N114-F117 WeakPolarHBondContact O-CB 3.49Å; N114-F117 PolarHBondContact O-N 3.25Å
115	E	84.6	Confident	89.3	Confident	74 Å²	74	52.3 Å²	52.3	35%	0.346	27%	0.27	S	S	.	.	G	3₁₀ helix	trans	-60	-28.9	-179.8	-55.1	-164.5	149.1	0	0	112.6	R55 Y57 R105 V107 F117 F118	R55-E115 IonicContact CZ-OE1 2.95Å; R55-E115 IonicContact NH1-OE1 2.67Å; R55-E115 PolarHBondContact NH1-OE1 3Å; Y57-E115 PolarHBondContact OH-OE1 3.26Å; Y57-E115 PolarHBondContact OH-OE2 3.39Å; R105-E115 WeakPolarHBondContact CD-O 3.42Å; V107-E115 HydrophobicContact CG1-CB 4.41Å; V107-E115 HydrophobicContact CG1-CG 4.13Å; V107-E115 HydrophobicContact CG2-CB 4.27Å; E115-F117 PolarHBondContact O-N 2.8Å; E115-F118 PolarHBondContact O-N 2.87Å
116	S	84.6	Confident	89.3	Confident	102 Å²	102	52 Å²	52	71%	0.713	27%	0.271	S	S	*	.	G	3₁₀ helix	trans	-69.3	-15.5	176.1	56.9	0	0	0	0	114.7	N114 F118	N114-S116 PolarHBondContact O-N 3Å; N114-S116 VanDerWaalsContact O-N 3.14Å; S116-F118 VanDerWaalsContact C-N 3.26Å; S116-F118 PolarHBondContact O-N 3.26Å
117	F	87	Confident	89.1	Confident	114 Å²	114	52.9 Å²	52.9	50%	0.5	28%	0.278	S	S	.	.	G	3₁₀ helix	trans	-68.7	-28.8	176	-179.7	-99.3	0	0	0	111.8	M113 N114 E115	M113-F117 HydrophobicContact CB-CB 3.96Å; M113-F117 HydrophobicContact CB-CD1 3.87Å; M113-F117 HydrophobicContact CB-CG 3.95Å; M113-F117 HydrophobicContact CG-CD1 3.92Å; M113-F117 HydrophobicContact CG-CE1 4.18Å; M113-F117 HydrophobicContact CG-CG 4.17Å; N114-F117 WeakPolarHBondContact O-CB 3.49Å; N114-F117 PolarHBondContact O-N 3.25Å; E115-F117 PolarHBondContact O-N 2.8Å
118	F	89.9	Confident	89	Confident	2 Å²	2	52.8 Å²	52.8	1%	0.009	28%	0.277	C	S	.	.	S	Bend	trans	-83.5	124.5	-177.6	-58.8	-79.1	0	0	0	110.3	E20 R105 V107 P108 M113 E115 S116	E20-F118 HydrophobicContact CB-CD1 4.36Å; R105-F118 WeakPolarHBondContact CD-O 3.46Å; R105-F118 HydrophobicContact CG-CB 4.43Å; R105-F118 PolarHBondContact NE-O 3.14Å; V107-F118 HydrophobicContact CB-CD2 4.34Å; V107-F118 HydrophobicContact CG1-CD2 3.78Å; V107-F118 HydrophobicContact CG1-CE2 3.84Å; V107-F118 HydrophobicContact CG2-CB 4.38Å; V107-F118 HydrophobicContact CG2-CD2 4.15Å; P108-F118 VanDerWaalsContact CD-CE1 3.5Å; P108-F118 HydrophobicContact CG-CD1 4.31Å; P108-F118 HydrophobicContact CG-CE1 3.56Å; P108-F118 HydrophobicContact CG-CZ 3.7Å; M113-F118 HydrophobicContact CB-CE2 4.37Å; M113-F118 HydrophobicContact CB-CZ 4.39Å; E115-F118 PolarHBondContact O-N 2.87Å; S116-F118 VanDerWaalsContact C-N 3.26Å; S116-F118 PolarHBondContact O-N 3.26Å
119	P	90.1	Very high	89	Confident	65 Å²	65	56.4 Å²	56.4	42%	0.422	29%	0.294	S	S	.	.	P	Polyproline II helix	trans	-67.3	146	-173.5	29.6	-38	0	0	0	111.6	E20	E20-P119 HydrophobicContact CB-CG 4.43Å; E20-P119 WeakPolarHBondContact OE2-CD 3.44Å; E20-P119 WeakPolarHBondContact OE2-CG 3.24Å
120	P	93.2	Very high	89.1	Confident	48 Å²	48	59.6 Å²	59.6	31%	0.312	31%	0.311	S	S	.	.	P	Polyproline II helix	trans	-75.4	149.6	170.8	31.6	-32.3	0	0	0	111.3	M103 V104 F122	M103-P120 HydrophobicContact CG-CB 3.49Å; M103-P120 VanDerWaalsContact CG-CB 3.49Å; M103-P120 HydrophobicContact SD-CB 3.68Å; M103-P120 HydrophobicContact SD-CG 4.26Å; V104-P120 CarbonylContact O-C 3.55Å; V104-P120 WeakPolarHBondContact O-CA 3.29Å; P120-F122 HydrophobicContact CB-CE2 4.47Å; P120-F122 HydrophobicContact CB-CZ 4.24Å; P120-F122 HydrophobicContact CG-CE2 4.1Å; P120-F122 HydrophobicContact CG-CZ 3.91Å
121	S	94.1	Very high	89.2	Confident	35 Å²	35	58.9 Å²	58.9	25%	0.245	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	142.8	163.1	-58.1	0	0	0	0	108.7	V104	V104-S121 PolarHBondContact N-O 3.12Å; V104-S121 PolarHBondContact O-N 3.22Å
122	F	93.8	Very high	89.5	Confident	150 Å²	150	60.3 Å²	60.3	66%	0.658	31%	0.312	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.9	139	-179.2	-60.2	-82.9	0	0	0	109.9	M103 P120	M103-F122 HydrophobicContact CB-CD1 4.29Å; M103-F122 HydrophobicContact CB-CE1 4.16Å; M103-F122 HydrophobicContact CG-CD1 4.35Å; M103-F122 HydrophobicContact CG-CE1 3.94Å; P120-F122 HydrophobicContact CB-CE2 4.47Å; P120-F122 HydrophobicContact CB-CZ 4.24Å; P120-F122 HydrophobicContact CG-CE2 4.1Å; P120-F122 HydrophobicContact CG-CZ 3.91Å
123	L	93.1	Very high	89.6	Confident	11 Å²	11	57.7 Å²	57.7	6%	0.058	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	148.7	174.1	73.7	92.9	0	0	0	109.7	F26 V37 D101 Y102 V104 T125	F26-L123 HydrophobicContact CD1-CB 4.27Å; F26-L123 HydrophobicContact CD1-CD2 3.43Å; F26-L123 VanDerWaalsContact CD1-CD2 3.43Å; F26-L123 HydrophobicContact CD1-CG 4.49Å; F26-L123 HydrophobicContact CD2-CB 3.78Å; F26-L123 HydrophobicContact CD2-CD2 4.46Å; F26-L123 HydrophobicContact CE1-CB 4.25Å; F26-L123 HydrophobicContact CE1-CD2 3.47Å; F26-L123 VanDerWaalsContact CE1-CD2 3.47Å; F26-L123 HydrophobicContact CE2-CB 3.76Å; F26-L123 HydrophobicContact CE2-CD2 4.49Å; F26-L123 HydrophobicContact CG-CB 4.03Å; F26-L123 HydrophobicContact CG-CD2 3.95Å; F26-L123 HydrophobicContact CZ-CB 4Å; F26-L123 HydrophobicContact CZ-CD2 4.02Å; V37-L123 HydrophobicContact CG1-CD2 4.03Å; V37-L123 HydrophobicContact CG2-CD1 4.1Å; D101-L123 CarbonylContact C-O 3.48Å; D101-L123 WeakPolarHBondContact CA-O 3.38Å; Y102-L123 HydrophobicContact CD2-CD1 4.25Å; Y102-L123 PolarHBondContact N-O 2.78Å; Y102-L123 PolarHBondContact O-N 3.21Å; V104-L123 HydrophobicContact CG2-CD2 3.4Å; V104-L123 HydrophobicContact CG2-CG 4.41Å; L123-T125 HydrophobicContact CD1-CG2 4.05Å
124	R	93.1	Very high	89.7	Confident	132 Å²	132	57.4 Å²	57.4	50%	0.498	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	128.1	166.2	-175.9	172.5	176.6	152.8	-4.2	108	H28 D99 T100	H28-R124 PolarHBondContact CE1-O 2.67Å; D99-R124 IonicContact OD1-CZ 3Å; D99-R124 IonicContact OD1-NE 3.31Å; D99-R124 PolarHBondContact OD1-NE 3.14Å; D99-R124 IonicContact OD1-NH2 3.62Å; D99-R124 PolarHBondContact OD1-NH2 3.23Å; D99-R124 IonicContact OD2-NH2 2.7Å; D99-R124 PolarHBondContact OD2-NH2 2.63Å; T100-R124 CarbonylContact O-C 3.53Å; T100-R124 WeakPolarHBondContact O-CA 3.34Å
125	T	92.7	Very high	89.7	Confident	2 Å²	2	56.8 Å²	56.8	1%	0.012	31%	0.307	C	S	.	.	P	Polyproline II helix	trans	-65.2	145.8	175.7	50.3	0	0	0	0	110.3	A35 V37 L96 T97 D99 T100 Y102 L123	A35-T125 HydrophobicContact CB-CG2 4.32Å; V37-T125 HydrophobicContact CG2-CG2 4.14Å; L96-T125 HydrophobicContact CB-CG2 4.2Å; L96-T125 HydrophobicContact CD1-CG2 4.23Å; T97-T125 WeakPolarHBondContact O-CB 3.34Å; T97-T125 PolarHBondContact O-OG1 2.97Å; D99-T125 WeakPolarHBondContact CA-O 3.18Å; D99-T125 PolarHBondContact N-O 3.44Å; D99-T125 PolarHBondContact N-OG1 3.22Å; D99-T125 VanDerWaalsContact N-OG1 3.15Å; T100-T125 PolarHBondContact N-OG1 3.49Å; T100-T125 PolarHBondContact O-N 3.21Å; T100-T125 PolarHBondContact O-OG1 2.8Å; Y102-T125 HydrophobicContact CD2-CG2 3.82Å; Y102-T125 HydrophobicContact CE2-CG2 3.66Å; L123-T125 HydrophobicContact CD1-CG2 4.05Å
126	N	92.4	Very high	89.9	Confident	37 Å²	37	55.9 Å²	55.9	20%	0.198	31%	0.305	C	S	.	.	P	Polyproline II helix	trans	-63.8	157.8	175.7	-76.2	-13.1	0	0	0	111.4	D99 I130 L131	D99-N126 PolarHBondContact N-O 3.08Å; N126-I130 HydrophobicContact CB-CB 4.4Å; N126-I130 HydrophobicContact CB-CG2 4.22Å; N126-L131 HydrophobicContact CB-CD1 3.94Å; N126-L131 HydrophobicContact CB-CD2 3.97Å; N126-L131 HydrophobicContact CB-CG 3.72Å
127	S	90.6	Very high	90.1	Very high	25 Å²	25	56.2 Å²	56.2	18%	0.175	30%	0.298	C	S	.	.	P	Polyproline II helix	trans	-67.4	155.4	174.4	62.5	0	0	0	0	111.1	E129 I130 L131	S127-E129 VanDerWaalsContact C-N 3.25Å; S127-E129 PolarHBondContact O-N 3.4Å; S127-E129 VanDerWaalsContact OG-CG 3.23Å; S127-E129 WeakPolarHBondContact OG-CG 3.43Å; S127-I130 PolarHBondContact O-N 3.24Å; S127-I130 VanDerWaalsContact O-N 3.17Å; S127-I130 VanDerWaalsContact OG-CD1 3.31Å; S127-I130 WeakPolarHBondContact OG-CD1 3.4Å; S127-I130 VanDerWaalsContact OG-CG1 3.3Å; S127-I130 WeakPolarHBondContact OG-CG1 3.44Å; S127-L131 PolarHBondContact O-N 3.14Å
128	C	90.3	Very high	90.1	Very high	4 Å²	4	53 Å²	53	3%	0.027	29%	0.287	C	S	.	.	H	α-helix	trans	-57.2	-40.7	178.4	-174.4	0	0	0	0	111.7	F98 I130 L131 L132 C139 F142	F98-C128 HydrophobicContact CB-CB 4.3Å; F98-C128 HydrophobicContact CD1-CB 4.01Å; F98-C128 HydrophobicContact CD2-CB 3.84Å; F98-C128 HydrophobicContact CE1-CB 4.31Å; F98-C128 HydrophobicContact CE2-CB 4.14Å; F98-C128 HydrophobicContact CG-CB 3.78Å; F98-C128 HydrophobicContact CZ-CB 4.38Å; C128-I130 VanDerWaalsContact C-N 3.29Å; C128-I130 PolarHBondContact O-N 2.91Å; C128-L131 PolarHBondContact O-N 3.47Å; C128-L132 WeakPolarHBondContact O-CB 3.33Å; C128-L132 PolarHBondContact O-N 3.27Å; C128-C139 HydrophobicContact CB-CB 3.69Å; C128-C139 WeakPolarHBondContact CB-SG 3.36Å; C128-C139 PolarHBondContact O-SG 2.77Å; C128-C139 VanDerWaalsContact O-SG 3.39Å; C128-C139 WeakPolarHBondContact SG-CA 3.38Å; C128-C139 WeakPolarHBondContact SG-CB 3.47Å; C128-C139 PolarHBondContact SG-N 2.86Å; C128-C139 VanDerWaalsContact SG-N 3.45Å; C128-C139 CovalentContact SG-SG 2.04Å; C128-C139 PolarHBondContact SG-SG 2.9Å; C128-F142 HydrophobicContact CB-CD2 4.33Å
129	E	89.8	Confident	90	Very high	78 Å²	78	53.2 Å²	53.2	36%	0.364	29%	0.289	S	S	.	.	H	α-helix	trans	-61.5	-33.5	179.3	57.2	174.2	-167.6	0	0	113.4	S127 G133 K146	S127-E129 VanDerWaalsContact C-N 3.25Å; S127-E129 PolarHBondContact O-N 3.4Å; S127-E129 VanDerWaalsContact OG-CG 3.23Å; S127-E129 WeakPolarHBondContact OG-CG 3.43Å; E129-G133 CarbonylContact O-C 3.59Å; E129-G133 WeakPolarHBondContact O-CA 3.48Å; E129-G133 PolarHBondContact O-N 3.49Å; E129-G133 VanDerWaalsContact O-N 3.13Å; E129-K146 WeakPolarHBondContact OE2-CE 3.49Å; E129-K146 IonicContact OE2-NZ 3.12Å
130	I	90.1	Very high	89.9	Confident	74 Å²	74	53.1 Å²	53.1	38%	0.379	28%	0.282	S	S	.	.	H	α-helix	trans	-75.8	-35.4	178.7	-68.4	170.5	0	0	0	110.9	N126 S127 C128 Q669	N126-I130 HydrophobicContact CB-CB 4.4Å; N126-I130 HydrophobicContact CB-CG2 4.22Å; S127-I130 PolarHBondContact O-N 3.24Å; S127-I130 VanDerWaalsContact O-N 3.17Å; S127-I130 VanDerWaalsContact OG-CD1 3.31Å; S127-I130 WeakPolarHBondContact OG-CD1 3.4Å; S127-I130 VanDerWaalsContact OG-CG1 3.3Å; S127-I130 WeakPolarHBondContact OG-CG1 3.44Å; C128-I130 VanDerWaalsContact C-N 3.29Å; C128-I130 PolarHBondContact O-N 2.91Å; I130-Q669 HydrophobicContact CG2-CG 4.45Å
131	L	89.3	Confident	89.5	Confident	11 Å²	11	53.7 Å²	53.7	6%	0.058	29%	0.286	C	S	.	.	H	α-helix	trans	-88.8	-37	-173.6	-70.6	-178.3	0	0	0	113.7	H28 A30 A35 F98 N126 S127 C128	H28-L131 HydrophobicContact CB-CD2 3.98Å; A30-L131 HydrophobicContact CB-CB 4.18Å; A35-L131 HydrophobicContact CB-CD1 4.2Å; F98-L131 HydrophobicContact CD1-CD1 3.96Å; F98-L131 HydrophobicContact CE1-CB 4.35Å; F98-L131 HydrophobicContact CE1-CD1 3.85Å; N126-L131 HydrophobicContact CB-CD1 3.94Å; N126-L131 HydrophobicContact CB-CD2 3.97Å; N126-L131 HydrophobicContact CB-CG 3.72Å; S127-L131 PolarHBondContact O-N 3.14Å; C128-L131 PolarHBondContact O-N 3.47Å
132	L	88.9	Confident	89	Confident	40 Å²	40	56.8 Å²	56.8	21%	0.209	30%	0.295	C	S	.	.	H	α-helix	trans	-116.1	-6.4	-173	-70.8	179.8	0	0	0	113.7	A30 F98 C128 N136 V138	A30-L132 HydrophobicContact CB-CD2 3.48Å; A30-L132 VanDerWaalsContact CB-CD2 3.48Å; A30-L132 HydrophobicContact CB-CG 4.05Å; F98-L132 HydrophobicContact CZ-CD1 3.85Å; C128-L132 WeakPolarHBondContact O-CB 3.33Å; C128-L132 PolarHBondContact O-N 3.27Å; L132-N136 HydrophobicContact CB-CB 4.14Å; L132-N136 WeakPolarHBondContact O-CB 3.46Å; L132-N136 PolarHBondContact O-ND2 3.01Å; L132-V138 HydrophobicContact CD1-CB 4Å; L132-V138 HydrophobicContact CD1-CG1 3.82Å
133	G	87.2	Confident	88.6	Confident	33 Å²	33	51.1 Å²	51.1	34%	0.34	27%	0.269	S	S	.	.			trans	90.2	150.5	-172.5	0	0	0	0	0	112.6	E129 D135 N136	E129-G133 CarbonylContact O-C 3.59Å; E129-G133 WeakPolarHBondContact O-CA 3.48Å; E129-G133 PolarHBondContact O-N 3.49Å; E129-G133 VanDerWaalsContact O-N 3.13Å; G133-D135 VanDerWaalsContact C-N 3.28Å; G133-D135 PolarHBondContact O-N 3.06Å; G133-N136 PolarHBondContact O-N 3.4Å
134	S	84.8	Confident	88.3	Confident	56 Å²	56	56.1 Å²	56.1	39%	0.392	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-34.4	-176.6	54	0	0	0	0	113.4	N136 P165 F168	S134-N136 VanDerWaalsContact C-N 3.32Å; S134-N136 PolarHBondContact O-N 2.93Å; S134-P165 WeakPolarHBondContact O-CG 3.44Å; S134-F168 VanDerWaalsContact O-CZ 3.27Å; S134-F168 WeakPolarHBondContact O-CZ 3.44Å
135	D	84.5	Confident	88	Confident	99 Å²	99	50.1 Å²	50.1	53%	0.529	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.1	-0.4	-169.6	-58.3	-11.1	0	0	0	112.8	G133 L137 P165 S167	G133-D135 VanDerWaalsContact C-N 3.28Å; G133-D135 PolarHBondContact O-N 3.06Å; D135-L137 PolarHBondContact O-N 3.35Å; D135-P165 WeakPolarHBondContact OD1-CB 3.5Å; D135-S167 PolarHBondContact O-OG 3.27Å
136	N	88.9	Confident	87.6	Confident	56 Å²	56	56.7 Å²	56.7	30%	0.299	30%	0.297	S	S	.	.			trans	-72.3	126.3	-179.4	-167.7	-39.5	0	0	0	111.3	L132 G133 S134 V138 C139 F168	L132-N136 HydrophobicContact CB-CB 4.14Å; L132-N136 WeakPolarHBondContact O-CB 3.46Å; L132-N136 PolarHBondContact O-ND2 3.01Å; G133-N136 PolarHBondContact O-N 3.4Å; S134-N136 VanDerWaalsContact C-N 3.32Å; S134-N136 PolarHBondContact O-N 2.93Å; N136-V138 PolarHBondContact O-N 2.83Å; N136-V138 VanDerWaalsContact O-N 3.12Å; N136-V138 WeakPolarHBondContact OD1-CG2 3.47Å; N136-V138 PolarHBondContact OD1-N 3.13Å; N136-V138 VanDerWaalsContact OD1-N 3.08Å; N136-C139 WeakPolarHBondContact O-CB 3.35Å; N136-C139 PolarHBondContact O-N 2.73Å; N136-F168 VanDerWaalsContact O-CE1 3.23Å; N136-F168 WeakPolarHBondContact O-CE1 3.43Å
137	L	88.1	Confident	87.4	Confident	109 Å²	109	56.8 Å²	56.8	57%	0.571	30%	0.299	S	S	*	.	G	3₁₀ helix	trans	-59.8	-25.2	-176.7	-64.9	178	0	0	0	113.9	D135 C139 K140 S167 F168	D135-L137 PolarHBondContact O-N 3.35Å; L137-C139 PolarHBondContact O-N 2.88Å; L137-K140 WeakPolarHBondContact O-CB 3.33Å; L137-K140 PolarHBondContact O-N 3.22Å; L137-K140 VanDerWaalsContact O-N 3.15Å; L137-S167 VanDerWaalsContact CD2-O 3.25Å; L137-S167 WeakPolarHBondContact CD2-O 3.46Å; L137-F168 HydrophobicContact CD2-CD1 4.13Å
138	V	87.6	Confident	87.4	Confident	45 Å²	45	55.9 Å²	55.9	27%	0.273	29%	0.292	S	S	.	.	G	3₁₀ helix	trans	-59.5	-29.2	173.3	175.8	0	0	0	0	111.4	D33 F98 L132 N136 K140 P141	D33-V138 HydrophobicContact CB-CG1 3.85Å; D33-V138 HydrophobicContact CB-CG2 3.96Å; F98-V138 HydrophobicContact CE2-CG1 4.25Å; L132-V138 HydrophobicContact CD1-CB 4Å; L132-V138 HydrophobicContact CD1-CG1 3.82Å; N136-V138 PolarHBondContact O-N 2.83Å; N136-V138 VanDerWaalsContact O-N 3.12Å; N136-V138 WeakPolarHBondContact OD1-CG2 3.47Å; N136-V138 PolarHBondContact OD1-N 3.13Å; N136-V138 VanDerWaalsContact OD1-N 3.08Å; V138-K140 VanDerWaalsContact C-N 3.33Å; V138-K140 PolarHBondContact O-N 2.89Å; V138-P141 WeakPolarHBondContact O-CD 3.43Å
139	C	88.2	Confident	87.5	Confident	7 Å²	7	60.6 Å²	60.6	5%	0.047	32%	0.317	C	S	.	.	G	3₁₀ helix	trans	-81.2	-11.2	-178.6	-55.7	0	0	0	0	113.8	C128 N136 L137 F142 W143 F168	C128-C139 HydrophobicContact CB-CB 3.69Å; C128-C139 WeakPolarHBondContact CB-SG 3.36Å; C128-C139 PolarHBondContact O-SG 2.77Å; C128-C139 VanDerWaalsContact O-SG 3.39Å; C128-C139 WeakPolarHBondContact SG-CA 3.38Å; C128-C139 WeakPolarHBondContact SG-CB 3.47Å; C128-C139 PolarHBondContact SG-N 2.86Å; C128-C139 VanDerWaalsContact SG-N 3.45Å; C128-C139 CovalentContact SG-SG 2.04Å; C128-C139 PolarHBondContact SG-SG 2.9Å; N136-C139 WeakPolarHBondContact O-CB 3.35Å; N136-C139 PolarHBondContact O-N 2.73Å; L137-C139 PolarHBondContact O-N 2.88Å; C139-F142 CarbonylContact O-C 3.55Å; C139-F142 PolarHBondContact O-N 2.86Å; C139-W143 PolarHBondContact O-N 3.24Å; C139-F168 HydrophobicContact CB-CZ 4.03Å
140	K	86.9	Confident	87.6	Confident	64 Å²	64	58 Å²	58	28%	0.278	31%	0.306	S	S	.	.	G	3₁₀ helix	trans	-50.1	-50.2	-179.8	-176.6	173	177.2	168.6	0	114.6	L137 V138 F142 W143 F168 F170 T222	L137-K140 WeakPolarHBondContact O-CB 3.33Å; L137-K140 PolarHBondContact O-N 3.22Å; L137-K140 VanDerWaalsContact O-N 3.15Å; V138-K140 VanDerWaalsContact C-N 3.33Å; V138-K140 PolarHBondContact O-N 2.89Å; K140-F142 PolarHBondContact O-N 3.36Å; K140-W143 WeakPolarHBondContact O-CB 3.28Å; K140-W143 PolarHBondContact O-N 3.26Å; K140-F168 HydrophobicContact CB-CD1 4.12Å; K140-F168 HydrophobicContact CB-CD2 4.13Å; K140-F168 HydrophobicContact CB-CE1 4.3Å; K140-F168 HydrophobicContact CB-CE2 4.34Å; K140-F168 HydrophobicContact CB-CG 4.05Å; K140-F168 HydrophobicContact CB-CZ 4.41Å; K140-F168 HydrophobicContact CD-CB 4.2Å; K140-F168 HydrophobicContact CD-CG 4.42Å; K140-F168 WeakPolarHBondContact CE-O 3.34Å; K140-F168 HydrophobicContact CG-CB 4.18Å; K140-F168 HydrophobicContact CG-CD2 4.17Å; K140-F168 HydrophobicContact CG-CG 4.03Å; K140-F168 PolarHBondContact NZ-O 3.48Å; K140-F170 HydrophobicContact CD-CE1 4.3Å; K140-F170 HydrophobicContact CG-CE1 4.04Å; K140-F170 HydrophobicContact CG-CZ 3.89Å; K140-T222 WeakPolarHBondContact O-CG2 3.45Å
141	P	85.8	Confident	87.7	Confident	60 Å²	60	57.3 Å²	57.3	39%	0.39	31%	0.308	S	S	.	.	G	3₁₀ helix	trans	-69.3	-19	178.6	27.2	-36.5	0	0	0	114.1	V138	V138-P141 WeakPolarHBondContact O-CD 3.43Å
142	F	83.1	Confident	87.7	Confident	100 Å²	100	59.1 Å²	59.1	44%	0.439	32%	0.316	S	S	.	.	G	3₁₀ helix	trans	-97	-7.4	-179.1	-56.3	-72.2	0	0	0	113	F98 C128 C139 K140	F98-F142 AromaticContact CD2-CD2 3.97Å; F98-F142 HydrophobicContact CD2-CD2 3.97Å; F98-F142 AromaticContact CD2-CE2 3.68Å; F98-F142 HydrophobicContact CD2-CE2 3.68Å; F98-F142 HydrophobicContact CD2-CZ 4.05Å; F98-F142 HydrophobicContact CE2-CE2 4.15Å; C128-F142 HydrophobicContact CB-CD2 4.33Å; C139-F142 CarbonylContact O-C 3.55Å; C139-F142 PolarHBondContact O-N 2.86Å; K140-F142 PolarHBondContact O-N 3.36Å
143	W	86	Confident	87.7	Confident	30 Å²	30	62.7 Å²	62.7	11%	0.114	34%	0.335	C	S	.	.			trans	-61.6	138.7	-176.6	179.1	81.1	0	0	0	111.5	C139 K140 P145 D162 A164 F168 F170 Y173 T222	C139-W143 PolarHBondContact O-N 3.24Å; K140-W143 WeakPolarHBondContact O-CB 3.28Å; K140-W143 PolarHBondContact O-N 3.26Å; W143-P145 HydrophobicContact CH2-CB 3.99Å; W143-P145 HydrophobicContact CH2-CG 4.41Å; W143-P145 HydrophobicContact CZ2-CB 4.05Å; W143-D162 WeakPolarHBondContact CZ2-O 2.85Å; W143-A164 HydrophobicContact CD2-CB 3.71Å; W143-A164 VanDerWaalsContact CE2-CA 3.42Å; W143-A164 VanDerWaalsContact CE2-CB 3.4Å; W143-A164 HydrophobicContact CE3-CB 4.14Å; W143-A164 HydrophobicContact CG-CB 4.25Å; W143-A164 HydrophobicContact CH2-CB 4.01Å; W143-A164 VanDerWaalsContact CZ2-CA 3.43Å; W143-A164 HydrophobicContact CZ2-CB 3.59Å; W143-A164 HydrophobicContact CZ3-CB 4.27Å; W143-F168 HydrophobicContact CB-CD2 4.23Å; W143-F168 HydrophobicContact CB-CE2 3.78Å; W143-F168 AromaticContact CD1-CE2 3.9Å; W143-F168 HydrophobicContact CG-CD2 4.26Å; W143-F168 AromaticContact CG-CE2 3.95Å; W143-F168 HydrophobicContact CG-CE2 3.95Å; W143-F170 HydrophobicContact CD2-CE2 4.18Å; W143-F170 HydrophobicContact CE3-CD2 4.48Å; W143-F170 AromaticContact CE3-CE2 3.7Å; W143-F170 HydrophobicContact CE3-CE2 3.7Å; W143-F170 HydrophobicContact CZ3-CD2 4.49Å; W143-F170 HydrophobicContact CZ3-CE2 4.11Å; W143-Y173 AromaticContact CH2-CE1 3.83Å; W143-Y173 HydrophobicContact CH2-CE1 3.83Å; W143-Y173 AromaticContact CZ3-CE1 3.85Å; W143-Y173 HydrophobicContact CZ3-CE1 3.85Å; W143-T222 HydrophobicContact CB-CG2 4.19Å; W143-T222 HydrophobicContact CE3-CG2 4.28Å; W143-T222 WeakPolarHBondContact O-CB 3.24Å; W143-T222 WeakPolarHBondContact O-CG2 3.29Å
144	K	85.3	Confident	87.6	Confident	117 Å²	117	62.9 Å²	62.9	51%	0.509	34%	0.337	S	S	.	.			trans	-141.3	141.5	169.5	-64.3	175.7	-173.8	162.4	0	106.6	K146	K144-K146 PolarHBondContact O-N 2.94Å
145	P	87.3	Confident	87.5	Confident	5 Å²	5	62.6 Å²	62.6	3%	0.032	34%	0.335	C	S	.	.			trans	-61.1	142.2	176.5	30.4	-38.4	0	0	0	108.6	W143 F161 L215 R224	W143-P145 HydrophobicContact CH2-CB 3.99Å; W143-P145 HydrophobicContact CH2-CG 4.41Å; W143-P145 HydrophobicContact CZ2-CB 4.05Å; P145-F161 HydrophobicContact CB-CB 4.2Å; P145-L215 HydrophobicContact CB-CD2 4.43Å; P145-L215 HydrophobicContact CG-CD2 3.7Å; P145-R224 HydrophobicContact CG-CB 4.29Å; P145-R224 WeakPolarHBondContact O-CD 3.42Å; P145-R224 VanDerWaalsContact O-CZ 3.27Å; P145-R224 PolarHBondContact O-NH1 3.05Å
146	K	85	Confident	87.8	Confident	141 Å²	141	60 Å²	60	61%	0.613	32%	0.321	S	S	*	.	S	Bend	trans	-73.9	-36.5	-179.3	-65.8	179.8	179	178.1	0	111.1	E129 K144 D162 R224	E129-K146 WeakPolarHBondContact OE2-CE 3.49Å; E129-K146 IonicContact OE2-NZ 3.12Å; K144-K146 PolarHBondContact O-N 2.94Å; K146-D162 WeakPolarHBondContact CB-OD2 3.16Å; K146-D162 PolarHBondContact N-OD2 3.25Å; K146-R224 PolarHBondContact O-NH1 3.47Å; K146-R224 PolarHBondContact O-NH2 3.5Å
147	T	87.4	Confident	88	Confident	38 Å²	38	57.4 Å²	57.4	23%	0.233	31%	0.307	C	S	.	.			trans	-116.1	141.5	173.5	66.5	0	0	0	0	111.7	F161 D162 R224	T147-F161 WeakPolarHBondContact O-CA 3.32Å; T147-F161 WeakPolarHBondContact O-CB 3.36Å; T147-D162 WeakPolarHBondContact CB-OD2 3.45Å; T147-D162 PolarHBondContact N-OD2 2.96Å; T147-D162 PolarHBondContact OG1-OD1 2.73Å; T147-D162 PolarHBondContact OG1-OD2 3.44Å; T147-R224 VanDerWaalsContact C-NH1 3.26Å
148	L	90.6	Very high	88.2	Confident	7 Å²	7	54.3 Å²	54.3	4%	0.037	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	95	173.3	176.4	65.4	0	0	0	106.9	V159 F161 R224 M226	L148-V159 HydrophobicContact CD1-CG1 3.73Å; L148-F161 HydrophobicContact CD1-CB 3.94Å; L148-F161 HydrophobicContact CD1-CD1 4.39Å; L148-R224 HydrophobicContact CD2-CB 4.41Å; L148-R224 HydrophobicContact CD2-CG 4.14Å; L148-M226 HydrophobicContact CD2-CB 3.98Å
149	N	92.1	Very high	88.5	Confident	103 Å²	103	52.1 Å²	52.1	55%	0.551	28%	0.277	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.6	145.3	-175.1	-69.3	-4.9	0	0	0	110	V159 T160	N149-V159 CarbonylContact O-C 3.55Å; N149-V159 WeakPolarHBondContact O-CA 3.48Å; N149-T160 PolarHBondContact N-O 2.95Å; N149-T160 PolarHBondContact O-N 3.26Å
150	V	92.8	Very high	88.7	Confident	22 Å²	22	53.5 Å²	53.5	13%	0.133	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	124.1	177.4	-174.8	0	0	0	0	107.3	L157 H158 V159 I213 Y228	V150-L157 HydrophobicContact CG1-CB 4.28Å; V150-L157 HydrophobicContact CG1-CD1 4.44Å; V150-L157 HydrophobicContact CG1-CD2 4.39Å; V150-H158 CarbonylContact C-O 3.57Å; V150-H158 WeakPolarHBondContact CA-O 3.17Å; V150-V159 HydrophobicContact CG1-CG2 4.27Å; V150-V159 HydrophobicContact CG2-CG1 4.27Å; V150-V159 HydrophobicContact CG2-CG2 4.19Å; V150-I213 HydrophobicContact CG1-CD1 4Å; V150-I213 HydrophobicContact CG2-CD1 3.96Å; V150-Y228 HydrophobicContact CB-CD2 3.65Å; V150-Y228 HydrophobicContact CB-CE2 4.14Å; V150-Y228 HydrophobicContact CB-CG 3.87Å; V150-Y228 HydrophobicContact CG1-CD1 3.81Å; V150-Y228 HydrophobicContact CG1-CD2 3.82Å; V150-Y228 HydrophobicContact CG1-CE1 4.23Å; V150-Y228 HydrophobicContact CG1-CE2 4.21Å; V150-Y228 HydrophobicContact CG1-CG 3.58Å; V150-Y228 WeakPolarHBondContact O-CE2 3.36Å
151	S	92.1	Very high	88.9	Confident	61 Å²	61	50.4 Å²	50.4	43%	0.427	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	140.2	174.9	56.5	0	0	0	0	110.1	H158	S151-H158 PolarHBondContact N-O 3.19Å; S151-H158 PolarHBondContact O-N 3.13Å; S151-H158 WeakPolarHBondContact OG-CB 3.34Å
152	Q	90.1	Very high	89.1	Confident	48 Å²	48	48.8 Å²	48.8	22%	0.224	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	125.9	176.9	-177.7	175.7	1.7	0	0	110.4	G154 L157 Y228 S231	Q152-G154 WeakPolarHBondContact CG-O 3.41Å; Q152-G154 PolarHBondContact NE2-O 2.89Å; Q152-L157 HydrophobicContact CB-CD2 3.9Å; Q152-L157 HydrophobicContact CG-CD2 4.11Å; Q152-Y228 HydrophobicContact CB-CE1 4.14Å; Q152-Y228 WeakPolarHBondContact CB-OH 3.45Å; Q152-Y228 PolarHBondContact N-OH 3.46Å; Q152-S231 PolarHBondContact NE2-O 2.93Å
153	L	88.1	Confident	89.4	Confident	115 Å²	115	45.4 Å²	45.4	60%	0.602	25%	0.246	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-125.5	100.3	171.8	-174.4	68.1	0	0	0	108.7	S155 N156	L153-S155 PolarHBondContact O-N 3.36Å; L153-N156 PolarHBondContact N-O 3.44Å; L153-N156 WeakPolarHBondContact O-CB 3.45Å; L153-N156 PolarHBondContact O-N 3.21Å
154	G	84.6	Confident	89.5	Confident	37 Å²	37	44.6 Å²	44.6	38%	0.381	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.3	-133	-172.1	0	0	0	0	0	111.7	Q152 N156 V233	Q152-G154 WeakPolarHBondContact CG-O 3.41Å; Q152-G154 PolarHBondContact NE2-O 2.89Å; G154-N156 PolarHBondContact O-N 2.79Å; G154-V233 WeakPolarHBondContact O-CG2 3.45Å
155	S	84.1	Confident	89.6	Confident	51 Å²	51	40.2 Å²	40.2	36%	0.357	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-3.8	175.3	55.8	0	0	0	0	113.6	L153 D205 I206	L153-S155 PolarHBondContact O-N 3.36Å; S155-D205 PolarHBondContact O-N 3.17Å; S155-D205 PolarHBondContact OG-OD1 2.99Å; S155-I206 PolarHBondContact O-N 3.48Å
156	N	90.3	Very high	89.4	Confident	44 Å²	44	45.2 Å²	45.2	24%	0.235	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	142.7	-174	-59.7	-30.4	0	0	0	111.5	L153 G154 V202 L203 Q204 D205	L153-N156 PolarHBondContact N-O 3.44Å; L153-N156 WeakPolarHBondContact O-CB 3.45Å; L153-N156 PolarHBondContact O-N 3.21Å; G154-N156 PolarHBondContact O-N 2.79Å; N156-V202 HydrophobicContact CB-CG1 3.87Å; N156-L203 CarbonylContact C-O 3.36Å; N156-L203 VanDerWaalsContact CA-O 3.25Å; N156-L203 WeakPolarHBondContact CA-O 3.31Å; N156-Q204 VanDerWaalsContact OD1-CA 3.3Å; N156-Q204 WeakPolarHBondContact OD1-CA 3.01Å; N156-D205 PolarHBondContact OD1-N 3.29Å
157	L	92.2	Very high	89.4	Confident	1 Å²	1	40.8 Å²	40.8	1%	0.005	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	126	169.7	-62	-179.9	0	0	0	110.2	V150 Q152 V202 L203 I206 I213 Y228 V230	V150-L157 HydrophobicContact CG1-CB 4.28Å; V150-L157 HydrophobicContact CG1-CD1 4.44Å; V150-L157 HydrophobicContact CG1-CD2 4.39Å; Q152-L157 HydrophobicContact CB-CD2 3.9Å; Q152-L157 HydrophobicContact CG-CD2 4.11Å; L157-V202 CarbonylContact O-C 3.38Å; L157-V202 WeakPolarHBondContact O-CA 3.47Å; L157-L203 HydrophobicContact CB-CB 4.16Å; L157-L203 HydrophobicContact CB-CD1 4.29Å; L157-L203 HydrophobicContact CB-CG 4.41Å; L157-L203 HydrophobicContact CD1-CD1 4.29Å; L157-L203 PolarHBondContact N-O 2.87Å; L157-L203 PolarHBondContact O-N 3.13Å; L157-I206 HydrophobicContact CD1-CB 4.42Å; L157-I206 HydrophobicContact CD1-CG1 4.25Å; L157-I206 HydrophobicContact CD1-CG2 4.02Å; L157-I206 HydrophobicContact CG-CB 4.33Å; L157-I206 HydrophobicContact CG-CG1 4.17Å; L157-I206 HydrophobicContact CG-CG2 4.4Å; L157-I213 HydrophobicContact CD1-CD1 4.26Å; L157-Y228 HydrophobicContact CD1-CD1 4.39Å; L157-Y228 HydrophobicContact CD2-CD1 3.93Å; L157-Y228 HydrophobicContact CD2-CE1 3.69Å; L157-V230 HydrophobicContact CD1-CG2 3.68Å; L157-V230 HydrophobicContact CD2-CG1 4.44Å; L157-V230 HydrophobicContact CD2-CG2 3.95Å; L157-V230 HydrophobicContact CG-CG2 4.22Å
158	H	93	Very high	89.4	Confident	44 Å²	44	39 Å²	39	20%	0.204	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	112.8	172.9	-69.6	-110.4	0	0	0	108.3	V150 S151 T200 C201	V150-H158 CarbonylContact C-O 3.57Å; V150-H158 WeakPolarHBondContact CA-O 3.17Å; S151-H158 PolarHBondContact N-O 3.19Å; S151-H158 PolarHBondContact O-N 3.13Å; S151-H158 WeakPolarHBondContact OG-CB 3.34Å; H158-T200 HydrophobicContact CB-CG2 3.95Å; H158-C201 CarbonylContact C-O 3.52Å; H158-C201 WeakPolarHBondContact CA-O 3.21Å
159	V	93.5	Very high	89.1	Confident	0 Å²	0	44 Å²	44	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	109.1	178.6	-175.7	0	0	0	0	108	L148 N149 V150 F161 L175 T200 C201 L203 I213	L148-V159 HydrophobicContact CD1-CG1 3.73Å; N149-V159 CarbonylContact O-C 3.55Å; N149-V159 WeakPolarHBondContact O-CA 3.48Å; V150-V159 HydrophobicContact CG1-CG2 4.27Å; V150-V159 HydrophobicContact CG2-CG1 4.27Å; V150-V159 HydrophobicContact CG2-CG2 4.19Å; V159-F161 HydrophobicContact CG1-CD1 4.43Å; V159-L175 HydrophobicContact CB-CD1 3.83Å; V159-L175 HydrophobicContact CG1-CD1 3.99Å; V159-L175 HydrophobicContact CG1-CD2 3.92Å; V159-L175 HydrophobicContact CG2-CD1 4.12Å; V159-T200 CarbonylContact O-C 3.52Å; V159-T200 WeakPolarHBondContact O-CA 3.43Å; V159-C201 HydrophobicContact CB-CB 4.39Å; V159-C201 PolarHBondContact N-O 3Å; V159-C201 PolarHBondContact O-N 3.22Å; V159-L203 HydrophobicContact CG2-CD1 4.13Å; V159-L203 HydrophobicContact CG2-CG 4.27Å; V159-I213 HydrophobicContact CG1-CG2 4.48Å; V159-I213 HydrophobicContact CG2-CD1 4.27Å; V159-I213 HydrophobicContact CG2-CG2 4.41Å
160	T	92.9	Very high	88.7	Confident	35 Å²	35	39.6 Å²	39.6	22%	0.215	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	131.4	-177.9	-55.2	0	0	0	0	110.4	N149 R198 T199 T200	N149-T160 PolarHBondContact N-O 2.95Å; N149-T160 PolarHBondContact O-N 3.26Å; T160-R198 HydrophobicContact CG2-CB 4.36Å; T160-T199 WeakPolarHBondContact CA-O 3.46Å; T160-T200 WeakPolarHBondContact OG1-CG2 3.39Å; T160-T200 PolarHBondContact OG1-OG1 3.31Å
161	F	91.8	Very high	88.2	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	157.4	-179.9	56.5	-88.7	0	0	0	112.4	P145 T147 L148 V159 L163 Y173 R198 T199 C201 L215	P145-F161 HydrophobicContact CB-CB 4.2Å; T147-F161 WeakPolarHBondContact O-CA 3.32Å; T147-F161 WeakPolarHBondContact O-CB 3.36Å; L148-F161 HydrophobicContact CD1-CB 3.94Å; L148-F161 HydrophobicContact CD1-CD1 4.39Å; V159-F161 HydrophobicContact CG1-CD1 4.43Å; F161-L163 HydrophobicContact CE2-CD2 4.31Å; F161-Y173 AromaticContact CE2-CD1 3.93Å; F161-Y173 HydrophobicContact CE2-CD1 3.93Å; F161-Y173 HydrophobicContact CE2-CD2 4.04Å; F161-Y173 HydrophobicContact CE2-CE1 4.23Å; F161-Y173 HydrophobicContact CE2-CE2 4.35Å; F161-Y173 AromaticContact CE2-CG 3.82Å; F161-Y173 HydrophobicContact CE2-CG 3.82Å; F161-Y173 HydrophobicContact CZ-CD1 4.39Å; F161-Y173 HydrophobicContact CZ-CD2 4.23Å; F161-Y173 AromaticContact CZ-CG 3.92Å; F161-Y173 HydrophobicContact CZ-CG 3.92Å; F161-R198 VanDerWaalsContact O-CA 3.32Å; F161-R198 WeakPolarHBondContact O-CA 3.1Å; F161-T199 HydrophobicContact CD1-CG2 4.29Å; F161-T199 HydrophobicContact CD2-CG2 3.89Å; F161-T199 HydrophobicContact CE1-CG2 3.76Å; F161-T199 HydrophobicContact CE2-CG2 3.29Å; F161-T199 HydrophobicContact CG-CG2 4.35Å; F161-T199 HydrophobicContact CZ-CG2 3.22Å; F161-T199 PolarHBondContact N-O 3.09Å; F161-T199 PolarHBondContact O-N 3.12Å; F161-C201 VanDerWaalsContact CE1-SG 3.57Å; F161-L215 HydrophobicContact CB-CD2 4.36Å; F161-L215 HydrophobicContact CD1-CD1 4.14Å; F161-L215 HydrophobicContact CD1-CD2 4.3Å; F161-L215 HydrophobicContact CD2-CD1 4.39Å; F161-L215 HydrophobicContact CD2-CD2 3.64Å; F161-L215 HydrophobicContact CE1-CD1 3.7Å; F161-L215 HydrophobicContact CE2-CD1 3.98Å; F161-L215 HydrophobicContact CE2-CD2 3.91Å; F161-L215 HydrophobicContact CG-CD1 4.46Å; F161-L215 HydrophobicContact CG-CD2 3.85Å; F161-L215 HydrophobicContact CZ-CD1 3.61Å; F161-L215 HydrophobicContact CZ-CD2 4.35Å
162	D	90	Very high	88	Confident	25 Å²	25	43.5 Å²	43.5	13%	0.134	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	139.3	175.3	-55.6	-50.7	0	0	0	111.1	W143 K146 T147 R198	W143-D162 WeakPolarHBondContact CZ2-O 2.85Å; K146-D162 WeakPolarHBondContact CB-OD2 3.16Å; K146-D162 PolarHBondContact N-OD2 3.25Å; T147-D162 WeakPolarHBondContact CB-OD2 3.45Å; T147-D162 PolarHBondContact N-OD2 2.96Å; T147-D162 PolarHBondContact OG1-OD1 2.73Å; T147-D162 PolarHBondContact OG1-OD2 3.44Å; D162-R198 VanDerWaalsContact OD1-CG 3.25Å; D162-R198 WeakPolarHBondContact OD1-CG 3.08Å; D162-R198 IonicContact OD1-CZ 3.75Å; D162-R198 IonicContact OD1-NE 3.77Å; D162-R198 PolarHBondContact OD1-NE 2.7Å; D162-R198 IonicContact OD1-NH2 2.94Å
163	L	88.6	Confident	88	Confident	29 Å²	29	41.4 Å²	41.4	15%	0.152	24%	0.244	C	C	.	.	P	Polyproline II helix	trans	-76.6	149.9	175.9	-68.3	-174.9	0	0	0	111.8	F161 Y173 P192 D193 Q196 A197 T199	F161-L163 HydrophobicContact CE2-CD2 4.31Å; L163-Y173 HydrophobicContact CD2-CD2 4.48Å; L163-Y173 HydrophobicContact CD2-CE2 3.7Å; L163-P192 HydrophobicContact CD1-CB 3.96Å; L163-P192 HydrophobicContact CD2-CB 3.54Å; L163-P192 HydrophobicContact CG-CB 4.46Å; L163-D193 VanDerWaalsContact CD1-O 3.3Å; L163-D193 WeakPolarHBondContact CD1-O 3.34Å; L163-Q196 VanDerWaalsContact CD1-O 3.24Å; L163-Q196 WeakPolarHBondContact CD1-O 3.39Å; L163-A197 PolarHBondContact N-O 3Å; L163-T199 HydrophobicContact CD2-CG2 3.43Å; L163-T199 VanDerWaalsContact CD2-CG2 3.43Å; L163-T199 HydrophobicContact CG-CG2 4.34Å
164	A	87.1	Confident	88.1	Confident	14 Å²	14	38.3 Å²	38.3	12%	0.116	22%	0.224	C	C	.	.	P	Polyproline II helix	trans	-67.8	155.7	168.7	0	0	0	0	0	111	W143 S166 F168 F170 Y173	W143-A164 HydrophobicContact CD2-CB 3.71Å; W143-A164 VanDerWaalsContact CE2-CA 3.42Å; W143-A164 VanDerWaalsContact CE2-CB 3.4Å; W143-A164 HydrophobicContact CE3-CB 4.14Å; W143-A164 HydrophobicContact CG-CB 4.25Å; W143-A164 HydrophobicContact CH2-CB 4.01Å; W143-A164 VanDerWaalsContact CZ2-CA 3.43Å; W143-A164 HydrophobicContact CZ2-CB 3.59Å; W143-A164 HydrophobicContact CZ3-CB 4.27Å; A164-S166 PolarHBondContact O-N 3.37Å; A164-F168 HydrophobicContact CB-CD2 4.02Å; A164-F170 HydrophobicContact CB-CD2 3.32Å; A164-F170 HydrophobicContact CB-CE2 3.49Å; A164-F170 VanDerWaalsContact CB-CE2 3.49Å; A164-Y173 WeakPolarHBondContact CB-OH 3.33Å; A164-Y173 PolarHBondContact N-OH 3.26Å; A164-Y173 VanDerWaalsContact N-OH 3.16Å
165	P	87.8	Confident	88.4	Confident	25 Å²	25	36.5 Å²	36.5	16%	0.162	21%	0.206	C	C	.	.	P	Polyproline II helix	trans	-46.4	139	169.4	-29.4	36.1	0	0	0	112.1	S134 D135 S167 F168	S134-P165 WeakPolarHBondContact O-CG 3.44Å; D135-P165 WeakPolarHBondContact OD1-CB 3.5Å; P165-S167 PolarHBondContact O-N 3.37Å; P165-S167 VanDerWaalsContact O-N 3.15Å; P165-F168 HydrophobicContact CB-CD1 4.45Å; P165-F168 HydrophobicContact CB-CE1 4.45Å; P165-F168 HydrophobicContact CG-CD2 4.45Å; P165-F168 HydrophobicContact CG-CE2 4.08Å; P165-F168 HydrophobicContact CG-CZ 4.14Å; P165-F168 WeakPolarHBondContact O-CB 3.29Å; P165-F168 PolarHBondContact O-N 3.48Å
166	S	83.6	Confident	88.7	Confident	109 Å²	109	37 Å²	37	76%	0.762	20%	0.2	S	C	*	.	G	3₁₀ helix	trans	-58.6	-29.5	-178.9	55.6	0	0	0	0	112.3	A164 F168 N169	A164-S166 PolarHBondContact O-N 3.37Å; S166-F168 PolarHBondContact O-N 2.93Å; S166-N169 PolarHBondContact O-N 3.09Å; S166-N169 VanDerWaalsContact O-N 3.1Å
167	S	85.3	Confident	88.8	Confident	48 Å²	48	36 Å²	36	34%	0.336	19%	0.193	S	C	.	.	G	3₁₀ helix	trans	-57.9	-27.5	174.5	63.2	0	0	0	0	113.5	D135 L137 P165 N169	D135-S167 PolarHBondContact O-OG 3.27Å; L137-S167 VanDerWaalsContact CD2-O 3.25Å; L137-S167 WeakPolarHBondContact CD2-O 3.46Å; P165-S167 PolarHBondContact O-N 3.37Å; P165-S167 VanDerWaalsContact O-N 3.15Å; S167-N169 VanDerWaalsContact C-N 3.29Å; S167-N169 PolarHBondContact O-N 3.29Å
168	F	86.6	Confident	88.7	Confident	2 Å²	2	39.9 Å²	39.9	1%	0.009	21%	0.208	C	C	.	.	G	3₁₀ helix	trans	-77.1	-17.8	-179.4	-65.4	0.4	0	0	0	112.9	S134 N136 L137 C139 K140 W143 A164 P165 S166 F170	S134-F168 VanDerWaalsContact O-CZ 3.27Å; S134-F168 WeakPolarHBondContact O-CZ 3.44Å; N136-F168 VanDerWaalsContact O-CE1 3.23Å; N136-F168 WeakPolarHBondContact O-CE1 3.43Å; L137-F168 HydrophobicContact CD2-CD1 4.13Å; C139-F168 HydrophobicContact CB-CZ 4.03Å; K140-F168 HydrophobicContact CB-CD1 4.12Å; K140-F168 HydrophobicContact CB-CD2 4.13Å; K140-F168 HydrophobicContact CB-CE1 4.3Å; K140-F168 HydrophobicContact CB-CE2 4.34Å; K140-F168 HydrophobicContact CB-CG 4.05Å; K140-F168 HydrophobicContact CB-CZ 4.41Å; K140-F168 HydrophobicContact CD-CB 4.2Å; K140-F168 HydrophobicContact CD-CG 4.42Å; K140-F168 WeakPolarHBondContact CE-O 3.34Å; K140-F168 HydrophobicContact CG-CB 4.18Å; K140-F168 HydrophobicContact CG-CD2 4.17Å; K140-F168 HydrophobicContact CG-CG 4.03Å; K140-F168 PolarHBondContact NZ-O 3.48Å; W143-F168 HydrophobicContact CB-CD2 4.23Å; W143-F168 HydrophobicContact CB-CE2 3.78Å; W143-F168 AromaticContact CD1-CE2 3.9Å; W143-F168 HydrophobicContact CG-CD2 4.26Å; W143-F168 AromaticContact CG-CE2 3.95Å; W143-F168 HydrophobicContact CG-CE2 3.95Å; A164-F168 HydrophobicContact CB-CD2 4.02Å; P165-F168 HydrophobicContact CB-CD1 4.45Å; P165-F168 HydrophobicContact CB-CE1 4.45Å; P165-F168 HydrophobicContact CG-CD2 4.45Å; P165-F168 HydrophobicContact CG-CE2 4.08Å; P165-F168 HydrophobicContact CG-CZ 4.14Å; P165-F168 WeakPolarHBondContact O-CB 3.29Å; P165-F168 PolarHBondContact O-N 3.48Å; S166-F168 PolarHBondContact O-N 2.93Å; F168-F170 HydrophobicContact CB-CD2 4.42Å; F168-F170 HydrophobicContact CB-CE2 4.25Å; F168-F170 HydrophobicContact CB-CZ 4.32Å; F168-F170 HydrophobicContact CD2-CE2 4.16Å; F168-F170 HydrophobicContact CD2-CZ 4.38Å; F168-F170 PolarHBondContact O-N 3.4Å
169	N	84.4	Confident	88.6	Confident	111 Å²	111	39.3 Å²	39.3	59%	0.594	21%	0.206	S	C	*	.			trans	52.9	48.3	175.1	-162.1	6.3	0	0	0	113.7	S166 S167 Q171	S166-N169 PolarHBondContact O-N 3.09Å; S166-N169 VanDerWaalsContact O-N 3.1Å; S167-N169 VanDerWaalsContact C-N 3.29Å; S167-N169 PolarHBondContact O-N 3.29Å; N169-Q171 PolarHBondContact O-N 2.92Å
170	F	84.6	Confident	88.3	Confident	11 Å²	11	47.3 Å²	47.3	5%	0.048	24%	0.237	C	C	.	.			trans	-75.9	106.4	171.9	-66.9	-35.1	0	0	0	110.5	K140 W143 A164 F168 Y173 D217	K140-F170 HydrophobicContact CD-CE1 4.3Å; K140-F170 HydrophobicContact CG-CE1 4.04Å; K140-F170 HydrophobicContact CG-CZ 3.89Å; W143-F170 HydrophobicContact CD2-CE2 4.18Å; W143-F170 HydrophobicContact CE3-CD2 4.48Å; W143-F170 AromaticContact CE3-CE2 3.7Å; W143-F170 HydrophobicContact CE3-CE2 3.7Å; W143-F170 HydrophobicContact CZ3-CD2 4.49Å; W143-F170 HydrophobicContact CZ3-CE2 4.11Å; A164-F170 HydrophobicContact CB-CD2 3.32Å; A164-F170 HydrophobicContact CB-CE2 3.49Å; A164-F170 VanDerWaalsContact CB-CE2 3.49Å; F168-F170 HydrophobicContact CB-CD2 4.42Å; F168-F170 HydrophobicContact CB-CE2 4.25Å; F168-F170 HydrophobicContact CB-CZ 4.32Å; F168-F170 HydrophobicContact CD2-CE2 4.16Å; F168-F170 HydrophobicContact CD2-CZ 4.38Å; F168-F170 PolarHBondContact O-N 3.4Å; F170-Y173 HydrophobicContact CB-CE1 4.34Å; F170-Y173 HydrophobicContact CB-CE2 4.25Å; F170-Y173 AromaticContact CD2-CE1 3.93Å; F170-Y173 HydrophobicContact CD2-CE1 3.93Å; F170-Y173 AromaticContact CD2-CZ 3.94Å; F170-Y173 WeakPolarHBondContact CD2-OH 3.46Å; F170-Y173 HydrophobicContact CG-CE1 4.48Å; F170-D217 HydrophobicContact CD1-CB 4.19Å; F170-D217 HydrophobicContact CD2-CB 4.48Å; F170-D217 HydrophobicContact CE1-CB 3.92Å; F170-D217 HydrophobicContact CE2-CB 4.27Å; F170-D217 HydrophobicContact CG-CB 4.48Å; F170-D217 HydrophobicContact CZ-CB 4Å
171	Q	82.4	Confident	87.7	Confident	132 Å²	132	54.5 Å²	54.5	62%	0.617	27%	0.268	S	S	*	.			trans	-76.2	-30.8	-177.6	-63.7	178.5	5.8	0	0	113.5	N169 P192	N169-Q171 PolarHBondContact O-N 2.92Å; Q171-P192 VanDerWaalsContact O-CD 3.31Å; Q171-P192 WeakPolarHBondContact O-CD 3.43Å
172	L	87.8	Confident	87	Confident	32 Å²	32	57.3 Å²	57.3	17%	0.168	28%	0.283	C	S	.	.			trans	-145	145.8	-178.1	-74.8	118.9	0	0	0	110.2	Y174 R189 R191	L172-Y174 HydrophobicContact CB-CE2 4.27Å; L172-R189 HydrophobicContact CD2-CB 4.39Å; L172-R191 HydrophobicContact CD2-CG 4.22Å
173	Y	89.1	Confident	86.2	Confident	5 Å²	5	59.2 Å²	59.2	2%	0.02	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	145.1	167.7	-64.6	-89.4	0	0	0	110	W143 F161 L163 A164 F170 C190 P192 L215	W143-Y173 AromaticContact CH2-CE1 3.83Å; W143-Y173 HydrophobicContact CH2-CE1 3.83Å; W143-Y173 AromaticContact CZ3-CE1 3.85Å; W143-Y173 HydrophobicContact CZ3-CE1 3.85Å; F161-Y173 AromaticContact CE2-CD1 3.93Å; F161-Y173 HydrophobicContact CE2-CD1 3.93Å; F161-Y173 HydrophobicContact CE2-CD2 4.04Å; F161-Y173 HydrophobicContact CE2-CE1 4.23Å; F161-Y173 HydrophobicContact CE2-CE2 4.35Å; F161-Y173 AromaticContact CE2-CG 3.82Å; F161-Y173 HydrophobicContact CE2-CG 3.82Å; F161-Y173 HydrophobicContact CZ-CD1 4.39Å; F161-Y173 HydrophobicContact CZ-CD2 4.23Å; F161-Y173 AromaticContact CZ-CG 3.92Å; F161-Y173 HydrophobicContact CZ-CG 3.92Å; L163-Y173 HydrophobicContact CD2-CD2 4.48Å; L163-Y173 HydrophobicContact CD2-CE2 3.7Å; A164-Y173 WeakPolarHBondContact CB-OH 3.33Å; A164-Y173 PolarHBondContact N-OH 3.26Å; A164-Y173 VanDerWaalsContact N-OH 3.16Å; F170-Y173 HydrophobicContact CB-CE1 4.34Å; F170-Y173 HydrophobicContact CB-CE2 4.25Å; F170-Y173 AromaticContact CD2-CE1 3.93Å; F170-Y173 HydrophobicContact CD2-CE1 3.93Å; F170-Y173 AromaticContact CD2-CZ 3.94Å; F170-Y173 WeakPolarHBondContact CD2-OH 3.46Å; F170-Y173 HydrophobicContact CG-CE1 4.48Å; Y173-C190 PolarHBondContact N-O 3.07Å; Y173-C190 PolarHBondContact O-N 3.5Å; Y173-P192 HydrophobicContact CD2-CB 4.15Å; Y173-P192 HydrophobicContact CD2-CG 4.17Å; Y173-P192 HydrophobicContact CE2-CB 3.78Å; Y173-P192 HydrophobicContact CE2-CG 3.86Å; Y173-L215 HydrophobicContact CD1-CD1 4.34Å
174	Y	90.1	Very high	85.9	Confident	49 Å²	49	63.5 Å²	63.5	19%	0.192	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	121.4	179.4	-64.1	-92.6	0	0	0	109.5	L172 Y176 V187 R189 R216 N218	L172-Y174 HydrophobicContact CB-CE2 4.27Å; Y174-Y176 HydrophobicContact CG-CE2 4.47Å; Y174-V187 HydrophobicContact CD1-CG1 3.92Å; Y174-R189 HydrophobicContact CD1-CG 3.94Å; Y174-R189 HydrophobicContact CE1-CG 3.8Å; Y174-R189 PolarHBondContact OH-NH2 3.39Å; Y174-R189 VanDerWaalsContact OH-NH2 3.1Å; Y174-R216 PolarHBondContact N-O 3.31Å; Y174-R216 PolarHBondContact O-N 2.98Å; Y174-N218 HydrophobicContact CE2-CB 4.32Å
175	L	91.8	Very high	85.8	Confident	0 Å²	0	66.1 Å²	66.1	0%	0	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	108.6	171.2	-74.7	174	0	0	0	109	V159 V187 Q188 C201 L203 I213 E214 L215	V159-L175 HydrophobicContact CB-CD1 3.83Å; V159-L175 HydrophobicContact CG1-CD1 3.99Å; V159-L175 HydrophobicContact CG1-CD2 3.92Å; V159-L175 HydrophobicContact CG2-CD1 4.12Å; L175-V187 CarbonylContact O-C 3.53Å; L175-V187 WeakPolarHBondContact O-CA 3.28Å; L175-Q188 HydrophobicContact CB-CB 4.25Å; L175-Q188 PolarHBondContact N-O 2.87Å; L175-Q188 PolarHBondContact O-N 3.19Å; L175-C201 HydrophobicContact CD1-CB 3.22Å; L175-C201 VanDerWaalsContact CD1-SG 3.54Å; L175-C201 HydrophobicContact CG-CB 4.48Å; L175-L203 HydrophobicContact CB-CD2 4.49Å; L175-L203 HydrophobicContact CD1-CD2 4.32Å; L175-I213 HydrophobicContact CD2-CG2 3.97Å; L175-E214 WeakPolarHBondContact CA-O 3.39Å; L175-L215 HydrophobicContact CD2-CB 4.08Å; L175-L215 HydrophobicContact CD2-CD1 3.54Å; L175-L215 HydrophobicContact CD2-CG 4.43Å; L175-L215 HydrophobicContact CG-CD1 4.1Å
176	Y	90.7	Very high	85.9	Confident	61 Å²	61	70.7 Å²	70.7	24%	0.239	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	123.6	171.1	-69.1	-101	0	0	0	108.1	Y174 F185 R186 V187 I213 E214 R216	Y174-Y176 HydrophobicContact CG-CE2 4.47Å; Y176-F185 HydrophobicContact CD1-CB 4.33Å; Y176-R186 CarbonylContact C-O 3.57Å; Y176-R186 WeakPolarHBondContact CA-O 3.24Å; Y176-V187 HydrophobicContact CD1-CG2 3.49Å; Y176-V187 VanDerWaalsContact CD1-CG2 3.49Å; Y176-V187 HydrophobicContact CE1-CB 4.5Å; Y176-V187 HydrophobicContact CE1-CG1 4.32Å; Y176-V187 HydrophobicContact CE1-CG2 3.37Å; Y176-V187 HydrophobicContact CE2-CG1 4.42Å; Y176-V187 HydrophobicContact CG-CG2 4.26Å; Y176-I213 CarbonylContact O-C 3.34Å; Y176-I213 WeakPolarHBondContact O-CA 3.3Å; Y176-E214 PolarHBondContact N-O 3.21Å; Y176-E214 PolarHBondContact O-N 3.47Å; Y176-R216 HydrophobicContact CD2-CB 4.21Å; Y176-R216 HydrophobicContact CD2-CG 3.75Å; Y176-R216 HydrophobicContact CE2-CB 4.05Å; Y176-R216 HydrophobicContact CE2-CG 3.96Å
177	Y	91.4	Very high	86.2	Confident	22 Å²	22	68.7 Å²	68.7	9%	0.086	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	140.2	179	64.7	-80.5	0	0	0	110.7	R186 Q188 L203 I206 Y211 V212	Y177-R186 HydrophobicContact CD1-CB 4.14Å; Y177-R186 WeakPolarHBondContact CD1-O 3.18Å; Y177-R186 HydrophobicContact CD2-CB 4.11Å; Y177-R186 HydrophobicContact CE1-CB 3.63Å; Y177-R186 HydrophobicContact CE2-CB 3.61Å; Y177-R186 HydrophobicContact CE2-CG 4.22Å; Y177-R186 HydrophobicContact CG-CB 4.35Å; Y177-R186 PolarHBondContact N-O 3.25Å; Y177-R186 PolarHBondContact O-N 2.86Å; Y177-Q188 HydrophobicContact CE1-CB 4.18Å; Y177-L203 HydrophobicContact CD1-CD1 4.09Å; Y177-L203 HydrophobicContact CD1-CD2 3.86Å; Y177-L203 HydrophobicContact CD2-CD1 4.35Å; Y177-L203 HydrophobicContact CE1-CD2 3.85Å; Y177-L203 HydrophobicContact CG-CD1 3.96Å; Y177-I206 HydrophobicContact CD2-CD1 4.24Å; Y177-I206 HydrophobicContact CE2-CD1 3.66Å; Y177-Y211 HydrophobicContact CD2-CD1 4.04Å; Y177-Y211 HydrophobicContact CD2-CE1 4.17Å; Y177-V212 VanDerWaalsContact CA-O 3.26Å; Y177-V212 WeakPolarHBondContact CA-O 3.36Å
178	R	91.3	Very high	86.5	Confident	83 Å²	83	69.6 Å²	69.6	31%	0.313	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	146.2	174.6	63.3	171.7	179.2	148.6	-0.2	110.7	L184 F185 Y211 V212	R178-L184 WeakPolarHBondContact CB-O 3.01Å; R178-F185 HydrophobicContact CB-CD1 3.96Å; R178-F185 HydrophobicContact CB-CE1 4.24Å; R178-F185 HydrophobicContact CB-CG 4.26Å; R178-F185 HydrophobicContact CG-CD1 3.89Å; R178-F185 HydrophobicContact CG-CE1 3.64Å; R178-F185 HydrophobicContact CG-CE2 4.44Å; R178-F185 HydrophobicContact CG-CG 4.43Å; R178-F185 HydrophobicContact CG-CZ 3.96Å; R178-F185 VanDerWaalsContact NE-CZ 3.25Å; R178-Y211 CarbonylContact O-C 3.58Å; R178-Y211 VanDerWaalsContact O-CA 3.23Å; R178-Y211 WeakPolarHBondContact O-CA 3.2Å; R178-V212 HydrophobicContact CG-CB 4.12Å; R178-V212 PolarHBondContact N-O 2.92Å; R178-V212 PolarHBondContact O-N 2.64Å
179	L	90.1	Very high	86.7	Confident	32 Å²	32	76.4 Å²	76.4	17%	0.168	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	137.3	167.8	-177.5	67.4	0	0	0	107.9	Q181 D182 Y211	L179-Q181 PolarHBondContact O-N 3.39Å; L179-D182 HydrophobicContact CB-CB 3.89Å; L179-D182 CarbonylContact O-C 3.14Å; L179-D182 WeakPolarHBondContact O-CA 3.36Å; L179-D182 PolarHBondContact O-N 3.19Å; L179-Y211 HydrophobicContact CB-CD1 4.37Å; L179-Y211 HydrophobicContact CB-CE1 3.92Å; L179-Y211 HydrophobicContact CD1-CD2 4.02Å; L179-Y211 HydrophobicContact CD1-CE1 4.45Å; L179-Y211 HydrophobicContact CD1-CE2 3.58Å
180	R	87.2	Confident	87	Confident	169 Å²	169	71.6 Å²	71.6	64%	0.638	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-26.1	-174.6	-161.4	-174.2	-168.2	-140.8	5.9	113.7	T210	R180-T210 WeakPolarHBondContact CB-O 3.46Å; R180-T210 PolarHBondContact N-O 3.12Å
181	Q	81	Confident	87.1	Confident	186 Å²	186	81 Å²	81	87%	0.869	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88	-18.9	177.2	-65.3	176	-16.1	0	0	113.2	L179	L179-Q181 PolarHBondContact O-N 3.39Å
182	D	75.6	Confident	87.1	Confident	59 Å²	59	75.7 Å²	75.7	32%	0.316	35%	0.348	S	S	.	.			trans	-98.2	126.9	178.9	-169	-5.9	0	0	0	109.5	L179 L184	L179-D182 HydrophobicContact CB-CB 3.89Å; L179-D182 CarbonylContact O-C 3.14Å; L179-D182 WeakPolarHBondContact O-CA 3.36Å; L179-D182 PolarHBondContact O-N 3.19Å; D182-L184 PolarHBondContact O-N 2.77Å; D182-L184 PolarHBondContact OD1-N 2.91Å; D182-L184 VanDerWaalsContact OD1-N 3.13Å
183	G	73.2	Confident	86.8	Confident	64 Å²	64	77.1 Å²	77.1	66%	0.66	36%	0.356	S	S	*	.			trans	-72.4	-17.5	179	0	0	0	0	0	113.3
184	L	84	Confident	86.1	Confident	119 Å²	119	83.6 Å²	83.6	62%	0.623	39%	0.39	S	S	*	.	P	Polyproline II helix	trans	-88.8	123.7	-170.2	-163	75.1	0	0	0	112.3	R178 D182	R178-L184 WeakPolarHBondContact CB-O 3.01Å; D182-L184 PolarHBondContact O-N 2.77Å; D182-L184 PolarHBondContact OD1-N 2.91Å; D182-L184 VanDerWaalsContact OD1-N 3.13Å
185	F	83.5	Confident	85.5	Confident	70 Å²	70	88.4 Å²	88.4	31%	0.307	42%	0.419	S	S	.	.	P	Polyproline II helix	trans	-79.4	124.4	169.9	-78.1	-87	0	0	0	110.9	Y176 R178 E214	Y176-F185 HydrophobicContact CD1-CB 4.33Å; R178-F185 HydrophobicContact CB-CD1 3.96Å; R178-F185 HydrophobicContact CB-CE1 4.24Å; R178-F185 HydrophobicContact CB-CG 4.26Å; R178-F185 HydrophobicContact CG-CD1 3.89Å; R178-F185 HydrophobicContact CG-CE1 3.64Å; R178-F185 HydrophobicContact CG-CE2 4.44Å; R178-F185 HydrophobicContact CG-CG 4.43Å; R178-F185 HydrophobicContact CG-CZ 3.96Å; R178-F185 VanDerWaalsContact NE-CZ 3.25Å; F185-E214 HydrophobicContact CE1-CG 4.32Å; F185-E214 WeakPolarHBondContact CE1-OE1 3.47Å; F185-E214 WeakPolarHBondContact CZ-OE1 3.36Å
186	R	89.9	Confident	85	Confident	121 Å²	121	93.9 Å²	93.9	46%	0.457	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	153.2	165.8	-60.8	-177.2	-173.5	-173.2	2.3	109.3	Y176 Y177	Y176-R186 CarbonylContact C-O 3.57Å; Y176-R186 WeakPolarHBondContact CA-O 3.24Å; Y177-R186 HydrophobicContact CD1-CB 4.14Å; Y177-R186 WeakPolarHBondContact CD1-O 3.18Å; Y177-R186 HydrophobicContact CD2-CB 4.11Å; Y177-R186 HydrophobicContact CE1-CB 3.63Å; Y177-R186 HydrophobicContact CE2-CB 3.61Å; Y177-R186 HydrophobicContact CE2-CG 4.22Å; Y177-R186 HydrophobicContact CG-CB 4.35Å; Y177-R186 PolarHBondContact N-O 3.25Å; Y177-R186 PolarHBondContact O-N 2.86Å
187	V	90.8	Very high	84.6	Confident	66 Å²	66	95 Å²	95	40%	0.4	47%	0.467	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	126.1	-174.6	-171.9	0	0	0	0	110.2	Y174 L175 Y176	Y174-V187 HydrophobicContact CD1-CG1 3.92Å; L175-V187 CarbonylContact O-C 3.53Å; L175-V187 WeakPolarHBondContact O-CA 3.28Å; Y176-V187 HydrophobicContact CD1-CG2 3.49Å; Y176-V187 VanDerWaalsContact CD1-CG2 3.49Å; Y176-V187 HydrophobicContact CE1-CB 4.5Å; Y176-V187 HydrophobicContact CE1-CG1 4.32Å; Y176-V187 HydrophobicContact CE1-CG2 3.37Å; Y176-V187 HydrophobicContact CE2-CG1 4.42Å; Y176-V187 HydrophobicContact CG-CG2 4.26Å
188	Q	91.3	Very high	84.5	Confident	67 Å²	67	100.1 Å²	100.1	31%	0.313	49%	0.486	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	133.1	168.7	-177.4	62.8	39.7	0	0	109.6	L175 Y177 L203	L175-Q188 HydrophobicContact CB-CB 4.25Å; L175-Q188 PolarHBondContact N-O 2.87Å; L175-Q188 PolarHBondContact O-N 3.19Å; Y177-Q188 HydrophobicContact CE1-CB 4.18Å; Q188-L203 HydrophobicContact CB-CD2 3.41Å; Q188-L203 VanDerWaalsContact CB-CD2 3.41Å; Q188-L203 HydrophobicContact CG-CD2 3.79Å
189	R	91.6	Very high	84.4	Confident	145 Å²	145	96.6 Å²	96.6	55%	0.547	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	133.7	176.4	-60.3	179.8	72.9	149.3	-0.4	109.6	L172 Y174	L172-R189 HydrophobicContact CD2-CB 4.39Å; Y174-R189 HydrophobicContact CD1-CG 3.94Å; Y174-R189 HydrophobicContact CE1-CG 3.8Å; Y174-R189 PolarHBondContact OH-NH2 3.39Å; Y174-R189 VanDerWaalsContact OH-NH2 3.1Å
190	C	88.7	Confident	84.5	Confident	10 Å²	10	98.4 Å²	98.4	7%	0.068	49%	0.486	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	131.4	179	-54.8	0	0	0	0	111.2	Y173 C201	Y173-C190 PolarHBondContact N-O 3.07Å; Y173-C190 PolarHBondContact O-N 3.5Å; C190-C201 HydrophobicContact CB-CB 4.22Å; C190-C201 WeakPolarHBondContact CB-SG 3.28Å; C190-C201 WeakPolarHBondContact SG-CB 3.39Å; C190-C201 CovalentContact SG-SG 2Å; C190-C201 PolarHBondContact SG-SG 2.87Å
191	R	87.1	Confident	84.7	Confident	209 Å²	209	90.6 Å²	90.6	79%	0.789	46%	0.457	S	S	*	.			trans	-93.5	125.3	170.2	-66.7	-171.1	-178.6	107.7	-2.5	108.2	L172	L172-R191 HydrophobicContact CD2-CG 4.22Å
192	P	83.4	Confident	85.2	Confident	21 Å²	21	84.1 Å²	84.1	14%	0.136	43%	0.43	C	S	.	.			trans	-70.6	142.9	176.2	30.4	-33.3	0	0	0	110.6	L163 Q171 Y173	L163-P192 HydrophobicContact CD1-CB 3.96Å; L163-P192 HydrophobicContact CD2-CB 3.54Å; L163-P192 HydrophobicContact CG-CB 4.46Å; Q171-P192 VanDerWaalsContact O-CD 3.31Å; Q171-P192 WeakPolarHBondContact O-CD 3.43Å; Y173-P192 HydrophobicContact CD2-CB 4.15Å; Y173-P192 HydrophobicContact CD2-CG 4.17Å; Y173-P192 HydrophobicContact CE2-CB 3.78Å; Y173-P192 HydrophobicContact CE2-CG 3.86Å
193	D	81.6	Confident	86	Confident	61 Å²	61	81.3 Å²	81.3	33%	0.326	42%	0.415	S	S	.	.			trans	-86.8	108.8	164.8	-178.1	0.2	0	0	0	107.7	L163 N195 Q196	L163-D193 VanDerWaalsContact CD1-O 3.3Å; L163-D193 WeakPolarHBondContact CD1-O 3.34Å; D193-N195 PolarHBondContact O-N 2.94Å; D193-N195 VanDerWaalsContact O-N 3.13Å; D193-N195 WeakPolarHBondContact OD1-CB 3.42Å; D193-N195 PolarHBondContact OD1-N 2.77Å; D193-N195 VanDerWaalsContact OD1-N 3.12Å; D193-N195 PolarHBondContact OD1-ND2 2.77Å; D193-Q196 PolarHBondContact O-N 2.76Å; D193-Q196 PolarHBondContact OD2-NE2 3.35Å
194	L	74.6	Confident	86.8	Confident	141 Å²	141	84.6 Å²	84.6	74%	0.738	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-11.7	-175.9	-64.6	174	0	0	0	113.1	Q196	L194-Q196 VanDerWaalsContact C-N 3.35Å
195	N	76.8	Confident	86.8	Confident	150 Å²	150	84.6 Å²	84.6	80%	0.802	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.9	-5.9	179.2	-60.3	-44.2	0	0	0	113.5	D193	D193-N195 PolarHBondContact O-N 2.94Å; D193-N195 VanDerWaalsContact O-N 3.13Å; D193-N195 WeakPolarHBondContact OD1-CB 3.42Å; D193-N195 PolarHBondContact OD1-N 2.77Å; D193-N195 VanDerWaalsContact OD1-N 3.12Å; D193-N195 PolarHBondContact OD1-ND2 2.77Å
196	Q	81.3	Confident	87	Confident	115 Å²	115	81.8 Å²	81.8	54%	0.537	40%	0.402	S	S	.	.	S	Bend	trans	-122	145.3	-175.6	-60.9	-176.8	35.2	0	0	111.1	L163 D193 L194 R198	L163-Q196 VanDerWaalsContact CD1-O 3.24Å; L163-Q196 WeakPolarHBondContact CD1-O 3.39Å; D193-Q196 PolarHBondContact O-N 2.76Å; D193-Q196 PolarHBondContact OD2-NE2 3.35Å; L194-Q196 VanDerWaalsContact C-N 3.35Å; Q196-R198 WeakPolarHBondContact CB-O 3.36Å; Q196-R198 PolarHBondContact O-N 2.98Å
197	A	82.7	Confident	86.8	Confident	86 Å²	86	80.1 Å²	80.1	71%	0.711	41%	0.405	S	S	*	.	S	Bend	trans	-69.9	-19.1	175.6	0	0	0	0	0	113.2	L163	L163-A197 PolarHBondContact N-O 3Å
198	R	88.9	Confident	86.6	Confident	128 Å²	128	82.1 Å²	82.1	48%	0.483	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	150.2	-178.9	-70.4	179.4	177.4	160.6	4.8	110.2	T160 F161 D162 Q196	T160-R198 HydrophobicContact CG2-CB 4.36Å; F161-R198 VanDerWaalsContact O-CA 3.32Å; F161-R198 WeakPolarHBondContact O-CA 3.1Å; D162-R198 VanDerWaalsContact OD1-CG 3.25Å; D162-R198 WeakPolarHBondContact OD1-CG 3.08Å; D162-R198 IonicContact OD1-CZ 3.75Å; D162-R198 IonicContact OD1-NE 3.77Å; D162-R198 PolarHBondContact OD1-NE 2.7Å; D162-R198 IonicContact OD1-NH2 2.94Å; Q196-R198 WeakPolarHBondContact CB-O 3.36Å; Q196-R198 PolarHBondContact O-N 2.98Å
199	T	89.8	Confident	86.4	Confident	10 Å²	10	79.6 Å²	79.6	6%	0.061	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	151.7	172.2	-166.7	0	0	0	0	110.5	T160 F161 L163	T160-T199 WeakPolarHBondContact CA-O 3.46Å; F161-T199 HydrophobicContact CD1-CG2 4.29Å; F161-T199 HydrophobicContact CD2-CG2 3.89Å; F161-T199 HydrophobicContact CE1-CG2 3.76Å; F161-T199 HydrophobicContact CE2-CG2 3.29Å; F161-T199 HydrophobicContact CG-CG2 4.35Å; F161-T199 HydrophobicContact CZ-CG2 3.22Å; F161-T199 PolarHBondContact N-O 3.09Å; F161-T199 PolarHBondContact O-N 3.12Å; L163-T199 HydrophobicContact CD2-CG2 3.43Å; L163-T199 VanDerWaalsContact CD2-CG2 3.43Å; L163-T199 HydrophobicContact CG-CG2 4.34Å
200	T	90.7	Very high	86.4	Confident	70 Å²	70	74.7 Å²	74.7	43%	0.429	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	126.2	178.3	-60.2	0	0	0	0	110	H158 V159 T160	H158-T200 HydrophobicContact CB-CG2 3.95Å; V159-T200 CarbonylContact O-C 3.52Å; V159-T200 WeakPolarHBondContact O-CA 3.43Å; T160-T200 WeakPolarHBondContact OG1-CG2 3.39Å; T160-T200 PolarHBondContact OG1-OG1 3.31Å
201	C	92.3	Very high	86.5	Confident	4 Å²	4	74.5 Å²	74.5	3%	0.027	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	138.3	174.1	-66.2	0	0	0	0	110.9	H158 V159 F161 L175 C190	H158-C201 CarbonylContact C-O 3.52Å; H158-C201 WeakPolarHBondContact CA-O 3.21Å; V159-C201 HydrophobicContact CB-CB 4.39Å; V159-C201 PolarHBondContact N-O 3Å; V159-C201 PolarHBondContact O-N 3.22Å; F161-C201 VanDerWaalsContact CE1-SG 3.57Å; L175-C201 HydrophobicContact CD1-CB 3.22Å; L175-C201 VanDerWaalsContact CD1-SG 3.54Å; L175-C201 HydrophobicContact CG-CB 4.48Å; C190-C201 HydrophobicContact CB-CB 4.22Å; C190-C201 WeakPolarHBondContact CB-SG 3.28Å; C190-C201 WeakPolarHBondContact SG-CB 3.39Å; C190-C201 CovalentContact SG-SG 2Å; C190-C201 PolarHBondContact SG-SG 2.87Å
202	V	92.1	Very high	86.8	Confident	51 Å²	51	64.9 Å²	64.9	31%	0.309	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	125.1	177.6	-171.6	0	0	0	0	109.7	N156 L157 Q204	N156-V202 HydrophobicContact CB-CG1 3.87Å; L157-V202 CarbonylContact O-C 3.38Å; L157-V202 WeakPolarHBondContact O-CA 3.47Å; V202-Q204 HydrophobicContact CG1-CG 4.35Å
203	L	91.7	Very high	87.2	Confident	0 Å²	0	63.9 Å²	63.9	0%	0	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	119.5	166.6	-48.7	179.2	0	0	0	107.6	N156 L157 V159 L175 Y177 Q188 I206 I213	N156-L203 CarbonylContact C-O 3.36Å; N156-L203 VanDerWaalsContact CA-O 3.25Å; N156-L203 WeakPolarHBondContact CA-O 3.31Å; L157-L203 HydrophobicContact CB-CB 4.16Å; L157-L203 HydrophobicContact CB-CD1 4.29Å; L157-L203 HydrophobicContact CB-CG 4.41Å; L157-L203 HydrophobicContact CD1-CD1 4.29Å; L157-L203 PolarHBondContact N-O 2.87Å; L157-L203 PolarHBondContact O-N 3.13Å; V159-L203 HydrophobicContact CG2-CD1 4.13Å; V159-L203 HydrophobicContact CG2-CG 4.27Å; L175-L203 HydrophobicContact CB-CD2 4.49Å; L175-L203 HydrophobicContact CD1-CD2 4.32Å; Y177-L203 HydrophobicContact CD1-CD1 4.09Å; Y177-L203 HydrophobicContact CD1-CD2 3.86Å; Y177-L203 HydrophobicContact CD2-CD1 4.35Å; Y177-L203 HydrophobicContact CE1-CD2 3.85Å; Y177-L203 HydrophobicContact CG-CD1 3.96Å; Q188-L203 HydrophobicContact CB-CD2 3.41Å; Q188-L203 VanDerWaalsContact CB-CD2 3.41Å; Q188-L203 HydrophobicContact CG-CD2 3.79Å; L203-I206 HydrophobicContact CB-CD1 3.87Å; L203-I206 HydrophobicContact CB-CG1 3.85Å; L203-I213 HydrophobicContact CD1-CD1 4.27Å
204	Q	89.9	Confident	87.6	Confident	133 Å²	133	61 Å²	61	62%	0.621	33%	0.329	S	S	*	.			trans	-90.7	147.3	-174.3	-67.9	176.2	-15	0	0	112.4	N156 V202 I206	N156-Q204 VanDerWaalsContact OD1-CA 3.3Å; N156-Q204 WeakPolarHBondContact OD1-CA 3.01Å; V202-Q204 HydrophobicContact CG1-CG 4.35Å; Q204-I206 PolarHBondContact O-N 3.4Å
205	D	83.1	Confident	88.3	Confident	118 Å²	118	54.5 Å²	54.5	63%	0.631	30%	0.295	S	S	*	.	S	Bend	trans	50.5	51.9	170.1	-60.6	-41.8	0	0	0	114.2	S155 N156	S155-D205 PolarHBondContact O-N 3.17Å; S155-D205 PolarHBondContact OG-OD1 2.99Å; N156-D205 PolarHBondContact OD1-N 3.29Å
206	I	88.1	Confident	88.9	Confident	12 Å²	12	49.3 Å²	49.3	6%	0.062	26%	0.264	C	S	.	.	P	Polyproline II helix	trans	-84.2	125.5	-179	-56.8	-61	0	0	0	110.2	S155 L157 Y177 L203 Q204 Y211 V230	S155-I206 PolarHBondContact O-N 3.48Å; L157-I206 HydrophobicContact CD1-CB 4.42Å; L157-I206 HydrophobicContact CD1-CG1 4.25Å; L157-I206 HydrophobicContact CD1-CG2 4.02Å; L157-I206 HydrophobicContact CG-CB 4.33Å; L157-I206 HydrophobicContact CG-CG1 4.17Å; L157-I206 HydrophobicContact CG-CG2 4.4Å; Y177-I206 HydrophobicContact CD2-CD1 4.24Å; Y177-I206 HydrophobicContact CE2-CD1 3.66Å; L203-I206 HydrophobicContact CB-CD1 3.87Å; L203-I206 HydrophobicContact CB-CG1 3.85Å; Q204-I206 PolarHBondContact O-N 3.4Å; I206-Y211 HydrophobicContact CG2-CD2 3.98Å; I206-Y211 HydrophobicContact CG2-CE1 4.02Å; I206-Y211 HydrophobicContact CG2-CE2 3.42Å; I206-Y211 VanDerWaalsContact CG2-CE2 3.42Å; I206-Y211 HydrophobicContact CG2-CG 4.49Å; I206-Y211 VanDerWaalsContact CG2-CZ 3.43Å; I206-V230 HydrophobicContact CG2-CG1 4.31Å; I206-V230 HydrophobicContact CG2-CG2 3.89Å
207	T	86.6	Confident	88.8	Confident	85 Å²	85	44 Å²	44	52%	0.521	24%	0.24	S	C	.	.	P	Polyproline II helix	trans	-71.3	160.8	177.3	50.9	0	0	0	0	111.7	Y211	T207-Y211 VanDerWaalsContact O-CE2 3.28Å; T207-Y211 WeakPolarHBondContact O-CE2 3.33Å; T207-Y211 PolarHBondContact O-OH 3.04Å; T207-Y211 PolarHBondContact OG1-OH 3.06Å
208	Q	85.8	Confident	88.4	Confident	108 Å²	108	43.9 Å²	43.9	51%	0.505	23%	0.227	S	C	.	.	S	Bend	trans	-61.4	138.1	177.3	-176.5	-177.4	9.2	0	0	111.7	V230 Q232	Q208-V230 WeakPolarHBondContact CG-O 3.43Å; Q208-Q232 HydrophobicContact CG-CB 4.38Å
209	G	87.8	Confident	87.4	Confident	14 Å²	14	40.6 Å²	40.6	14%	0.144	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	143	-178.3	172.4	0	0	0	0	0	114	Y211 V230	G209-Y211 WeakPolarHBondContact O-CD2 3.19Å; G209-V230 PolarHBondContact N-O 3.45Å; G209-V230 VanDerWaalsContact N-O 3.14Å; G209-V230 PolarHBondContact O-N 2.9Å
210	T	90.8	Very high	86.4	Confident	43 Å²	43	44.7 Å²	44.7	26%	0.264	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	116.4	-178.4	-56.4	0	0	0	0	110.7	R180 Q227 H229	R180-T210 WeakPolarHBondContact CB-O 3.46Å; R180-T210 PolarHBondContact N-O 3.12Å; T210-Q227 HydrophobicContact CG2-CB 4.47Å; T210-H229 PolarHBondContact OG1-ND1 3.3Å
211	Y	91.8	Very high	85.2	Confident	6 Å²	6	44.8 Å²	44.8	2%	0.024	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	140.7	178.1	-75.2	-100.6	0	0	0	111.5	Y177 R178 L179 I206 T207 G209 Q227 Y228 V230	Y177-Y211 HydrophobicContact CD2-CD1 4.04Å; Y177-Y211 HydrophobicContact CD2-CE1 4.17Å; R178-Y211 CarbonylContact O-C 3.58Å; R178-Y211 VanDerWaalsContact O-CA 3.23Å; R178-Y211 WeakPolarHBondContact O-CA 3.2Å; L179-Y211 HydrophobicContact CB-CD1 4.37Å; L179-Y211 HydrophobicContact CB-CE1 3.92Å; L179-Y211 HydrophobicContact CD1-CD2 4.02Å; L179-Y211 HydrophobicContact CD1-CE1 4.45Å; L179-Y211 HydrophobicContact CD1-CE2 3.58Å; I206-Y211 HydrophobicContact CG2-CD2 3.98Å; I206-Y211 HydrophobicContact CG2-CE1 4.02Å; I206-Y211 HydrophobicContact CG2-CE2 3.42Å; I206-Y211 VanDerWaalsContact CG2-CE2 3.42Å; I206-Y211 HydrophobicContact CG2-CG 4.49Å; I206-Y211 VanDerWaalsContact CG2-CZ 3.43Å; T207-Y211 VanDerWaalsContact O-CE2 3.28Å; T207-Y211 WeakPolarHBondContact O-CE2 3.33Å; T207-Y211 PolarHBondContact O-OH 3.04Å; T207-Y211 PolarHBondContact OG1-OH 3.06Å; G209-Y211 WeakPolarHBondContact O-CD2 3.19Å; Y211-Q227 CarbonylContact O-C 3.51Å; Y211-Q227 WeakPolarHBondContact O-CA 3.24Å; Y211-Y228 PolarHBondContact N-O 2.97Å; Y211-Y228 PolarHBondContact O-N 3.31Å; Y211-V230 HydrophobicContact CD2-CB 4.48Å; Y211-V230 HydrophobicContact CD2-CG2 3.58Å; Y211-V230 HydrophobicContact CE2-CG2 3.95Å
212	V	92.4	Very high	83.9	Confident	7 Å²	7	44.9 Å²	44.9	4%	0.042	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	119.3	163.8	-176.2	0	0	0	0	106.9	Y177 R178 E214 Q227	Y177-V212 VanDerWaalsContact CA-O 3.26Å; Y177-V212 WeakPolarHBondContact CA-O 3.36Å; R178-V212 HydrophobicContact CG-CB 4.12Å; R178-V212 PolarHBondContact N-O 2.92Å; R178-V212 PolarHBondContact O-N 2.64Å; V212-E214 HydrophobicContact CG1-CG 4.28Å; V212-Q227 HydrophobicContact CG2-CG 4.24Å
213	I	92.1	Very high	83	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	125.4	-179.2	-58.1	168.8	0	0	0	107.7	V150 L157 V159 L175 Y176 L203 Q225 M226	V150-I213 HydrophobicContact CG1-CD1 4Å; V150-I213 HydrophobicContact CG2-CD1 3.96Å; L157-I213 HydrophobicContact CD1-CD1 4.26Å; V159-I213 HydrophobicContact CG1-CG2 4.48Å; V159-I213 HydrophobicContact CG2-CD1 4.27Å; V159-I213 HydrophobicContact CG2-CG2 4.41Å; L175-I213 HydrophobicContact CD2-CG2 3.97Å; Y176-I213 CarbonylContact O-C 3.34Å; Y176-I213 WeakPolarHBondContact O-CA 3.3Å; L203-I213 HydrophobicContact CD1-CD1 4.27Å; I213-Q225 CarbonylContact O-C 3.54Å; I213-Q225 VanDerWaalsContact O-CA 3.31Å; I213-Q225 WeakPolarHBondContact O-CA 3.44Å; I213-M226 PolarHBondContact N-O 3.38Å; I213-M226 PolarHBondContact O-N 2.94Å
214	E	90.9	Very high	82.6	Confident	1 Å²	1	52.3 Å²	52.3	1%	0.005	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	120	-179.1	-49.8	179.8	179.3	0	0	109.4	L175 Y176 F185 V212 R216 R223 R224 Q225	L175-E214 WeakPolarHBondContact CA-O 3.39Å; Y176-E214 PolarHBondContact N-O 3.21Å; Y176-E214 PolarHBondContact O-N 3.47Å; F185-E214 HydrophobicContact CE1-CG 4.32Å; F185-E214 WeakPolarHBondContact CE1-OE1 3.47Å; F185-E214 WeakPolarHBondContact CZ-OE1 3.36Å; V212-E214 HydrophobicContact CG1-CG 4.28Å; E214-R216 IonicContact OE2-CZ 3.6Å; E214-R216 IonicContact OE2-NE 3.49Å; E214-R216 PolarHBondContact OE2-NE 2.93Å; E214-R216 IonicContact OE2-NH2 2.84Å; E214-R216 PolarHBondContact OE2-NH2 3.46Å; E214-R223 IonicContact OE1-CZ 3.8Å; E214-R223 IonicContact OE1-NE 2.76Å; E214-R223 IonicContact OE1-NH2 3.18Å; E214-R223 PolarHBondContact OE1-NH2 2.85Å; E214-R223 IonicContact OE2-CZ 3.09Å; E214-R223 VanDerWaalsContact OE2-CZ 3.22Å; E214-R223 IonicContact OE2-NE 2.76Å; E214-R223 PolarHBondContact OE2-NE 3.29Å; E214-R223 IonicContact OE2-NH2 3.97Å; E214-R223 PolarHBondContact OE2-NH2 3.43Å; E214-R224 WeakPolarHBondContact CA-O 3.44Å; E214-Q225 HydrophobicContact CG-CB 3.94Å
215	L	89.8	Confident	82.5	Confident	4 Å²	4	51.7 Å²	51.7	2%	0.021	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	130.8	170	-174.8	73.7	0	0	0	109.3	P145 F161 Y173 L175 R224	P145-L215 HydrophobicContact CB-CD2 4.43Å; P145-L215 HydrophobicContact CG-CD2 3.7Å; F161-L215 HydrophobicContact CB-CD2 4.36Å; F161-L215 HydrophobicContact CD1-CD1 4.14Å; F161-L215 HydrophobicContact CD1-CD2 4.3Å; F161-L215 HydrophobicContact CD2-CD1 4.39Å; F161-L215 HydrophobicContact CD2-CD2 3.64Å; F161-L215 HydrophobicContact CE1-CD1 3.7Å; F161-L215 HydrophobicContact CE2-CD1 3.98Å; F161-L215 HydrophobicContact CE2-CD2 3.91Å; F161-L215 HydrophobicContact CG-CD1 4.46Å; F161-L215 HydrophobicContact CG-CD2 3.85Å; F161-L215 HydrophobicContact CZ-CD1 3.61Å; F161-L215 HydrophobicContact CZ-CD2 4.35Å; Y173-L215 HydrophobicContact CD1-CD1 4.34Å; L175-L215 HydrophobicContact CD2-CB 4.08Å; L175-L215 HydrophobicContact CD2-CD1 3.54Å; L175-L215 HydrophobicContact CD2-CG 4.43Å; L175-L215 HydrophobicContact CG-CD1 4.1Å; L215-R224 PolarHBondContact N-O 3.41Å; L215-R224 PolarHBondContact O-N 3.5Å
216	R	87.5	Confident	82.8	Confident	41 Å²	41	49.5 Å²	49.5	16%	0.155	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	144.7	173.6	-52.5	-164.7	-170.7	-178.2	3.6	110.8	Y174 Y176 E214 N220	Y174-R216 PolarHBondContact N-O 3.31Å; Y174-R216 PolarHBondContact O-N 2.98Å; Y176-R216 HydrophobicContact CD2-CB 4.21Å; Y176-R216 HydrophobicContact CD2-CG 3.75Å; Y176-R216 HydrophobicContact CE2-CB 4.05Å; Y176-R216 HydrophobicContact CE2-CG 3.96Å; E214-R216 IonicContact OE2-CZ 3.6Å; E214-R216 IonicContact OE2-NE 3.49Å; E214-R216 PolarHBondContact OE2-NE 2.93Å; E214-R216 IonicContact OE2-NH2 2.84Å; E214-R216 PolarHBondContact OE2-NH2 3.46Å; R216-N220 WeakPolarHBondContact CD-OD1 3.33Å; R216-N220 PolarHBondContact NH1-OD1 3.39Å
217	D	80	Confident	82.9	Confident	3 Å²	3	52.6 Å²	52.6	2%	0.016	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	176.2	167.3	74.6	-70.3	0	0	0	111.2	F170 S219 N220 T221 T222	F170-D217 HydrophobicContact CD1-CB 4.19Å; F170-D217 HydrophobicContact CD2-CB 4.48Å; F170-D217 HydrophobicContact CE1-CB 3.92Å; F170-D217 HydrophobicContact CE2-CB 4.27Å; F170-D217 HydrophobicContact CG-CB 4.48Å; F170-D217 HydrophobicContact CZ-CB 4Å; D217-S219 VanDerWaalsContact C-N 3.26Å; D217-S219 PolarHBondContact O-N 2.81Å; D217-S219 WeakPolarHBondContact OD2-CA 3.45Å; D217-S219 VanDerWaalsContact OD2-CB 3.25Å; D217-S219 WeakPolarHBondContact OD2-CB 3.44Å; D217-S219 PolarHBondContact OD2-N 3.15Å; D217-S219 PolarHBondContact OD2-OG 3.44Å; D217-N220 PolarHBondContact O-N 3.18Å; D217-T221 PolarHBondContact OD1-N 2.88Å; D217-T222 WeakPolarHBondContact CB-OG1 3.45Å; D217-T222 VanDerWaalsContact CG-OG1 3.23Å; D217-T222 WeakPolarHBondContact OD1-CB 3.36Å; D217-T222 PolarHBondContact OD1-N 3.39Å; D217-T222 PolarHBondContact OD1-OG1 3.18Å
218	N	74.1	Confident	83.1	Confident	84 Å²	84	51.3 Å²	51.3	45%	0.449	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-24.2	-179.7	65.4	-26.6	0	0	0	114.2	Y174	Y174-N218 HydrophobicContact CE2-CB 4.32Å
219	S	67.8	Low	83.4	Confident	58 Å²	58	51 Å²	51	41%	0.406	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.1	-3.1	177.2	74.2	0	0	0	0	113.5	D217 T221	D217-S219 VanDerWaalsContact C-N 3.26Å; D217-S219 PolarHBondContact O-N 2.81Å; D217-S219 WeakPolarHBondContact OD2-CA 3.45Å; D217-S219 VanDerWaalsContact OD2-CB 3.25Å; D217-S219 WeakPolarHBondContact OD2-CB 3.44Å; D217-S219 PolarHBondContact OD2-N 3.15Å; D217-S219 PolarHBondContact OD2-OG 3.44Å; S219-T221 PolarHBondContact O-N 3.37Å; S219-T221 VanDerWaalsContact O-N 3.1Å; S219-T221 WeakPolarHBondContact OG-CG2 3.49Å; S219-T221 PolarHBondContact OG-OG1 2.86Å
220	N	69.4	Low	83.4	Confident	96 Å²	96	50.4 Å²	50.4	51%	0.513	25%	0.245	S	C	.	.	S	Bend	trans	56.3	22.4	-179.5	-170.1	36.6	0	0	0	113.4	R216 D217	R216-N220 WeakPolarHBondContact CD-OD1 3.33Å; R216-N220 PolarHBondContact NH1-OD1 3.39Å; D217-N220 PolarHBondContact O-N 3.18Å
221	T	64.9	Low	83.1	Confident	73 Å²	73	51.4 Å²	51.4	45%	0.448	25%	0.254	S	S	.	.			trans	-90.2	-34	-178.8	53.4	0	0	0	0	111.2	D217 S219	D217-T221 PolarHBondContact OD1-N 2.88Å; S219-T221 PolarHBondContact O-N 3.37Å; S219-T221 VanDerWaalsContact O-N 3.1Å; S219-T221 WeakPolarHBondContact OG-CG2 3.49Å; S219-T221 PolarHBondContact OG-OG1 2.86Å
222	T	66.1	Low	82.5	Confident	6 Å²	6	56.5 Å²	56.5	4%	0.037	28%	0.278	C	S	.	.			trans	-100.5	118.2	-177.8	67.3	0	0	0	0	109.9	K140 W143 D217	K140-T222 WeakPolarHBondContact O-CG2 3.45Å; W143-T222 HydrophobicContact CB-CG2 4.19Å; W143-T222 HydrophobicContact CE3-CG2 4.28Å; W143-T222 WeakPolarHBondContact O-CB 3.24Å; W143-T222 WeakPolarHBondContact O-CG2 3.29Å; D217-T222 WeakPolarHBondContact CB-OG1 3.45Å; D217-T222 VanDerWaalsContact CG-OG1 3.23Å; D217-T222 WeakPolarHBondContact OD1-CB 3.36Å; D217-T222 PolarHBondContact OD1-N 3.39Å; D217-T222 PolarHBondContact OD1-OG1 3.18Å
223	R	73.4	Confident	81.5	Confident	125 Å²	125	60.2 Å²	60.2	47%	0.472	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	122	178.3	-169.4	176.4	177.8	-155.5	1.5	110.2	E214	E214-R223 IonicContact OE1-CZ 3.8Å; E214-R223 IonicContact OE1-NE 2.76Å; E214-R223 IonicContact OE1-NH2 3.18Å; E214-R223 PolarHBondContact OE1-NH2 2.85Å; E214-R223 IonicContact OE2-CZ 3.09Å; E214-R223 VanDerWaalsContact OE2-CZ 3.22Å; E214-R223 IonicContact OE2-NE 2.76Å; E214-R223 PolarHBondContact OE2-NE 3.29Å; E214-R223 IonicContact OE2-NH2 3.97Å; E214-R223 PolarHBondContact OE2-NH2 3.43Å
224	R	82.9	Confident	79.8	Confident	82 Å²	82	65.6 Å²	65.6	31%	0.309	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	130	166	-164.1	175.5	-168.8	-164.3	3.8	109	P145 K146 T147 L148 E214 L215	P145-R224 HydrophobicContact CG-CB 4.29Å; P145-R224 WeakPolarHBondContact O-CD 3.42Å; P145-R224 VanDerWaalsContact O-CZ 3.27Å; P145-R224 PolarHBondContact O-NH1 3.05Å; K146-R224 PolarHBondContact O-NH1 3.47Å; K146-R224 PolarHBondContact O-NH2 3.5Å; T147-R224 VanDerWaalsContact C-NH1 3.26Å; L148-R224 HydrophobicContact CD2-CB 4.41Å; L148-R224 HydrophobicContact CD2-CG 4.14Å; E214-R224 WeakPolarHBondContact CA-O 3.44Å; L215-R224 PolarHBondContact N-O 3.41Å; L215-R224 PolarHBondContact O-N 3.5Å
225	Q	88.1	Confident	78.2	Confident	120 Å²	120	69 Å²	69	56%	0.561	35%	0.349	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.4	147	-179.1	68.5	178.7	-2.8	0	0	111.3	I213 E214	I213-Q225 CarbonylContact O-C 3.54Å; I213-Q225 VanDerWaalsContact O-CA 3.31Å; I213-Q225 WeakPolarHBondContact O-CA 3.44Å; E214-Q225 HydrophobicContact CG-CB 3.94Å
226	M	88.9	Confident	76.7	Confident	72 Å²	72	74.2 Å²	74.2	36%	0.355	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	150.2	173.3	179.4	56	76.6	0	0	109	L148 I213	L148-M226 HydrophobicContact CD2-CB 3.98Å; I213-M226 PolarHBondContact N-O 3.38Å; I213-M226 PolarHBondContact O-N 2.94Å
227	Q	91.1	Very high	75.3	Confident	76 Å²	76	80.8 Å²	80.8	36%	0.355	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	132.9	169.4	-41	178.8	-7.3	0	0	109.9	T210 Y211 V212 R537	T210-Q227 HydrophobicContact CG2-CB 4.47Å; Y211-Q227 CarbonylContact O-C 3.51Å; Y211-Q227 WeakPolarHBondContact O-CA 3.24Å; V212-Q227 HydrophobicContact CG2-CG 4.24Å; Q227-R537 VanDerWaalsContact CB-NH2 3.27Å; Q227-R537 VanDerWaalsContact O-CZ 3.24Å; Q227-R537 PolarHBondContact O-NH1 3.5Å; Q227-R537 PolarHBondContact O-NH2 3.15Å
228	Y	90.6	Very high	74.1	Confident	59 Å²	59	81.9 Å²	81.9	23%	0.231	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	135.4	-180	-171.6	-95.1	0	0	0	110.4	V150 Q152 L157 Y211 V230	V150-Y228 HydrophobicContact CB-CD2 3.65Å; V150-Y228 HydrophobicContact CB-CE2 4.14Å; V150-Y228 HydrophobicContact CB-CG 3.87Å; V150-Y228 HydrophobicContact CG1-CD1 3.81Å; V150-Y228 HydrophobicContact CG1-CD2 3.82Å; V150-Y228 HydrophobicContact CG1-CE1 4.23Å; V150-Y228 HydrophobicContact CG1-CE2 4.21Å; V150-Y228 HydrophobicContact CG1-CG 3.58Å; V150-Y228 WeakPolarHBondContact O-CE2 3.36Å; Q152-Y228 HydrophobicContact CB-CE1 4.14Å; Q152-Y228 WeakPolarHBondContact CB-OH 3.45Å; Q152-Y228 PolarHBondContact N-OH 3.46Å; L157-Y228 HydrophobicContact CD1-CD1 4.39Å; L157-Y228 HydrophobicContact CD2-CD1 3.93Å; L157-Y228 HydrophobicContact CD2-CE1 3.69Å; Y211-Y228 PolarHBondContact N-O 2.97Å; Y211-Y228 PolarHBondContact O-N 3.31Å; Y228-V230 HydrophobicContact CD1-CG2 4.13Å
229	H	90.8	Very high	73.4	Confident	100 Å²	100	80 Å²	80	46%	0.463	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	117	177.9	-173.2	70.7	0	0	0	109.8	T210	T210-H229 PolarHBondContact OG1-ND1 3.3Å
230	V	89.2	Confident	73.3	Confident	2 Å²	2	80.7 Å²	80.7	1%	0.012	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	116.8	179.2	-172.6	0	0	0	0	108.5	L157 I206 Q208 G209 Y211 Y228	L157-V230 HydrophobicContact CD1-CG2 3.68Å; L157-V230 HydrophobicContact CD2-CG1 4.44Å; L157-V230 HydrophobicContact CD2-CG2 3.95Å; L157-V230 HydrophobicContact CG-CG2 4.22Å; I206-V230 HydrophobicContact CG2-CG1 4.31Å; I206-V230 HydrophobicContact CG2-CG2 3.89Å; Q208-V230 WeakPolarHBondContact CG-O 3.43Å; G209-V230 PolarHBondContact N-O 3.45Å; G209-V230 VanDerWaalsContact N-O 3.14Å; G209-V230 PolarHBondContact O-N 2.9Å; Y211-V230 HydrophobicContact CD2-CB 4.48Å; Y211-V230 HydrophobicContact CD2-CG2 3.58Å; Y211-V230 HydrophobicContact CE2-CG2 3.95Å; Y228-V230 HydrophobicContact CD1-CG2 4.13Å
231	S	84.5	Confident	73.1	Confident	65 Å²	65	81.5 Å²	81.5	46%	0.455	42%	0.424	S	S	.	.	P	Polyproline II helix	trans	-81.3	153.6	-179.1	-61.4	0	0	0	0	111.2	Q152 V233	Q152-S231 PolarHBondContact NE2-O 2.93Å; S231-V233 PolarHBondContact O-N 3.36Å
232	Q	78.6	Confident	73	Confident	113 Å²	113	84.9 Å²	84.9	53%	0.528	43%	0.429	S	S	.	.	P	Polyproline II helix	trans	-68.5	116.5	177	-167.3	177	-4.9	0	0	110.7	Q208 H234	Q208-Q232 HydrophobicContact CG-CB 4.38Å; Q232-H234 PolarHBondContact O-N 3.23Å
233	V	70.4	Confident	72.9	Confident	85 Å²	85	87 Å²	87	52%	0.515	45%	0.447	S	S	.	.			trans	-80.9	106.5	171	-172.3	0	0	0	0	108.2	G154 S231	G154-V233 WeakPolarHBondContact O-CG2 3.45Å; S231-V233 PolarHBondContact O-N 3.36Å
234	H	57.8	Low	72.9	Confident	113 Å²	113	87 Å²	87	52%	0.523	45%	0.454	S	S	.	.			trans	-67.4	131.9	171	-79.1	77	0	0	0	109	Q232	Q232-H234 PolarHBondContact O-N 3.23Å
235	S	56.7	Low	72.4	Confident	72 Å²	72	86.2 Å²	86.2	50%	0.503	47%	0.465	S	S	.	.			trans	-54.6	130.7	173.1	172.6	0	0	0	0	109.3	W237 A238	S235-W237 PolarHBondContact O-N 3.29Å; S235-W237 PolarHBondContact OG-N 3.45Å; S235-A238 WeakPolarHBondContact O-CB 3.48Å; S235-A238 PolarHBondContact O-N 2.76Å
236	P	59	Low	71.7	Confident	114 Å²	114	85.5 Å²	85.5	74%	0.74	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-15.3	179	21.1	-30.2	0	0	0	113
237	W	56.8	Low	71.1	Confident	178 Å²	178	85.3 Å²	85.3	67%	0.674	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	-9.7	176.5	-67.9	88.9	0	0	0	114.7	S235 G239 P240 I241	S235-W237 PolarHBondContact O-N 3.29Å; S235-W237 PolarHBondContact OG-N 3.45Å; W237-G239 VanDerWaalsContact C-N 3.29Å; W237-G239 PolarHBondContact O-N 2.98Å; W237-P240 WeakPolarHBondContact O-CD 3.44Å; W237-I241 HydrophobicContact CB-CD1 4.39Å; W237-I241 WeakPolarHBondContact O-CD1 3.38Å; W237-I241 VanDerWaalsContact O-CG1 3.29Å; W237-I241 WeakPolarHBondContact O-CG1 3.33Å; W237-I241 PolarHBondContact O-N 2.97Å
238	A	55.2	Low	70.7	Confident	26 Å²	26	85.2 Å²	85.2	22%	0.215	47%	0.471	C	S	.	.	H	α-helix	trans	-74.3	-18.6	-177.2	0	0	0	0	0	113.5	S235 R242	S235-A238 WeakPolarHBondContact O-CB 3.48Å; S235-A238 PolarHBondContact O-N 2.76Å; A238-R242 WeakPolarHBondContact O-CB 3.49Å; A238-R242 VanDerWaalsContact O-CG 3.31Å; A238-R242 WeakPolarHBondContact O-CG 3.48Å; A238-R242 PolarHBondContact O-NE 3.06Å
239	G	59.2	Low	70.2	Confident	45 Å²	45	85.6 Å²	85.6	46%	0.464	48%	0.481	S	S	.	.	H	α-helix	trans	-74.7	-57.9	173.3	0	0	0	0	0	112.4	W237 I241 R242 A243	W237-G239 VanDerWaalsContact C-N 3.29Å; W237-G239 PolarHBondContact O-N 2.98Å; G239-I241 VanDerWaalsContact C-N 3.32Å; G239-I241 PolarHBondContact O-N 3.14Å; G239-R242 PolarHBondContact O-N 3.38Å; G239-A243 WeakPolarHBondContact O-CB 3.28Å; G239-A243 PolarHBondContact O-N 3.48Å
240	P	66.4	Low	69.6	Low	72 Å²	72	86 Å²	86	47%	0.468	49%	0.486	S	S	.	.	H	α-helix	trans	-57.8	-38.4	180	-27.4	34.7	0	0	0	114.1	W237 A243 M244	W237-P240 WeakPolarHBondContact O-CD 3.44Å; P240-A243 PolarHBondContact O-N 3.32Å; P240-M244 VanDerWaalsContact O-CG 3.26Å; P240-M244 WeakPolarHBondContact O-CG 3.26Å; P240-M244 PolarHBondContact O-N 2.95Å
241	I	63.9	Low	69.5	Low	113 Å²	113	90.5 Å²	90.5	58%	0.579	51%	0.513	S	S	*	.	H	α-helix	trans	-68.3	-40	179.2	-63.1	169.8	0	0	0	111	W237 G239 A245	W237-I241 HydrophobicContact CB-CD1 4.39Å; W237-I241 WeakPolarHBondContact O-CD1 3.38Å; W237-I241 VanDerWaalsContact O-CG1 3.29Å; W237-I241 WeakPolarHBondContact O-CG1 3.33Å; W237-I241 PolarHBondContact O-N 2.97Å; G239-I241 VanDerWaalsContact C-N 3.32Å; G239-I241 PolarHBondContact O-N 3.14Å; I241-A245 WeakPolarHBondContact O-CB 3.5Å; I241-A245 PolarHBondContact O-N 3.08Å; I241-A245 VanDerWaalsContact O-N 3.08Å
242	R	63.1	Low	69.6	Low	144 Å²	144	91.5 Å²	91.5	54%	0.543	51%	0.512	S	S	.	.	H	α-helix	trans	-71.7	-36.7	175.8	-75.2	-173.1	-94	-149.5	3.5	112.3	A238 G239 A245 I246	A238-R242 WeakPolarHBondContact O-CB 3.49Å; A238-R242 VanDerWaalsContact O-CG 3.31Å; A238-R242 WeakPolarHBondContact O-CG 3.48Å; A238-R242 PolarHBondContact O-NE 3.06Å; G239-R242 PolarHBondContact O-N 3.38Å; R242-A245 PolarHBondContact O-N 3.2Å; R242-I246 WeakPolarHBondContact O-CD1 3.38Å; R242-I246 VanDerWaalsContact O-CG1 3.26Å; R242-I246 WeakPolarHBondContact O-CG1 3.27Å; R242-I246 PolarHBondContact O-N 3.42Å; R242-I246 VanDerWaalsContact O-N 3.15Å
243	A	65.3	Low	69.9	Low	50 Å²	50	92.1 Å²	92.1	41%	0.413	52%	0.517	S	S	.	.	H	α-helix	trans	-61.6	-47.8	174.5	0	0	0	0	0	111	G239 P240 A245 I246 T247	G239-A243 WeakPolarHBondContact O-CB 3.28Å; G239-A243 PolarHBondContact O-N 3.48Å; P240-A243 PolarHBondContact O-N 3.32Å; A243-A245 PolarHBondContact O-N 3.09Å; A243-I246 PolarHBondContact O-N 3.28Å; A243-T247 WeakPolarHBondContact O-CB 3.24Å; A243-T247 VanDerWaalsContact O-CG2 3.25Å; A243-T247 WeakPolarHBondContact O-CG2 3.43Å; A243-T247 PolarHBondContact O-N 3.14Å; A243-T247 PolarHBondContact O-OG1 3.13Å
244	M	72.9	Confident	70.4	Confident	126 Å²	126	91.1 Å²	91.1	62%	0.621	51%	0.514	S	S	*	.	H	α-helix	trans	-64.9	-38.8	177.8	-67.8	-67.4	-82.8	0	0	112.7	P240 I246 V248	P240-M244 VanDerWaalsContact O-CG 3.26Å; P240-M244 WeakPolarHBondContact O-CG 3.26Å; P240-M244 PolarHBondContact O-N 2.95Å; M244-I246 VanDerWaalsContact C-N 3.25Å; M244-I246 PolarHBondContact O-N 3.15Å; M244-V248 WeakPolarHBondContact O-CB 3.24Å; M244-V248 VanDerWaalsContact O-CG2 3.29Å; M244-V248 WeakPolarHBondContact O-CG2 2.8Å; M244-V248 PolarHBondContact O-N 3.26Å
245	A	71.4	Confident	71.7	Confident	66 Å²	66	88.3 Å²	88.3	55%	0.545	51%	0.51	S	S	.	.	H	α-helix	trans	-67	-24.2	177.8	0	0	0	0	0	113.5	I241 R242 A243 P249	I241-A245 WeakPolarHBondContact O-CB 3.5Å; I241-A245 PolarHBondContact O-N 3.08Å; I241-A245 VanDerWaalsContact O-N 3.08Å; R242-A245 PolarHBondContact O-N 3.2Å; A243-A245 PolarHBondContact O-N 3.09Å; A245-P249 WeakPolarHBondContact O-CD 3.28Å; A245-P249 WeakPolarHBondContact O-CG 3.16Å
246	I	74.9	Confident	72.9	Confident	104 Å²	104	91.3 Å²	91.3	53%	0.533	51%	0.514	S	S	.	.	H	α-helix	trans	-95.6	-41.3	179.4	-64.8	167.4	0	0	0	111.3	R242 A243 M244 P249 L250	R242-I246 WeakPolarHBondContact O-CD1 3.38Å; R242-I246 VanDerWaalsContact O-CG1 3.26Å; R242-I246 WeakPolarHBondContact O-CG1 3.27Å; R242-I246 PolarHBondContact O-N 3.42Å; R242-I246 VanDerWaalsContact O-N 3.15Å; A243-I246 PolarHBondContact O-N 3.28Å; M244-I246 VanDerWaalsContact C-N 3.25Å; M244-I246 PolarHBondContact O-N 3.15Å; I246-P249 WeakPolarHBondContact O-CD 3.44Å; I246-L250 HydrophobicContact CG2-CD1 3.66Å; I246-L250 HydrophobicContact CG2-CG 4.47Å; I246-L250 WeakPolarHBondContact O-CB 3.25Å; I246-L250 WeakPolarHBondContact O-CD1 3.46Å; I246-L250 VanDerWaalsContact O-CG 3.28Å; I246-L250 WeakPolarHBondContact O-CG 3.47Å; I246-L250 PolarHBondContact O-N 3.33Å
247	T	76.4	Confident	73.9	Confident	68 Å²	68	88.5 Å²	88.5	42%	0.417	50%	0.5	S	S	.	.	H	α-helix	trans	-71.5	-38.2	-175.9	56.2	0	0	0	0	112.4	A243 L250 V251	A243-T247 WeakPolarHBondContact O-CB 3.24Å; A243-T247 VanDerWaalsContact O-CG2 3.25Å; A243-T247 WeakPolarHBondContact O-CG2 3.43Å; A243-T247 PolarHBondContact O-N 3.14Å; A243-T247 PolarHBondContact O-OG1 3.13Å; T247-L250 PolarHBondContact O-N 3.11Å; T247-V251 WeakPolarHBondContact O-CB 3.24Å; T247-V251 VanDerWaalsContact O-CG2 3.26Å; T247-V251 WeakPolarHBondContact O-CG2 3.43Å; T247-V251 PolarHBondContact O-N 3.13Å
248	V	81.8	Confident	75	Confident	75 Å²	75	83.9 Å²	83.9	46%	0.455	49%	0.492	S	S	.	.	H	α-helix	trans	-63.8	-48.6	-178.6	173.8	0	0	0	0	111.8	M244 L250 V251 I252	M244-V248 WeakPolarHBondContact O-CB 3.24Å; M244-V248 VanDerWaalsContact O-CG2 3.29Å; M244-V248 WeakPolarHBondContact O-CG2 2.8Å; M244-V248 PolarHBondContact O-N 3.26Å; V248-L250 PolarHBondContact O-N 2.89Å; V248-V251 PolarHBondContact O-N 3.41Å; V248-I252 HydrophobicContact CG1-CD1 3.92Å; V248-I252 WeakPolarHBondContact O-CD1 3.42Å; V248-I252 VanDerWaalsContact O-CG1 3.24Å; V248-I252 WeakPolarHBondContact O-CG1 3.48Å; V248-I252 PolarHBondContact O-N 3.45Å; V248-I252 VanDerWaalsContact O-N 3.15Å
249	P	79.9	Confident	76	Confident	66 Å²	66	88.2 Å²	88.2	43%	0.429	51%	0.511	S	S	.	.	H	α-helix	trans	-64.6	-37.7	174.5	-23.1	34.9	0	0	0	113.6	A245 I246 I252 M253	A245-P249 WeakPolarHBondContact O-CD 3.28Å; A245-P249 WeakPolarHBondContact O-CG 3.16Å; I246-P249 WeakPolarHBondContact O-CD 3.44Å; P249-I252 PolarHBondContact O-N 2.94Å; P249-M253 WeakPolarHBondContact O-CB 3.41Å; P249-M253 VanDerWaalsContact O-CG 3.27Å; P249-M253 WeakPolarHBondContact O-CG 3.09Å; P249-M253 PolarHBondContact O-N 3.27Å
250	L	78.9	Confident	76.7	Confident	109 Å²	109	93.4 Å²	93.4	57%	0.571	52%	0.521	S	S	*	.	H	α-helix	trans	-65.2	-40.7	178.7	-77.3	172.7	0	0	0	112.3	I246 T247 V248 M253 S254	I246-L250 HydrophobicContact CG2-CD1 3.66Å; I246-L250 HydrophobicContact CG2-CG 4.47Å; I246-L250 WeakPolarHBondContact O-CB 3.25Å; I246-L250 WeakPolarHBondContact O-CD1 3.46Å; I246-L250 VanDerWaalsContact O-CG 3.28Å; I246-L250 WeakPolarHBondContact O-CG 3.47Å; I246-L250 PolarHBondContact O-N 3.33Å; T247-L250 PolarHBondContact O-N 3.11Å; V248-L250 PolarHBondContact O-N 2.89Å; L250-M253 PolarHBondContact O-N 3.01Å; L250-S254 VanDerWaalsContact O-CB 3.29Å; L250-S254 WeakPolarHBondContact O-CB 3.21Å; L250-S254 PolarHBondContact O-N 2.98Å; L250-S254 PolarHBondContact O-OG 3.27Å
251	V	86.4	Confident	76.7	Confident	96 Å²	96	93.1 Å²	93.1	58%	0.582	52%	0.518	S	S	*	.	H	α-helix	trans	-63.9	-44.6	175.5	171.6	0	0	0	0	110.2	T247 V248 S254 A255	T247-V251 WeakPolarHBondContact O-CB 3.24Å; T247-V251 VanDerWaalsContact O-CG2 3.26Å; T247-V251 WeakPolarHBondContact O-CG2 3.43Å; T247-V251 PolarHBondContact O-N 3.13Å; V248-V251 PolarHBondContact O-N 3.41Å; V251-S254 PolarHBondContact O-N 3.14Å; V251-S254 PolarHBondContact O-OG 3.47Å; V251-A255 PolarHBondContact O-N 3.05Å
252	I	87.2	Confident	77	Confident	86 Å²	86	92.6 Å²	92.6	44%	0.441	52%	0.52	S	S	.	.	H	α-helix	trans	-61.8	-47.9	177.3	-66.4	168	0	0	0	110.8	V248 P249 S254 A255 F256	V248-I252 HydrophobicContact CG1-CD1 3.92Å; V248-I252 WeakPolarHBondContact O-CD1 3.42Å; V248-I252 VanDerWaalsContact O-CG1 3.24Å; V248-I252 WeakPolarHBondContact O-CG1 3.48Å; V248-I252 PolarHBondContact O-N 3.45Å; V248-I252 VanDerWaalsContact O-N 3.15Å; P249-I252 PolarHBondContact O-N 2.94Å; I252-S254 VanDerWaalsContact C-N 3.34Å; I252-S254 PolarHBondContact O-N 3.05Å; I252-A255 WeakPolarHBondContact O-CB 3.43Å; I252-A255 PolarHBondContact O-N 3.2Å; I252-F256 HydrophobicContact CG2-CD2 3.8Å; I252-F256 HydrophobicContact CG2-CE2 3.57Å; I252-F256 WeakPolarHBondContact O-CD2 3.26Å; I252-F256 PolarHBondContact O-N 3.15Å; I252-F256 VanDerWaalsContact O-N 3.08Å
253	M	83.4	Confident	77.1	Confident	126 Å²	126	90.8 Å²	90.8	62%	0.621	53%	0.525	S	S	*	.	H	α-helix	trans	-62.8	-38.3	177.7	-73.5	-63.9	-67.8	0	0	112.5	P249 L250 F256 A257	P249-M253 WeakPolarHBondContact O-CB 3.41Å; P249-M253 VanDerWaalsContact O-CG 3.27Å; P249-M253 WeakPolarHBondContact O-CG 3.09Å; P249-M253 PolarHBondContact O-N 3.27Å; L250-M253 PolarHBondContact O-N 3.01Å; M253-F256 PolarHBondContact O-N 3.17Å; M253-A257 WeakPolarHBondContact O-CB 3.45Å; M253-A257 PolarHBondContact O-N 3.18Å
254	S	81.8	Confident	76.6	Confident	65 Å²	65	91.7 Å²	91.7	46%	0.455	53%	0.527	S	S	.	.	H	α-helix	trans	-66.8	-35.4	176.2	76	0	0	0	0	112.5	L250 V251 I252 A257 T258	L250-S254 VanDerWaalsContact O-CB 3.29Å; L250-S254 WeakPolarHBondContact O-CB 3.21Å; L250-S254 PolarHBondContact O-N 2.98Å; L250-S254 PolarHBondContact O-OG 3.27Å; V251-S254 PolarHBondContact O-N 3.14Å; V251-S254 PolarHBondContact O-OG 3.47Å; I252-S254 VanDerWaalsContact C-N 3.34Å; I252-S254 PolarHBondContact O-N 3.05Å; S254-A257 PolarHBondContact O-N 3Å; S254-T258 WeakPolarHBondContact O-CB 3.36Å; S254-T258 WeakPolarHBondContact O-CG2 3.26Å; S254-T258 PolarHBondContact O-N 3.41Å; S254-T258 PolarHBondContact O-OG1 3.37Å
255	A	84.1	Confident	75.8	Confident	54 Å²	54	93.6 Å²	93.6	45%	0.446	53%	0.528	S	S	.	.	H	α-helix	trans	-67.4	-39.8	174.8	0	0	0	0	0	111.6	V251 I252 T258 L259	V251-A255 PolarHBondContact O-N 3.05Å; I252-A255 WeakPolarHBondContact O-CB 3.43Å; I252-A255 PolarHBondContact O-N 3.2Å; A255-T258 WeakPolarHBondContact CA-OG1 3.29Å; A255-T258 PolarHBondContact O-OG1 3.23Å; A255-L259 WeakPolarHBondContact O-CB 3.43Å; A255-L259 PolarHBondContact O-N 2.67Å; A255-L259 VanDerWaalsContact O-N 3.14Å
256	F	83.4	Confident	74.7	Confident	135 Å²	135	99.9 Å²	99.9	59%	0.592	54%	0.543	S	S	*	.	H	α-helix	trans	-69.1	-41	174.2	-77.4	-69.6	0	0	0	112.6	I252 M253 L259 F260	I252-F256 HydrophobicContact CG2-CD2 3.8Å; I252-F256 HydrophobicContact CG2-CE2 3.57Å; I252-F256 WeakPolarHBondContact O-CD2 3.26Å; I252-F256 PolarHBondContact O-N 3.15Å; I252-F256 VanDerWaalsContact O-N 3.08Å; M253-F256 PolarHBondContact O-N 3.17Å; F256-L259 PolarHBondContact O-N 3.03Å; F256-F260 WeakPolarHBondContact O-CB 3.49Å; F256-F260 PolarHBondContact O-N 3.32Å
257	A	79.9	Confident	73.3	Confident	54 Å²	54	104.4 Å²	104.4	45%	0.446	56%	0.558	S	S	.	*	H	α-helix	trans	-65.8	-38.7	178.4	0	0	0	0	0	112.8	M253 S254 F260 T261	M253-A257 WeakPolarHBondContact O-CB 3.45Å; M253-A257 PolarHBondContact O-N 3.18Å; S254-A257 PolarHBondContact O-N 3Å; A257-F260 PolarHBondContact O-N 2.93Å; A257-T261 WeakPolarHBondContact O-CB 3.31Å; A257-T261 WeakPolarHBondContact O-CG2 3.37Å; A257-T261 PolarHBondContact O-N 3.48Å; A257-T261 PolarHBondContact O-OG1 3.19Å
258	T	79.3	Confident	71.4	Confident	82 Å²	82	109.4 Å²	109.4	50%	0.503	58%	0.577	S	S	.	*	H	α-helix	trans	-67.9	-40.4	175	47.4	0	0	0	0	111.9	S254 A255 F260 T261 V262	S254-T258 WeakPolarHBondContact O-CB 3.36Å; S254-T258 WeakPolarHBondContact O-CG2 3.26Å; S254-T258 PolarHBondContact O-N 3.41Å; S254-T258 PolarHBondContact O-OG1 3.37Å; A255-T258 WeakPolarHBondContact CA-OG1 3.29Å; A255-T258 PolarHBondContact O-OG1 3.23Å; T258-F260 PolarHBondContact O-N 3.21Å; T258-T261 VanDerWaalsContact CA-OG1 3.29Å; T258-T261 WeakPolarHBondContact CA-OG1 3.4Å; T258-T261 PolarHBondContact O-N 3.08Å; T258-T261 PolarHBondContact O-OG1 3.04Å; T258-T261 VanDerWaalsContact O-OG1 3.06Å; T258-V262 VanDerWaalsContact O-CG2 3.28Å; T258-V262 WeakPolarHBondContact O-CG2 3.29Å; T258-V262 PolarHBondContact O-N 3.45Å
259	L	76.4	Confident	69.5	Low	117 Å²	117	113.4 Å²	113.4	61%	0.613	59%	0.591	S	S	*	*	H	α-helix	trans	-62.2	-43.9	173.8	-162.2	80.6	0	0	0	111.4	A255 F256 V262 V263	A255-L259 WeakPolarHBondContact O-CB 3.43Å; A255-L259 PolarHBondContact O-N 2.67Å; A255-L259 VanDerWaalsContact O-N 3.14Å; F256-L259 PolarHBondContact O-N 3.03Å; L259-V262 PolarHBondContact O-N 3.24Å; L259-V263 VanDerWaalsContact O-CG2 3.28Å; L259-V263 WeakPolarHBondContact O-CG2 3.41Å; L259-V263 PolarHBondContact O-N 2.83Å; L259-V263 VanDerWaalsContact O-N 3.07Å
260	F	72.9	Confident	67.6	Low	154 Å²	154	119 Å²	119	68%	0.675	61%	0.611	S	S	*	*	H	α-helix	trans	-66.1	-41.3	179	-146.3	-93.4	0	0	0	111.8	F256 A257 T258 V263 C264	F256-F260 WeakPolarHBondContact O-CB 3.49Å; F256-F260 PolarHBondContact O-N 3.32Å; A257-F260 PolarHBondContact O-N 2.93Å; T258-F260 PolarHBondContact O-N 3.21Å; F260-V263 PolarHBondContact O-N 3.26Å; F260-C264 WeakPolarHBondContact O-CB 3.35Å; F260-C264 PolarHBondContact O-N 3Å; F260-C264 PolarHBondContact O-SG 3.02Å
261	T	67.3	Low	65.5	Low	65 Å²	65	121.1 Å²	121.1	40%	0.399	62%	0.623	S	S	.	*	H	α-helix	trans	-70.2	-32.8	177.3	44.5	0	0	0	0	113.2	A257 T258 R265	A257-T261 WeakPolarHBondContact O-CB 3.31Å; A257-T261 WeakPolarHBondContact O-CG2 3.37Å; A257-T261 PolarHBondContact O-N 3.48Å; A257-T261 PolarHBondContact O-OG1 3.19Å; T258-T261 VanDerWaalsContact CA-OG1 3.29Å; T258-T261 WeakPolarHBondContact CA-OG1 3.4Å; T258-T261 PolarHBondContact O-N 3.08Å; T258-T261 PolarHBondContact O-OG1 3.04Å; T258-T261 VanDerWaalsContact O-OG1 3.06Å; T261-R265 WeakPolarHBondContact O-CB 3.28Å; T261-R265 VanDerWaalsContact O-CG 3.23Å; T261-R265 WeakPolarHBondContact O-CG 3.37Å; T261-R265 PolarHBondContact O-N 3.36Å
262	V	70.6	Confident	63.4	Low	103 Å²	103	123.9 Å²	123.9	62%	0.624	63%	0.633	S	S	*	*	H	α-helix	trans	-70.8	-36.3	173.4	172.3	0	0	0	0	111.5	T258 L259 K266	T258-V262 VanDerWaalsContact O-CG2 3.28Å; T258-V262 WeakPolarHBondContact O-CG2 3.29Å; T258-V262 PolarHBondContact O-N 3.45Å; L259-V262 PolarHBondContact O-N 3.24Å; V262-K266 PolarHBondContact O-N 2.97Å
263	V	63.7	Low	60.9	Low	106 Å²	106	129 Å²	129	64%	0.642	65%	0.648	S	S	*	*	H	α-helix	trans	-70	-38.3	174.2	173.6	0	0	0	0	111.6	L259 F260	L259-V263 VanDerWaalsContact O-CG2 3.28Å; L259-V263 WeakPolarHBondContact O-CG2 3.41Å; L259-V263 PolarHBondContact O-N 2.83Å; L259-V263 VanDerWaalsContact O-N 3.07Å; F260-V263 PolarHBondContact O-N 3.26Å
264	C	56.2	Low	58.8	Low	69 Å²	69	128 Å²	128	47%	0.466	65%	0.654	S	S	.	*	H	α-helix	trans	-72.9	-36.5	174.3	-69.5	0	0	0	0	113.1	F260 K266 K267	F260-C264 WeakPolarHBondContact O-CB 3.35Å; F260-C264 PolarHBondContact O-N 3Å; F260-C264 PolarHBondContact O-SG 3.02Å; C264-K266 VanDerWaalsContact C-N 3.29Å; C264-K266 PolarHBondContact O-N 3.28Å; C264-K267 PolarHBondContact O-N 2.76Å
265	R	55.6	Low	56.7	Low	166 Å²	166	133.4 Å²	133.4	63%	0.626	67%	0.672	S	S	*	*	H	α-helix	trans	-71.1	-19.3	178.2	-81.3	-178.9	163.7	148.6	-3.3	113.8	T261 K267	T261-R265 WeakPolarHBondContact O-CB 3.28Å; T261-R265 VanDerWaalsContact O-CG 3.23Å; T261-R265 WeakPolarHBondContact O-CG 3.37Å; T261-R265 PolarHBondContact O-N 3.36Å; R265-K267 PolarHBondContact O-N 3.28Å
266	K	47.9	Very low	54.5	Low	197 Å²	197	139 Å²	139	86%	0.857	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.4	-5.7	172.3	-165.9	164.2	176.4	162.3	0	113.6	V262 C264	V262-K266 PolarHBondContact O-N 2.97Å; C264-K266 VanDerWaalsContact C-N 3.29Å; C264-K266 PolarHBondContact O-N 3.28Å
267	K	46.1	Very low	52.1	Low	199 Å²	199	139 Å²	139	87%	0.865	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124.7	1.6	-178.4	-152.1	176.9	176.6	178.2	0	115.2	C264 R265	C264-K267 PolarHBondContact O-N 2.76Å; R265-K267 PolarHBondContact O-N 3.28Å
268	Q	37.2	Very low	50.2	Low	173 Å²	173	145.5 Å²	145.5	81%	0.808	72%	0.72	S	S	*	*			trans	-141.9	37.2	-176.5	-145.2	-172.5	2.5	0	0	114	E270	Q268-E270 PolarHBondContact O-N 2.76Å
269	Q	40.3	Very low	48.1	Very low	160 Å²	160	150.4 Å²	150.4	75%	0.748	74%	0.738	S	S	*	*			trans	-93.1	75.9	169.8	-171	74.1	17.3	0	0	109
270	E	40.8	Very low	46.3	Very low	183 Å²	183	150.5 Å²	150.5	86%	0.855	75%	0.748	S	S	*	*	S	Bend	trans	-178.2	66.8	159.7	-106.8	175.3	-148.9	0	0	110.2	Q268	Q268-E270 PolarHBondContact O-N 2.76Å
271	N	35.8	Very low	44.5	Very low	154 Å²	154	148.7 Å²	148.7	82%	0.824	76%	0.755	S	S	*	*	S	Bend	trans	168.2	139.4	144.2	-103.2	-63.5	0	0	0	110
272	I	41.2	Very low	42.9	Very low	154 Å²	154	154.7 Å²	154.7	79%	0.79	78%	0.778	S	S	*	*			trans	77.8	65.6	170.8	-34.1	-167.8	0	0	0	114.8
273	Y	35.6	Very low	41.2	Very low	194 Å²	194	155 Å²	155	76%	0.761	79%	0.785	S	S	*	*			trans	-127.1	89.2	146	-132.6	-75.6	0	0	0	107.3	D277	Y273-D277 PolarHBondContact OH-OD2 3.25Å
274	S	38.3	Very low	39.9	Very low	105 Å²	105	154.7 Å²	154.7	73%	0.734	79%	0.787	S	S	*	*	S	Bend	trans	-170.2	25.3	167	70.4	0	0	0	0	116.2
275	Q	38	Very low	38.8	Very low	178 Å²	178	158.5 Å²	158.5	83%	0.832	80%	0.803	S	S	*	*	S	Bend	trans	-157.3	17.6	177.5	-134.3	174.3	-15.1	0	0	121.8
276	L	38.6	Very low	37.9	Very low	172 Å²	172	157.9 Å²	157.9	90%	0.901	81%	0.807	S	S	*	*	S	Bend	trans	-146.1	29.5	177.7	-77.8	-179.9	0	0	0	116
277	D	32.7	Very low	37.3	Very low	134 Å²	134	153.8 Å²	153.8	72%	0.717	80%	0.803	S	S	*	*	S	Bend	trans	-122.1	23.1	177	-92.2	-22.6	0	0	0	114.1	Y273	Y273-D277 PolarHBondContact OH-OD2 3.25Å
278	E	39.7	Very low	36.9	Very low	190 Å²	190	148.6 Å²	148.6	89%	0.888	80%	0.798	S	S	*	*	S	Bend	trans	-123.4	32.7	179.4	-146.1	179.2	166.6	0	0	113.9
279	E	36.1	Very low	36.6	Very low	186 Å²	186	144.4 Å²	144.4	87%	0.869	79%	0.793	S	S	*	*	S	Bend	trans	-156.6	48.4	166.5	-156.2	158.5	92.7	0	0	114.8
280	S	38.7	Very low	36.2	Very low	119 Å²	119	142.8 Å²	142.8	83%	0.832	79%	0.789	S	S	*	*	S	Bend	trans	-153.7	19.5	175.8	-81.5	0	0	0	0	117.4
281	S	34.3	Very low	36.1	Very low	116 Å²	116	139.9 Å²	139.9	81%	0.811	78%	0.779	S	S	*	*	S	Bend	trans	-131.5	6.7	-173.5	-53.9	0	0	0	0	117
282	E	34.5	Very low	36.1	Very low	190 Å²	190	137.4 Å²	137.4	89%	0.888	77%	0.774	S	S	*	*	S	Bend	trans	-135	80.6	171.3	-73.5	-167.4	126.5	0	0	111.4
283	S	34.7	Very low	36	Very low	109 Å²	109	139.3 Å²	139.3	76%	0.762	78%	0.779	S	S	*	*	S	Bend	trans	-143.7	5.5	163	68.8	0	0	0	0	115.4
284	S	36	Very low	36.6	Very low	100 Å²	100	134.2 Å²	134.2	70%	0.699	76%	0.759	S	S	*	*	S	Bend	trans	-94.5	-7.5	179.8	77.9	0	0	0	0	115.2
285	N	33.4	Very low	37.1	Very low	150 Å²	150	134 Å²	134	80%	0.802	76%	0.755	S	S	*	*	S	Bend	trans	-118.3	8.7	-173.8	-68.1	-15.3	0	0	0	115.1
286	Q	36.6	Very low	37.4	Very low	153 Å²	153	136.6 Å²	136.6	72%	0.715	76%	0.757	S	S	*	*	S	Bend	trans	-114.1	29.1	-175.8	-147.9	141.9	40.7	0	0	114.5
287	S	35.3	Very low	38.7	Very low	110 Å²	110	132.8 Å²	132.8	77%	0.769	74%	0.743	S	S	*	*	S	Bend	trans	-130.4	9.6	177.5	35.7	0	0	0	0	114.5
288	A	36.6	Very low	41.1	Very low	90 Å²	90	131.1 Å²	131.1	74%	0.744	73%	0.726	S	S	*	*	S	Bend	trans	-124.2	-3.3	175.2	0	0	0	0	0	114.8
289	A	31.8	Very low	43.5	Very low	86 Å²	86	122.5 Å²	122.5	71%	0.711	69%	0.687	S	S	*	*	S	Bend	trans	-123.9	11.6	-174.1	0	0	0	0	0	115.4
290	L	31.5	Very low	46.2	Very low	126 Å²	126	115 Å²	115	66%	0.66	65%	0.651	S	S	*	*			trans	-113.9	69.4	171.3	-65.6	177.6	0	0	0	110.4
291	N	39.5	Very low	49	Very low	121 Å²	121	109.3 Å²	109.3	65%	0.647	61%	0.612	S	S	*	*			trans	-110.6	19.5	164.9	-84.6	-40.5	0	0	0	112.4	R294	N291-R294 PolarHBondContact OD1-NH2 3.38Å
292	S	34.3	Very low	52	Low	102 Å²	102	104.1 Å²	104.1	71%	0.713	57%	0.574	S	S	*	*	S	Bend	trans	-110.1	123.4	162	-64.9	0	0	0	0	106.9
293	E	39.7	Very low	55	Low	195 Å²	195	95.2 Å²	95.2	91%	0.911	53%	0.533	S	S	*	.			trans	77.5	68.7	176.5	-59.9	172	143.9	0	0	116.3
294	R	48	Very low	57.9	Low	86 Å²	86	90.2 Å²	90.2	33%	0.325	50%	0.498	S	S	.	.	P	Polyproline II helix	trans	-85.4	135.2	153.9	-64.1	-162.7	-149.1	172.3	-3.8	109.2	N291 W296 R298	N291-R294 PolarHBondContact OD1-NH2 3.38Å; R294-W296 PolarHBondContact O-N 2.78Å; R294-R298 VanDerWaalsContact CD-NH2 3.34Å
295	P	49	Very low	60.8	Low	101 Å²	101	85.9 Å²	85.9	66%	0.656	47%	0.466	S	S	*	.	P	Polyproline II helix	trans	-60.5	125.1	178.4	-17.9	29.4	0	0	0	110.4
296	W	44.1	Very low	63.7	Low	233 Å²	233	78.7 Å²	78.7	88%	0.883	43%	0.428	S	S	*	.	S	Bend	trans	-85.5	144.2	168.7	-83.8	76.2	0	0	0	109.4	R294	R294-W296 PolarHBondContact O-N 2.78Å
297	P	67.1	Low	66.3	Low	92 Å²	92	74.6 Å²	74.6	60%	0.597	41%	0.411	S	S	*	.	P	Polyproline II helix	cis	-96.4	146.5	0.5	33.6	-30	0	0	0	113.7	Q472	P297-Q472 PolarHBondContact O-NE2 2.93Å
298	R	82.4	Confident	68.8	Low	99 Å²	99	72.3 Å²	72.3	37%	0.374	39%	0.385	S	S	.	.	P	Polyproline II helix	trans	-76	140.6	173.8	-64.2	-176.7	-170.6	-176.3	10.6	110.6	R294 K300 G329	R294-R298 VanDerWaalsContact CD-NH2 3.34Å; R298-K300 PolarHBondContact O-N 2.58Å; R298-G329 WeakPolarHBondContact CB-O 3.46Å; R298-G329 WeakPolarHBondContact CD-O 3.38Å; R298-G329 VanDerWaalsContact CG-O 3.29Å; R298-G329 WeakPolarHBondContact CG-O 3.39Å
299	P	89.8	Confident	71.4	Confident	8 Å²	8	68.5 Å²	68.5	5%	0.052	35%	0.352	C	S	.	.	P	Polyproline II helix	trans	-69.1	128.2	176.7	27.9	-32.3	0	0	0	110.5	C330 E331 F360	P299-C330 HydrophobicContact CG-CB 4.44Å; P299-C330 WeakPolarHBondContact O-CA 3.3Å; P299-E331 PolarHBondContact O-N 3.48Å; P299-F360 HydrophobicContact CB-CD2 4.04Å; P299-F360 HydrophobicContact CB-CE2 3.94Å
300	K	93.9	Very high	74.1	Confident	29 Å²	29	64.9 Å²	64.9	13%	0.126	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	122.9	173.8	-170.8	174.4	-177.9	174.3	0	110.4	R298 E331 V333 E357 N359 F360	R298-K300 PolarHBondContact O-N 2.58Å; K300-E331 CarbonylContact C-O 3.45Å; K300-E331 VanDerWaalsContact CA-O 3.31Å; K300-E331 WeakPolarHBondContact CA-O 3.18Å; K300-E331 HydrophobicContact CB-CB 4.46Å; K300-E331 HydrophobicContact CG-CG 4.38Å; K300-V333 HydrophobicContact CD-CG2 4.47Å; K300-V333 VanDerWaalsContact CE-CG2 3.48Å; K300-V333 HydrophobicContact CG-CG2 4.19Å; K300-E357 IonicContact NZ-OE2 2.76Å; K300-E357 PolarHBondContact NZ-OE2 3.39Å; K300-N359 WeakPolarHBondContact CB-OD1 3.4Å; K300-N359 PolarHBondContact N-OD1 3.39Å; K300-N359 WeakPolarHBondContact O-CA 3.07Å; K300-N359 WeakPolarHBondContact O-CB 3.36Å; K300-N359 PolarHBondContact O-N 3.4Å; K300-F360 PolarHBondContact O-N 3Å
301	V	95.9	Very high	77.1	Confident	0 Å²	0	63 Å²	63	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	120	-173.4	-177.8	0	0	0	0	109.8	L324 C330 E331 V332 V333 F360 I362 L468	V301-L324 HydrophobicContact CG1-CD1 4.32Å; V301-C330 HydrophobicContact CG2-CB 3.78Å; V301-E331 PolarHBondContact N-O 3.08Å; V301-V332 WeakPolarHBondContact O-CA 3.12Å; V301-V333 PolarHBondContact O-N 2.96Å; V301-F360 CarbonylContact C-O 3.52Å; V301-F360 VanDerWaalsContact CA-O 3.32Å; V301-F360 WeakPolarHBondContact CA-O 3.46Å; V301-F360 HydrophobicContact CG2-CB 4.28Å; V301-I362 HydrophobicContact CG1-CB 4.5Å; V301-I362 HydrophobicContact CG1-CD1 3.58Å; V301-I362 HydrophobicContact CG1-CG1 3.88Å; V301-L468 HydrophobicContact CG2-CD2 3.74Å
302	F	97.1	Very high	79.7	Confident	7 Å²	7	61.3 Å²	61.3	3%	0.031	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	129.9	171.7	173.9	-123.5	0	0	0	110.8	C304 V333 W350 L351 Q354 L355 A358 F360 I361 I362	F302-C304 HydrophobicContact CE1-CB 4.2Å; F302-V333 HydrophobicContact CD2-CB 4.28Å; F302-V333 HydrophobicContact CD2-CG1 4.16Å; F302-W350 HydrophobicContact CD2-CH2 4.49Å; F302-W350 AromaticContact CE2-CH2 3.71Å; F302-W350 HydrophobicContact CE2-CH2 3.71Å; F302-W350 AromaticContact CE2-CZ3 3.93Å; F302-W350 HydrophobicContact CE2-CZ3 3.93Å; F302-W350 HydrophobicContact CZ-CZ3 4.3Å; F302-L351 HydrophobicContact CE1-CD1 4.01Å; F302-L351 HydrophobicContact CZ-CD1 3.87Å; F302-Q354 HydrophobicContact CD1-CB 4.49Å; F302-Q354 HydrophobicContact CD2-CB 3.98Å; F302-Q354 HydrophobicContact CD2-CG 4.41Å; F302-Q354 HydrophobicContact CE2-CB 4.27Å; F302-Q354 HydrophobicContact CG-CB 4.11Å; F302-L355 HydrophobicContact CD1-CD2 4.04Å; F302-L355 HydrophobicContact CE1-CD2 3.99Å; F302-A358 HydrophobicContact CB-CB 3.71Å; F302-F360 PolarHBondContact N-O 3.06Å; F302-I361 HydrophobicContact CB-CG1 4.44Å; F302-I361 HydrophobicContact CD1-CG1 4.41Å; F302-I361 HydrophobicContact CD1-CG2 4.13Å; F302-I362 PolarHBondContact O-N 3.19Å
303	I	97.8	Very high	82.7	Confident	3 Å²	3	56.5 Å²	56.5	2%	0.015	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	116.5	178.4	-58	176.2	0	0	0	110.2	Y305 I317 F320 A321 L324 V332 V333 L334 I362 V364	I303-Y305 HydrophobicContact CG2-CD1 4.39Å; I303-I317 HydrophobicContact CG2-CG2 4.18Å; I303-F320 HydrophobicContact CD1-CD1 4.41Å; I303-A321 HydrophobicContact CD1-CB 3.64Å; I303-L324 HydrophobicContact CD1-CD1 4.06Å; I303-V332 HydrophobicContact CD1-CG1 3.52Å; I303-V332 HydrophobicContact CG1-CG1 4.06Å; I303-V333 PolarHBondContact N-O 3.3Å; I303-V333 VanDerWaalsContact N-O 3.12Å; I303-L334 HydrophobicContact CB-CD1 4.19Å; I303-L334 HydrophobicContact CG2-CD1 4.31Å; I303-I362 WeakPolarHBondContact CA-O 3.43Å; I303-V364 HydrophobicContact CG2-CG2 4.03Å
304	C	96.9	Very high	85.3	Confident	4 Å²	4	48.7 Å²	48.7	3%	0.027	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	127.8	171.1	179	0	0	0	0	109.7	F302 I362 T363 V364 I411	F302-C304 HydrophobicContact CE1-CB 4.2Å; C304-I362 PolarHBondContact N-O 3.19Å; C304-T363 HydrophobicContact CB-CG2 4.35Å; C304-T363 CarbonylContact O-C 3.57Å; C304-T363 VanDerWaalsContact O-CA 3.29Å; C304-T363 WeakPolarHBondContact O-CA 3.41Å; C304-V364 PolarHBondContact O-N 2.91Å; C304-I411 HydrophobicContact CB-CD1 4.09Å
305	Y	96.8	Very high	87.7	Confident	8 Å²	8	46.9 Å²	46.9	3%	0.031	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	167.7	-178.9	72.2	-79.9	0	0	0	111	I303 N307 I317 L334 D335 L336 F404	I303-Y305 HydrophobicContact CG2-CD1 4.39Å; Y305-N307 HydrophobicContact CE2-CB 4.13Å; Y305-I317 HydrophobicContact CD1-CG2 3.73Å; Y305-I317 HydrophobicContact CD2-CB 4.44Å; Y305-I317 HydrophobicContact CD2-CD1 4.42Å; Y305-I317 HydrophobicContact CD2-CG1 3.75Å; Y305-I317 HydrophobicContact CD2-CG2 4.24Å; Y305-I317 HydrophobicContact CE1-CG2 3.98Å; Y305-I317 HydrophobicContact CE2-CG1 4.35Å; Y305-I317 HydrophobicContact CE2-CG2 4.48Å; Y305-I317 HydrophobicContact CG-CB 4.47Å; Y305-I317 HydrophobicContact CG-CD1 4.21Å; Y305-I317 HydrophobicContact CG-CG1 3.91Å; Y305-I317 HydrophobicContact CG-CG2 3.87Å; Y305-L334 HydrophobicContact CD1-CD1 4.1Å; Y305-L334 HydrophobicContact CE1-CD1 3.65Å; Y305-D335 WeakPolarHBondContact CE1-OD1 3.34Å; Y305-D335 PolarHBondContact OH-OD1 3.45Å; Y305-D335 VanDerWaalsContact OH-OD1 3.08Å; Y305-L336 WeakPolarHBondContact OH-CD1 3.23Å; Y305-L336 WeakPolarHBondContact OH-CD2 3.43Å; Y305-L336 WeakPolarHBondContact OH-CG 3.33Å; Y305-F404 WeakPolarHBondContact O-CB 3.26Å
306	S	94.3	Very high	90	Very high	0 Å²	0	42 Å²	42	0%	0	21%	0.207	C	C	.	.			trans	-86.4	118.6	174.8	154.8	0	0	0	0	110.8	R308 D309	S306-R308 PolarHBondContact O-N 3.41Å; S306-R308 PolarHBondContact OG-N 3.01Å; S306-D309 WeakPolarHBondContact CB-OD2 3.19Å; S306-D309 PolarHBondContact OG-OD2 3.29Å
307	N	90.1	Very high	92.6	Very high	66 Å²	66	31 Å²	31	35%	0.353	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.2	6.9	171	72.8	-19.9	0	0	0	113.1	Y305 F404	Y305-N307 HydrophobicContact CE2-CB 4.13Å; N307-F404 WeakPolarHBondContact OD1-CD1 3.5Å; N307-F404 VanDerWaalsContact OD1-CE1 3.3Å; N307-F404 WeakPolarHBondContact OD1-CE1 3.42Å
308	R	89.3	Confident	94	Very high	63 Å²	63	30.4 Å²	30.4	24%	0.238	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.1	20.8	179.9	-60.8	-72.8	-166.1	156.4	2.1	112.4	S306 Y372 D402 F404 Q520	S306-R308 PolarHBondContact O-N 3.41Å; S306-R308 PolarHBondContact OG-N 3.01Å; R308-Y372 HydrophobicContact CB-CD2 3.69Å; R308-Y372 HydrophobicContact CB-CE2 3.25Å; R308-Y372 HydrophobicContact CG-CD2 4.2Å; R308-Y372 HydrophobicContact CG-CE2 3.95Å; R308-D402 IonicContact CZ-OD1 2.78Å; R308-D402 IonicContact NE-OD1 3.22Å; R308-D402 PolarHBondContact NE-OD1 2.87Å; R308-D402 IonicContact NH2-OD1 3.54Å; R308-D402 PolarHBondContact NH2-OD1 3.05Å; R308-D402 IonicContact NH2-OD2 3.15Å; R308-F404 HydrophobicContact CB-CE1 4.36Å; R308-F404 HydrophobicContact CB-CZ 4.36Å; R308-F404 HydrophobicContact CG-CE1 3.67Å; R308-F404 HydrophobicContact CG-CZ 4Å; R308-Q520 PolarHBondContact O-OE1 3.27Å
309	D	89.3	Confident	94.7	Very high	9 Å²	9	26.3 Å²	26.3	5%	0.048	14%	0.141	C	C	.	.	S	Bend	trans	-92.3	-163.4	163.2	-70	-72.8	0	0	0	109.2	S306 H313 S366 G368 W516 Q520	S306-D309 WeakPolarHBondContact CB-OD2 3.19Å; S306-D309 PolarHBondContact OG-OD2 3.29Å; D309-H313 HydrophobicContact CB-CB 3.76Å; D309-H313 IonicContact OD2-CD2 2.77Å; D309-H313 IonicContact OD2-NE2 3.39Å; D309-S366 WeakPolarHBondContact OD2-CB 3.27Å; D309-S366 PolarHBondContact OD2-OG 3.3Å; D309-G368 WeakPolarHBondContact OD1-CA 3.48Å; D309-G368 PolarHBondContact OD1-N 3.33Å; D309-W516 HydrophobicContact CB-CZ3 4.42Å; D309-Q520 PolarHBondContact O-NE2 3.15Å
310	C	90.3	Very high	95.1	Very high	10 Å²	10	25.9 Å²	25.9	7%	0.068	14%	0.139	C	C	.	.			trans	-85.1	163.5	177.5	69.2	0	0	0	0	112.3	K312 H313 T314 M506 W516	C310-K312 PolarHBondContact O-N 2.96Å; C310-K312 VanDerWaalsContact O-N 3.15Å; C310-H313 WeakPolarHBondContact O-CB 3.38Å; C310-H313 PolarHBondContact O-N 3.09Å; C310-T314 PolarHBondContact O-N 3.36Å; C310-M506 VanDerWaalsContact SG-CE 3.58Å; C310-W516 HydrophobicContact CB-CE3 4.3Å; C310-W516 HydrophobicContact CB-CZ3 4.49Å
311	S	93.2	Very high	95.3	Very high	88 Å²	88	24.5 Å²	24.5	62%	0.615	13%	0.133	S	C	*	.	H	α-helix	trans	-57.9	-30.5	179	56.7	0	0	0	0	113.4	H313 T314 S315	S311-H313 VanDerWaalsContact C-N 3.34Å; S311-T314 WeakPolarHBondContact O-CB 3.4Å; S311-T314 PolarHBondContact O-N 2.91Å; S311-S315 PolarHBondContact O-N 2.86Å; S311-S315 PolarHBondContact O-OG 3.45Å
312	K	95.4	Very high	95.3	Very high	84 Å²	84	30 Å²	30	37%	0.365	15%	0.154	S	C	.	.	H	α-helix	trans	-65.8	-35.2	175	-59.1	-59.5	-175.5	-178.5	0	112.3	C310 S315 V316 M506 H509	C310-K312 PolarHBondContact O-N 2.96Å; C310-K312 VanDerWaalsContact O-N 3.15Å; K312-S315 PolarHBondContact O-N 3.32Å; K312-V316 WeakPolarHBondContact O-CG2 3.45Å; K312-V316 PolarHBondContact O-N 2.82Å; K312-M506 HydrophobicContact CB-CB 4.48Å; K312-M506 HydrophobicContact CB-SD 3.67Å; K312-H509 HydrophobicContact CG-CB 4.01Å
313	H	96.1	Very high	95.2	Very high	1 Å²	1	29.6 Å²	29.6	1%	0.005	15%	0.152	C	C	.	.	H	α-helix	trans	-63.9	-46.8	171.6	-179.8	65	0	0	0	110.7	D309 C310 S311 S315 V316 I317 Y439 M506	D309-H313 HydrophobicContact CB-CB 3.76Å; D309-H313 IonicContact OD2-CD2 2.77Å; D309-H313 IonicContact OD2-NE2 3.39Å; C310-H313 WeakPolarHBondContact O-CB 3.38Å; C310-H313 PolarHBondContact O-N 3.09Å; S311-H313 VanDerWaalsContact C-N 3.34Å; H313-S315 VanDerWaalsContact C-N 3.27Å; H313-S315 PolarHBondContact O-N 3.42Å; H313-V316 WeakPolarHBondContact O-CA 3.13Å; H313-V316 WeakPolarHBondContact O-CB 3.27Å; H313-V316 PolarHBondContact O-N 2.98Å; H313-I317 WeakPolarHBondContact O-CG1 3.29Å; H313-I317 PolarHBondContact O-N 2.76Å; H313-Y439 PolarHBondContact CE1-OH 3.43Å; H313-Y439 AromaticContact ND1-CE2 3.69Å; H313-Y439 AromaticContact ND1-CZ 3.71Å; H313-Y439 PolarHBondContact ND1-OH 2.86Å; H313-M506 HydrophobicContact CB-CE 4.36Å; H313-M506 HydrophobicContact CB-SD 4.35Å
314	T	95.6	Very high	95.1	Very high	31 Å²	31	29.5 Å²	29.5	19%	0.19	15%	0.152	C	C	.	.	H	α-helix	trans	-57.2	-39.5	176.4	-50.3	0	0	0	0	112.4	C310 S311 V316 I317 Q318 L336	C310-T314 PolarHBondContact O-N 3.36Å; S311-T314 WeakPolarHBondContact O-CB 3.4Å; S311-T314 PolarHBondContact O-N 2.91Å; T314-V316 VanDerWaalsContact C-N 3.33Å; T314-V316 PolarHBondContact O-N 3.29Å; T314-I317 WeakPolarHBondContact O-CB 3.47Å; T314-I317 PolarHBondContact O-N 3.34Å; T314-Q318 PolarHBondContact O-N 3.16Å; T314-L336 HydrophobicContact CG2-CD1 3.66Å
315	S	97.1	Very high	94.8	Very high	48 Å²	48	32.1 Å²	32.1	34%	0.336	16%	0.164	S	C	.	.	H	α-helix	trans	-62.4	-37.4	173.5	-57.9	0	0	0	0	112.9	S311 K312 H313 Q318 S319	S311-S315 PolarHBondContact O-N 2.86Å; S311-S315 PolarHBondContact O-OG 3.45Å; K312-S315 PolarHBondContact O-N 3.32Å; H313-S315 VanDerWaalsContact C-N 3.27Å; H313-S315 PolarHBondContact O-N 3.42Å; S315-Q318 PolarHBondContact O-N 2.79Å; S315-S319 PolarHBondContact O-N 3.38Å; S315-S319 PolarHBondContact O-OG 3.05Å
316	V	98.1	Very high	94.4	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-62.8	-43	172.9	176.1	0	0	0	0	110.8	K312 H313 T314 Q318 S319 F320 F437 Y439 L499 S502 I503 M506	K312-V316 WeakPolarHBondContact O-CG2 3.45Å; K312-V316 PolarHBondContact O-N 2.82Å; H313-V316 WeakPolarHBondContact O-CA 3.13Å; H313-V316 WeakPolarHBondContact O-CB 3.27Å; H313-V316 PolarHBondContact O-N 2.98Å; T314-V316 VanDerWaalsContact C-N 3.33Å; T314-V316 PolarHBondContact O-N 3.29Å; V316-Q318 PolarHBondContact O-N 2.99Å; V316-S319 PolarHBondContact O-N 3.23Å; V316-F320 WeakPolarHBondContact O-CB 3.48Å; V316-F320 PolarHBondContact O-N 3.36Å; V316-F437 HydrophobicContact CG1-CD1 4.33Å; V316-F437 HydrophobicContact CG1-CD2 3.86Å; V316-F437 HydrophobicContact CG1-CE1 4.1Å; V316-F437 HydrophobicContact CG1-CE2 3.6Å; V316-F437 HydrophobicContact CG1-CG 4.22Å; V316-F437 HydrophobicContact CG1-CZ 3.73Å; V316-Y439 HydrophobicContact CG1-CE1 4.15Å; V316-Y439 WeakPolarHBondContact CG1-OH 3.48Å; V316-Y439 HydrophobicContact CG2-CE1 4.08Å; V316-L499 HydrophobicContact CG1-CD1 4.16Å; V316-S502 WeakPolarHBondContact CG2-O 2.8Å; V316-I503 HydrophobicContact CG1-CG1 4.03Å; V316-I503 HydrophobicContact CG2-CG1 4.32Å; V316-M506 HydrophobicContact CG2-CB 4.16Å
317	I	98	Very high	94.1	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-60.3	-46.9	178.1	-57.7	-56.3	0	0	0	111.3	I303 Y305 H313 T314 F320 A321 L334 V364	I303-I317 HydrophobicContact CG2-CG2 4.18Å; Y305-I317 HydrophobicContact CD1-CG2 3.73Å; Y305-I317 HydrophobicContact CD2-CB 4.44Å; Y305-I317 HydrophobicContact CD2-CD1 4.42Å; Y305-I317 HydrophobicContact CD2-CG1 3.75Å; Y305-I317 HydrophobicContact CD2-CG2 4.24Å; Y305-I317 HydrophobicContact CE1-CG2 3.98Å; Y305-I317 HydrophobicContact CE2-CG1 4.35Å; Y305-I317 HydrophobicContact CE2-CG2 4.48Å; Y305-I317 HydrophobicContact CG-CB 4.47Å; Y305-I317 HydrophobicContact CG-CD1 4.21Å; Y305-I317 HydrophobicContact CG-CG1 3.91Å; Y305-I317 HydrophobicContact CG-CG2 3.87Å; H313-I317 WeakPolarHBondContact O-CG1 3.29Å; H313-I317 PolarHBondContact O-N 2.76Å; T314-I317 WeakPolarHBondContact O-CB 3.47Å; T314-I317 PolarHBondContact O-N 3.34Å; I317-F320 PolarHBondContact O-N 3.47Å; I317-A321 WeakPolarHBondContact O-CB 3.22Å; I317-A321 PolarHBondContact O-N 3.08Å; I317-L334 HydrophobicContact CG2-CD1 3.76Å; I317-V364 HydrophobicContact CD1-CB 3.8Å; I317-V364 HydrophobicContact CD1-CG1 3.6Å; I317-V364 HydrophobicContact CD1-CG2 3.9Å
318	Q	97.1	Very high	93.9	Very high	81 Å²	81	34.5 Å²	34.5	38%	0.379	18%	0.175	S	C	.	.	H	α-helix	trans	-63.4	-47	178	-71.5	-179.8	-33.4	0	0	112.3	T314 S315 V316 F320 A321 Y322 L334 L336	T314-Q318 PolarHBondContact O-N 3.16Å; S315-Q318 PolarHBondContact O-N 2.79Å; V316-Q318 PolarHBondContact O-N 2.99Å; Q318-F320 VanDerWaalsContact C-N 3.25Å; Q318-F320 PolarHBondContact O-N 3.24Å; Q318-A321 PolarHBondContact O-N 3.2Å; Q318-Y322 PolarHBondContact O-N 2.91Å; Q318-L334 HydrophobicContact CG-CD2 4.32Å; Q318-L336 HydrophobicContact CG-CD1 3.64Å
319	S	97.6	Very high	93.8	Very high	12 Å²	12	32.3 Å²	32.3	8%	0.084	17%	0.172	C	C	.	.	H	α-helix	trans	-63.2	-33.6	176.4	-65.6	0	0	0	0	112.1	S315 V316 F323 S498 S502	S315-S319 PolarHBondContact O-N 3.38Å; S315-S319 PolarHBondContact O-OG 3.05Å; V316-S319 PolarHBondContact O-N 3.23Å; S319-F323 VanDerWaalsContact O-CB 3.31Å; S319-F323 WeakPolarHBondContact O-CB 3.48Å; S319-F323 PolarHBondContact O-N 3.42Å; S319-S498 PolarHBondContact OG-OG 2.92Å; S319-S502 PolarHBondContact OG-OG 2.91Å
320	F	97.9	Very high	93.9	Very high	0 Å²	0	32 Å²	32	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-70.6	-42.6	176.4	179.6	-118.6	0	0	0	111.9	I303 V316 I317 Q318 Y322 F323 L324 I362 F437 L457 L464 L499	I303-F320 HydrophobicContact CD1-CD1 4.41Å; V316-F320 WeakPolarHBondContact O-CB 3.48Å; V316-F320 PolarHBondContact O-N 3.36Å; I317-F320 PolarHBondContact O-N 3.47Å; Q318-F320 VanDerWaalsContact C-N 3.25Å; Q318-F320 PolarHBondContact O-N 3.24Å; F320-Y322 VanDerWaalsContact C-N 3.32Å; F320-Y322 PolarHBondContact O-N 2.97Å; F320-F323 HydrophobicContact CD2-CD1 4.36Å; F320-F323 HydrophobicContact CE2-CD1 4.49Å; F320-F323 WeakPolarHBondContact O-CB 3.38Å; F320-F323 PolarHBondContact O-N 2.95Å; F320-L324 HydrophobicContact CD1-CD1 4.15Å; F320-L324 HydrophobicContact CE1-CD1 3.64Å; F320-L324 HydrophobicContact CE1-CG 4.29Å; F320-L324 HydrophobicContact CE2-CD1 4.35Å; F320-L324 HydrophobicContact CE2-CD2 4.21Å; F320-L324 HydrophobicContact CE2-CG 4.13Å; F320-L324 HydrophobicContact CZ-CD1 3.76Å; F320-L324 HydrophobicContact CZ-CD2 4.11Å; F320-L324 HydrophobicContact CZ-CG 4.01Å; F320-L324 WeakPolarHBondContact O-CG 3.49Å; F320-L324 PolarHBondContact O-N 2.99Å; F320-I362 HydrophobicContact CE1-CG2 4.21Å; F320-F437 HydrophobicContact CB-CZ 3.98Å; F320-F437 HydrophobicContact CD1-CZ 4.29Å; F320-F437 HydrophobicContact CD2-CE1 4.46Å; F320-F437 AromaticContact CD2-CZ 3.9Å; F320-F437 HydrophobicContact CD2-CZ 3.9Å; F320-F437 HydrophobicContact CE2-CZ 4.48Å; F320-F437 AromaticContact CG-CZ 3.8Å; F320-F437 HydrophobicContact CG-CZ 3.8Å; F320-L457 HydrophobicContact CE1-CD1 4.38Å; F320-L457 HydrophobicContact CE2-CD1 3.68Å; F320-L457 HydrophobicContact CZ-CD1 3.58Å; F320-L464 HydrophobicContact CE2-CD2 4.19Å; F320-L464 HydrophobicContact CZ-CD2 3.92Å; F320-L499 HydrophobicContact CB-CD1 3.89Å; F320-L499 HydrophobicContact CD2-CD2 3.93Å
321	A	97.3	Very high	94.1	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-58.3	-45.6	173.2	0	0	0	0	0	111.2	I303 I317 Q318 F323 L324 Q325 V332 L334 W337	I303-A321 HydrophobicContact CD1-CB 3.64Å; I317-A321 WeakPolarHBondContact O-CB 3.22Å; I317-A321 PolarHBondContact O-N 3.08Å; Q318-A321 PolarHBondContact O-N 3.2Å; A321-F323 VanDerWaalsContact C-N 3.35Å; A321-F323 PolarHBondContact O-N 3.31Å; A321-L324 PolarHBondContact O-N 3.43Å; A321-Q325 PolarHBondContact O-N 3.45Å; A321-V332 HydrophobicContact CB-CG1 3.92Å; A321-L334 HydrophobicContact CB-CD2 3.94Å; A321-W337 HydrophobicContact CB-CH2 3.42Å; A321-W337 VanDerWaalsContact CB-CH2 3.42Å; A321-W337 HydrophobicContact CB-CZ2 3.9Å; A321-W337 HydrophobicContact CB-CZ3 3.89Å
322	Y	96.1	Very high	94.2	Very high	114 Å²	114	32.5 Å²	32.5	45%	0.447	16%	0.162	S	C	.	.	H	α-helix	trans	-63.9	-39.2	176	-172.2	-106.7	0	0	0	112.4	Q318 F320 Q325 D326	Q318-Y322 PolarHBondContact O-N 2.91Å; F320-Y322 VanDerWaalsContact C-N 3.32Å; F320-Y322 PolarHBondContact O-N 2.97Å; Y322-Q325 PolarHBondContact O-N 2.93Å; Y322-D326 HydrophobicContact CE1-CB 4.39Å; Y322-D326 WeakPolarHBondContact O-CB 3.5Å; Y322-D326 PolarHBondContact O-N 3.01Å
323	F	95.5	Very high	94.2	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-61.7	-41.3	173.4	175	-98.6	0	0	0	112.7	S319 F320 A321 F327 C328 M458 L461 Y490 L499	S319-F323 VanDerWaalsContact O-CB 3.31Å; S319-F323 WeakPolarHBondContact O-CB 3.48Å; S319-F323 PolarHBondContact O-N 3.42Å; F320-F323 HydrophobicContact CD2-CD1 4.36Å; F320-F323 HydrophobicContact CE2-CD1 4.49Å; F320-F323 WeakPolarHBondContact O-CB 3.38Å; F320-F323 PolarHBondContact O-N 2.95Å; A321-F323 VanDerWaalsContact C-N 3.35Å; A321-F323 PolarHBondContact O-N 3.31Å; F323-F327 HydrophobicContact CD2-CB 3.71Å; F323-F327 HydrophobicContact CD2-CD1 4.45Å; F323-F327 HydrophobicContact CD2-CG 4.17Å; F323-F327 HydrophobicContact CE1-CD1 4.23Å; F323-F327 HydrophobicContact CE2-CB 3.56Å; F323-F327 AromaticContact CE2-CD1 3.5Å; F323-F327 HydrophobicContact CE2-CD1 3.5Å; F323-F327 VanDerWaalsContact CE2-CD1 3.5Å; F323-F327 HydrophobicContact CE2-CD2 4.26Å; F323-F327 HydrophobicContact CE2-CE1 4.23Å; F323-F327 AromaticContact CE2-CG 3.5Å; F323-F327 HydrophobicContact CE2-CG 3.5Å; F323-F327 HydrophobicContact CG-CB 4.38Å; F323-F327 HydrophobicContact CZ-CB 4.11Å; F323-F327 AromaticContact CZ-CD1 3.35Å; F323-F327 HydrophobicContact CZ-CD1 3.35Å; F323-F327 AromaticContact CZ-CE1 3.96Å; F323-F327 HydrophobicContact CZ-CE1 3.96Å; F323-F327 AromaticContact CZ-CG 3.88Å; F323-F327 HydrophobicContact CZ-CG 3.88Å; F323-F327 WeakPolarHBondContact O-CA 3.4Å; F323-F327 VanDerWaalsContact O-CB 3.27Å; F323-F327 WeakPolarHBondContact O-CB 3.13Å; F323-F327 PolarHBondContact O-N 3.21Å; F323-C328 PolarHBondContact O-N 3.47Å; F323-M458 HydrophobicContact CE1-CE 3.95Å; F323-M458 HydrophobicContact CZ-CE 4.06Å; F323-L461 HydrophobicContact CE1-CD1 3.73Å; F323-L461 HydrophobicContact CE1-CD2 4.41Å; F323-L461 HydrophobicContact CZ-CD1 4.11Å; F323-L461 HydrophobicContact CZ-CD2 3.97Å; F323-Y490 HydrophobicContact CE2-CD2 4.31Å; F323-L499 HydrophobicContact CB-CB 4.5Å; F323-L499 HydrophobicContact CB-CD2 4.03Å; F323-L499 HydrophobicContact CD1-CD2 3.95Å; F323-L499 HydrophobicContact CD2-CD2 4.46Å; F323-L499 HydrophobicContact CG-CD2 3.88Å
324	L	94.6	Very high	94.2	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-64.9	-37.9	175.2	-71.7	176.2	0	0	0	112.4	V301 I303 F320 A321 C328 G329 C330 V332 I362 L464 L468	V301-L324 HydrophobicContact CG1-CD1 4.32Å; I303-L324 HydrophobicContact CD1-CD1 4.06Å; F320-L324 HydrophobicContact CD1-CD1 4.15Å; F320-L324 HydrophobicContact CE1-CD1 3.64Å; F320-L324 HydrophobicContact CE1-CG 4.29Å; F320-L324 HydrophobicContact CE2-CD1 4.35Å; F320-L324 HydrophobicContact CE2-CD2 4.21Å; F320-L324 HydrophobicContact CE2-CG 4.13Å; F320-L324 HydrophobicContact CZ-CD1 3.76Å; F320-L324 HydrophobicContact CZ-CD2 4.11Å; F320-L324 HydrophobicContact CZ-CG 4.01Å; F320-L324 WeakPolarHBondContact O-CG 3.49Å; F320-L324 PolarHBondContact O-N 2.99Å; A321-L324 PolarHBondContact O-N 3.43Å; L324-C328 HydrophobicContact CD2-CB 4.07Å; L324-C328 CarbonylContact O-C 3.6Å; L324-C328 WeakPolarHBondContact O-CA 3.09Å; L324-C328 VanDerWaalsContact O-CB 3.32Å; L324-C328 WeakPolarHBondContact O-CB 3.33Å; L324-C328 PolarHBondContact O-N 3.11Å; L324-G329 PolarHBondContact O-N 3.4Å; L324-G329 VanDerWaalsContact O-N 3.13Å; L324-C330 WeakPolarHBondContact O-CB 3.22Å; L324-C330 PolarHBondContact O-N 3.21Å; L324-V332 HydrophobicContact CB-CG2 3.62Å; L324-I362 HydrophobicContact CD1-CD1 3.92Å; L324-L464 HydrophobicContact CD2-CD2 4.32Å; L324-L468 HydrophobicContact CD2-CD1 3.89Å
325	Q	91.7	Very high	94	Very high	60 Å²	60	29 Å²	29	28%	0.28	15%	0.147	S	C	.	.	H	α-helix	trans	-68.8	-50.1	176.6	-71.5	-176.1	-26.9	0	0	113	A321 Y322 C330 V332 W337	A321-Q325 PolarHBondContact O-N 3.45Å; Y322-Q325 PolarHBondContact O-N 2.93Å; Q325-C330 WeakPolarHBondContact CA-O 3.21Å; Q325-V332 HydrophobicContact CB-CG2 4.46Å; Q325-V332 HydrophobicContact CG-CB 3.61Å; Q325-V332 HydrophobicContact CG-CG2 3.47Å; Q325-V332 VanDerWaalsContact CG-CG2 3.47Å; Q325-W337 VanDerWaalsContact CD-CZ3 3.42Å; Q325-W337 HydrophobicContact CG-CZ3 4.33Å
326	D	88.1	Confident	93.6	Very high	70 Å²	70	30.1 Å²	30.1	37%	0.374	15%	0.149	S	C	.	.	H	α-helix	trans	-81.3	-50.3	-171.4	-178.7	60.2	0	0	0	112	Y322 S495	Y322-D326 HydrophobicContact CE1-CB 4.39Å; Y322-D326 WeakPolarHBondContact O-CB 3.5Å; Y322-D326 PolarHBondContact O-N 3.01Å; D326-S495 WeakPolarHBondContact OD2-CB 3.42Å; D326-S495 PolarHBondContact OD2-OG 3.12Å
327	F	87.2	Confident	93.3	Very high	51 Å²	51	34.7 Å²	34.7	22%	0.224	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.4	-41.1	-174.7	-170.7	-95.2	0	0	0	112.9	F323 V483 I485	F323-F327 HydrophobicContact CD2-CB 3.71Å; F323-F327 HydrophobicContact CD2-CD1 4.45Å; F323-F327 HydrophobicContact CD2-CG 4.17Å; F323-F327 HydrophobicContact CE1-CD1 4.23Å; F323-F327 HydrophobicContact CE2-CB 3.56Å; F323-F327 AromaticContact CE2-CD1 3.5Å; F323-F327 HydrophobicContact CE2-CD1 3.5Å; F323-F327 VanDerWaalsContact CE2-CD1 3.5Å; F323-F327 HydrophobicContact CE2-CD2 4.26Å; F323-F327 HydrophobicContact CE2-CE1 4.23Å; F323-F327 AromaticContact CE2-CG 3.5Å; F323-F327 HydrophobicContact CE2-CG 3.5Å; F323-F327 HydrophobicContact CG-CB 4.38Å; F323-F327 HydrophobicContact CZ-CB 4.11Å; F323-F327 AromaticContact CZ-CD1 3.35Å; F323-F327 HydrophobicContact CZ-CD1 3.35Å; F323-F327 AromaticContact CZ-CE1 3.96Å; F323-F327 HydrophobicContact CZ-CE1 3.96Å; F323-F327 AromaticContact CZ-CG 3.88Å; F323-F327 HydrophobicContact CZ-CG 3.88Å; F323-F327 WeakPolarHBondContact O-CA 3.4Å; F323-F327 VanDerWaalsContact O-CB 3.27Å; F323-F327 WeakPolarHBondContact O-CB 3.13Å; F323-F327 PolarHBondContact O-N 3.21Å; F327-V483 HydrophobicContact CZ-CG1 4.45Å; F327-I485 HydrophobicContact CE1-CD1 3.79Å; F327-I485 HydrophobicContact CE1-CG1 3.79Å; F327-I485 HydrophobicContact CE1-CG2 4.2Å; F327-I485 HydrophobicContact CZ-CD1 4.27Å; F327-I485 HydrophobicContact CZ-CG1 3.87Å
328	C	87.3	Confident	92.7	Very high	2 Å²	2	37.4 Å²	37.4	1%	0.014	18%	0.179	C	C	.	.	S	Bend	trans	-88.6	-4.1	179.7	-54.7	0	0	0	0	113.7	F323 L324 C330 Y465 L468 H469	F323-C328 PolarHBondContact O-N 3.47Å; L324-C328 HydrophobicContact CD2-CB 4.07Å; L324-C328 CarbonylContact O-C 3.6Å; L324-C328 WeakPolarHBondContact O-CA 3.09Å; L324-C328 VanDerWaalsContact O-CB 3.32Å; L324-C328 WeakPolarHBondContact O-CB 3.33Å; L324-C328 PolarHBondContact O-N 3.11Å; C328-C330 PolarHBondContact O-N 3.41Å; C328-C330 PolarHBondContact O-SG 3.05Å; C328-Y465 HydrophobicContact CB-CD2 4.25Å; C328-Y465 HydrophobicContact CB-CE2 4.47Å; C328-L468 HydrophobicContact CB-CD1 4.35Å; C328-H469 PolarHBondContact O-CE1 2.9Å; C328-H469 VanDerWaalsContact O-CE1 3.24Å; C328-H469 PolarHBondContact O-NE2 2.94Å
329	G	87	Confident	91.8	Very high	18 Å²	18	39 Å²	39	19%	0.186	19%	0.186	C	C	.	.			trans	63.8	26.6	176.4	0	0	0	0	0	114.3	R298 L324	R298-G329 WeakPolarHBondContact CB-O 3.46Å; R298-G329 WeakPolarHBondContact CD-O 3.38Å; R298-G329 VanDerWaalsContact CG-O 3.29Å; R298-G329 WeakPolarHBondContact CG-O 3.39Å; L324-G329 PolarHBondContact O-N 3.4Å; L324-G329 VanDerWaalsContact O-N 3.13Å
330	C	91.5	Very high	90.9	Very high	2 Å²	2	44.7 Å²	44.7	1%	0.014	22%	0.215	C	C	.	.			trans	-89.6	153.4	-179.1	-58.4	0	0	0	0	111.7	P299 V301 L324 Q325 C328 V332	P299-C330 HydrophobicContact CG-CB 4.44Å; P299-C330 WeakPolarHBondContact O-CA 3.3Å; V301-C330 HydrophobicContact CG2-CB 3.78Å; L324-C330 WeakPolarHBondContact O-CB 3.22Å; L324-C330 PolarHBondContact O-N 3.21Å; Q325-C330 WeakPolarHBondContact CA-O 3.21Å; C328-C330 PolarHBondContact O-N 3.41Å; C328-C330 PolarHBondContact O-SG 3.05Å; C330-V332 HydrophobicContact CB-CG2 3.99Å
331	E	93.7	Very high	90	Very high	101 Å²	101	48.5 Å²	48.5	47%	0.472	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	122.6	158.3	-179.5	-173.6	143.8	0	0	107	P299 K300 V301	P299-E331 PolarHBondContact O-N 3.48Å; K300-E331 CarbonylContact C-O 3.45Å; K300-E331 VanDerWaalsContact CA-O 3.31Å; K300-E331 WeakPolarHBondContact CA-O 3.18Å; K300-E331 HydrophobicContact CB-CB 4.46Å; K300-E331 HydrophobicContact CG-CG 4.38Å; V301-E331 PolarHBondContact N-O 3.08Å
332	V	95.9	Very high	89.3	Confident	7 Å²	7	49.2 Å²	49.2	4%	0.042	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	126.5	-172.2	179.3	0	0	0	0	110.1	V301 I303 A321 L324 Q325 C330 W337	V301-V332 WeakPolarHBondContact O-CA 3.12Å; I303-V332 HydrophobicContact CD1-CG1 3.52Å; I303-V332 HydrophobicContact CG1-CG1 4.06Å; A321-V332 HydrophobicContact CB-CG1 3.92Å; L324-V332 HydrophobicContact CB-CG2 3.62Å; Q325-V332 HydrophobicContact CB-CG2 4.46Å; Q325-V332 HydrophobicContact CG-CB 3.61Å; Q325-V332 HydrophobicContact CG-CG2 3.47Å; Q325-V332 VanDerWaalsContact CG-CG2 3.47Å; C330-V332 HydrophobicContact CB-CG2 3.99Å; V332-W337 HydrophobicContact CB-CZ3 4.25Å; V332-W337 HydrophobicContact CG1-CZ3 4.18Å
333	V	95.6	Very high	88.4	Confident	7 Å²	7	48 Å²	48	4%	0.042	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	120.3	173.8	-176.1	0	0	0	0	109.2	K300 V301 F302 I303 E338 W350 Q354	K300-V333 HydrophobicContact CD-CG2 4.47Å; K300-V333 VanDerWaalsContact CE-CG2 3.48Å; K300-V333 HydrophobicContact CG-CG2 4.19Å; V301-V333 PolarHBondContact O-N 2.96Å; F302-V333 HydrophobicContact CD2-CB 4.28Å; F302-V333 HydrophobicContact CD2-CG1 4.16Å; I303-V333 PolarHBondContact N-O 3.3Å; I303-V333 VanDerWaalsContact N-O 3.12Å; V333-E338 HydrophobicContact CG1-CG 4.37Å; V333-W350 HydrophobicContact CG1-CH2 4.28Å; V333-W350 HydrophobicContact CG1-CZ2 3.72Å; V333-Q354 HydrophobicContact CG1-CG 3.91Å
334	L	95.2	Very high	87.8	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	28%	0.281	C	S	.	.			trans	-133.5	131.1	178.5	-178.2	67.9	0	0	0	108.6	I303 Y305 I317 Q318 A321 L336 W337 E338	I303-L334 HydrophobicContact CB-CD1 4.19Å; I303-L334 HydrophobicContact CG2-CD1 4.31Å; Y305-L334 HydrophobicContact CD1-CD1 4.1Å; Y305-L334 HydrophobicContact CE1-CD1 3.65Å; I317-L334 HydrophobicContact CG2-CD1 3.76Å; Q318-L334 HydrophobicContact CG-CD2 4.32Å; A321-L334 HydrophobicContact CB-CD2 3.94Å; L334-L336 HydrophobicContact CD2-CB 4.07Å; L334-L336 HydrophobicContact CD2-CD1 4.25Å; L334-L336 HydrophobicContact CD2-CG 4.44Å; L334-L336 HydrophobicContact CG-CB 4.13Å; L334-L336 HydrophobicContact CG-CG 4.41Å; L334-L336 PolarHBondContact O-N 2.91Å; L334-W337 HydrophobicContact CB-CD2 4.03Å; L334-W337 HydrophobicContact CB-CE3 3.92Å; L334-W337 HydrophobicContact CB-CG 4.29Å; L334-W337 HydrophobicContact CB-CZ3 4.49Å; L334-W337 HydrophobicContact CD2-CD2 4.01Å; L334-W337 HydrophobicContact CD2-CE3 4.49Å; L334-W337 HydrophobicContact CD2-CG 4.32Å; L334-W337 HydrophobicContact CD2-CZ2 4.26Å; L334-W337 PolarHBondContact O-N 2.94Å; L334-E338 PolarHBondContact O-N 3.15Å
335	D	91.3	Very high	87.5	Confident	37 Å²	37	60.1 Å²	60.1	20%	0.198	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-36.6	-179.3	63.1	-13	0	0	0	113.2	Y305 W337 E338 H339 M342 W350	Y305-D335 WeakPolarHBondContact CE1-OD1 3.34Å; Y305-D335 PolarHBondContact OH-OD1 3.45Å; Y305-D335 VanDerWaalsContact OH-OD1 3.08Å; D335-W337 PolarHBondContact O-N 2.66Å; D335-E338 PolarHBondContact O-N 3.21Å; D335-E338 VanDerWaalsContact O-N 3.17Å; D335-H339 PolarHBondContact O-N 3.24Å; D335-M342 HydrophobicContact CB-CE 4.43Å; D335-M342 HydrophobicContact CB-SD 3.79Å; D335-W350 HydrophobicContact CB-CH2 3.9Å; D335-W350 HydrophobicContact CB-CZ3 4.34Å
336	L	89.4	Confident	87.2	Confident	71 Å²	71	58.7 Å²	58.7	37%	0.372	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-21.4	175.9	-59.8	178	0	0	0	113.7	Y305 T314 Q318 L334	Y305-L336 WeakPolarHBondContact OH-CD1 3.23Å; Y305-L336 WeakPolarHBondContact OH-CD2 3.43Å; Y305-L336 WeakPolarHBondContact OH-CG 3.33Å; T314-L336 HydrophobicContact CG2-CD1 3.66Å; Q318-L336 HydrophobicContact CG-CD1 3.64Å; L334-L336 HydrophobicContact CD2-CB 4.07Å; L334-L336 HydrophobicContact CD2-CD1 4.25Å; L334-L336 HydrophobicContact CD2-CG 4.44Å; L334-L336 HydrophobicContact CG-CB 4.13Å; L334-L336 HydrophobicContact CG-CG 4.41Å; L334-L336 PolarHBondContact O-N 2.91Å
337	W	91.3	Very high	87.1	Confident	95 Å²	95	58 Å²	58	36%	0.36	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.3	-18.4	178.9	-62	-16.3	0	0	0	112.6	A321 Q325 V332 L334 D335	A321-W337 HydrophobicContact CB-CH2 3.42Å; A321-W337 VanDerWaalsContact CB-CH2 3.42Å; A321-W337 HydrophobicContact CB-CZ2 3.9Å; A321-W337 HydrophobicContact CB-CZ3 3.89Å; Q325-W337 VanDerWaalsContact CD-CZ3 3.42Å; Q325-W337 HydrophobicContact CG-CZ3 4.33Å; V332-W337 HydrophobicContact CB-CZ3 4.25Å; V332-W337 HydrophobicContact CG1-CZ3 4.18Å; L334-W337 HydrophobicContact CB-CD2 4.03Å; L334-W337 HydrophobicContact CB-CE3 3.92Å; L334-W337 HydrophobicContact CB-CG 4.29Å; L334-W337 HydrophobicContact CB-CZ3 4.49Å; L334-W337 HydrophobicContact CD2-CD2 4.01Å; L334-W337 HydrophobicContact CD2-CE3 4.49Å; L334-W337 HydrophobicContact CD2-CG 4.32Å; L334-W337 HydrophobicContact CD2-CZ2 4.26Å; L334-W337 PolarHBondContact O-N 2.94Å; D335-W337 PolarHBondContact O-N 2.66Å
338	E	85.4	Confident	87.3	Confident	58 Å²	58	60.4 Å²	60.4	27%	0.271	31%	0.306	S	S	.	.			trans	-114.5	22	-171	-63.7	-62.6	165.7	0	0	113.7	V333 L334 D335 L340 E341 M342 W350	V333-E338 HydrophobicContact CG1-CG 4.37Å; L334-E338 PolarHBondContact O-N 3.15Å; D335-E338 PolarHBondContact O-N 3.21Å; D335-E338 VanDerWaalsContact O-N 3.17Å; E338-L340 PolarHBondContact O-N 3.47Å; E338-L340 VanDerWaalsContact O-N 3.15Å; E338-E341 PolarHBondContact O-N 3.15Å; E338-E341 WeakPolarHBondContact OE2-CG 3.28Å; E338-M342 WeakPolarHBondContact O-CG 3.49Å; E338-M342 PolarHBondContact O-N 3.37Å; E338-W350 HydrophobicContact CB-CZ2 3.9Å; E338-W350 HydrophobicContact CG-CZ2 4.28Å
339	H	78.6	Confident	87.4	Confident	113 Å²	113	63.6 Å²	63.6	52%	0.523	33%	0.329	S	S	.	.	H	α-helix	trans	-55	-38.4	-175	-175.8	-83.8	0	0	0	113.2	D335 M342 C343	D335-H339 PolarHBondContact O-N 3.24Å; H339-M342 PolarHBondContact O-N 3.41Å; H339-C343 PolarHBondContact CE1-SG 3.09Å; H339-C343 PolarHBondContact O-N 2.98Å; H339-C343 VanDerWaalsContact O-N 3.08Å; H339-C343 PolarHBondContact O-SG 2.93Å
340	L	78.2	Confident	87.7	Confident	133 Å²	133	62.9 Å²	62.9	70%	0.696	32%	0.32	S	S	*	.	H	α-helix	trans	-67.4	-38.1	178.7	-68	174.9	0	0	0	112.5	E338 C343 K344	E338-L340 PolarHBondContact O-N 3.47Å; E338-L340 VanDerWaalsContact O-N 3.15Å; L340-C343 PolarHBondContact O-N 3.45Å; L340-K344 WeakPolarHBondContact O-CG 3.2Å; L340-K344 PolarHBondContact O-N 3.08Å
341	E	79.3	Confident	87.8	Confident	80 Å²	80	62.8 Å²	62.8	37%	0.374	32%	0.32	S	S	.	.	H	α-helix	trans	-67.5	-44.4	175.8	-64.5	-160.8	158.6	0	0	111	E338 C343 K344 E345 R353	E338-E341 PolarHBondContact O-N 3.15Å; E338-E341 WeakPolarHBondContact OE2-CG 3.28Å; E341-C343 PolarHBondContact O-N 3.34Å; E341-K344 PolarHBondContact O-N 2.91Å; E341-E345 PolarHBondContact O-N 2.84Å; E341-R353 IonicContact OE2-NH2 2.67Å; E341-R353 PolarHBondContact OE2-NH2 3.26Å
342	M	82.6	Confident	87.8	Confident	15 Å²	15	60.3 Å²	60.3	7%	0.074	31%	0.313	C	S	.	.	H	α-helix	trans	-57.8	-36.8	176.7	-68.4	178.7	66	0	0	112.5	D335 E338 H339 G346 Q347 W350 L403	D335-M342 HydrophobicContact CB-CE 4.43Å; D335-M342 HydrophobicContact CB-SD 3.79Å; E338-M342 WeakPolarHBondContact O-CG 3.49Å; E338-M342 PolarHBondContact O-N 3.37Å; H339-M342 PolarHBondContact O-N 3.41Å; M342-G346 CarbonylContact O-C 3.6Å; M342-G346 VanDerWaalsContact O-CA 3.28Å; M342-G346 WeakPolarHBondContact O-CA 3.31Å; M342-G346 PolarHBondContact O-N 2.98Å; M342-G346 VanDerWaalsContact O-N 3.14Å; M342-Q347 HydrophobicContact CE-CG 4.06Å; M342-W350 HydrophobicContact CE-CE3 4.28Å; M342-W350 HydrophobicContact CE-CZ3 4.45Å; M342-W350 HydrophobicContact CG-CB 4.25Å; M342-W350 HydrophobicContact CG-CD2 3.53Å; M342-W350 HydrophobicContact CG-CE3 4Å; M342-W350 HydrophobicContact CG-CG 3.61Å; M342-W350 HydrophobicContact CG-CZ2 4.32Å; M342-W350 HydrophobicContact SD-CD2 4.2Å; M342-W350 HydrophobicContact SD-CE3 4.15Å; M342-W350 HydrophobicContact SD-CH2 4.26Å; M342-W350 HydrophobicContact SD-CZ2 4.31Å; M342-W350 HydrophobicContact SD-CZ3 4.18Å; M342-L403 HydrophobicContact CE-CD2 3.43Å; M342-L403 VanDerWaalsContact CE-CD2 3.43Å
343	C	78.2	Confident	87.7	Confident	88 Å²	88	63 Å²	63	60%	0.595	32%	0.323	S	S	*	.	H	α-helix	trans	-70.1	-34.1	174.6	-71.9	0	0	0	0	113	H339 L340 E341	H339-C343 PolarHBondContact CE1-SG 3.09Å; H339-C343 PolarHBondContact O-N 2.98Å; H339-C343 VanDerWaalsContact O-N 3.08Å; H339-C343 PolarHBondContact O-SG 2.93Å; L340-C343 PolarHBondContact O-N 3.45Å; E341-C343 PolarHBondContact O-N 3.34Å
344	K	82.8	Confident	87.6	Confident	181 Å²	181	62.8 Å²	62.8	79%	0.787	32%	0.321	S	S	*	.	H	α-helix	trans	-76.6	-47.3	-176.9	-74.8	173.5	-178	178	0	113.4	L340 E341	L340-K344 WeakPolarHBondContact O-CG 3.2Å; L340-K344 PolarHBondContact O-N 3.08Å; E341-K344 PolarHBondContact O-N 2.91Å
345	E	86.6	Confident	87.5	Confident	73 Å²	73	62.9 Å²	62.9	34%	0.341	32%	0.322	S	S	.	.	H	α-helix	trans	-98.8	-10.7	-175.3	73.5	-175.4	170.4	0	0	114.1	E341 S349 W350 R353	E341-E345 PolarHBondContact O-N 2.84Å; E345-S349 VanDerWaalsContact O-CB 3.24Å; E345-S349 WeakPolarHBondContact O-CB 3.43Å; E345-S349 PolarHBondContact O-OG 2.8Å; E345-W350 HydrophobicContact CG-CB 3.92Å; E345-W350 WeakPolarHBondContact OE1-CA 3.47Å; E345-W350 WeakPolarHBondContact OE1-CB 3.42Å; E345-R353 IonicContact OE1-CZ 3.96Å; E345-R353 VanDerWaalsContact OE1-CZ 3.31Å; E345-R353 IonicContact OE1-NE 2.77Å; E345-R353 PolarHBondContact OE1-NE 3.08Å; E345-R353 VanDerWaalsContact OE1-NE 3.09Å; E345-R353 IonicContact OE1-NH2 3.67Å; E345-R353 PolarHBondContact OE1-NH2 3.44Å; E345-R353 IonicContact OE2-CZ 3.03Å; E345-R353 IonicContact OE2-NE 3.69Å; E345-R353 PolarHBondContact OE2-NE 2.99Å; E345-R353 VanDerWaalsContact OE2-NE 3.12Å; E345-R353 IonicContact OE2-NH2 3.14Å
346	G	86.9	Confident	87.5	Confident	30 Å²	30	65.5 Å²	65.5	31%	0.309	34%	0.336	S	S	.	.			trans	89.7	141.6	-176.9	0	0	0	0	0	113.1	M342 M348 S349 W350	M342-G346 CarbonylContact O-C 3.6Å; M342-G346 VanDerWaalsContact O-CA 3.28Å; M342-G346 WeakPolarHBondContact O-CA 3.31Å; M342-G346 PolarHBondContact O-N 2.98Å; M342-G346 VanDerWaalsContact O-N 3.14Å; G346-M348 VanDerWaalsContact C-N 3.31Å; G346-M348 PolarHBondContact O-N 3.46Å; G346-S349 PolarHBondContact O-N 2.8Å; G346-W350 PolarHBondContact O-N 2.87Å
347	Q	86.1	Confident	87.6	Confident	56 Å²	56	66.6 Å²	66.6	26%	0.262	34%	0.339	S	S	.	.	H	α-helix	trans	-56.8	-37.9	-171.6	-64.5	-175.2	-26.4	0	0	114.3	M342 L351 H400 L403	M342-Q347 HydrophobicContact CE-CG 4.06Å; Q347-L351 VanDerWaalsContact O-CB 3.32Å; Q347-L351 WeakPolarHBondContact O-CB 3.15Å; Q347-L351 PolarHBondContact O-N 3.28Å; Q347-H400 PolarHBondContact NE2-CE1 2.77Å; Q347-L403 HydrophobicContact CB-CD1 4.21Å; Q347-L403 HydrophobicContact CB-CD2 4.49Å
348	M	90.1	Very high	87.7	Confident	101 Å²	101	62.3 Å²	62.3	50%	0.498	32%	0.324	S	S	.	.	H	α-helix	trans	-73.9	-40.1	-179.8	-70.7	-59.7	-57.8	0	0	112.5	G346 L351 S352 V406 M410	G346-M348 VanDerWaalsContact C-N 3.31Å; G346-M348 PolarHBondContact O-N 3.46Å; M348-L351 PolarHBondContact O-N 3.04Å; M348-S352 PolarHBondContact O-N 2.73Å; M348-V406 HydrophobicContact CE-CG1 3.81Å; M348-V406 HydrophobicContact SD-CG1 3.99Å; M348-M410 HydrophobicContact CE-SD 4.48Å
349	S	90.3	Very high	88	Confident	70 Å²	70	63.7 Å²	63.7	49%	0.49	33%	0.333	S	S	.	.	H	α-helix	trans	-64.3	-46.4	176.5	-44.9	0	0	0	0	110.3	E345 G346 S352 R353	E345-S349 VanDerWaalsContact O-CB 3.24Å; E345-S349 WeakPolarHBondContact O-CB 3.43Å; E345-S349 PolarHBondContact O-OG 2.8Å; G346-S349 PolarHBondContact O-N 2.8Å; S349-S352 PolarHBondContact O-N 3.48Å; S349-R353 WeakPolarHBondContact O-CB 3.34Å; S349-R353 PolarHBondContact O-N 3.3Å
350	W	93.7	Very high	88.8	Confident	2 Å²	2	58.7 Å²	58.7	1%	0.008	31%	0.31	C	S	.	.	H	α-helix	trans	-57.6	-50.7	175.2	-178.2	94.4	0	0	0	111.5	F302 V333 D335 E338 M342 E345 G346 S352 R353 Q354	F302-W350 HydrophobicContact CD2-CH2 4.49Å; F302-W350 AromaticContact CE2-CH2 3.71Å; F302-W350 HydrophobicContact CE2-CH2 3.71Å; F302-W350 AromaticContact CE2-CZ3 3.93Å; F302-W350 HydrophobicContact CE2-CZ3 3.93Å; F302-W350 HydrophobicContact CZ-CZ3 4.3Å; V333-W350 HydrophobicContact CG1-CH2 4.28Å; V333-W350 HydrophobicContact CG1-CZ2 3.72Å; D335-W350 HydrophobicContact CB-CH2 3.9Å; D335-W350 HydrophobicContact CB-CZ3 4.34Å; E338-W350 HydrophobicContact CB-CZ2 3.9Å; E338-W350 HydrophobicContact CG-CZ2 4.28Å; M342-W350 HydrophobicContact CE-CE3 4.28Å; M342-W350 HydrophobicContact CE-CZ3 4.45Å; M342-W350 HydrophobicContact CG-CB 4.25Å; M342-W350 HydrophobicContact CG-CD2 3.53Å; M342-W350 HydrophobicContact CG-CE3 4Å; M342-W350 HydrophobicContact CG-CG 3.61Å; M342-W350 HydrophobicContact CG-CZ2 4.32Å; M342-W350 HydrophobicContact SD-CD2 4.2Å; M342-W350 HydrophobicContact SD-CE3 4.15Å; M342-W350 HydrophobicContact SD-CH2 4.26Å; M342-W350 HydrophobicContact SD-CZ2 4.31Å; M342-W350 HydrophobicContact SD-CZ3 4.18Å; E345-W350 HydrophobicContact CG-CB 3.92Å; E345-W350 WeakPolarHBondContact OE1-CA 3.47Å; E345-W350 WeakPolarHBondContact OE1-CB 3.42Å; G346-W350 PolarHBondContact O-N 2.87Å; W350-S352 PolarHBondContact O-N 2.89Å; W350-R353 WeakPolarHBondContact O-CB 3.29Å; W350-R353 PolarHBondContact O-N 2.86Å; W350-Q354 HydrophobicContact CD2-CG 3.9Å; W350-Q354 HydrophobicContact CE3-CG 4.16Å; W350-Q354 HydrophobicContact CH2-CG 4.09Å; W350-Q354 HydrophobicContact CZ2-CG 3.81Å; W350-Q354 HydrophobicContact CZ3-CG 4.25Å; W350-Q354 WeakPolarHBondContact O-CG 3.36Å; W350-Q354 PolarHBondContact O-N 3.15Å
351	L	93.6	Very high	89.6	Confident	1 Å²	1	52.4 Å²	52.4	1%	0.005	28%	0.277	C	S	.	.	H	α-helix	trans	-60.2	-44.5	179.7	175	62.3	0	0	0	112.1	F302 Q347 M348 R353 Q354 L355 L403 V406 A407 M410	F302-L351 HydrophobicContact CE1-CD1 4.01Å; F302-L351 HydrophobicContact CZ-CD1 3.87Å; Q347-L351 VanDerWaalsContact O-CB 3.32Å; Q347-L351 WeakPolarHBondContact O-CB 3.15Å; Q347-L351 PolarHBondContact O-N 3.28Å; M348-L351 PolarHBondContact O-N 3.04Å; L351-R353 VanDerWaalsContact C-N 3.35Å; L351-R353 PolarHBondContact O-N 3.18Å; L351-Q354 PolarHBondContact O-N 3.49Å; L351-L355 HydrophobicContact CD1-CD1 4.02Å; L351-L355 HydrophobicContact CD1-CG 4.13Å; L351-L355 HydrophobicContact CG-CD1 4.08Å; L351-L355 VanDerWaalsContact O-CG 3.29Å; L351-L355 WeakPolarHBondContact O-CG 3.45Å; L351-L355 PolarHBondContact O-N 3.24Å; L351-L403 HydrophobicContact CB-CD1 4.29Å; L351-L403 HydrophobicContact CD2-CD1 3.75Å; L351-L403 HydrophobicContact CD2-CG 4.31Å; L351-V406 HydrophobicContact CD2-CG1 4.3Å; L351-A407 HydrophobicContact CD1-CB 3.64Å; L351-A407 HydrophobicContact CD2-CB 3.88Å; L351-A407 HydrophobicContact CG-CB 4.39Å; L351-M410 HydrophobicContact CD2-SD 3.97Å; L351-M410 HydrophobicContact CG-SD 4.33Å
352	S	93	Very high	90.5	Very high	48 Å²	48	48.6 Å²	48.6	34%	0.336	26%	0.259	S	S	.	.	H	α-helix	trans	-60.5	-46	177.3	-164.9	0	0	0	0	111.2	M348 S349 W350 Q354 L355 D356	M348-S352 PolarHBondContact O-N 2.73Å; S349-S352 PolarHBondContact O-N 3.48Å; W350-S352 PolarHBondContact O-N 2.89Å; S352-Q354 PolarHBondContact O-N 3.35Å; S352-L355 PolarHBondContact O-N 2.88Å; S352-D356 PolarHBondContact O-N 3.35Å; S352-D356 VanDerWaalsContact O-N 3.14Å
353	R	93.9	Very high	91.2	Very high	65 Å²	65	48 Å²	48	25%	0.245	26%	0.256	C	S	.	.	H	α-helix	trans	-58.6	-47.6	177.4	-177.4	171.9	63	88.1	-5.7	111.7	E341 E345 S349 W350 L351 L355 D356 E357	E341-R353 IonicContact OE2-NH2 2.67Å; E341-R353 PolarHBondContact OE2-NH2 3.26Å; E345-R353 IonicContact OE1-CZ 3.96Å; E345-R353 VanDerWaalsContact OE1-CZ 3.31Å; E345-R353 IonicContact OE1-NE 2.77Å; E345-R353 PolarHBondContact OE1-NE 3.08Å; E345-R353 VanDerWaalsContact OE1-NE 3.09Å; E345-R353 IonicContact OE1-NH2 3.67Å; E345-R353 PolarHBondContact OE1-NH2 3.44Å; E345-R353 IonicContact OE2-CZ 3.03Å; E345-R353 IonicContact OE2-NE 3.69Å; E345-R353 PolarHBondContact OE2-NE 2.99Å; E345-R353 VanDerWaalsContact OE2-NE 3.12Å; E345-R353 IonicContact OE2-NH2 3.14Å; S349-R353 WeakPolarHBondContact O-CB 3.34Å; S349-R353 PolarHBondContact O-N 3.3Å; W350-R353 WeakPolarHBondContact O-CB 3.29Å; W350-R353 PolarHBondContact O-N 2.86Å; L351-R353 VanDerWaalsContact C-N 3.35Å; L351-R353 PolarHBondContact O-N 3.18Å; R353-L355 VanDerWaalsContact C-N 3.33Å; R353-L355 PolarHBondContact O-N 3.47Å; R353-D356 PolarHBondContact O-N 3.43Å; R353-E357 WeakPolarHBondContact CD-OE1 3.34Å; R353-E357 VanDerWaalsContact CG-CD 3.5Å; R353-E357 HydrophobicContact CG-CG 4.13Å; R353-E357 WeakPolarHBondContact CG-OE1 3.34Å; R353-E357 IonicContact NH1-OE2 2.8Å; R353-E357 WeakPolarHBondContact O-CB 3.39Å; R353-E357 WeakPolarHBondContact O-CG 3.49Å; R353-E357 PolarHBondContact O-N 3.35Å
354	Q	94.1	Very high	92.2	Very high	2 Å²	2	43.8 Å²	43.8	1%	0.009	23%	0.228	C	C	.	.	H	α-helix	trans	-64.4	-36	178.8	-59.6	-42.8	-38.6	0	0	113	F302 V333 W350 L351 S352 D356 A358	F302-Q354 HydrophobicContact CD1-CB 4.49Å; F302-Q354 HydrophobicContact CD2-CB 3.98Å; F302-Q354 HydrophobicContact CD2-CG 4.41Å; F302-Q354 HydrophobicContact CE2-CB 4.27Å; F302-Q354 HydrophobicContact CG-CB 4.11Å; V333-Q354 HydrophobicContact CG1-CG 3.91Å; W350-Q354 HydrophobicContact CD2-CG 3.9Å; W350-Q354 HydrophobicContact CE3-CG 4.16Å; W350-Q354 HydrophobicContact CH2-CG 4.09Å; W350-Q354 HydrophobicContact CZ2-CG 3.81Å; W350-Q354 HydrophobicContact CZ3-CG 4.25Å; W350-Q354 WeakPolarHBondContact O-CG 3.36Å; W350-Q354 PolarHBondContact O-N 3.15Å; L351-Q354 PolarHBondContact O-N 3.49Å; S352-Q354 PolarHBondContact O-N 3.35Å; Q354-D356 VanDerWaalsContact C-N 3.3Å; Q354-D356 PolarHBondContact O-N 2.81Å; Q354-A358 WeakPolarHBondContact O-CB 3.42Å; Q354-A358 PolarHBondContact O-N 2.89Å; Q354-A358 VanDerWaalsContact O-N 3.08Å
355	L	92.8	Very high	92.9	Very high	2 Å²	2	35.2 Å²	35.2	1%	0.01	19%	0.191	C	C	.	.	H	α-helix	trans	-69.4	-27.9	177.8	-71.7	173.3	0	0	0	113.4	F302 L351 S352 R353 I361 M410 I411 R431	F302-L355 HydrophobicContact CD1-CD2 4.04Å; F302-L355 HydrophobicContact CE1-CD2 3.99Å; L351-L355 HydrophobicContact CD1-CD1 4.02Å; L351-L355 HydrophobicContact CD1-CG 4.13Å; L351-L355 HydrophobicContact CG-CD1 4.08Å; L351-L355 VanDerWaalsContact O-CG 3.29Å; L351-L355 WeakPolarHBondContact O-CG 3.45Å; L351-L355 PolarHBondContact O-N 3.24Å; S352-L355 PolarHBondContact O-N 2.88Å; R353-L355 VanDerWaalsContact C-N 3.33Å; R353-L355 PolarHBondContact O-N 3.47Å; L355-I361 HydrophobicContact CD2-CD1 3.64Å; L355-I361 HydrophobicContact CD2-CG1 4.38Å; L355-I361 HydrophobicContact CD2-CG2 4.45Å; L355-M410 HydrophobicContact CD1-CB 3.71Å; L355-M410 HydrophobicContact CD1-CE 3.8Å; L355-M410 HydrophobicContact CD1-CG 4.49Å; L355-M410 HydrophobicContact CD1-SD 4.03Å; L355-I411 HydrophobicContact CD2-CD1 4.08Å; L355-I411 HydrophobicContact CD2-CG1 3.57Å; L355-R431 PolarHBondContact O-NH1 2.78Å; L355-R431 PolarHBondContact O-NH2 2.81Å
356	D	91.3	Very high	93.4	Very high	92 Å²	92	31.8 Å²	31.8	49%	0.492	18%	0.175	S	C	.	.	H	α-helix	trans	-89.9	-36.5	179	-67	-31.5	0	0	0	112.2	S352 R353 Q354 K414	S352-D356 PolarHBondContact O-N 3.35Å; S352-D356 VanDerWaalsContact O-N 3.14Å; R353-D356 PolarHBondContact O-N 3.43Å; Q354-D356 VanDerWaalsContact C-N 3.3Å; Q354-D356 PolarHBondContact O-N 2.81Å; D356-K414 IonicContact OD1-NZ 2.75Å; D356-K414 PolarHBondContact OD1-NZ 2.8Å
357	E	91.9	Very high	93.7	Very high	93 Å²	93	33.9 Å²	33.9	44%	0.435	18%	0.176	S	C	.	.	H	α-helix	trans	-84.3	-27.1	-178.5	-70.9	-178.5	-171	0	0	114.7	K300 R353 N359	K300-E357 IonicContact NZ-OE2 2.76Å; K300-E357 PolarHBondContact NZ-OE2 3.39Å; R353-E357 WeakPolarHBondContact CD-OE1 3.34Å; R353-E357 VanDerWaalsContact CG-CD 3.5Å; R353-E357 HydrophobicContact CG-CG 4.13Å; R353-E357 WeakPolarHBondContact CG-OE1 3.34Å; R353-E357 IonicContact NH1-OE2 2.8Å; R353-E357 WeakPolarHBondContact O-CB 3.39Å; R353-E357 WeakPolarHBondContact O-CG 3.49Å; R353-E357 PolarHBondContact O-N 3.35Å; E357-N359 PolarHBondContact O-N 2.74Å
358	A	93.1	Very high	94	Very high	5 Å²	5	31.2 Å²	31.2	4%	0.041	16%	0.163	C	C	.	.			trans	-71	130.5	-175.4	0	0	0	0	0	112.1	F302 Q354 F360 I361	F302-A358 HydrophobicContact CB-CB 3.71Å; Q354-A358 WeakPolarHBondContact O-CB 3.42Å; Q354-A358 PolarHBondContact O-N 2.89Å; Q354-A358 VanDerWaalsContact O-N 3.08Å; A358-F360 VanDerWaalsContact C-N 3.3Å; A358-F360 PolarHBondContact O-N 2.97Å; A358-I361 HydrophobicContact CB-CG1 4.29Å
359	N	91.9	Very high	94.2	Very high	88 Å²	88	26.4 Å²	26.4	47%	0.471	14%	0.14	S	C	.	.	S	Bend	trans	-65.8	-34.7	172.6	-57.6	113.6	0	0	0	111.7	K300 E357 R431	K300-N359 WeakPolarHBondContact CB-OD1 3.4Å; K300-N359 PolarHBondContact N-OD1 3.39Å; K300-N359 WeakPolarHBondContact O-CA 3.07Å; K300-N359 WeakPolarHBondContact O-CB 3.36Å; K300-N359 PolarHBondContact O-N 3.4Å; E357-N359 PolarHBondContact O-N 2.74Å; N359-R431 WeakPolarHBondContact O-CB 3.42Å
360	F	94.1	Very high	94.4	Very high	8 Å²	8	27 Å²	27	4%	0.035	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	144	175.1	-62.3	-83.1	0	0	0	111.6	P299 K300 V301 F302 A358 R431 M433 R467 L468	P299-F360 HydrophobicContact CB-CD2 4.04Å; P299-F360 HydrophobicContact CB-CE2 3.94Å; K300-F360 PolarHBondContact O-N 3Å; V301-F360 CarbonylContact C-O 3.52Å; V301-F360 VanDerWaalsContact CA-O 3.32Å; V301-F360 WeakPolarHBondContact CA-O 3.46Å; V301-F360 HydrophobicContact CG2-CB 4.28Å; F302-F360 PolarHBondContact N-O 3.06Å; A358-F360 VanDerWaalsContact C-N 3.3Å; A358-F360 PolarHBondContact O-N 2.97Å; F360-R431 CarbonylContact C-O 3.53Å; F360-R431 WeakPolarHBondContact CA-O 3.36Å; F360-M433 HydrophobicContact CB-CE 3.96Å; F360-M433 HydrophobicContact CD1-CE 3.71Å; F360-M433 HydrophobicContact CG-CE 4.1Å; F360-R467 VanDerWaalsContact CZ-O 3.23Å; F360-R467 WeakPolarHBondContact CZ-O 3.49Å; F360-L468 HydrophobicContact CB-CD2 4.06Å; F360-L468 HydrophobicContact CD1-CD2 4.46Å; F360-L468 HydrophobicContact CD2-CD2 3.72Å; F360-L468 HydrophobicContact CE2-CD2 4.28Å; F360-L468 WeakPolarHBondContact CE2-O 3.4Å; F360-L468 HydrophobicContact CG-CD2 3.82Å
361	I	96.2	Very high	94.3	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	-119.3	112.4	176.2	-63.2	163.8	0	0	0	108.2	F302 L355 A358 I411 R431 F432 M433	F302-I361 HydrophobicContact CB-CG1 4.44Å; F302-I361 HydrophobicContact CD1-CG1 4.41Å; F302-I361 HydrophobicContact CD1-CG2 4.13Å; L355-I361 HydrophobicContact CD2-CD1 3.64Å; L355-I361 HydrophobicContact CD2-CG1 4.38Å; L355-I361 HydrophobicContact CD2-CG2 4.45Å; A358-I361 HydrophobicContact CB-CG1 4.29Å; I361-I411 HydrophobicContact CG2-CD1 3.71Å; I361-I411 HydrophobicContact CG2-CG1 4.13Å; I361-R431 PolarHBondContact N-O 3.02Å; I361-F432 HydrophobicContact CB-CD1 3.98Å; I361-F432 HydrophobicContact CB-CE1 4.42Å; I361-F432 HydrophobicContact CD1-CD1 3.84Å; I361-F432 HydrophobicContact CD1-CE1 3.39Å; I361-F432 HydrophobicContact CD1-CZ 4.22Å; I361-F432 HydrophobicContact CG1-CD1 4.49Å; I361-F432 HydrophobicContact CG1-CE1 4.47Å; I361-F432 HydrophobicContact CG2-CD1 4.33Å; I361-M433 PolarHBondContact O-N 3.13Å
362	I	97.7	Very high	94.2	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	114.2	178	-63.2	178.8	0	0	0	108.5	V301 F302 I303 C304 F320 L324 V364 M433 V435 L464	V301-I362 HydrophobicContact CG1-CB 4.5Å; V301-I362 HydrophobicContact CG1-CD1 3.58Å; V301-I362 HydrophobicContact CG1-CG1 3.88Å; F302-I362 PolarHBondContact O-N 3.19Å; I303-I362 WeakPolarHBondContact CA-O 3.43Å; C304-I362 PolarHBondContact N-O 3.19Å; F320-I362 HydrophobicContact CE1-CG2 4.21Å; L324-I362 HydrophobicContact CD1-CD1 3.92Å; I362-V364 HydrophobicContact CG2-CG2 4.29Å; I362-M433 HydrophobicContact CD1-CE 4.39Å; I362-M433 HydrophobicContact CG1-CE 3.92Å; I362-V435 HydrophobicContact CG2-CB 4.3Å; I362-V435 HydrophobicContact CG2-CG1 3.82Å; I362-V435 HydrophobicContact CG2-CG2 3.44Å; I362-V435 VanDerWaalsContact CG2-CG2 3.44Å; I362-L464 HydrophobicContact CD1-CD1 4.02Å
363	T	97.9	Very high	94.1	Very high	3 Å²	3	32.1 Å²	32.1	2%	0.018	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	108.9	171.7	-53.3	0	0	0	0	110.2	C304 C365 L369 V408 M433 V435 L449	C304-T363 HydrophobicContact CB-CG2 4.35Å; C304-T363 CarbonylContact O-C 3.57Å; C304-T363 VanDerWaalsContact O-CA 3.29Å; C304-T363 WeakPolarHBondContact O-CA 3.41Å; T363-C365 PolarHBondContact O-N 3.27Å; T363-L369 HydrophobicContact CG2-CD2 3.68Å; T363-V408 HydrophobicContact CG2-CG2 4.24Å; T363-M433 PolarHBondContact N-O 2.91Å; T363-V435 PolarHBondContact O-N 3.28Å; T363-L449 HydrophobicContact CG2-CD1 3.6Å
364	V	98.2	Very high	93.8	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	105.7	176.1	-171.3	0	0	0	0	109.3	I303 C304 I317 I362 V435 F437	I303-V364 HydrophobicContact CG2-CG2 4.03Å; C304-V364 PolarHBondContact O-N 2.91Å; I317-V364 HydrophobicContact CD1-CB 3.8Å; I317-V364 HydrophobicContact CD1-CG1 3.6Å; I317-V364 HydrophobicContact CD1-CG2 3.9Å; I362-V364 HydrophobicContact CG2-CG2 4.29Å; V364-V435 CarbonylContact C-O 3.54Å; V364-V435 WeakPolarHBondContact CA-O 3.48Å; V364-V435 HydrophobicContact CB-CG2 4.23Å; V364-V435 HydrophobicContact CG1-CG2 4.41Å; V364-V435 HydrophobicContact CG2-CG2 3.79Å; V364-F437 HydrophobicContact CG1-CD2 4.03Å; V364-F437 HydrophobicContact CG1-CE2 3.86Å
365	C	97.9	Very high	93.1	Very high	1 Å²	1	36.2 Å²	36.2	1%	0.007	17%	0.166	C	C	.	.			trans	-85.4	127.1	-178.1	-59.8	0	0	0	0	110.8	T363 L369 V435 Y436 I445	T363-C365 PolarHBondContact O-N 3.27Å; C365-L369 HydrophobicContact CB-CD2 4.22Å; C365-V435 PolarHBondContact N-O 3.41Å; C365-Y436 WeakPolarHBondContact O-CB 3.38Å; C365-I445 HydrophobicContact CB-CB 4.45Å; C365-I445 HydrophobicContact CB-CG1 3.8Å
366	S	96.4	Very high	91.6	Very high	1 Å²	1	42.5 Å²	42.5	1%	0.007	19%	0.193	C	C	.	.			trans	-138.4	167	-178.5	64.8	0	0	0	0	109.6	D309 G368 L369 R370	D309-S366 WeakPolarHBondContact OD2-CB 3.27Å; D309-S366 PolarHBondContact OD2-OG 3.3Å; S366-G368 PolarHBondContact O-N 2.83Å; S366-L369 PolarHBondContact O-N 2.88Å; S366-L369 VanDerWaalsContact O-N 3.11Å; S366-L369 PolarHBondContact OG-N 3.26Å; S366-L369 VanDerWaalsContact OG-N 3.13Å; S366-R370 PolarHBondContact O-N 3.27Å; S366-R370 VanDerWaalsContact O-N 3.14Å
367	K	93.6	Very high	90	Very high	74 Å²	74	41.5 Å²	41.5	32%	0.322	19%	0.193	S	C	.	.	H	α-helix	trans	-53.1	-41.2	174.7	-168	172.3	179.8	179.7	0	111.7	Y371 W516 F517	K367-Y371 WeakPolarHBondContact O-CB 3.3Å; K367-Y371 PolarHBondContact O-N 2.97Å; K367-Y371 VanDerWaalsContact O-N 3.09Å; K367-W516 HydrophobicContact CB-CH2 4.36Å; K367-W516 HydrophobicContact CB-CZ2 4.34Å; K367-W516 HydrophobicContact CD-CZ2 4.39Å; K367-F517 HydrophobicContact CD-CB 3.9Å; K367-F517 HydrophobicContact CD-CD1 3.93Å; K367-F517 HydrophobicContact CD-CG 3.87Å; K367-F517 HydrophobicContact CG-CD1 3.91Å; K367-F517 HydrophobicContact CG-CD2 4.42Å; K367-F517 HydrophobicContact CG-CE1 4.24Å; K367-F517 HydrophobicContact CG-CG 4.01Å
368	G	92.6	Very high	88.2	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-62.8	-48.9	173.6	0	0	0	0	0	113.9	D309 S366 R370 Y371 Y372 F517	D309-G368 WeakPolarHBondContact OD1-CA 3.48Å; D309-G368 PolarHBondContact OD1-N 3.33Å; S366-G368 PolarHBondContact O-N 2.83Å; G368-R370 VanDerWaalsContact C-N 3.33Å; G368-R370 PolarHBondContact O-N 2.98Å; G368-Y371 PolarHBondContact O-N 3.14Å; G368-Y372 VanDerWaalsContact O-CD2 3.24Å; G368-Y372 WeakPolarHBondContact O-CD2 3.37Å; G368-Y372 PolarHBondContact O-N 2.54Å; G368-Y372 VanDerWaalsContact O-N 3.08Å; G368-F517 VanDerWaalsContact CA-CZ 3.48Å
369	L	93.9	Very high	86.2	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-54.5	-50.4	180	-167.4	83.3	0	0	0	111.2	T363 C365 S366 V373 F404 V408 P446	T363-L369 HydrophobicContact CG2-CD2 3.68Å; C365-L369 HydrophobicContact CB-CD2 4.22Å; S366-L369 PolarHBondContact O-N 2.88Å; S366-L369 VanDerWaalsContact O-N 3.11Å; S366-L369 PolarHBondContact OG-N 3.26Å; S366-L369 VanDerWaalsContact OG-N 3.13Å; L369-V373 WeakPolarHBondContact O-CB 3.23Å; L369-V373 WeakPolarHBondContact O-CG2 3.43Å; L369-V373 PolarHBondContact O-N 3.49Å; L369-V373 VanDerWaalsContact O-N 3.15Å; L369-F404 HydrophobicContact CD1-CD2 3.52Å; L369-F404 HydrophobicContact CD1-CE2 4.07Å; L369-F404 HydrophobicContact CD1-CG 4.41Å; L369-V408 HydrophobicContact CD1-CG2 4.06Å; L369-V408 HydrophobicContact CD2-CG2 4.41Å; L369-V408 HydrophobicContact CG-CG2 4.47Å; L369-P446 HydrophobicContact CD2-CG 3.97Å; L369-P446 HydrophobicContact CG-CG 4.26Å
370	R	93.6	Very high	84.2	Confident	83 Å²	83	55.9 Å²	55.9	31%	0.313	26%	0.256	S	S	.	.	H	α-helix	trans	-60.9	-49.6	177.9	-179.4	168.1	-179.2	-163.2	7.8	112.4	S366 G368 Y372 V373 E374 S443 D444	S366-R370 PolarHBondContact O-N 3.27Å; S366-R370 VanDerWaalsContact O-N 3.14Å; G368-R370 VanDerWaalsContact C-N 3.33Å; G368-R370 PolarHBondContact O-N 2.98Å; R370-Y372 PolarHBondContact O-N 3.41Å; R370-V373 PolarHBondContact O-N 3.5Å; R370-E374 HydrophobicContact CG-CG 4.13Å; R370-E374 WeakPolarHBondContact CG-OE2 3.25Å; R370-E374 IonicContact CZ-OE2 3.94Å; R370-E374 IonicContact NE-OE1 2.8Å; R370-E374 IonicContact NE-OE2 2.81Å; R370-E374 PolarHBondContact NE-OE2 3.04Å; R370-E374 IonicContact NH2-OE2 3.88Å; R370-E374 WeakPolarHBondContact O-CB 3.31Å; R370-E374 WeakPolarHBondContact O-CG 2.99Å; R370-E374 PolarHBondContact O-N 3.31Å; R370-S443 WeakPolarHBondContact CD-O 2.99Å; R370-S443 PolarHBondContact NE-O 2.85Å; R370-S443 PolarHBondContact NH1-O 2.87Å; R370-D444 WeakPolarHBondContact CB-O 3.42Å
371	Y	92.1	Very high	81.8	Confident	102 Å²	102	63.6 Å²	63.6	40%	0.4	29%	0.29	S	S	.	.	H	α-helix	trans	-55.5	-51.2	-176.2	176.8	-95.4	0	0	0	111.7	K367 G368 K375 F517	K367-Y371 WeakPolarHBondContact O-CB 3.3Å; K367-Y371 PolarHBondContact O-N 2.97Å; K367-Y371 VanDerWaalsContact O-N 3.09Å; G368-Y371 PolarHBondContact O-N 3.14Å; Y371-K375 HydrophobicContact CD1-CD 4.5Å; Y371-K375 HydrophobicContact CE1-CD 3.73Å; Y371-K375 WeakPolarHBondContact O-CB 3.39Å; Y371-K375 PolarHBondContact O-N 3.28Å; Y371-K375 PolarHBondContact OH-NZ 2.96Å; Y371-F517 HydrophobicContact CD1-CE1 4.22Å; Y371-F517 HydrophobicContact CD1-CZ 4.02Å; Y371-F517 HydrophobicContact CD2-CE1 4.08Å; Y371-F517 AromaticContact CG-CE1 3.77Å; Y371-F517 HydrophobicContact CG-CE1 3.77Å; Y371-F517 AromaticContact CG-CZ 3.87Å; Y371-F517 HydrophobicContact CG-CZ 3.87Å
372	Y	91.1	Very high	78.8	Confident	39 Å²	39	69.2 Å²	69.2	15%	0.153	32%	0.324	C	S	.	.	H	α-helix	trans	-73.3	-38.9	-175.4	-73.8	-77.5	0	0	0	113.1	R308 G368 R370 K376 F404 F517	R308-Y372 HydrophobicContact CB-CD2 3.69Å; R308-Y372 HydrophobicContact CB-CE2 3.25Å; R308-Y372 HydrophobicContact CG-CD2 4.2Å; R308-Y372 HydrophobicContact CG-CE2 3.95Å; G368-Y372 VanDerWaalsContact O-CD2 3.24Å; G368-Y372 WeakPolarHBondContact O-CD2 3.37Å; G368-Y372 PolarHBondContact O-N 2.54Å; G368-Y372 VanDerWaalsContact O-N 3.08Å; R370-Y372 PolarHBondContact O-N 3.41Å; Y372-K376 PolarHBondContact O-N 3.09Å; Y372-F404 HydrophobicContact CD2-CZ 4.08Å; Y372-F404 HydrophobicContact CG-CZ 4.01Å; Y372-F517 HydrophobicContact CE2-CZ 4.37Å
373	V	91.4	Very high	76.3	Confident	17 Å²	17	74.9 Å²	74.9	10%	0.103	36%	0.361	C	S	.	.	H	α-helix	trans	-65.7	-47	177.6	172.6	0	0	0	0	110.9	L369 R370 S377 F404 V405 V408 P446	L369-V373 WeakPolarHBondContact O-CB 3.23Å; L369-V373 WeakPolarHBondContact O-CG2 3.43Å; L369-V373 PolarHBondContact O-N 3.49Å; L369-V373 VanDerWaalsContact O-N 3.15Å; R370-V373 PolarHBondContact O-N 3.5Å; V373-S377 PolarHBondContact O-N 2.79Å; V373-F404 HydrophobicContact CG2-CE2 4.48Å; V373-V405 HydrophobicContact CG2-CG2 4.32Å; V373-V408 HydrophobicContact CG1-CG1 3.86Å; V373-V408 HydrophobicContact CG2-CB 4.05Å; V373-V408 HydrophobicContact CG2-CG1 3.97Å; V373-V408 HydrophobicContact CG2-CG2 4.21Å; V373-P446 HydrophobicContact CB-CB 4.33Å; V373-P446 HydrophobicContact CB-CG 4.34Å; V373-P446 HydrophobicContact CG1-CB 3.91Å; V373-P446 HydrophobicContact CG1-CG 4.35Å
374	E	87.9	Confident	73.5	Confident	33 Å²	33	81.5 Å²	81.5	15%	0.154	40%	0.401	C	S	.	.	H	α-helix	trans	-76.4	-31.8	-177.5	-64.1	-167.3	153.5	0	0	112.6	R370 K376 S377 R378 T447	R370-E374 HydrophobicContact CG-CG 4.13Å; R370-E374 WeakPolarHBondContact CG-OE2 3.25Å; R370-E374 IonicContact CZ-OE2 3.94Å; R370-E374 IonicContact NE-OE1 2.8Å; R370-E374 IonicContact NE-OE2 2.81Å; R370-E374 PolarHBondContact NE-OE2 3.04Å; R370-E374 IonicContact NH2-OE2 3.88Å; R370-E374 WeakPolarHBondContact O-CB 3.31Å; R370-E374 WeakPolarHBondContact O-CG 2.99Å; R370-E374 PolarHBondContact O-N 3.31Å; E374-K376 PolarHBondContact O-N 2.95Å; E374-S377 PolarHBondContact O-N 3.38Å; E374-R378 WeakPolarHBondContact O-CG 3.43Å; E374-R378 PolarHBondContact O-N 3.36Å; E374-R378 VanDerWaalsContact O-N 3.09Å; E374-T447 PolarHBondContact OE1-N 3.15Å; E374-T447 VanDerWaalsContact OE1-N 3.14Å; E374-T447 PolarHBondContact OE1-OG1 3Å
375	K	79.6	Confident	70.9	Confident	119 Å²	119	84.8 Å²	84.8	52%	0.517	44%	0.435	S	S	.	.	H	α-helix	trans	-62.2	-40.3	174.4	-177.6	176.9	-176.6	177.5	0	112.2	Y371	Y371-K375 HydrophobicContact CD1-CD 4.5Å; Y371-K375 HydrophobicContact CE1-CD 3.73Å; Y371-K375 WeakPolarHBondContact O-CB 3.39Å; Y371-K375 PolarHBondContact O-N 3.28Å; Y371-K375 PolarHBondContact OH-NZ 2.96Å
376	K	61.3	Low	67.9	Low	134 Å²	134	96.6 Å²	96.6	58%	0.583	48%	0.48	S	S	*	.	H	α-helix	trans	-70.5	-36.1	176.7	-162.7	176.4	-179.6	178.5	0	111.7	Y372 E374 R379 V405	Y372-K376 PolarHBondContact O-N 3.09Å; E374-K376 PolarHBondContact O-N 2.95Å; K376-R379 PolarHBondContact O-N 3.19Å; K376-V405 HydrophobicContact CB-CG1 4.48Å; K376-V405 HydrophobicContact CD-CG1 3.7Å
377	S	56.7	Low	65.3	Low	71 Å²	71	108.8 Å²	108.8	50%	0.497	53%	0.526	S	S	.	.	H	α-helix	trans	-63.3	-39.2	176	-174.8	0	0	0	0	113.1	V373 E374 R379 G380	V373-S377 PolarHBondContact O-N 2.79Å; E374-S377 PolarHBondContact O-N 3.38Å; S377-R379 VanDerWaalsContact C-N 3.3Å; S377-R379 PolarHBondContact O-N 3.27Å; S377-G380 PolarHBondContact O-N 3.17Å
378	R	54.5	Low	62.3	Low	201 Å²	201	110.4 Å²	110.4	76%	0.758	55%	0.546	S	S	*	.	H	α-helix	trans	-67.2	-26.2	177.4	-70	-177.3	-172.5	-129.2	3.2	114	E374 G380	E374-R378 WeakPolarHBondContact O-CG 3.43Å; E374-R378 PolarHBondContact O-N 3.36Å; E374-R378 VanDerWaalsContact O-N 3.09Å; R378-G380 PolarHBondContact O-N 2.78Å
379	R	52.4	Low	59.7	Low	221 Å²	221	118.2 Å²	118.2	83%	0.834	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.6	-14.2	178.1	-136.2	173.3	-172.4	-179.4	0.2	113.1	K376 S377	K376-R379 PolarHBondContact O-N 3.19Å; S377-R379 VanDerWaalsContact C-N 3.3Å; S377-R379 PolarHBondContact O-N 3.27Å
380	G	49.1	Very low	56.8	Low	66 Å²	66	122.5 Å²	122.5	68%	0.68	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.3	4.3	179.2	0	0	0	0	0	115.6	S377 R378	S377-G380 PolarHBondContact O-N 3.17Å; R378-G380 PolarHBondContact O-N 2.78Å
381	K	43.3	Very low	53.7	Low	171 Å²	171	122.1 Å²	122.1	74%	0.743	64%	0.64	S	S	*	*			trans	-132.9	64.9	-176.1	-71.1	-177.7	176.5	175.6	0	112.9
382	T	33.6	Very low	50.8	Low	118 Å²	118	123.3 Å²	123.3	72%	0.724	66%	0.663	S	S	*	*			trans	-144.3	115.7	155	47.3	0	0	0	0	109.2
383	P	45.2	Very low	47.8	Very low	119 Å²	119	124.7 Å²	124.7	77%	0.773	69%	0.689	S	S	*	*			trans	-74.3	153.4	152.4	32.1	-26	0	0	0	108
384	V	39.3	Very low	44.7	Very low	141 Å²	141	128 Å²	128	86%	0.855	71%	0.712	S	S	*	*	S	Bend	trans	93.7	91	177.2	-164.2	0	0	0	0	116.1
385	G	43	Very low	42.3	Very low	70 Å²	70	132.6 Å²	132.6	72%	0.722	75%	0.746	S	S	*	*				50.2	91.2	126.2	0	0	0	0	0	120
386	R	35.9	Very low	40.1	Very low	248 Å²	248	132.7 Å²	132.7	94%	0.936	76%	0.756	S	S	*	*			trans	-164	128.2	133.6	-111.9	169	174.8	-177.9	-2.1	110.5	S388	R386-S388 PolarHBondContact O-N 3.28Å
387	R	41.5	Very low	38.5	Very low	258 Å²	258	129.6 Å²	129.6	97%	0.974	76%	0.762	S	S	*	*			trans	-53.5	116.4	177.5	-72.7	174	173.9	171	-3.1	110.2
388	S	30	Very low	37.5	Very low	107 Å²	107	130.7 Å²	130.7	75%	0.748	79%	0.785	S	S	*	*			trans	-123.3	111.8	153.2	-164	0	0	0	0	107.2	R386 S390	R386-S388 PolarHBondContact O-N 3.28Å; S388-S390 PolarHBondContact O-N 3.32Å; S388-S390 VanDerWaalsContact O-N 3.16Å
389	N	39.3	Very low	36.7	Very low	164 Å²	164	125.8 Å²	125.8	88%	0.877	78%	0.781	S	S	*	*			trans	-66.5	103.9	172.7	-163	49.3	0	0	0	107.3
390	S	31.9	Very low	36.5	Very low	91 Å²	91	120.3 Å²	120.3	64%	0.636	77%	0.765	S	S	*	*			trans	-139.8	112.6	165.7	-71.3	0	0	0	0	106.3	S388	S388-S390 PolarHBondContact O-N 3.32Å; S388-S390 VanDerWaalsContact O-N 3.16Å
391	G	28.2	Very low	36.7	Very low	74 Å²	74	120 Å²	120	76%	0.763	75%	0.752	S	S	*	*			trans	-52.2	135.6	-168	0	0	0	0	0	112.9	G393	G391-G393 VanDerWaalsContact C-N 3.32Å; G391-G393 PolarHBondContact O-N 2.87Å
392	S	32.1	Very low	38.4	Very low	128 Å²	128	113.7 Å²	113.7	90%	0.895	73%	0.727	S	S	*	*			trans	-49.6	94.4	154.6	172.9	0	0	0	0	109.7
393	G	27.2	Very low	40.9	Very low	67 Å²	67	108.9 Å²	108.9	69%	0.691	70%	0.697	S	S	*	*			trans	-78.7	115.2	160.2	0	0	0	0	0	108.5	G391	G391-G393 VanDerWaalsContact C-N 3.32Å; G391-G393 PolarHBondContact O-N 2.87Å
394	S	26.5	Very low	43.2	Very low	86 Å²	86	103.8 Å²	103.8	60%	0.601	66%	0.662	S	S	*	*			trans	-50.3	141.5	164.8	-173.4	0	0	0	0	110.2	T396	S394-T396 PolarHBondContact O-N 3.24Å; S394-T396 PolarHBondContact OG-OG1 3.29Å
395	P	37.5	Very low	45.7	Very low	131 Å²	131	97.7 Å²	97.7	85%	0.851	63%	0.625	S	S	*	*	S	Bend	trans	-79.2	37.2	-175.8	34.1	-35.6	0	0	0	113.3
396	T	33.5	Very low	48.1	Very low	120 Å²	120	95.9 Å²	95.9	74%	0.736	60%	0.6	S	S	*	*			trans	-129.8	86.5	-176.5	52	0	0	0	0	108.9	S394	S394-T396 PolarHBondContact O-N 3.24Å; S394-T396 PolarHBondContact OG-OG1 3.29Å
397	G	27.8	Very low	50.9	Low	69 Å²	69	84.1 Å²	84.1	71%	0.711	56%	0.556	S	S	*	*	S	Bend	trans	154.6	90.8	174	0	0	0	0	0	113.9	S399	G397-S399 VanDerWaalsContact C-N 3.27Å; G397-S399 PolarHBondContact O-N 3.18Å
398	G	34.7	Very low	53.5	Low	94 Å²	94	71.9 Å²	71.9	97%	0.969	51%	0.51	S	S	*	.			trans	54.1	12.7	141.7	0	0	0	0	0	121.3
399	S	38.5	Very low	56.5	Low	99 Å²	99	69.6 Å²	69.6	69%	0.692	50%	0.498	S	S	*	.			trans	-85.5	119.6	167.8	-167.8	0	0	0	0	107.6	G397 S401	G397-S399 VanDerWaalsContact C-N 3.27Å; G397-S399 PolarHBondContact O-N 3.18Å; S399-S401 PolarHBondContact O-N 3.38Å
400	H	47.7	Very low	59.1	Low	105 Å²	105	64.2 Å²	64.2	49%	0.486	47%	0.468	S	S	.	.			trans	-56.8	81.1	160	-106.4	-99.3	0	0	0	106.9	Q347 D402	Q347-H400 PolarHBondContact NE2-CE1 2.77Å; H400-D402 PolarHBondContact O-N 2.81Å
401	S	54.3	Low	62.1	Low	59 Å²	59	60 Å²	60	41%	0.413	44%	0.438	S	S	.	.			trans	-54.2	128.2	163.4	62.1	0	0	0	0	105	S399 L403	S399-S401 PolarHBondContact O-N 3.38Å; S401-L403 VanDerWaalsContact C-N 3.29Å; S401-L403 PolarHBondContact O-N 3.43Å
402	D	77.8	Confident	65.3	Low	40 Å²	40	57.3 Å²	57.3	21%	0.214	41%	0.409	C	S	.	.			trans	-53.2	93.2	-174.6	-63.9	-42.2	0	0	0	110.2	R308 H400 F404 V405 V406	R308-D402 IonicContact CZ-OD1 2.78Å; R308-D402 IonicContact NE-OD1 3.22Å; R308-D402 PolarHBondContact NE-OD1 2.87Å; R308-D402 IonicContact NH2-OD1 3.54Å; R308-D402 PolarHBondContact NH2-OD1 3.05Å; R308-D402 IonicContact NH2-OD2 3.15Å; H400-D402 PolarHBondContact O-N 2.81Å; D402-F404 HydrophobicContact CB-CD1 3.95Å; D402-F404 HydrophobicContact CB-CE1 3.55Å; D402-F404 HydrophobicContact CB-CZ 4.1Å; D402-F404 PolarHBondContact O-N 2.89Å; D402-V405 HydrophobicContact CB-CB 4.09Å; D402-V405 HydrophobicContact CB-CG2 3.57Å; D402-V405 WeakPolarHBondContact O-CB 3.39Å; D402-V405 PolarHBondContact O-N 3.1Å; D402-V406 PolarHBondContact O-N 3.17Å
403	L	87.9	Confident	68.1	Low	17 Å²	17	55.1 Å²	55.1	9%	0.089	39%	0.385	C	S	.	.	H	α-helix	trans	-60	-35.4	-169.1	-177.5	65.3	0	0	0	109.9	M342 Q347 L351 S401 V405 V406 A407	M342-L403 HydrophobicContact CE-CD2 3.43Å; M342-L403 VanDerWaalsContact CE-CD2 3.43Å; Q347-L403 HydrophobicContact CB-CD1 4.21Å; Q347-L403 HydrophobicContact CB-CD2 4.49Å; L351-L403 HydrophobicContact CB-CD1 4.29Å; L351-L403 HydrophobicContact CD2-CD1 3.75Å; L351-L403 HydrophobicContact CD2-CG 4.31Å; S401-L403 VanDerWaalsContact C-N 3.29Å; S401-L403 PolarHBondContact O-N 3.43Å; L403-V405 VanDerWaalsContact C-N 3.31Å; L403-V405 PolarHBondContact O-N 3.07Å; L403-V406 PolarHBondContact O-N 2.77Å; L403-A407 WeakPolarHBondContact O-CB 3.45Å; L403-A407 PolarHBondContact O-N 2.87Å
404	F	92.1	Very high	71.1	Confident	12 Å²	12	55 Å²	55	5%	0.053	37%	0.365	C	S	.	.	H	α-helix	trans	-61.5	-33.6	174.2	76.7	-93.8	0	0	0	113.5	Y305 N307 R308 L369 Y372 V373 D402 V406 A407 V408	Y305-F404 WeakPolarHBondContact O-CB 3.26Å; N307-F404 WeakPolarHBondContact OD1-CD1 3.5Å; N307-F404 VanDerWaalsContact OD1-CE1 3.3Å; N307-F404 WeakPolarHBondContact OD1-CE1 3.42Å; R308-F404 HydrophobicContact CB-CE1 4.36Å; R308-F404 HydrophobicContact CB-CZ 4.36Å; R308-F404 HydrophobicContact CG-CE1 3.67Å; R308-F404 HydrophobicContact CG-CZ 4Å; L369-F404 HydrophobicContact CD1-CD2 3.52Å; L369-F404 HydrophobicContact CD1-CE2 4.07Å; L369-F404 HydrophobicContact CD1-CG 4.41Å; Y372-F404 HydrophobicContact CD2-CZ 4.08Å; Y372-F404 HydrophobicContact CG-CZ 4.01Å; V373-F404 HydrophobicContact CG2-CE2 4.48Å; D402-F404 HydrophobicContact CB-CD1 3.95Å; D402-F404 HydrophobicContact CB-CE1 3.55Å; D402-F404 HydrophobicContact CB-CZ 4.1Å; D402-F404 PolarHBondContact O-N 2.89Å; F404-V406 VanDerWaalsContact C-N 3.33Å; F404-A407 PolarHBondContact O-N 2.83Å; F404-V408 WeakPolarHBondContact O-CB 3.34Å; F404-V408 VanDerWaalsContact O-CG2 3.24Å; F404-V408 WeakPolarHBondContact O-CG2 3.42Å; F404-V408 PolarHBondContact O-N 3.23Å
405	V	93.3	Very high	74.2	Confident	13 Å²	13	50.9 Å²	50.9	8%	0.079	34%	0.336	C	S	.	.	H	α-helix	trans	-68.2	-39.2	177.1	177.4	0	0	0	0	110	V373 K376 D402 L403 A409	V373-V405 HydrophobicContact CG2-CG2 4.32Å; K376-V405 HydrophobicContact CB-CG1 4.48Å; K376-V405 HydrophobicContact CD-CG1 3.7Å; D402-V405 HydrophobicContact CB-CB 4.09Å; D402-V405 HydrophobicContact CB-CG2 3.57Å; D402-V405 WeakPolarHBondContact O-CB 3.39Å; D402-V405 PolarHBondContact O-N 3.1Å; L403-V405 VanDerWaalsContact C-N 3.31Å; L403-V405 PolarHBondContact O-N 3.07Å; V405-A409 PolarHBondContact O-N 2.89Å
406	V	93	Very high	76.7	Confident	31 Å²	31	48.9 Å²	48.9	19%	0.188	31%	0.312	C	S	.	.	H	α-helix	trans	-68.6	-45.3	175.1	-177.3	0	0	0	0	110.4	M348 L351 D402 L403 F404 V408 A409 M410	M348-V406 HydrophobicContact CE-CG1 3.81Å; M348-V406 HydrophobicContact SD-CG1 3.99Å; L351-V406 HydrophobicContact CD2-CG1 4.3Å; D402-V406 PolarHBondContact O-N 3.17Å; L403-V406 PolarHBondContact O-N 2.77Å; F404-V406 VanDerWaalsContact C-N 3.33Å; V406-V408 PolarHBondContact O-N 2.78Å; V406-A409 WeakPolarHBondContact O-CB 3.45Å; V406-A409 PolarHBondContact O-N 2.82Å; V406-A409 VanDerWaalsContact O-N 3.13Å; V406-M410 HydrophobicContact CG1-SD 4.26Å; V406-M410 WeakPolarHBondContact O-CG 3.41Å; V406-M410 PolarHBondContact O-N 3.36Å
407	A	94.4	Very high	79.3	Confident	2 Å²	2	46.4 Å²	46.4	2%	0.017	29%	0.294	C	S	.	.	H	α-helix	trans	-56.3	-48.6	176.2	0	0	0	0	0	111.9	L351 L403 F404 A409 M410 I411	L351-A407 HydrophobicContact CD1-CB 3.64Å; L351-A407 HydrophobicContact CD2-CB 3.88Å; L351-A407 HydrophobicContact CG-CB 4.39Å; L403-A407 WeakPolarHBondContact O-CB 3.45Å; L403-A407 PolarHBondContact O-N 2.87Å; F404-A407 PolarHBondContact O-N 2.83Å; A407-A409 VanDerWaalsContact C-N 3.3Å; A407-A409 PolarHBondContact O-N 2.98Å; A407-M410 PolarHBondContact O-N 3.33Å; A407-I411 WeakPolarHBondContact O-CB 3.3Å; A407-I411 WeakPolarHBondContact O-CD1 3.39Å; A407-I411 WeakPolarHBondContact O-CG1 3.23Å; A407-I411 PolarHBondContact O-N 3.46Å
408	V	95.6	Very high	81.9	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-60.6	-38.9	176.9	170.2	0	0	0	0	111.7	T363 L369 V373 F404 V406 I411 A412 L449	T363-V408 HydrophobicContact CG2-CG2 4.24Å; L369-V408 HydrophobicContact CD1-CG2 4.06Å; L369-V408 HydrophobicContact CD2-CG2 4.41Å; L369-V408 HydrophobicContact CG-CG2 4.47Å; V373-V408 HydrophobicContact CG1-CG1 3.86Å; V373-V408 HydrophobicContact CG2-CB 4.05Å; V373-V408 HydrophobicContact CG2-CG1 3.97Å; V373-V408 HydrophobicContact CG2-CG2 4.21Å; F404-V408 WeakPolarHBondContact O-CB 3.34Å; F404-V408 VanDerWaalsContact O-CG2 3.24Å; F404-V408 WeakPolarHBondContact O-CG2 3.42Å; F404-V408 PolarHBondContact O-N 3.23Å; V406-V408 PolarHBondContact O-N 2.78Å; V408-I411 PolarHBondContact O-N 3.01Å; V408-A412 VanDerWaalsContact O-CB 3.26Å; V408-A412 WeakPolarHBondContact O-CB 3.25Å; V408-A412 PolarHBondContact O-N 3.45Å; V408-L449 HydrophobicContact CG1-CD1 4.03Å; V408-L449 HydrophobicContact CG1-CD2 4.18Å; V408-L449 HydrophobicContact CG1-CG 4.01Å; V408-L449 HydrophobicContact CG2-CD1 4.45Å
409	A	93.8	Very high	84.2	Confident	60 Å²	60	44.6 Å²	44.6	50%	0.496	24%	0.24	S	C	.	.	H	α-helix	trans	-65.7	-41.8	176.4	0	0	0	0	0	112.2	V405 V406 A407 A412 E413	V405-A409 PolarHBondContact O-N 2.89Å; V406-A409 WeakPolarHBondContact O-CB 3.45Å; V406-A409 PolarHBondContact O-N 2.82Å; V406-A409 VanDerWaalsContact O-N 3.13Å; A407-A409 VanDerWaalsContact C-N 3.3Å; A407-A409 PolarHBondContact O-N 2.98Å; A409-A412 PolarHBondContact O-N 3.14Å; A409-E413 PolarHBondContact O-N 2.93Å
410	M	94.4	Very high	86.1	Confident	51 Å²	51	46 Å²	46	25%	0.251	24%	0.235	S	C	.	.	H	α-helix	trans	-66.3	-42.4	175.8	-68.2	-179.6	69.8	0	0	112	M348 L351 L355 V406 A407 E413 K414	M348-M410 HydrophobicContact CE-SD 4.48Å; L351-M410 HydrophobicContact CD2-SD 3.97Å; L351-M410 HydrophobicContact CG-SD 4.33Å; L355-M410 HydrophobicContact CD1-CB 3.71Å; L355-M410 HydrophobicContact CD1-CE 3.8Å; L355-M410 HydrophobicContact CD1-CG 4.49Å; L355-M410 HydrophobicContact CD1-SD 4.03Å; V406-M410 HydrophobicContact CG1-SD 4.26Å; V406-M410 WeakPolarHBondContact O-CG 3.41Å; V406-M410 PolarHBondContact O-N 3.36Å; A407-M410 PolarHBondContact O-N 3.33Å; M410-E413 PolarHBondContact O-N 2.85Å; M410-K414 WeakPolarHBondContact O-CG 3.5Å; M410-K414 PolarHBondContact O-N 3.4Å
411	I	95.1	Very high	87.2	Confident	2 Å²	2	47 Å²	47	1%	0.01	24%	0.244	C	C	.	.	H	α-helix	trans	-60.5	-46.3	175	-69.4	163.8	0	0	0	110.3	C304 L355 I361 A407 V408 E413 K414 L415 F432 L449	C304-I411 HydrophobicContact CB-CD1 4.09Å; L355-I411 HydrophobicContact CD2-CD1 4.08Å; L355-I411 HydrophobicContact CD2-CG1 3.57Å; I361-I411 HydrophobicContact CG2-CD1 3.71Å; I361-I411 HydrophobicContact CG2-CG1 4.13Å; A407-I411 WeakPolarHBondContact O-CB 3.3Å; A407-I411 WeakPolarHBondContact O-CD1 3.39Å; A407-I411 WeakPolarHBondContact O-CG1 3.23Å; A407-I411 PolarHBondContact O-N 3.46Å; V408-I411 PolarHBondContact O-N 3.01Å; I411-E413 VanDerWaalsContact C-N 3.3Å; I411-E413 PolarHBondContact O-N 3.06Å; I411-K414 PolarHBondContact O-N 2.71Å; I411-L415 HydrophobicContact CG2-CD1 3.91Å; I411-L415 HydrophobicContact CG2-CG 4.45Å; I411-L415 WeakPolarHBondContact O-CB 3.19Å; I411-L415 WeakPolarHBondContact O-CG 3.49Å; I411-L415 PolarHBondContact O-N 2.82Å; I411-F432 HydrophobicContact CG2-CD1 3.73Å; I411-F432 HydrophobicContact CG2-CE1 4.05Å; I411-L449 HydrophobicContact CB-CD2 4.31Å; I411-L449 HydrophobicContact CG2-CD2 3.66Å
412	A	93.9	Very high	87.5	Confident	17 Å²	17	47.9 Å²	47.9	14%	0.14	24%	0.242	C	C	.	.	H	α-helix	trans	-60.3	-39.2	177.7	0	0	0	0	0	112.4	V408 A409 R416 A448 L449	V408-A412 VanDerWaalsContact O-CB 3.26Å; V408-A412 WeakPolarHBondContact O-CB 3.25Å; V408-A412 PolarHBondContact O-N 3.45Å; A409-A412 PolarHBondContact O-N 3.14Å; A412-R416 WeakPolarHBondContact O-CB 3.33Å; A412-R416 PolarHBondContact O-N 2.79Å; A412-A448 HydrophobicContact CB-CB 3.81Å; A412-A448 VanDerWaalsContact CB-O 3.31Å; A412-A448 WeakPolarHBondContact CB-O 3.32Å; A412-L449 HydrophobicContact CB-CD2 4.43Å
413	E	92	Very high	86.4	Confident	83 Å²	83	54.5 Å²	54.5	39%	0.388	28%	0.277	S	S	.	.	H	α-helix	trans	-68.6	-44.2	176.5	-177.8	59.7	-171.7	0	0	111.9	A409 M410 I411 L415 R416 L417	A409-E413 PolarHBondContact O-N 2.93Å; M410-E413 PolarHBondContact O-N 2.85Å; I411-E413 VanDerWaalsContact C-N 3.3Å; I411-E413 PolarHBondContact O-N 3.06Å; E413-L415 VanDerWaalsContact C-N 3.33Å; E413-L415 PolarHBondContact O-N 2.79Å; E413-R416 WeakPolarHBondContact O-CB 3.46Å; E413-R416 PolarHBondContact O-N 2.92Å; E413-R416 VanDerWaalsContact O-N 3.13Å; E413-R416 IonicContact OE1-CZ 3.59Å; E413-R416 IonicContact OE1-NE 2.73Å; E413-R416 IonicContact OE1-NH2 2.68Å; E413-R416 PolarHBondContact OE1-NH2 3.2Å; E413-R416 IonicContact OE2-CZ 3.48Å; E413-R416 IonicContact OE2-NE 3.51Å; E413-R416 PolarHBondContact OE2-NE 2.85Å; E413-R416 IonicContact OE2-NH2 3.6Å; E413-L417 HydrophobicContact CG-CD1 4.28Å; E413-L417 WeakPolarHBondContact O-CG 3.5Å; E413-L417 PolarHBondContact O-N 2.77Å
414	K	90.4	Very high	84.6	Confident	63 Å²	63	57 Å²	57	27%	0.274	31%	0.307	S	S	.	.	H	α-helix	trans	-61.1	-40.8	174.7	-67.2	-83.7	-166.4	164.4	0	111.6	D356 M410 I411 R416 L417 A418 F432	D356-K414 IonicContact OD1-NZ 2.75Å; D356-K414 PolarHBondContact OD1-NZ 2.8Å; M410-K414 WeakPolarHBondContact O-CG 3.5Å; M410-K414 PolarHBondContact O-N 3.4Å; I411-K414 PolarHBondContact O-N 2.71Å; K414-R416 VanDerWaalsContact C-N 3.33Å; K414-R416 PolarHBondContact O-N 2.71Å; K414-L417 PolarHBondContact O-N 2.62Å; K414-A418 WeakPolarHBondContact O-CB 3.45Å; K414-A418 PolarHBondContact O-N 2.83Å; K414-F432 HydrophobicContact CB-CE1 4.25Å; K414-F432 HydrophobicContact CB-CE2 4.45Å; K414-F432 HydrophobicContact CB-CZ 3.64Å
415	L	91.3	Very high	82.7	Confident	0 Å²	0	66.4 Å²	66.4	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-59.7	-41.4	172.8	-81.2	166.3	0	0	0	112.3	I411 E413 K419 L429 F432 L449 L451 A452	I411-L415 HydrophobicContact CG2-CD1 3.91Å; I411-L415 HydrophobicContact CG2-CG 4.45Å; I411-L415 WeakPolarHBondContact O-CB 3.19Å; I411-L415 WeakPolarHBondContact O-CG 3.49Å; I411-L415 PolarHBondContact O-N 2.82Å; E413-L415 VanDerWaalsContact C-N 3.33Å; E413-L415 PolarHBondContact O-N 2.79Å; L415-K419 WeakPolarHBondContact O-CB 3.4Å; L415-K419 PolarHBondContact O-N 2.86Å; L415-K419 VanDerWaalsContact O-N 3.08Å; L415-L429 HydrophobicContact CD2-CD2 3.82Å; L415-F432 HydrophobicContact CD2-CB 3.64Å; L415-F432 HydrophobicContact CD2-CD2 3.64Å; L415-F432 HydrophobicContact CD2-CE2 4.42Å; L415-F432 HydrophobicContact CD2-CG 3.72Å; L415-F432 HydrophobicContact CG-CB 4.23Å; L415-F432 HydrophobicContact CG-CD1 4.39Å; L415-F432 HydrophobicContact CG-CD2 4.09Å; L415-F432 HydrophobicContact CG-CG 4Å; L415-L449 HydrophobicContact CD1-CD2 3.93Å; L415-L451 HydrophobicContact CB-CB 4.48Å; L415-A452 HydrophobicContact CD1-CB 3.91Å; L415-A452 HydrophobicContact CD2-CB 4.27Å
416	R	89.3	Confident	81.1	Confident	89 Å²	89	71.5 Å²	71.5	34%	0.336	37%	0.369	S	S	.	.	H	α-helix	trans	-67.8	-41.4	178.4	-169.1	-166.7	67.8	69.6	2	111.7	A412 E413 K414 K419 Q420	A412-R416 WeakPolarHBondContact O-CB 3.33Å; A412-R416 PolarHBondContact O-N 2.79Å; E413-R416 WeakPolarHBondContact O-CB 3.46Å; E413-R416 PolarHBondContact O-N 2.92Å; E413-R416 VanDerWaalsContact O-N 3.13Å; E413-R416 IonicContact OE1-CZ 3.59Å; E413-R416 IonicContact OE1-NE 2.73Å; E413-R416 IonicContact OE1-NH2 2.68Å; E413-R416 PolarHBondContact OE1-NH2 3.2Å; E413-R416 IonicContact OE2-CZ 3.48Å; E413-R416 IonicContact OE2-NE 3.51Å; E413-R416 PolarHBondContact OE2-NE 2.85Å; E413-R416 IonicContact OE2-NH2 3.6Å; K414-R416 VanDerWaalsContact C-N 3.33Å; K414-R416 PolarHBondContact O-N 2.71Å; R416-K419 PolarHBondContact O-N 2.81Å; R416-Q420 WeakPolarHBondContact O-CG 3.04Å; R416-Q420 PolarHBondContact O-N 3.26Å; R416-Q420 VanDerWaalsContact O-N 3.16Å
417	L	87.7	Confident	79.6	Confident	69 Å²	69	74 Å²	74	36%	0.361	39%	0.385	S	S	.	.	H	α-helix	trans	-65.8	-46.9	176.6	-69.3	172.1	0	0	0	111.4	E413 K414 K419 Q420 N421	E413-L417 HydrophobicContact CG-CD1 4.28Å; E413-L417 WeakPolarHBondContact O-CG 3.5Å; E413-L417 PolarHBondContact O-N 2.77Å; K414-L417 PolarHBondContact O-N 2.62Å; L417-K419 PolarHBondContact O-N 3.07Å; L417-Q420 PolarHBondContact O-N 2.77Å; L417-N421 PolarHBondContact O-N 2.78Å; L417-N421 VanDerWaalsContact O-N 3.15Å
418	A	83.9	Confident	78.5	Confident	1 Å²	1	77.9 Å²	77.9	1%	0.008	40%	0.403	C	S	.	.	H	α-helix	trans	-57.4	-38.5	175.5	0	0	0	0	0	111.7	K414 Q420 E428 L429	K414-A418 WeakPolarHBondContact O-CB 3.45Å; K414-A418 PolarHBondContact O-N 2.83Å; A418-Q420 PolarHBondContact O-N 2.95Å; A418-E428 HydrophobicContact CB-CB 4.19Å; A418-E428 HydrophobicContact CB-CG 4.14Å; A418-L429 HydrophobicContact CB-CD2 3.67Å; A418-L429 HydrophobicContact CB-CG 4.16Å
419	K	82.7	Confident	77.6	Confident	123 Å²	123	79.1 Å²	79.1	54%	0.535	41%	0.41	S	S	.	.	H	α-helix	trans	-68.5	-29.7	174.4	-176.8	172.5	-178.8	179.1	0	114	L415 R416 L417 L451	L415-K419 WeakPolarHBondContact O-CB 3.4Å; L415-K419 PolarHBondContact O-N 2.86Å; L415-K419 VanDerWaalsContact O-N 3.08Å; R416-K419 PolarHBondContact O-N 2.81Å; L417-K419 PolarHBondContact O-N 3.07Å; K419-L451 HydrophobicContact CB-CD1 4.35Å; K419-L451 HydrophobicContact CD-CD1 3.77Å; K419-L451 HydrophobicContact CD-CD2 3.69Å; K419-L451 HydrophobicContact CD-CG 4.36Å
420	Q	77.3	Confident	76.9	Confident	130 Å²	130	78.5 Å²	78.5	61%	0.607	40%	0.402	S	S	*	.	H	α-helix	trans	-81.4	-22.7	-179.2	-77.7	-173.2	-18.1	0	0	113.5	R416 L417 A418	R416-Q420 WeakPolarHBondContact O-CG 3.04Å; R416-Q420 PolarHBondContact O-N 3.26Å; R416-Q420 VanDerWaalsContact O-N 3.16Å; L417-Q420 PolarHBondContact O-N 2.77Å; A418-Q420 PolarHBondContact O-N 2.95Å
421	N	72.2	Confident	76.6	Confident	125 Å²	125	77.7 Å²	77.7	67%	0.668	40%	0.396	S	S	*	.	S	Bend	trans	-88.3	-1.9	-176.3	-72.3	-18.6	0	0	0	114.2	L417	L417-N421 PolarHBondContact O-N 2.78Å; L417-N421 VanDerWaalsContact O-N 3.15Å
422	E	60	Low	76.5	Confident	78 Å²	78	77.7 Å²	77.7	36%	0.364	40%	0.396	S	S	.	.			trans	-112.8	103.7	-164.1	-97.4	-75.3	169.5	0	0	114.1	G424 R425 P427	E422-G424 VanDerWaalsContact C-N 3.34Å; E422-G424 PolarHBondContact O-N 2.86Å; E422-G424 PolarHBondContact OE2-N 2.91Å; E422-G424 VanDerWaalsContact OE2-N 3.11Å; E422-R425 PolarHBondContact OE2-N 2.78Å; E422-P427 WeakPolarHBondContact OE1-CD 3.08Å
423	D	53.8	Low	76.6	Confident	178 Å²	178	77 Å²	77	95%	0.952	39%	0.389	S	S	*	.	S	Bend	trans	-83	71.7	151.3	-86.6	-37.1	0	0	0	109.3
424	G	49.7	Very low	76.8	Confident	69 Å²	69	73 Å²	73	71%	0.711	37%	0.371	S	S	*	.	S	Bend	trans	104.9	12.4	146.5	0	0	0	0	0	122	E422	E422-G424 VanDerWaalsContact C-N 3.34Å; E422-G424 PolarHBondContact O-N 2.86Å; E422-G424 PolarHBondContact OE2-N 2.91Å; E422-G424 VanDerWaalsContact OE2-N 3.11Å
425	R	53.5	Low	77.2	Confident	211 Å²	211	70 Å²	70	80%	0.796	36%	0.358	S	S	*	.			trans	-138.1	154.3	166.5	-65.2	-171.8	-171.4	125.3	4.7	112.1	E422 P427	E422-R425 PolarHBondContact OE2-N 2.78Å; R425-P427 WeakPolarHBondContact O-CD 3.26Å
426	D	58.3	Low	77.5	Confident	120 Å²	120	71.3 Å²	71.3	64%	0.642	36%	0.363	S	S	*	.			trans	-99	23.7	-164	-123.7	-22.8	0	0	0	116.5	S430	D426-S430 WeakPolarHBondContact O-CB 3.38Å; D426-S430 PolarHBondContact O-N 2.72Å
427	P	62.3	Low	77.9	Confident	82 Å²	82	67.1 Å²	67.1	53%	0.532	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-39.9	-162.6	30.6	-33.3	0	0	0	113.9	E422 R425 S430	E422-P427 WeakPolarHBondContact OE1-CD 3.08Å; R425-P427 WeakPolarHBondContact O-CD 3.26Å; P427-S430 PolarHBondContact O-OG 3Å
428	E	70.4	Confident	78.2	Confident	84 Å²	84	66.9 Å²	66.9	39%	0.393	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-30.6	-175.9	-161.4	-179.2	-178.7	0	0	112.6	A418 S430 R431	A418-E428 HydrophobicContact CB-CB 4.19Å; A418-E428 HydrophobicContact CB-CG 4.14Å; E428-S430 VanDerWaalsContact C-N 3.32Å; E428-R431 WeakPolarHBondContact O-CG 3.49Å
429	L	77.2	Confident	78.7	Confident	27 Å²	27	68 Å²	68	14%	0.141	35%	0.351	C	S	.	.	G	3₁₀ helix	trans	-70.4	-30.8	174.6	-68.3	175.2	0	0	0	111.9	L415 A418 R431 F432	L415-L429 HydrophobicContact CD2-CD2 3.82Å; A418-L429 HydrophobicContact CB-CD2 3.67Å; A418-L429 HydrophobicContact CB-CG 4.16Å; L429-R431 PolarHBondContact O-N 3.24Å; L429-R431 VanDerWaalsContact O-N 3.13Å; L429-F432 PolarHBondContact O-N 2.76Å; L429-F432 VanDerWaalsContact O-N 3.15Å
430	S	78.5	Confident	79.4	Confident	46 Å²	46	62.7 Å²	62.7	32%	0.322	33%	0.329	S	S	.	.	G	3₁₀ helix	trans	-62.8	-19.4	-178.8	77.8	0	0	0	0	114.1	D426 P427 E428 F432	D426-S430 WeakPolarHBondContact O-CB 3.38Å; D426-S430 PolarHBondContact O-N 2.72Å; P427-S430 PolarHBondContact O-OG 3Å; E428-S430 VanDerWaalsContact C-N 3.32Å; S430-F432 VanDerWaalsContact C-N 3.35Å
431	R	89.1	Confident	80.2	Confident	34 Å²	34	59.8 Å²	59.8	13%	0.128	32%	0.32	C	S	.	.	G	3₁₀ helix	trans	-75.4	-22.4	178.1	89.1	-175.1	-178.3	101.2	-4.8	113.7	L355 N359 F360 I361 E428 L429	L355-R431 PolarHBondContact O-NH1 2.78Å; L355-R431 PolarHBondContact O-NH2 2.81Å; N359-R431 WeakPolarHBondContact O-CB 3.42Å; F360-R431 CarbonylContact C-O 3.53Å; F360-R431 WeakPolarHBondContact CA-O 3.36Å; I361-R431 PolarHBondContact N-O 3.02Å; E428-R431 WeakPolarHBondContact O-CG 3.49Å; L429-R431 PolarHBondContact O-N 3.24Å; L429-R431 VanDerWaalsContact O-N 3.13Å
432	F	93.5	Very high	81.3	Confident	2 Å²	2	58.4 Å²	58.4	1%	0.009	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	133.8	-179	-60.6	-82.9	0	0	0	110.3	I361 I411 K414 L415 L429 S430 P453	I361-F432 HydrophobicContact CB-CD1 3.98Å; I361-F432 HydrophobicContact CB-CE1 4.42Å; I361-F432 HydrophobicContact CD1-CD1 3.84Å; I361-F432 HydrophobicContact CD1-CE1 3.39Å; I361-F432 HydrophobicContact CD1-CZ 4.22Å; I361-F432 HydrophobicContact CG1-CD1 4.49Å; I361-F432 HydrophobicContact CG1-CE1 4.47Å; I361-F432 HydrophobicContact CG2-CD1 4.33Å; I411-F432 HydrophobicContact CG2-CD1 3.73Å; I411-F432 HydrophobicContact CG2-CE1 4.05Å; K414-F432 HydrophobicContact CB-CE1 4.25Å; K414-F432 HydrophobicContact CB-CE2 4.45Å; K414-F432 HydrophobicContact CB-CZ 3.64Å; L415-F432 HydrophobicContact CD2-CB 3.64Å; L415-F432 HydrophobicContact CD2-CD2 3.64Å; L415-F432 HydrophobicContact CD2-CE2 4.42Å; L415-F432 HydrophobicContact CD2-CG 3.72Å; L415-F432 HydrophobicContact CG-CB 4.23Å; L415-F432 HydrophobicContact CG-CD1 4.39Å; L415-F432 HydrophobicContact CG-CD2 4.09Å; L415-F432 HydrophobicContact CG-CG 4Å; L429-F432 PolarHBondContact O-N 2.76Å; L429-F432 VanDerWaalsContact O-N 3.15Å; S430-F432 VanDerWaalsContact C-N 3.35Å; F432-P453 WeakPolarHBondContact O-CD 3.4Å
433	M	94.9	Very high	82.9	Confident	2 Å²	2	57.9 Å²	57.9	1%	0.01	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	129.9	178	-68.7	174.9	-82.7	0	0	110.5	F360 I361 I362 T363 V435 L455 L464 R467 L468	F360-M433 HydrophobicContact CB-CE 3.96Å; F360-M433 HydrophobicContact CD1-CE 3.71Å; F360-M433 HydrophobicContact CG-CE 4.1Å; I361-M433 PolarHBondContact O-N 3.13Å; I362-M433 HydrophobicContact CD1-CE 4.39Å; I362-M433 HydrophobicContact CG1-CE 3.92Å; T363-M433 PolarHBondContact N-O 2.91Å; M433-V435 HydrophobicContact CB-CG1 4.25Å; M433-L455 HydrophobicContact SD-CD1 4.07Å; M433-L464 HydrophobicContact CE-CD1 4.11Å; M433-L464 HydrophobicContact SD-CD1 3.65Å; M433-R467 HydrophobicContact SD-CB 4.33Å; M433-L468 HydrophobicContact CE-CD2 4.2Å
434	A	97.2	Very high	84.9	Confident	1 Å²	1	50.4 Å²	50.4	1%	0.008	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	113.7	168.2	0	0	0	0	0	108.1	I445 A452 P453 R454 L455	A434-I445 HydrophobicContact CB-CD1 4.42Å; A434-I445 HydrophobicContact CB-CG2 4.06Å; A434-A452 HydrophobicContact CB-CB 4.16Å; A434-P453 PolarHBondContact N-O 3.4Å; A434-R454 CarbonylContact O-C 3.54Å; A434-R454 VanDerWaalsContact O-CA 3.25Å; A434-R454 WeakPolarHBondContact O-CA 3.48Å; A434-L455 PolarHBondContact O-N 3.36Å
435	V	97.9	Very high	87.1	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	149.5	-178.1	-50.8	0	0	0	0	110.4	I362 T363 V364 C365 M433 L455 L457	I362-V435 HydrophobicContact CG2-CB 4.3Å; I362-V435 HydrophobicContact CG2-CG1 3.82Å; I362-V435 HydrophobicContact CG2-CG2 3.44Å; I362-V435 VanDerWaalsContact CG2-CG2 3.44Å; T363-V435 PolarHBondContact O-N 3.28Å; V364-V435 CarbonylContact C-O 3.54Å; V364-V435 WeakPolarHBondContact CA-O 3.48Å; V364-V435 HydrophobicContact CB-CG2 4.23Å; V364-V435 HydrophobicContact CG1-CG2 4.41Å; V364-V435 HydrophobicContact CG2-CG2 3.79Å; C365-V435 PolarHBondContact N-O 3.41Å; M433-V435 HydrophobicContact CB-CG1 4.25Å; V435-L455 CarbonylContact C-O 3.57Å; V435-L455 VanDerWaalsContact CA-O 3.25Å; V435-L455 WeakPolarHBondContact CA-O 3.38Å; V435-L455 HydrophobicContact CG1-CB 4.17Å; V435-L457 HydrophobicContact CB-CD1 3.86Å; V435-L457 HydrophobicContact CB-CG 4.2Å; V435-L457 HydrophobicContact CG1-CD1 4.35Å; V435-L457 HydrophobicContact CG2-CD1 3.94Å
436	Y	98.1	Very high	89.1	Confident	26 Å²	26	37.8 Å²	37.8	10%	0.102	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	143.6	173.2	62.2	-80.4	0	0	0	110.1	C365 E442 I445 L455 K456 L457	C365-Y436 WeakPolarHBondContact O-CB 3.38Å; Y436-E442 HydrophobicContact CE1-CB 4.27Å; Y436-E442 HydrophobicContact CE1-CG 4.42Å; Y436-I445 HydrophobicContact CD1-CD1 3.88Å; Y436-I445 HydrophobicContact CD1-CG1 4.37Å; Y436-I445 HydrophobicContact CE1-CD1 4.07Å; Y436-L455 PolarHBondContact N-O 2.9Å; Y436-K456 HydrophobicContact CD2-CG 4.19Å; Y436-K456 HydrophobicContact CE1-CB 4.09Å; Y436-K456 HydrophobicContact CE2-CB 3.91Å; Y436-K456 HydrophobicContact CE2-CD 3.9Å; Y436-K456 HydrophobicContact CE2-CG 3.58Å; Y436-L457 PolarHBondContact O-N 2.83Å
437	F	97.5	Very high	90.7	Very high	1 Å²	1	36.7 Å²	36.7	0%	0.004	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	165.9	176	-70.7	-80.9	0	0	0	111.2	V316 F320 V364 Y439 S440 L457 M458 L499 I503	V316-F437 HydrophobicContact CG1-CD1 4.33Å; V316-F437 HydrophobicContact CG1-CD2 3.86Å; V316-F437 HydrophobicContact CG1-CE1 4.1Å; V316-F437 HydrophobicContact CG1-CE2 3.6Å; V316-F437 HydrophobicContact CG1-CG 4.22Å; V316-F437 HydrophobicContact CG1-CZ 3.73Å; F320-F437 HydrophobicContact CB-CZ 3.98Å; F320-F437 HydrophobicContact CD1-CZ 4.29Å; F320-F437 HydrophobicContact CD2-CE1 4.46Å; F320-F437 AromaticContact CD2-CZ 3.9Å; F320-F437 HydrophobicContact CD2-CZ 3.9Å; F320-F437 HydrophobicContact CE2-CZ 4.48Å; F320-F437 AromaticContact CG-CZ 3.8Å; F320-F437 HydrophobicContact CG-CZ 3.8Å; V364-F437 HydrophobicContact CG1-CD2 4.03Å; V364-F437 HydrophobicContact CG1-CE2 3.86Å; F437-Y439 HydrophobicContact CB-CD1 3.68Å; F437-Y439 HydrophobicContact CB-CE1 3.28Å; F437-Y439 HydrophobicContact CB-CE2 4.3Å; F437-Y439 HydrophobicContact CB-CG 4.34Å; F437-Y439 HydrophobicContact CD2-CE1 4.16Å; F437-Y439 AromaticContact CD2-CZ 3.97Å; F437-Y439 WeakPolarHBondContact CD2-OH 3.42Å; F437-Y439 AromaticContact CG-CE1 3.78Å; F437-Y439 HydrophobicContact CG-CE1 3.78Å; F437-Y439 PolarHBondContact O-N 3.21Å; F437-S440 CarbonylContact O-C 3.6Å; F437-S440 WeakPolarHBondContact O-CA 3.36Å; F437-S440 PolarHBondContact O-N 2.84Å; F437-S440 VanDerWaalsContact O-O 3.05Å; F437-L457 WeakPolarHBondContact CA-O 3.33Å; F437-L457 HydrophobicContact CD1-CB 3.96Å; F437-L457 HydrophobicContact CE1-CB 3.98Å; F437-L457 HydrophobicContact CE1-CD1 4.33Å; F437-L457 HydrophobicContact CZ-CD1 4.28Å; F437-M458 HydrophobicContact CE1-SD 4.27Å; F437-L499 HydrophobicContact CE1-CD1 4.21Å; F437-L499 HydrophobicContact CZ-CD1 4.38Å; F437-I503 HydrophobicContact CD1-CD1 3.7Å; F437-I503 HydrophobicContact CD1-CG1 4.11Å; F437-I503 HydrophobicContact CE1-CD1 3.84Å; F437-I503 HydrophobicContact CE1-CG1 4.39Å
438	D	94.7	Very high	92.1	Very high	64 Å²	64	35.1 Å²	35.1	34%	0.342	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-15	-177.6	64.4	-11.4	0	0	0	115.4	S440 L457 I503 H507	D438-S440 VanDerWaalsContact C-N 3.3Å; D438-L457 PolarHBondContact N-O 3.31Å; D438-I503 WeakPolarHBondContact OD1-CG2 2.91Å; D438-H507 IonicContact OD1-CD2 3.02Å; D438-H507 IonicContact OD1-CE1 2.79Å; D438-H507 IonicContact OD1-NE2 2.72Å; D438-H507 PolarHBondContact OD1-NE2 2.77Å; D438-H507 IonicContact OD2-NE2 3.14Å; D438-H507 PolarHBondContact OD2-NE2 2.85Å
439	Y	95	Very high	93.2	Very high	26 Å²	26	31.1 Å²	31.1	10%	0.102	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-5.2	167.7	61	-102	0	0	0	113.9	H313 V316 F437 I503 M506 I510	H313-Y439 PolarHBondContact CE1-OH 3.43Å; H313-Y439 AromaticContact ND1-CE2 3.69Å; H313-Y439 AromaticContact ND1-CZ 3.71Å; H313-Y439 PolarHBondContact ND1-OH 2.86Å; V316-Y439 HydrophobicContact CG1-CE1 4.15Å; V316-Y439 WeakPolarHBondContact CG1-OH 3.48Å; V316-Y439 HydrophobicContact CG2-CE1 4.08Å; F437-Y439 HydrophobicContact CB-CD1 3.68Å; F437-Y439 HydrophobicContact CB-CE1 3.28Å; F437-Y439 HydrophobicContact CB-CE2 4.3Å; F437-Y439 HydrophobicContact CB-CG 4.34Å; F437-Y439 HydrophobicContact CD2-CE1 4.16Å; F437-Y439 AromaticContact CD2-CZ 3.97Å; F437-Y439 WeakPolarHBondContact CD2-OH 3.42Å; F437-Y439 AromaticContact CG-CE1 3.78Å; F437-Y439 HydrophobicContact CG-CE1 3.78Å; F437-Y439 PolarHBondContact O-N 3.21Å; Y439-I503 HydrophobicContact CD1-CG2 4.38Å; Y439-M506 HydrophobicContact CD1-CB 4.12Å; Y439-M506 HydrophobicContact CD1-CG 3.78Å; Y439-M506 HydrophobicContact CD2-CE 4.17Å; Y439-M506 HydrophobicContact CD2-CG 3.8Å; Y439-M506 HydrophobicContact CE1-CB 4.18Å; Y439-M506 HydrophobicContact CE1-CG 3.9Å; Y439-M506 HydrophobicContact CE2-CE 4.27Å; Y439-M506 HydrophobicContact CE2-CG 3.95Å; Y439-M506 HydrophobicContact CG-CG 3.72Å; Y439-I510 HydrophobicContact CD2-CD1 4.34Å; Y439-I510 HydrophobicContact CG-CD1 4.33Å
440	S	95.6	Very high	93.9	Very high	11 Å²	11	32.5 Å²	32.5	8%	0.077	19%	0.192	C	C	.	.	S	Bend	trans	-115.9	171	172.4	-59	0	0	0	0	109.8	F437 D438	F437-S440 CarbonylContact O-C 3.6Å; F437-S440 WeakPolarHBondContact O-CA 3.36Å; F437-S440 PolarHBondContact O-N 2.84Å; F437-S440 VanDerWaalsContact O-O 3.05Å; D438-S440 VanDerWaalsContact C-N 3.3Å
441	T	95	Very high	94.5	Very high	68 Å²	68	33.2 Å²	33.2	42%	0.417	19%	0.191	S	C	.	.			trans	-120.9	161.6	-177.1	67	0	0	0	0	111.5	S443 D444	T441-S443 PolarHBondContact O-N 2.83Å; T441-S443 PolarHBondContact OG1-N 2.83Å; T441-S443 PolarHBondContact OG1-OG 3.34Å; T441-D444 PolarHBondContact N-OD2 3.47Å; T441-D444 WeakPolarHBondContact O-CB 3.21Å; T441-D444 PolarHBondContact O-N 3.49Å; T441-D444 PolarHBondContact OG1-N 3.31Å; T441-D444 PolarHBondContact OG1-OD2 2.81Å
442	E	94.8	Very high	94.6	Very high	97 Å²	97	31.9 Å²	31.9	45%	0.453	19%	0.188	S	C	.	.	G	3₁₀ helix	trans	-59.4	-29.1	171.8	-167.9	-176	170.6	0	0	111.4	Y436 D444 I445 R454	Y436-E442 HydrophobicContact CE1-CB 4.27Å; Y436-E442 HydrophobicContact CE1-CG 4.42Å; E442-D444 PolarHBondContact O-N 2.79Å; E442-I445 HydrophobicContact CG-CD1 3.98Å; E442-I445 WeakPolarHBondContact O-CB 2.99Å; E442-I445 WeakPolarHBondContact O-CG1 3.34Å; E442-I445 PolarHBondContact O-N 2.78Å; E442-I445 VanDerWaalsContact O-N 3.12Å; E442-R454 VanDerWaalsContact OE1-CD 3.3Å; E442-R454 WeakPolarHBondContact OE1-CD 3.43Å; E442-R454 IonicContact OE1-CZ 3.65Å; E442-R454 IonicContact OE1-NE 3.74Å; E442-R454 IonicContact OE1-NH1 2.86Å; E442-R454 PolarHBondContact OE1-NH1 3.21Å
443	S	94	Very high	94.5	Very high	67 Å²	67	33.5 Å²	33.5	47%	0.469	20%	0.198	S	C	.	.	G	3₁₀ helix	trans	-62.7	-24.1	175.4	86.6	0	0	0	0	111.9	R370 T441 I445	R370-S443 WeakPolarHBondContact CD-O 2.99Å; R370-S443 PolarHBondContact NE-O 2.85Å; R370-S443 PolarHBondContact NH1-O 2.87Å; T441-S443 PolarHBondContact O-N 2.83Å; T441-S443 PolarHBondContact OG1-N 2.83Å; T441-S443 PolarHBondContact OG1-OG 3.34Å; S443-I445 PolarHBondContact O-N 2.94Å
444	D	95.5	Very high	94.5	Very high	20 Å²	20	38.5 Å²	38.5	11%	0.107	22%	0.217	C	C	.	.	G	3₁₀ helix	trans	-76.5	1.8	178.2	-60.1	-53.6	0	0	0	113.5	R370 T441 E442 P446	R370-D444 WeakPolarHBondContact CB-O 3.42Å; T441-D444 PolarHBondContact N-OD2 3.47Å; T441-D444 WeakPolarHBondContact O-CB 3.21Å; T441-D444 PolarHBondContact O-N 3.49Å; T441-D444 PolarHBondContact OG1-N 3.31Å; T441-D444 PolarHBondContact OG1-OD2 2.81Å; E442-D444 PolarHBondContact O-N 2.79Å; D444-P446 WeakPolarHBondContact O-CD 3.44Å
445	I	96.3	Very high	94.4	Very high	14 Å²	14	38.6 Å²	38.6	7%	0.072	22%	0.217	C	C	.	.	S	Bend	trans	-81	118.4	172.3	-58.5	173	0	0	0	108.7	C365 A434 Y436 E442 S443 L449 R454	C365-I445 HydrophobicContact CB-CB 4.45Å; C365-I445 HydrophobicContact CB-CG1 3.8Å; A434-I445 HydrophobicContact CB-CD1 4.42Å; A434-I445 HydrophobicContact CB-CG2 4.06Å; Y436-I445 HydrophobicContact CD1-CD1 3.88Å; Y436-I445 HydrophobicContact CD1-CG1 4.37Å; Y436-I445 HydrophobicContact CE1-CD1 4.07Å; E442-I445 HydrophobicContact CG-CD1 3.98Å; E442-I445 WeakPolarHBondContact O-CB 2.99Å; E442-I445 WeakPolarHBondContact O-CG1 3.34Å; E442-I445 PolarHBondContact O-N 2.78Å; E442-I445 VanDerWaalsContact O-N 3.12Å; S443-I445 PolarHBondContact O-N 2.94Å; I445-L449 HydrophobicContact CG2-CB 4.23Å; I445-R454 HydrophobicContact CD1-CB 3.89Å; I445-R454 HydrophobicContact CD1-CG 3.71Å
446	P	95.2	Very high	94.3	Very high	1 Å²	1	41.7 Å²	41.7	1%	0.006	23%	0.231	C	C	.	.			trans	-57.6	141.5	178.6	-20.7	29.1	0	0	0	112	L369 V373 D444 A448 L449	L369-P446 HydrophobicContact CD2-CG 3.97Å; L369-P446 HydrophobicContact CG-CG 4.26Å; V373-P446 HydrophobicContact CB-CB 4.33Å; V373-P446 HydrophobicContact CB-CG 4.34Å; V373-P446 HydrophobicContact CG1-CB 3.91Å; V373-P446 HydrophobicContact CG1-CG 4.35Å; D444-P446 WeakPolarHBondContact O-CD 3.44Å; P446-A448 PolarHBondContact O-N 2.86Å; P446-L449 HydrophobicContact CG-CD1 4.39Å; P446-L449 PolarHBondContact O-N 2.78Å
447	T	92.2	Very high	94.2	Very high	98 Å²	98	40.4 Å²	40.4	60%	0.601	23%	0.226	S	C	*	.	G	3₁₀ helix	trans	-54.1	-31.5	179.6	-52.6	0	0	0	0	113.1	E374 L449 S450	E374-T447 PolarHBondContact OE1-N 3.15Å; E374-T447 VanDerWaalsContact OE1-N 3.14Å; E374-T447 PolarHBondContact OE1-OG1 3Å; T447-L449 PolarHBondContact O-N 2.78Å; T447-S450 WeakPolarHBondContact O-CB 3.35Å; T447-S450 PolarHBondContact O-N 3.41Å; T447-S450 VanDerWaalsContact O-N 3.12Å; T447-S450 PolarHBondContact O-OG 2.99Å
448	A	91.4	Very high	93.9	Very high	48 Å²	48	40.8 Å²	40.8	40%	0.397	23%	0.228	S	C	.	.	G	3₁₀ helix	trans	-62	-24.2	177.3	0	0	0	0	0	113.7	A412 P446	A412-A448 HydrophobicContact CB-CB 3.81Å; A412-A448 VanDerWaalsContact CB-O 3.31Å; A412-A448 WeakPolarHBondContact CB-O 3.32Å; P446-A448 PolarHBondContact O-N 2.86Å
449	L	94	Very high	93.8	Very high	1 Å²	1	40.2 Å²	40.2	1%	0.005	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-100.3	13.7	178.2	-59.3	179	0	0	0	112.7	T363 V408 I411 A412 L415 I445 P446 T447 L451 A452	T363-L449 HydrophobicContact CG2-CD1 3.6Å; V408-L449 HydrophobicContact CG1-CD1 4.03Å; V408-L449 HydrophobicContact CG1-CD2 4.18Å; V408-L449 HydrophobicContact CG1-CG 4.01Å; V408-L449 HydrophobicContact CG2-CD1 4.45Å; I411-L449 HydrophobicContact CB-CD2 4.31Å; I411-L449 HydrophobicContact CG2-CD2 3.66Å; A412-L449 HydrophobicContact CB-CD2 4.43Å; L415-L449 HydrophobicContact CD1-CD2 3.93Å; I445-L449 HydrophobicContact CG2-CB 4.23Å; P446-L449 HydrophobicContact CG-CD1 4.39Å; P446-L449 PolarHBondContact O-N 2.78Å; T447-L449 PolarHBondContact O-N 2.78Å; L449-L451 PolarHBondContact O-N 3.3Å; L449-L451 VanDerWaalsContact O-N 3.07Å; L449-A452 WeakPolarHBondContact O-CB 3.14Å; L449-A452 PolarHBondContact O-N 3.09Å
450	S	91.4	Very high	93.7	Very high	56 Å²	56	41.8 Å²	41.8	39%	0.392	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-22.9	-176.7	53.2	0	0	0	0	114.7	T447 R454	T447-S450 WeakPolarHBondContact O-CB 3.35Å; T447-S450 PolarHBondContact O-N 3.41Å; T447-S450 VanDerWaalsContact O-N 3.12Å; T447-S450 PolarHBondContact O-OG 2.99Å; S450-R454 PolarHBondContact O-NH2 2.86Å
451	L	90.4	Very high	93.5	Very high	61 Å²	61	41.3 Å²	41.3	32%	0.319	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-21.2	176.4	-60	-179.5	0	0	0	113.4	L415 K419 L449	L415-L451 HydrophobicContact CB-CB 4.48Å; K419-L451 HydrophobicContact CB-CD1 4.35Å; K419-L451 HydrophobicContact CD-CD1 3.77Å; K419-L451 HydrophobicContact CD-CD2 3.69Å; K419-L451 HydrophobicContact CD-CG 4.36Å; L449-L451 PolarHBondContact O-N 3.3Å; L449-L451 VanDerWaalsContact O-N 3.07Å
452	A	91.4	Very high	93.3	Very high	6 Å²	6	40.8 Å²	40.8	5%	0.05	23%	0.227	C	C	.	.	S	Bend	trans	-75.5	140.2	-179.9	0	0	0	0	0	110.5	L415 A434 L449 R454	L415-A452 HydrophobicContact CD1-CB 3.91Å; L415-A452 HydrophobicContact CD2-CB 4.27Å; A434-A452 HydrophobicContact CB-CB 4.16Å; L449-A452 WeakPolarHBondContact O-CB 3.14Å; L449-A452 PolarHBondContact O-N 3.09Å; A452-R454 PolarHBondContact O-N 3.35Å
453	P	91.6	Very high	93	Very high	35 Å²	35	40.9 Å²	40.9	23%	0.227	23%	0.227	C	C	.	.	P	Polyproline II helix	trans	-52.3	130.4	167.7	-27.7	32.6	0	0	0	112.6	F432 A434	F432-P453 WeakPolarHBondContact O-CD 3.4Å; A434-P453 PolarHBondContact N-O 3.4Å
454	R	94.6	Very high	92.9	Very high	108 Å²	108	37.7 Å²	37.7	41%	0.408	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	125	-176	-52.4	175	-167.1	167.5	6.4	109.8	A434 E442 I445 S450 A452	A434-R454 CarbonylContact O-C 3.54Å; A434-R454 VanDerWaalsContact O-CA 3.25Å; A434-R454 WeakPolarHBondContact O-CA 3.48Å; E442-R454 VanDerWaalsContact OE1-CD 3.3Å; E442-R454 WeakPolarHBondContact OE1-CD 3.43Å; E442-R454 IonicContact OE1-CZ 3.65Å; E442-R454 IonicContact OE1-NE 3.74Å; E442-R454 IonicContact OE1-NH1 2.86Å; E442-R454 PolarHBondContact OE1-NH1 3.21Å; I445-R454 HydrophobicContact CD1-CB 3.89Å; I445-R454 HydrophobicContact CD1-CG 3.71Å; S450-R454 PolarHBondContact O-NH2 2.86Å; A452-R454 PolarHBondContact O-N 3.35Å
455	L	94.9	Very high	92.6	Very high	2 Å²	2	40 Å²	40	1%	0.01	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	125.6	178.2	-60.5	172.7	0	0	0	111.7	M433 A434 V435 Y436 Q460 Q463 L464	M433-L455 HydrophobicContact SD-CD1 4.07Å; A434-L455 PolarHBondContact O-N 3.36Å; V435-L455 CarbonylContact C-O 3.57Å; V435-L455 VanDerWaalsContact CA-O 3.25Å; V435-L455 WeakPolarHBondContact CA-O 3.38Å; V435-L455 HydrophobicContact CG1-CB 4.17Å; Y436-L455 PolarHBondContact N-O 2.9Å; L455-Q460 VanDerWaalsContact CA-OE1 3.24Å; L455-Q460 HydrophobicContact CD2-CB 4.13Å; L455-Q463 HydrophobicContact CD2-CB 4.07Å; L455-L464 HydrophobicContact CD1-CB 4.08Å; L455-L464 HydrophobicContact CD1-CD1 4.14Å
456	K	96.4	Very high	92.2	Very high	65 Å²	65	41.1 Å²	41.1	28%	0.283	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	116.3	172.1	-171.9	176.9	175.7	-147.1	0	110.2	Y436 D459 Q460	Y436-K456 HydrophobicContact CD2-CG 4.19Å; Y436-K456 HydrophobicContact CE1-CB 4.09Å; Y436-K456 HydrophobicContact CE2-CB 3.91Å; Y436-K456 HydrophobicContact CE2-CD 3.9Å; Y436-K456 HydrophobicContact CE2-CG 3.58Å; K456-D459 HydrophobicContact CB-CB 4.48Å; K456-D459 VanDerWaalsContact CD-OD2 3.29Å; K456-D459 WeakPolarHBondContact CD-OD2 3.43Å; K456-D459 VanDerWaalsContact CE-OD2 3.25Å; K456-D459 WeakPolarHBondContact CE-OD2 3.47Å; K456-D459 HydrophobicContact CG-CB 4.43Å; K456-D459 IonicContact NZ-OD2 3.69Å; K456-D459 PolarHBondContact NZ-OD2 3Å; K456-D459 PolarHBondContact O-N 3.17Å; K456-D459 VanDerWaalsContact O-N 3.17Å; K456-Q460 PolarHBondContact O-N 3.02Å
457	L	95.2	Very high	91.8	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	137.5	177	-61.2	-178.7	0	0	0	110.4	F320 V435 Y436 F437 D438 L464	F320-L457 HydrophobicContact CE1-CD1 4.38Å; F320-L457 HydrophobicContact CE2-CD1 3.68Å; F320-L457 HydrophobicContact CZ-CD1 3.58Å; V435-L457 HydrophobicContact CB-CD1 3.86Å; V435-L457 HydrophobicContact CB-CG 4.2Å; V435-L457 HydrophobicContact CG1-CD1 4.35Å; V435-L457 HydrophobicContact CG2-CD1 3.94Å; Y436-L457 PolarHBondContact O-N 2.83Å; F437-L457 WeakPolarHBondContact CA-O 3.33Å; F437-L457 HydrophobicContact CD1-CB 3.96Å; F437-L457 HydrophobicContact CE1-CB 3.98Å; F437-L457 HydrophobicContact CE1-CD1 4.33Å; F437-L457 HydrophobicContact CZ-CD1 4.28Å; D438-L457 PolarHBondContact N-O 3.31Å; L457-L464 HydrophobicContact CD1-CD2 4.25Å; L457-L464 HydrophobicContact CD2-CB 4.43Å; L457-L464 HydrophobicContact CD2-CD2 3.94Å
458	M	93.1	Very high	91.7	Very high	9 Å²	9	40.1 Å²	40.1	4%	0.044	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	cis	-96.2	14.4	4.7	-62	-63.7	-82	0	0	113.7	F323 F437 L461 Y490 L499 I503	F323-M458 HydrophobicContact CE1-CE 3.95Å; F323-M458 HydrophobicContact CZ-CE 4.06Å; F437-M458 HydrophobicContact CE1-SD 4.27Å; M458-L461 HydrophobicContact CE-CB 4.46Å; M458-L461 HydrophobicContact CE-CD1 4.01Å; M458-L461 HydrophobicContact CE-CD2 3.73Å; M458-L461 HydrophobicContact CE-CG 4.27Å; M458-Y490 HydrophobicContact CB-CD1 4.16Å; M458-Y490 HydrophobicContact CB-CE1 3.75Å; M458-Y490 HydrophobicContact CE-CD1 4.02Å; M458-Y490 HydrophobicContact CE-CD2 3.45Å; M458-Y490 VanDerWaalsContact CE-CD2 3.45Å; M458-Y490 HydrophobicContact CE-CE1 4.24Å; M458-Y490 HydrophobicContact CE-CE2 3.7Å; M458-Y490 HydrophobicContact CE-CG 3.61Å; M458-Y490 HydrophobicContact CG-CD1 4.38Å; M458-Y490 HydrophobicContact CG-CE1 3.81Å; M458-Y490 HydrophobicContact CG-CE2 4.19Å; M458-L499 HydrophobicContact CE-CD2 3.71Å; M458-L499 HydrophobicContact SD-CD2 3.96Å; M458-I503 HydrophobicContact CG-CD1 4.21Å
459	D	92	Very high	91.3	Very high	51 Å²	51	39.5 Å²	39.5	27%	0.273	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-45.5	-178.3	-70.9	-17.3	0	0	0	112.1	K456 R487	K456-D459 HydrophobicContact CB-CB 4.48Å; K456-D459 VanDerWaalsContact CD-OD2 3.29Å; K456-D459 WeakPolarHBondContact CD-OD2 3.43Å; K456-D459 VanDerWaalsContact CE-OD2 3.25Å; K456-D459 WeakPolarHBondContact CE-OD2 3.47Å; K456-D459 HydrophobicContact CG-CB 4.43Å; K456-D459 IonicContact NZ-OD2 3.69Å; K456-D459 PolarHBondContact NZ-OD2 3Å; K456-D459 PolarHBondContact O-N 3.17Å; K456-D459 VanDerWaalsContact O-N 3.17Å; D459-R487 WeakPolarHBondContact OD1-CD 3.36Å; D459-R487 IonicContact OD1-CZ 3.94Å; D459-R487 IonicContact OD1-NE 2.78Å; D459-R487 PolarHBondContact OD1-NE 3.13Å; D459-R487 VanDerWaalsContact OD1-NE 3.14Å; D459-R487 IonicContact OD1-NH1 3.79Å; D459-R487 PolarHBondContact OD1-NH1 3.23Å; D459-R487 IonicContact OD1-NH2 2.75Å; D459-R487 IonicContact OD2-NH1 3.71Å
460	Q	93.2	Very high	90.4	Very high	60 Å²	60	42.4 Å²	42.4	28%	0.28	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.2	25.9	-176.7	-65.5	175.4	-37.3	0	0	112.5	L455 K456 P462 Q463 L464	L455-Q460 VanDerWaalsContact CA-OE1 3.24Å; L455-Q460 HydrophobicContact CD2-CB 4.13Å; K456-Q460 PolarHBondContact O-N 3.02Å; Q460-P462 VanDerWaalsContact C-N 3.32Å; Q460-Q463 HydrophobicContact CB-CB 4.41Å; Q460-Q463 HydrophobicContact CB-CG 4.4Å; Q460-Q463 WeakPolarHBondContact O-CB 3.35Å; Q460-Q463 PolarHBondContact O-N 2.96Å; Q460-L464 PolarHBondContact O-N 3.42Å; Q460-L464 VanDerWaalsContact O-N 3.12Å
461	L	91.6	Very high	88.8	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-52.2	-41.8	174	174.8	66.3	0	0	0	113.5	F323 M458 Q463 L464 Y465 I485 Y490	F323-L461 HydrophobicContact CE1-CD1 3.73Å; F323-L461 HydrophobicContact CE1-CD2 4.41Å; F323-L461 HydrophobicContact CZ-CD1 4.11Å; F323-L461 HydrophobicContact CZ-CD2 3.97Å; M458-L461 HydrophobicContact CE-CB 4.46Å; M458-L461 HydrophobicContact CE-CD1 4.01Å; M458-L461 HydrophobicContact CE-CD2 3.73Å; M458-L461 HydrophobicContact CE-CG 4.27Å; L461-Q463 PolarHBondContact O-N 2.93Å; L461-L464 HydrophobicContact CD1-CD2 4.41Å; L461-L464 WeakPolarHBondContact O-CB 3.16Å; L461-L464 PolarHBondContact O-N 2.82Å; L461-Y465 PolarHBondContact O-N 2.89Å; L461-I485 HydrophobicContact CD2-CG2 3.43Å; L461-I485 VanDerWaalsContact CD2-CG2 3.43Å; L461-I485 HydrophobicContact CG-CG2 3.71Å; L461-Y490 HydrophobicContact CD2-CG 4.3Å
462	P	89.7	Confident	87	Confident	58 Å²	58	44.7 Å²	44.7	38%	0.377	24%	0.236	S	C	.	.	H	α-helix	trans	-62.1	-33.4	178.8	-23.1	35.2	0	0	0	112.6	Q460 G466 I485	Q460-P462 VanDerWaalsContact C-N 3.32Å; P462-G466 PolarHBondContact O-N 2.68Å; P462-I485 WeakPolarHBondContact CG-O 3.24Å
463	Q	89.9	Confident	84.9	Confident	98 Å²	98	49 Å²	49	46%	0.458	27%	0.266	S	S	.	.	H	α-helix	trans	-71.6	-38.7	177.2	-58.1	176.1	11.9	0	0	111.2	L455 Q460 L461 R467	L455-Q463 HydrophobicContact CD2-CB 4.07Å; Q460-Q463 HydrophobicContact CB-CB 4.41Å; Q460-Q463 HydrophobicContact CB-CG 4.4Å; Q460-Q463 WeakPolarHBondContact O-CB 3.35Å; Q460-Q463 PolarHBondContact O-N 2.96Å; L461-Q463 PolarHBondContact O-N 2.93Å; Q463-R467 WeakPolarHBondContact O-CB 3.17Å; Q463-R467 WeakPolarHBondContact O-CG 3.27Å; Q463-R467 PolarHBondContact O-N 2.84Å; Q463-R467 VanDerWaalsContact O-N 3.09Å
464	L	91.8	Very high	82.8	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-61.5	-50.6	172.4	178.2	65.7	0	0	0	110.8	F320 L324 I362 M433 L455 L457 Q460 L461 G466 R467 L468	F320-L464 HydrophobicContact CE2-CD2 4.19Å; F320-L464 HydrophobicContact CZ-CD2 3.92Å; L324-L464 HydrophobicContact CD2-CD2 4.32Å; I362-L464 HydrophobicContact CD1-CD1 4.02Å; M433-L464 HydrophobicContact CE-CD1 4.11Å; M433-L464 HydrophobicContact SD-CD1 3.65Å; L455-L464 HydrophobicContact CD1-CB 4.08Å; L455-L464 HydrophobicContact CD1-CD1 4.14Å; L457-L464 HydrophobicContact CD1-CD2 4.25Å; L457-L464 HydrophobicContact CD2-CB 4.43Å; L457-L464 HydrophobicContact CD2-CD2 3.94Å; Q460-L464 PolarHBondContact O-N 3.42Å; Q460-L464 VanDerWaalsContact O-N 3.12Å; L461-L464 HydrophobicContact CD1-CD2 4.41Å; L461-L464 WeakPolarHBondContact O-CB 3.16Å; L461-L464 PolarHBondContact O-N 2.82Å; L464-G466 PolarHBondContact O-N 2.97Å; L464-R467 PolarHBondContact O-N 3.06Å; L464-L468 HydrophobicContact CD1-CD1 4.23Å; L464-L468 HydrophobicContact CD1-CG 4.39Å; L464-L468 HydrophobicContact CG-CD1 4.02Å; L464-L468 WeakPolarHBondContact O-CG 3.46Å; L464-L468 PolarHBondContact O-N 3.02Å
465	Y	89.3	Confident	80.5	Confident	68 Å²	68	54.7 Å²	54.7	27%	0.267	31%	0.314	S	S	.	.	H	α-helix	trans	-60.8	-47.2	-179.6	-175.2	-90.5	0	0	0	111.9	C328 L461 R467 L468 H469 I485	C328-Y465 HydrophobicContact CB-CD2 4.25Å; C328-Y465 HydrophobicContact CB-CE2 4.47Å; L461-Y465 PolarHBondContact O-N 2.89Å; Y465-R467 VanDerWaalsContact C-N 3.26Å; Y465-R467 PolarHBondContact O-N 3.23Å; Y465-L468 PolarHBondContact O-N 2.83Å; Y465-H469 AromaticContact CD2-CD2 3.93Å; Y465-H469 AromaticContact CE1-CD2 3.8Å; Y465-H469 AromaticContact CE2-CD2 3.67Å; Y465-H469 AromaticContact CE2-NE2 3.69Å; Y465-H469 AromaticContact CZ-CD2 3.59Å; Y465-H469 AromaticContact CZ-NE2 3.89Å; Y465-H469 PolarHBondContact O-CD2 2.8Å; Y465-H469 PolarHBondContact O-N 2.81Å; Y465-I485 HydrophobicContact CD1-CD1 3.65Å; Y465-I485 HydrophobicContact CD2-CD1 3.54Å; Y465-I485 HydrophobicContact CE1-CD1 3.77Å; Y465-I485 HydrophobicContact CE2-CD1 3.65Å; Y465-I485 HydrophobicContact CG-CD1 3.53Å
466	G	86.7	Confident	77.8	Confident	39 Å²	39	58.3 Å²	58.3	40%	0.402	34%	0.344	S	S	.	.	H	α-helix	trans	-59.1	-36.1	176.7	0	0	0	0	0	112.8	P462 L464 S470	P462-G466 PolarHBondContact O-N 2.68Å; L464-G466 PolarHBondContact O-N 2.97Å; G466-S470 WeakPolarHBondContact O-CA 3.3Å; G466-S470 VanDerWaalsContact O-CB 3.23Å; G466-S470 WeakPolarHBondContact O-CB 3.22Å; G466-S470 PolarHBondContact O-N 3.15Å
467	R	88	Confident	74.8	Confident	77 Å²	77	62.8 Å²	62.8	29%	0.291	37%	0.371	S	S	.	.	H	α-helix	trans	-69.5	-46.5	175.9	-78.2	-177.6	180	169.3	1.4	113.1	F360 M433 Q463 L464 Y465 H469 S470	F360-R467 VanDerWaalsContact CZ-O 3.23Å; F360-R467 WeakPolarHBondContact CZ-O 3.49Å; M433-R467 HydrophobicContact SD-CB 4.33Å; Q463-R467 WeakPolarHBondContact O-CB 3.17Å; Q463-R467 WeakPolarHBondContact O-CG 3.27Å; Q463-R467 PolarHBondContact O-N 2.84Å; Q463-R467 VanDerWaalsContact O-N 3.09Å; L464-R467 PolarHBondContact O-N 3.06Å; Y465-R467 VanDerWaalsContact C-N 3.26Å; Y465-R467 PolarHBondContact O-N 3.23Å; R467-H469 PolarHBondContact O-N 3.35Å; R467-H469 VanDerWaalsContact O-N 3.16Å; R467-S470 PolarHBondContact O-N 3.46Å; R467-S470 PolarHBondContact O-OG 2.61Å
468	L	88.8	Confident	72.2	Confident	1 Å²	1	67.7 Å²	67.7	1%	0.005	41%	0.406	C	S	.	.	H	α-helix	trans	-57.3	-31	179	-68.8	169.6	0	0	0	112.2	V301 L324 C328 F360 M433 L464 Y465	V301-L468 HydrophobicContact CG2-CD2 3.74Å; L324-L468 HydrophobicContact CD2-CD1 3.89Å; C328-L468 HydrophobicContact CB-CD1 4.35Å; F360-L468 HydrophobicContact CB-CD2 4.06Å; F360-L468 HydrophobicContact CD1-CD2 4.46Å; F360-L468 HydrophobicContact CD2-CD2 3.72Å; F360-L468 HydrophobicContact CE2-CD2 4.28Å; F360-L468 WeakPolarHBondContact CE2-O 3.4Å; F360-L468 HydrophobicContact CG-CD2 3.82Å; M433-L468 HydrophobicContact CE-CD2 4.2Å; L464-L468 HydrophobicContact CD1-CD1 4.23Å; L464-L468 HydrophobicContact CD1-CG 4.39Å; L464-L468 HydrophobicContact CG-CD1 4.02Å; L464-L468 WeakPolarHBondContact O-CG 3.46Å; L464-L468 PolarHBondContact O-N 3.02Å; Y465-L468 PolarHBondContact O-N 2.83Å
469	H	83.6	Confident	69.5	Low	35 Å²	35	76 Å²	76	16%	0.162	44%	0.444	C	S	.	.	H	α-helix	trans	-106.6	-1.1	-178.5	-65.6	-65.5	0	0	0	114.6	C328 Y465 R467 S471 Q472 S473	C328-H469 PolarHBondContact O-CE1 2.9Å; C328-H469 VanDerWaalsContact O-CE1 3.24Å; C328-H469 PolarHBondContact O-NE2 2.94Å; Y465-H469 AromaticContact CD2-CD2 3.93Å; Y465-H469 AromaticContact CE1-CD2 3.8Å; Y465-H469 AromaticContact CE2-CD2 3.67Å; Y465-H469 AromaticContact CE2-NE2 3.69Å; Y465-H469 AromaticContact CZ-CD2 3.59Å; Y465-H469 AromaticContact CZ-NE2 3.89Å; Y465-H469 PolarHBondContact O-CD2 2.8Å; Y465-H469 PolarHBondContact O-N 2.81Å; R467-H469 PolarHBondContact O-N 3.35Å; R467-H469 VanDerWaalsContact O-N 3.16Å; H469-S471 PolarHBondContact O-N 3.15Å; H469-Q472 PolarHBondContact O-N 2.9Å; H469-S473 PolarHBondContact O-N 2.85Å
470	S	74.4	Confident	66.9	Low	62 Å²	62	82.4 Å²	82.4	43%	0.434	47%	0.473	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-30.8	-177	59.8	0	0	0	0	113.7	G466 R467 Q472	G466-S470 WeakPolarHBondContact O-CA 3.3Å; G466-S470 VanDerWaalsContact O-CB 3.23Å; G466-S470 WeakPolarHBondContact O-CB 3.22Å; G466-S470 PolarHBondContact O-N 3.15Å; R467-S470 PolarHBondContact O-N 3.46Å; R467-S470 PolarHBondContact O-OG 2.61Å; S470-Q472 VanDerWaalsContact C-N 3.29Å; S470-Q472 PolarHBondContact O-N 2.01Å
471	S	57.3	Low	64.1	Low	96 Å²	96	88.2 Å²	88.2	67%	0.671	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.2	-16.7	176.4	-63.4	0	0	0	0	113.6	H469	H469-S471 PolarHBondContact O-N 3.15Å
472	Q	54.2	Low	62.1	Low	69 Å²	69	93.1 Å²	93.1	32%	0.322	53%	0.532	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.4	-23.4	-179.9	-61.3	-174.1	7.3	0	0	112.7	P297 H469 S470 A474 L475	P297-Q472 PolarHBondContact O-NE2 2.93Å; H469-Q472 PolarHBondContact O-N 2.9Å; S470-Q472 VanDerWaalsContact C-N 3.29Å; S470-Q472 PolarHBondContact O-N 2.01Å; Q472-A474 PolarHBondContact O-N 2.99Å; Q472-L475 PolarHBondContact O-N 2.73Å
473	S	46.8	Very low	60.5	Low	96 Å²	96	95 Å²	95	67%	0.671	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	-10.9	-179.8	-109.7	0	0	0	0	115	H469 L475	H469-S473 PolarHBondContact O-N 2.85Å; S473-L475 VanDerWaalsContact C-N 3.27Å; S473-L475 PolarHBondContact O-N 2.83Å
474	A	47.7	Very low	59.2	Low	91 Å²	91	97 Å²	97	75%	0.752	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.5	-11.3	178.1	0	0	0	0	0	113.8	Q472	Q472-A474 PolarHBondContact O-N 2.99Å
475	L	46.2	Very low	58.4	Low	171 Å²	171	97.9 Å²	97.9	90%	0.895	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-125.4	-5.9	-174.7	-70.4	174.4	0	0	0	114.9	Q472 S473	Q472-L475 PolarHBondContact O-N 2.73Å; S473-L475 VanDerWaalsContact C-N 3.27Å; S473-L475 PolarHBondContact O-N 2.83Å
476	A	38.2	Very low	57.8	Low	78 Å²	78	96.5 Å²	96.5	65%	0.645	56%	0.561	S	S	*	*			trans	-98.7	107.7	179.3	0	0	0	0	0	110.4
477	D	33	Very low	57.3	Low	159 Å²	159	101.1 Å²	101.1	85%	0.85	57%	0.566	S	S	*	*			trans	-59	153.7	168.6	-152	-6.7	0	0	0	110.6
478	S	40.8	Very low	56.7	Low	103 Å²	103	107.1 Å²	107.1	72%	0.72	59%	0.589	S	S	*	*	S	Bend	trans	-46.7	144.1	-173.6	-165.8	0	0	0	0	114
479	E	36.1	Very low	56.3	Low	183 Å²	183	109 Å²	109	86%	0.855	60%	0.599	S	S	*	*			trans	128.3	29.7	163.7	-61.7	-114.4	133	0	0	117.8
480	Q	38	Very low	56.3	Low	186 Å²	186	108 Å²	108	87%	0.869	59%	0.594	S	S	*	*			trans	-128.8	102.9	156.7	-75	-177	-7.5	0	0	110
481	Q	35	Very low	56.9	Low	183 Å²	183	109.1 Å²	109.1	86%	0.855	59%	0.591	S	S	*	*			trans	-56.2	122.9	175.1	-160.2	156.7	2.3	0	0	108.4	V483	Q481-V483 PolarHBondContact O-N 3.28Å
482	P	48.9	Very low	58.2	Low	102 Å²	102	113.3 Å²	113.3	66%	0.662	59%	0.592	S	S	*	*			trans	-60.3	130.2	-175.1	22.1	-30.8	0	0	0	108.1	N484	P482-N484 PolarHBondContact O-N 2.83Å; P482-N484 VanDerWaalsContact O-N 3.12Å
483	V	55.8	Low	59.6	Low	97 Å²	97	111.2 Å²	111.2	59%	0.588	59%	0.585	S	S	*	*			trans	-42.2	126.8	168.9	177.8	0	0	0	0	106.8	F327 Q481 I485	F327-V483 HydrophobicContact CZ-CG1 4.45Å; Q481-V483 PolarHBondContact O-N 3.28Å; V483-I485 HydrophobicContact CB-CD1 4.33Å; V483-I485 HydrophobicContact CB-CG1 3.95Å; V483-I485 HydrophobicContact CG1-CG1 3.79Å; V483-I485 WeakPolarHBondContact O-CG1 3.29Å; V483-I485 PolarHBondContact O-N 2.88Å
484	N	63.3	Low	61.6	Low	140 Å²	140	114.2 Å²	114.2	75%	0.749	59%	0.586	S	S	*	*			trans	-67.6	66	178.9	-93	-39.9	0	0	0	110.1	P482 S486 N489	P482-N484 PolarHBondContact O-N 2.83Å; P482-N484 VanDerWaalsContact O-N 3.12Å; N484-S486 PolarHBondContact O-N 3.2Å; N484-N489 PolarHBondContact O-ND2 2.74Å
485	I	73.6	Confident	63.7	Low	20 Å²	20	109.9 Å²	109.9	10%	0.103	55%	0.55	C	S	.	.			trans	-70.5	116.6	178.8	-61.8	169.9	0	0	0	105.6	F327 L461 P462 Y465 V483	F327-I485 HydrophobicContact CE1-CD1 3.79Å; F327-I485 HydrophobicContact CE1-CG1 3.79Å; F327-I485 HydrophobicContact CE1-CG2 4.2Å; F327-I485 HydrophobicContact CZ-CD1 4.27Å; F327-I485 HydrophobicContact CZ-CG1 3.87Å; L461-I485 HydrophobicContact CD2-CG2 3.43Å; L461-I485 VanDerWaalsContact CD2-CG2 3.43Å; L461-I485 HydrophobicContact CG-CG2 3.71Å; P462-I485 WeakPolarHBondContact CG-O 3.24Å; Y465-I485 HydrophobicContact CD1-CD1 3.65Å; Y465-I485 HydrophobicContact CD2-CD1 3.54Å; Y465-I485 HydrophobicContact CE1-CD1 3.77Å; Y465-I485 HydrophobicContact CE2-CD1 3.65Å; Y465-I485 HydrophobicContact CG-CD1 3.53Å; V483-I485 HydrophobicContact CB-CD1 4.33Å; V483-I485 HydrophobicContact CB-CG1 3.95Å; V483-I485 HydrophobicContact CG1-CG1 3.79Å; V483-I485 WeakPolarHBondContact O-CG1 3.29Å; V483-I485 PolarHBondContact O-N 2.88Å
486	S	76.7	Confident	65.9	Low	39 Å²	39	101.8 Å²	101.8	27%	0.273	51%	0.507	S	S	.	.			trans	-141	162.3	175.5	76.4	0	0	0	0	109.3	N484 R488 N489 Y490	N484-S486 PolarHBondContact O-N 3.2Å; S486-R488 PolarHBondContact O-N 3.1Å; S486-R488 PolarHBondContact OG-N 3.2Å; S486-N489 PolarHBondContact O-N 2.98Å; S486-N489 PolarHBondContact OG-N 2.95Å; S486-N489 PolarHBondContact OG-ND2 2.67Å; S486-Y490 PolarHBondContact O-N 2.79Å
487	R	76.6	Confident	68.4	Low	136 Å²	136	104.6 Å²	104.6	51%	0.513	50%	0.501	S	S	.	.	T	Hydrogen-bonded Turn	trans	-47.6	-32.4	170.2	-176.7	-170.1	176	167.8	-6.8	112.3	D459 Y490	D459-R487 WeakPolarHBondContact OD1-CD 3.36Å; D459-R487 IonicContact OD1-CZ 3.94Å; D459-R487 IonicContact OD1-NE 2.78Å; D459-R487 PolarHBondContact OD1-NE 3.13Å; D459-R487 VanDerWaalsContact OD1-NE 3.14Å; D459-R487 IonicContact OD1-NH1 3.79Å; D459-R487 PolarHBondContact OD1-NH1 3.23Å; D459-R487 IonicContact OD1-NH2 2.75Å; D459-R487 IonicContact OD2-NH1 3.71Å; R487-Y490 VanDerWaalsContact O-CD1 3.25Å; R487-Y490 WeakPolarHBondContact O-CD1 3.09Å; R487-Y490 WeakPolarHBondContact O-CE1 3.46Å
488	R	76	Confident	71.4	Confident	203 Å²	203	99.5 Å²	99.5	77%	0.766	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90	-3.8	-175.3	-62.5	-173.4	-177.9	130	-0.8	114.5	S486 F491	S486-R488 PolarHBondContact O-N 3.1Å; S486-R488 PolarHBondContact OG-N 3.2Å; R488-F491 WeakPolarHBondContact O-CE1 3.05Å; R488-F491 WeakPolarHBondContact O-CZ 3.04Å
489	N	79.8	Confident	74.1	Confident	41 Å²	41	94.6 Å²	94.6	22%	0.219	44%	0.444	C	S	.	.	T	Hydrogen-bonded Turn	trans	-128.3	-9.2	-173.2	-67.1	-21.8	0	0	0	114.3	N484 S486 F491 R492	N484-N489 PolarHBondContact O-ND2 2.74Å; S486-N489 PolarHBondContact O-N 2.98Å; S486-N489 PolarHBondContact OG-N 2.95Å; S486-N489 PolarHBondContact OG-ND2 2.67Å; N489-F491 PolarHBondContact O-N 2.84Å; N489-R492 WeakPolarHBondContact O-CB 3.2Å; N489-R492 WeakPolarHBondContact O-CG 3.49Å; N489-R492 PolarHBondContact O-N 3.49Å; N489-R492 PolarHBondContact OD1-NE 2.82Å; N489-R492 PolarHBondContact OD1-NH2 3.13Å
490	Y	84.6	Confident	76.9	Confident	14 Å²	14	91.4 Å²	91.4	6%	0.055	43%	0.425	C	S	.	.	G	3₁₀ helix	trans	-61.3	-31.1	-178.7	80.9	-89.3	0	0	0	112.6	F323 M458 L461 S486 R487 R492 S493 G496 L499 Y500	F323-Y490 HydrophobicContact CE2-CD2 4.31Å; M458-Y490 HydrophobicContact CB-CD1 4.16Å; M458-Y490 HydrophobicContact CB-CE1 3.75Å; M458-Y490 HydrophobicContact CE-CD1 4.02Å; M458-Y490 HydrophobicContact CE-CD2 3.45Å; M458-Y490 VanDerWaalsContact CE-CD2 3.45Å; M458-Y490 HydrophobicContact CE-CE1 4.24Å; M458-Y490 HydrophobicContact CE-CE2 3.7Å; M458-Y490 HydrophobicContact CE-CG 3.61Å; M458-Y490 HydrophobicContact CG-CD1 4.38Å; M458-Y490 HydrophobicContact CG-CE1 3.81Å; M458-Y490 HydrophobicContact CG-CE2 4.19Å; L461-Y490 HydrophobicContact CD2-CG 4.3Å; S486-Y490 PolarHBondContact O-N 2.79Å; R487-Y490 VanDerWaalsContact O-CD1 3.25Å; R487-Y490 WeakPolarHBondContact O-CD1 3.09Å; R487-Y490 WeakPolarHBondContact O-CE1 3.46Å; Y490-R492 PolarHBondContact O-N 2.83Å; Y490-R492 VanDerWaalsContact O-N 3.13Å; Y490-S493 PolarHBondContact O-N 2.79Å; Y490-S493 PolarHBondContact O-OG 3.27Å; Y490-G496 WeakPolarHBondContact CE2-O 3.5Å; Y490-G496 WeakPolarHBondContact O-CA 3.46Å; Y490-L499 HydrophobicContact CE2-CD2 4.35Å; Y490-L499 HydrophobicContact CE2-CG 4.38Å; Y490-Y500 WeakPolarHBondContact OH-CD2 3.49Å
491	F	86.8	Confident	79.7	Confident	84 Å²	84	86.1 Å²	86.1	37%	0.368	41%	0.405	S	S	.	.	G	3₁₀ helix	trans	-73.4	7.5	175.6	61.6	-101.2	0	0	0	114	R488 N489 R497 Y500	R488-F491 WeakPolarHBondContact O-CE1 3.05Å; R488-F491 WeakPolarHBondContact O-CZ 3.04Å; N489-F491 PolarHBondContact O-N 2.84Å; F491-R497 HydrophobicContact CB-CG 4.39Å; F491-R497 WeakPolarHBondContact O-CG 3.02Å; F491-Y500 HydrophobicContact CB-CG 4.5Å
492	R	83.9	Confident	82.7	Confident	185 Å²	185	78.1 Å²	78.1	70%	0.698	37%	0.369	S	S	*	.	G	3₁₀ helix	trans	-76.7	-28.4	171.9	-67	-179.1	-178.1	-167.2	-1.8	111.9	N489 Y490	N489-R492 WeakPolarHBondContact O-CB 3.2Å; N489-R492 WeakPolarHBondContact O-CG 3.49Å; N489-R492 PolarHBondContact O-N 3.49Å; N489-R492 PolarHBondContact OD1-NE 2.82Å; N489-R492 PolarHBondContact OD1-NH2 3.13Å; Y490-R492 PolarHBondContact O-N 2.83Å; Y490-R492 VanDerWaalsContact O-N 3.13Å
493	S	84.1	Confident	84.9	Confident	24 Å²	24	73.6 Å²	73.6	17%	0.168	34%	0.339	C	S	.	.	S	Bend	trans	-79.8	157.5	175.7	71.6	0	0	0	0	111.9	Y490 S495 G496 R497	Y490-S493 PolarHBondContact O-N 2.79Å; Y490-S493 PolarHBondContact O-OG 3.27Å; S493-S495 PolarHBondContact OG-OG 3.32Å; S493-G496 PolarHBondContact O-N 3.26Å; S493-G496 WeakPolarHBondContact OG-CA 3.4Å; S493-G496 PolarHBondContact OG-N 3.24Å; S493-R497 WeakPolarHBondContact O-CG 3.4Å; S493-R497 PolarHBondContact O-N 3.46Å
494	K	88.2	Confident	86.8	Confident	160 Å²	160	71.2 Å²	71.2	70%	0.696	33%	0.326	S	S	*	.	H	α-helix	trans	-58.9	-48.3	175.3	-70.9	-179.6	-180	178.9	0	111.2	R497 S498	K494-R497 PolarHBondContact O-N 2.82Å; K494-S498 PolarHBondContact O-N 3.11Å; K494-S498 VanDerWaalsContact O-N 3.15Å
495	S	91.6	Very high	88.4	Confident	0 Å²	0	67.5 Å²	67.5	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-63.1	-40.4	177.3	49.8	0	0	0	0	112.9	D326 S493 S498 L499	D326-S495 WeakPolarHBondContact OD2-CB 3.42Å; D326-S495 PolarHBondContact OD2-OG 3.12Å; S493-S495 PolarHBondContact OG-OG 3.32Å; S495-S498 WeakPolarHBondContact O-CB 3.32Å; S495-S498 PolarHBondContact O-N 2.84Å; S495-L499 PolarHBondContact O-N 3.45Å
496	G	92.1	Very high	89.5	Confident	0 Å²	0	66.5 Å²	66.5	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-68.3	-35.7	177.2	0	0	0	0	0	113.6	Y490 S493 L499 Y500	Y490-G496 WeakPolarHBondContact CE2-O 3.5Å; Y490-G496 WeakPolarHBondContact O-CA 3.46Å; S493-G496 PolarHBondContact O-N 3.26Å; S493-G496 WeakPolarHBondContact OG-CA 3.4Å; S493-G496 PolarHBondContact OG-N 3.24Å; G496-L499 PolarHBondContact O-N 3.17Å; G496-Y500 WeakPolarHBondContact O-CB 2.9Å; G496-Y500 PolarHBondContact O-N 3.2Å
497	R	92.6	Very high	90.4	Very high	137 Å²	137	68 Å²	68	52%	0.517	30%	0.304	S	S	.	.	H	α-helix	trans	-62.5	-44	170.9	-73.3	-174	-73.1	156.2	-3.6	111.9	F491 S493 K494 L499 Y500 V501	F491-R497 HydrophobicContact CB-CG 4.39Å; F491-R497 WeakPolarHBondContact O-CG 3.02Å; S493-R497 WeakPolarHBondContact O-CG 3.4Å; S493-R497 PolarHBondContact O-N 3.46Å; K494-R497 PolarHBondContact O-N 2.82Å; R497-L499 VanDerWaalsContact C-N 3.33Å; R497-L499 PolarHBondContact O-N 3.26Å; R497-Y500 PolarHBondContact O-N 3.32Å; R497-V501 WeakPolarHBondContact O-CG2 3.46Å; R497-V501 PolarHBondContact O-N 3.13Å
498	S	95.6	Very high	91.2	Very high	52 Å²	52	66.3 Å²	66.3	36%	0.364	30%	0.302	S	S	.	.	H	α-helix	trans	-58.2	-46.7	176.4	178.6	0	0	0	0	111.1	S319 K494 S495 V501 S502	S319-S498 PolarHBondContact OG-OG 2.92Å; K494-S498 PolarHBondContact O-N 3.11Å; K494-S498 VanDerWaalsContact O-N 3.15Å; S495-S498 WeakPolarHBondContact O-CB 3.32Å; S495-S498 PolarHBondContact O-N 2.84Å; S498-V501 PolarHBondContact O-N 3.31Å; S498-S502 PolarHBondContact O-N 3.39Å; S498-S502 PolarHBondContact O-OG 3.47Å
499	L	96.6	Very high	92	Very high	0 Å²	0	58.8 Å²	58.8	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-61.1	-45.2	175.8	178.1	57.8	0	0	0	112.7	V316 F320 F323 F437 M458 Y490 S495 G496 R497 V501 S502 I503	V316-L499 HydrophobicContact CG1-CD1 4.16Å; F320-L499 HydrophobicContact CB-CD1 3.89Å; F320-L499 HydrophobicContact CD2-CD2 3.93Å; F323-L499 HydrophobicContact CB-CB 4.5Å; F323-L499 HydrophobicContact CB-CD2 4.03Å; F323-L499 HydrophobicContact CD1-CD2 3.95Å; F323-L499 HydrophobicContact CD2-CD2 4.46Å; F323-L499 HydrophobicContact CG-CD2 3.88Å; F437-L499 HydrophobicContact CE1-CD1 4.21Å; F437-L499 HydrophobicContact CZ-CD1 4.38Å; M458-L499 HydrophobicContact CE-CD2 3.71Å; M458-L499 HydrophobicContact SD-CD2 3.96Å; Y490-L499 HydrophobicContact CE2-CD2 4.35Å; Y490-L499 HydrophobicContact CE2-CG 4.38Å; S495-L499 PolarHBondContact O-N 3.45Å; G496-L499 PolarHBondContact O-N 3.17Å; R497-L499 VanDerWaalsContact C-N 3.33Å; R497-L499 PolarHBondContact O-N 3.26Å; L499-V501 PolarHBondContact O-N 2.86Å; L499-S502 PolarHBondContact O-N 3.29Å; L499-I503 HydrophobicContact CD1-CD1 3.9Å; L499-I503 HydrophobicContact CD1-CG1 4.16Å; L499-I503 HydrophobicContact CG-CD1 3.91Å; L499-I503 WeakPolarHBondContact O-CG1 3.37Å; L499-I503 PolarHBondContact O-N 2.87Å
500	Y	95.4	Very high	92.7	Very high	117 Å²	117	58.8 Å²	58.8	46%	0.459	28%	0.275	S	S	.	.	H	α-helix	trans	-57.2	-48.1	176.6	175.8	-97.4	0	0	0	111.8	Y490 F491 G496 R497 S502 I503 C504	Y490-Y500 WeakPolarHBondContact OH-CD2 3.49Å; F491-Y500 HydrophobicContact CB-CG 4.5Å; G496-Y500 WeakPolarHBondContact O-CB 2.9Å; G496-Y500 PolarHBondContact O-N 3.2Å; R497-Y500 PolarHBondContact O-N 3.32Å; Y500-S502 PolarHBondContact O-N 3.02Å; Y500-I503 PolarHBondContact O-N 2.04Å; Y500-C504 VanDerWaalsContact CZ-SG 3.53Å; Y500-C504 PolarHBondContact O-N 3.45Å; Y500-C504 PolarHBondContact O-SG 3.02Å; Y500-C504 VanDerWaalsContact O-SG 3.36Å
501	V	96.3	Very high	93	Very high	75 Å²	75	62.7 Å²	62.7	46%	0.455	30%	0.304	S	S	.	.	H	α-helix	trans	-61.3	-43.6	178.3	171.6	0	0	0	0	111.4	R497 S498 L499 I503 C504 N505	R497-V501 WeakPolarHBondContact O-CG2 3.46Å; R497-V501 PolarHBondContact O-N 3.13Å; S498-V501 PolarHBondContact O-N 3.31Å; L499-V501 PolarHBondContact O-N 2.86Å; V501-I503 VanDerWaalsContact C-N 3.34Å; V501-I503 PolarHBondContact O-N 3.46Å; V501-C504 PolarHBondContact O-N 3Å; V501-N505 WeakPolarHBondContact O-CB 3.47Å; V501-N505 VanDerWaalsContact O-CG 3.22Å; V501-N505 PolarHBondContact O-N 3.16Å; V501-N505 PolarHBondContact O-ND2 2.97Å
502	S	97.4	Very high	93.2	Very high	14 Å²	14	64.7 Å²	64.7	10%	0.098	32%	0.315	C	S	.	.	H	α-helix	trans	-61.5	-40.5	176.7	-68.5	0	0	0	0	112.2	V316 S319 S498 L499 Y500 N505 M506	V316-S502 WeakPolarHBondContact CG2-O 2.8Å; S319-S502 PolarHBondContact OG-OG 2.91Å; S498-S502 PolarHBondContact O-N 3.39Å; S498-S502 PolarHBondContact O-OG 3.47Å; L499-S502 PolarHBondContact O-N 3.29Å; Y500-S502 PolarHBondContact O-N 3.02Å; S502-N505 PolarHBondContact O-N 3.2Å; S502-M506 PolarHBondContact O-N 2.91Å; S502-M506 VanDerWaalsContact O-N 3.09Å
503	I	96.6	Very high	93.3	Very high	7 Å²	7	58.4 Å²	58.4	4%	0.036	30%	0.295	C	S	.	.	H	α-helix	trans	-64.7	-45.9	175.2	-68.5	165.8	0	0	0	110.7	V316 F437 D438 Y439 M458 L499 Y500 V501 N505 M506 H507	V316-I503 HydrophobicContact CG1-CG1 4.03Å; V316-I503 HydrophobicContact CG2-CG1 4.32Å; F437-I503 HydrophobicContact CD1-CD1 3.7Å; F437-I503 HydrophobicContact CD1-CG1 4.11Å; F437-I503 HydrophobicContact CE1-CD1 3.84Å; F437-I503 HydrophobicContact CE1-CG1 4.39Å; D438-I503 WeakPolarHBondContact OD1-CG2 2.91Å; Y439-I503 HydrophobicContact CD1-CG2 4.38Å; M458-I503 HydrophobicContact CG-CD1 4.21Å; L499-I503 HydrophobicContact CD1-CD1 3.9Å; L499-I503 HydrophobicContact CD1-CG1 4.16Å; L499-I503 HydrophobicContact CG-CD1 3.91Å; L499-I503 WeakPolarHBondContact O-CG1 3.37Å; L499-I503 PolarHBondContact O-N 2.87Å; Y500-I503 PolarHBondContact O-N 2.04Å; V501-I503 VanDerWaalsContact C-N 3.34Å; V501-I503 PolarHBondContact O-N 3.46Å; I503-N505 VanDerWaalsContact C-N 3.33Å; I503-N505 PolarHBondContact O-N 2.95Å; I503-M506 WeakPolarHBondContact O-CB 3.2Å; I503-M506 PolarHBondContact O-N 2.99Å; I503-M506 VanDerWaalsContact O-N 3.13Å; I503-H507 PolarHBondContact O-CD2 3.43Å; I503-H507 VanDerWaalsContact O-CD2 3.27Å; I503-H507 PolarHBondContact O-N 3.39Å
504	C	96	Very high	93.1	Very high	47 Å²	47	62.6 Å²	62.6	32%	0.318	32%	0.324	S	S	.	.	H	α-helix	trans	-59.4	-42.5	176.1	-69.8	0	0	0	0	112.3	Y500 V501 M506 H507 Q508	Y500-C504 VanDerWaalsContact CZ-SG 3.53Å; Y500-C504 PolarHBondContact O-N 3.45Å; Y500-C504 PolarHBondContact O-SG 3.02Å; Y500-C504 VanDerWaalsContact O-SG 3.36Å; V501-C504 PolarHBondContact O-N 3Å; C504-M506 VanDerWaalsContact C-N 3.27Å; C504-M506 PolarHBondContact O-N 2.85Å; C504-H507 PolarHBondContact O-N 2Å; C504-Q508 PolarHBondContact O-N 3.33Å
505	N	96.9	Very high	92.9	Very high	62 Å²	62	57.2 Å²	57.2	33%	0.332	30%	0.303	S	S	.	.	H	α-helix	trans	-62.6	-34.7	176.5	-73	-22	0	0	0	112.3	V501 S502 I503 H509	V501-N505 WeakPolarHBondContact O-CB 3.47Å; V501-N505 VanDerWaalsContact O-CG 3.22Å; V501-N505 PolarHBondContact O-N 3.16Å; V501-N505 PolarHBondContact O-ND2 2.97Å; S502-N505 PolarHBondContact O-N 3.2Å; I503-N505 VanDerWaalsContact C-N 3.33Å; I503-N505 PolarHBondContact O-N 2.95Å; N505-H509 WeakPolarHBondContact O-CB 3.18Å; N505-H509 PolarHBondContact O-N 2.65Å
506	M	95.6	Very high	92.5	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-67.8	-46.5	174	-175.9	62.4	-173.6	0	0	111.3	C310 K312 H313 V316 Y439 S502 I503 C504 Q508 H509 I510 W516	C310-M506 VanDerWaalsContact SG-CE 3.58Å; K312-M506 HydrophobicContact CB-CB 4.48Å; K312-M506 HydrophobicContact CB-SD 3.67Å; H313-M506 HydrophobicContact CB-CE 4.36Å; H313-M506 HydrophobicContact CB-SD 4.35Å; V316-M506 HydrophobicContact CG2-CB 4.16Å; Y439-M506 HydrophobicContact CD1-CB 4.12Å; Y439-M506 HydrophobicContact CD1-CG 3.78Å; Y439-M506 HydrophobicContact CD2-CE 4.17Å; Y439-M506 HydrophobicContact CD2-CG 3.8Å; Y439-M506 HydrophobicContact CE1-CB 4.18Å; Y439-M506 HydrophobicContact CE1-CG 3.9Å; Y439-M506 HydrophobicContact CE2-CE 4.27Å; Y439-M506 HydrophobicContact CE2-CG 3.95Å; Y439-M506 HydrophobicContact CG-CG 3.72Å; S502-M506 PolarHBondContact O-N 2.91Å; S502-M506 VanDerWaalsContact O-N 3.09Å; I503-M506 WeakPolarHBondContact O-CB 3.2Å; I503-M506 PolarHBondContact O-N 2.99Å; I503-M506 VanDerWaalsContact O-N 3.13Å; C504-M506 VanDerWaalsContact C-N 3.27Å; C504-M506 PolarHBondContact O-N 2.85Å; M506-Q508 VanDerWaalsContact C-N 3.32Å; M506-Q508 PolarHBondContact O-N 2.86Å; M506-H509 WeakPolarHBondContact O-CB 3.45Å; M506-H509 PolarHBondContact O-N 3.02Å; M506-H509 VanDerWaalsContact O-N 3.11Å; M506-I510 HydrophobicContact CE-CD1 3.77Å; M506-I510 HydrophobicContact CE-CG1 3.9Å; M506-I510 HydrophobicContact CG-CD1 4.18Å; M506-I510 WeakPolarHBondContact O-CG1 3.46Å; M506-I510 PolarHBondContact O-N 3.38Å; M506-W516 HydrophobicContact CE-CD2 4.49Å; M506-W516 HydrophobicContact CE-CE3 4.22Å; M506-W516 HydrophobicContact CE-CH2 3.74Å; M506-W516 HydrophobicContact CE-CZ2 4.03Å; M506-W516 HydrophobicContact CE-CZ3 3.85Å
507	H	95.3	Very high	92	Very high	69 Å²	69	59.5 Å²	59.5	32%	0.319	31%	0.312	S	S	.	.	H	α-helix	trans	-57.5	-44.3	175	-80.4	-69.8	0	0	0	112.4	D438 I503 C504 H509 I510 S511	D438-H507 IonicContact OD1-CD2 3.02Å; D438-H507 IonicContact OD1-CE1 2.79Å; D438-H507 IonicContact OD1-NE2 2.72Å; D438-H507 PolarHBondContact OD1-NE2 2.77Å; D438-H507 IonicContact OD2-NE2 3.14Å; D438-H507 PolarHBondContact OD2-NE2 2.85Å; I503-H507 PolarHBondContact O-CD2 3.43Å; I503-H507 VanDerWaalsContact O-CD2 3.27Å; I503-H507 PolarHBondContact O-N 3.39Å; C504-H507 PolarHBondContact O-N 2Å; H507-H509 VanDerWaalsContact C-N 3.3Å; H507-H509 PolarHBondContact O-N 3.13Å; H507-I510 PolarHBondContact O-N 3.23Å; H507-S511 PolarHBondContact O-N 2.88Å; H507-S511 PolarHBondContact O-OG 2.9Å
508	Q	95.1	Very high	91.3	Very high	102 Å²	102	60.3 Å²	60.3	48%	0.477	32%	0.322	S	S	.	.	H	α-helix	trans	-61.3	-39.6	175.7	-176.2	178.8	3.9	0	0	111.9	C504 M506 S511 Q512	C504-Q508 PolarHBondContact O-N 3.33Å; M506-Q508 VanDerWaalsContact C-N 3.32Å; M506-Q508 PolarHBondContact O-N 2.86Å; Q508-S511 PolarHBondContact O-N 2.86Å; Q508-S511 PolarHBondContact O-OG 2.84Å; Q508-Q512 WeakPolarHBondContact O-CB 3.14Å; Q508-Q512 VanDerWaalsContact O-CG 3.24Å; Q508-Q512 WeakPolarHBondContact O-CG 3.04Å; Q508-Q512 PolarHBondContact O-N 3.29Å; Q508-Q512 VanDerWaalsContact O-N 3.08Å
509	H	92.5	Very high	89.6	Confident	45 Å²	45	64.3 Å²	64.3	21%	0.208	33%	0.333	C	S	.	.	H	α-helix	trans	-65.6	-41.6	177.7	-178.6	69.2	0	0	0	112.3	K312 N505 M506 H507 N513	K312-H509 HydrophobicContact CG-CB 4.01Å; N505-H509 WeakPolarHBondContact O-CB 3.18Å; N505-H509 PolarHBondContact O-N 2.65Å; M506-H509 WeakPolarHBondContact O-CB 3.45Å; M506-H509 PolarHBondContact O-N 3.02Å; M506-H509 VanDerWaalsContact O-N 3.11Å; H507-H509 VanDerWaalsContact C-N 3.3Å; H507-H509 PolarHBondContact O-N 3.13Å; H509-N513 WeakPolarHBondContact O-CB 3.22Å; H509-N513 PolarHBondContact O-N 3.12Å; H509-N513 VanDerWaalsContact O-N 3.09Å; H509-N513 PolarHBondContact O-ND2 2.02Å
510	I	93.2	Very high	87.7	Confident	41 Å²	41	67.1 Å²	67.1	21%	0.21	35%	0.346	C	S	.	.	H	α-helix	trans	-66.4	-41.2	176.8	-63.7	172.1	0	0	0	111	Y439 M506 H507 Q512 N513 W516	Y439-I510 HydrophobicContact CD2-CD1 4.34Å; Y439-I510 HydrophobicContact CG-CD1 4.33Å; M506-I510 HydrophobicContact CE-CD1 3.77Å; M506-I510 HydrophobicContact CE-CG1 3.9Å; M506-I510 HydrophobicContact CG-CD1 4.18Å; M506-I510 WeakPolarHBondContact O-CG1 3.46Å; M506-I510 PolarHBondContact O-N 3.38Å; H507-I510 PolarHBondContact O-N 3.23Å; I510-Q512 VanDerWaalsContact C-N 3.33Å; I510-Q512 PolarHBondContact O-N 3.01Å; I510-N513 CarbonylContact O-C 3.47Å; I510-N513 PolarHBondContact O-N 3.47Å; I510-N513 VanDerWaalsContact O-O 3.05Å; I510-W516 HydrophobicContact CD1-CZ2 4.43Å; I510-W516 HydrophobicContact CG1-CD2 4.35Å; I510-W516 HydrophobicContact CG1-CG 4.32Å
511	S	91.1	Very high	85.2	Confident	95 Å²	95	67 Å²	67	66%	0.664	36%	0.36	S	S	*	.	H	α-helix	trans	-67.8	-34.4	179.8	69.5	0	0	0	0	112.6	H507 Q508 N513	H507-S511 PolarHBondContact O-N 2.88Å; H507-S511 PolarHBondContact O-OG 2.9Å; Q508-S511 PolarHBondContact O-N 2.86Å; Q508-S511 PolarHBondContact O-OG 2.84Å; S511-N513 VanDerWaalsContact C-N 3.33Å
512	Q	90.9	Very high	82.2	Confident	127 Å²	127	68 Å²	68	59%	0.593	37%	0.37	S	S	*	.	H	α-helix	trans	-74.4	-23	174.4	-70.7	173.9	-7.1	0	0	113	Q508 I510	Q508-Q512 WeakPolarHBondContact O-CB 3.14Å; Q508-Q512 VanDerWaalsContact O-CG 3.24Å; Q508-Q512 WeakPolarHBondContact O-CG 3.04Å; Q508-Q512 PolarHBondContact O-N 3.29Å; Q508-Q512 VanDerWaalsContact O-N 3.08Å; I510-Q512 VanDerWaalsContact C-N 3.33Å; I510-Q512 PolarHBondContact O-N 3.01Å
513	N	86.5	Confident	79.1	Confident	52 Å²	52	71.1 Å²	71.1	28%	0.278	39%	0.39	S	S	.	.			trans	-137.2	85.7	-174.2	-56.6	-87.6	0	0	0	109.8	H509 I510 S511 D515 W516	H509-N513 WeakPolarHBondContact O-CB 3.22Å; H509-N513 PolarHBondContact O-N 3.12Å; H509-N513 VanDerWaalsContact O-N 3.09Å; H509-N513 PolarHBondContact O-ND2 2.02Å; I510-N513 CarbonylContact O-C 3.47Å; I510-N513 PolarHBondContact O-N 3.47Å; I510-N513 VanDerWaalsContact O-O 3.05Å; S511-N513 VanDerWaalsContact C-N 3.33Å; N513-D515 PolarHBondContact O-N 2.81Å; N513-D515 VanDerWaalsContact O-N 3.12Å; N513-W516 HydrophobicContact CB-CB 3.85Å; N513-W516 VanDerWaalsContact O-CB 3.24Å; N513-W516 WeakPolarHBondContact O-CB 3.23Å; N513-W516 VanDerWaalsContact O-CD1 3.29Å; N513-W516 PolarHBondContact O-N 3.49Å
514	S	80.4	Confident	75.9	Confident	113 Å²	113	77.1 Å²	77.1	79%	0.79	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-25	-179.4	54.4	0	0	0	0	113.4
515	D	82.9	Confident	72.8	Confident	46 Å²	46	77.3 Å²	77.3	25%	0.246	44%	0.439	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.2	23.9	176.9	62.8	-16.1	0	0	0	113.5	N513 F517 E518 K519	N513-D515 PolarHBondContact O-N 2.81Å; N513-D515 VanDerWaalsContact O-N 3.12Å; D515-F517 PolarHBondContact O-N 3.08Å; D515-E518 HydrophobicContact CB-CB 4.46Å; D515-E518 PolarHBondContact O-N 2.9Å; D515-K519 VanDerWaalsContact CG-CE 3.5Å; D515-K519 PolarHBondContact O-N 3.12Å; D515-K519 WeakPolarHBondContact OD1-CD 3.33Å; D515-K519 IonicContact OD1-NZ 3.56Å; D515-K519 PolarHBondContact OD1-NZ 2.8Å; D515-K519 VanDerWaalsContact OD2-CD 3.24Å; D515-K519 WeakPolarHBondContact OD2-CD 3.18Å; D515-K519 WeakPolarHBondContact OD2-CE 3.33Å; D515-K519 WeakPolarHBondContact OD2-CG 3.48Å; D515-K519 IonicContact OD2-NZ 3.85Å; D515-K519 PolarHBondContact OD2-NZ 2.97Å
516	W	83.9	Confident	69.8	Low	29 Å²	29	81 Å²	81	11%	0.11	47%	0.466	C	S	.	.	T	Hydrogen-bonded Turn	trans	-49.7	-29.7	-177.2	68	-87	0	0	0	114.8	D309 C310 K367 M506 I510 N513	D309-W516 HydrophobicContact CB-CZ3 4.42Å; C310-W516 HydrophobicContact CB-CE3 4.3Å; C310-W516 HydrophobicContact CB-CZ3 4.49Å; K367-W516 HydrophobicContact CB-CH2 4.36Å; K367-W516 HydrophobicContact CB-CZ2 4.34Å; K367-W516 HydrophobicContact CD-CZ2 4.39Å; M506-W516 HydrophobicContact CE-CD2 4.49Å; M506-W516 HydrophobicContact CE-CE3 4.22Å; M506-W516 HydrophobicContact CE-CH2 3.74Å; M506-W516 HydrophobicContact CE-CZ2 4.03Å; M506-W516 HydrophobicContact CE-CZ3 3.85Å; I510-W516 HydrophobicContact CD1-CZ2 4.43Å; I510-W516 HydrophobicContact CG1-CD2 4.35Å; I510-W516 HydrophobicContact CG1-CG 4.32Å; N513-W516 HydrophobicContact CB-CB 3.85Å; N513-W516 VanDerWaalsContact O-CB 3.24Å; N513-W516 WeakPolarHBondContact O-CB 3.23Å; N513-W516 VanDerWaalsContact O-CD1 3.29Å; N513-W516 PolarHBondContact O-N 3.49Å
517	F	81.1	Confident	66.6	Low	19 Å²	19	85.4 Å²	85.4	8%	0.083	50%	0.503	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.3	-34.6	179	-170.8	-103.1	0	0	0	113.2	K367 G368 Y371 Y372 D515 Q520	K367-F517 HydrophobicContact CD-CB 3.9Å; K367-F517 HydrophobicContact CD-CD1 3.93Å; K367-F517 HydrophobicContact CD-CG 3.87Å; K367-F517 HydrophobicContact CG-CD1 3.91Å; K367-F517 HydrophobicContact CG-CD2 4.42Å; K367-F517 HydrophobicContact CG-CE1 4.24Å; K367-F517 HydrophobicContact CG-CG 4.01Å; G368-F517 VanDerWaalsContact CA-CZ 3.48Å; Y371-F517 HydrophobicContact CD1-CE1 4.22Å; Y371-F517 HydrophobicContact CD1-CZ 4.02Å; Y371-F517 HydrophobicContact CD2-CE1 4.08Å; Y371-F517 AromaticContact CG-CE1 3.77Å; Y371-F517 HydrophobicContact CG-CE1 3.77Å; Y371-F517 AromaticContact CG-CZ 3.87Å; Y371-F517 HydrophobicContact CG-CZ 3.87Å; Y372-F517 HydrophobicContact CE2-CZ 4.37Å; D515-F517 PolarHBondContact O-N 3.08Å; F517-Q520 PolarHBondContact O-N 3.44Å
518	E	78.5	Confident	63.2	Low	154 Å²	154	88.2 Å²	88.2	72%	0.72	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.5	-27.4	-177	-68.3	174.8	-167.4	0	0	112.2	D515 Q520	D515-E518 HydrophobicContact CB-CB 4.46Å; D515-E518 PolarHBondContact O-N 2.9Å; E518-Q520 VanDerWaalsContact C-N 3.25Å; E518-Q520 PolarHBondContact O-N 3.2Å
519	K	59.9	Low	60	Low	137 Å²	137	88.4 Å²	88.4	60%	0.596	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.3	-3.5	173.2	-80.9	179.5	171	139.3	0	114.5	D515 P521	D515-K519 VanDerWaalsContact CG-CE 3.5Å; D515-K519 PolarHBondContact O-N 3.12Å; D515-K519 WeakPolarHBondContact OD1-CD 3.33Å; D515-K519 IonicContact OD1-NZ 3.56Å; D515-K519 PolarHBondContact OD1-NZ 2.8Å; D515-K519 VanDerWaalsContact OD2-CD 3.24Å; D515-K519 WeakPolarHBondContact OD2-CD 3.18Å; D515-K519 WeakPolarHBondContact OD2-CE 3.33Å; D515-K519 WeakPolarHBondContact OD2-CG 3.48Å; D515-K519 IonicContact OD2-NZ 3.85Å; D515-K519 PolarHBondContact OD2-NZ 2.97Å; K519-P521 VanDerWaalsContact O-CD 3.28Å; K519-P521 WeakPolarHBondContact O-CD 3.48Å
520	Q	57.4	Low	57.1	Low	59 Å²	59	91.5 Å²	91.5	28%	0.276	57%	0.568	S	S	.	*	P	Polyproline II helix	trans	-69.5	118.4	179.5	-71.4	-140.6	-29.8	0	0	110.7	R308 D309 F517 E518 S522	R308-Q520 PolarHBondContact O-OE1 3.27Å; D309-Q520 PolarHBondContact O-NE2 3.15Å; F517-Q520 PolarHBondContact O-N 3.44Å; E518-Q520 VanDerWaalsContact C-N 3.25Å; E518-Q520 PolarHBondContact O-N 3.2Å; Q520-S522 PolarHBondContact O-N 3Å
521	P	42	Very low	54	Low	115 Å²	115	95.2 Å²	95.2	75%	0.747	60%	0.598	S	S	*	*	P	Polyproline II helix	trans	-66.2	131.6	179.5	25.6	-30.7	0	0	0	109.5	K519	K519-P521 VanDerWaalsContact O-CD 3.28Å; K519-P521 WeakPolarHBondContact O-CD 3.48Å
522	S	33.8	Very low	51.1	Low	95 Å²	95	97.2 Å²	97.2	66%	0.664	61%	0.606	S	S	*	*	P	Polyproline II helix	trans	-48.5	145.4	157.1	47.9	0	0	0	0	109.3	Q520	Q520-S522 PolarHBondContact O-N 3Å
523	P	32.6	Very low	48	Very low	80 Å²	80	97 Å²	97	52%	0.519	62%	0.615	S	S	.	*	P	Polyproline II helix	trans	-52.5	138.4	178.2	22.7	-31.6	0	0	0	109.3	G525	P523-G525 PolarHBondContact O-N 2.98Å
524	P	28.5	Very low	45.1	Very low	133 Å²	133	102.6 Å²	102.6	86%	0.864	64%	0.639	S	S	*	*			trans	-62.5	106.3	-176.9	24.2	-31.1	0	0	0	108.7
525	G	30.9	Very low	42.8	Very low	50 Å²	50	103.2 Å²	103.2	52%	0.515	64%	0.641	S	S	.	*			trans	-62.3	155.5	153.8	0	0	0	0	0	108.4	P523 A527	P523-G525 PolarHBondContact O-N 2.98Å; G525-A527 PolarHBondContact O-N 3.09Å
526	P	33.8	Very low	40.2	Very low	141 Å²	141	110 Å²	110	92%	0.916	67%	0.671	S	S	*	*			trans	-67.5	99	-176.6	29.3	-31.7	0	0	0	108.2
527	A	27.9	Very low	37.6	Very low	92 Å²	92	115.4 Å²	115.4	76%	0.76	69%	0.691	S	S	*	*			trans	-118.2	107	169.8	0	0	0	0	0	107.5	G525 S529	G525-A527 PolarHBondContact O-N 3.09Å; A527-S529 PolarHBondContact O-N 3.25Å
528	C	25.2	Very low	35	Very low	127 Å²	127	122.7 Å²	122.7	86%	0.858	73%	0.73	S	S	*	*			trans	-56.8	124.3	162.7	-56.8	0	0	0	0	109.2
529	S	27.4	Very low	32.5	Very low	106 Å²	106	124.9 Å²	124.9	74%	0.741	74%	0.738	S	S	*	*			trans	142.3	103.7	133.9	70.9	0	0	0	0	113.8	A527	A527-S529 PolarHBondContact O-N 3.25Å
530	S	31	Very low	30.8	Very low	110 Å²	110	126.1 Å²	126.1	77%	0.769	75%	0.751	S	S	*	*			trans	52.2	92.9	132.6	58.4	0	0	0	0	120.4
531	S	28.3	Very low	29.4	Very low	120 Å²	120	128.9 Å²	128.9	84%	0.839	78%	0.776	S	S	*	*				-173.9	133	128.3	43.6	0	0	0	0	110
532	V	29.4	Very low	28.7	Very low	137 Å²	137	126.8 Å²	126.8	83%	0.83	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-101.7	128.9	-169.9	174.4	0	0	0	0	110.6
533	P	26.1	Very low	28.4	Very low	121 Å²	121	128.9 Å²	128.9	79%	0.786	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-101.6	140	145	-1.7	21.6	0	0	0	110.7
534	Q	25.7	Very low	28.2	Very low	170 Å²	170	131.4 Å²	131.4	79%	0.794	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-63.7	151.3	-176.4	-70.1	-167.7	-72.1	0	0	114
535	P	33.4	Very low	28.1	Very low	126 Å²	126	132.8 Å²	132.8	82%	0.818	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-83.5	133.9	174.8	31.2	-30.7	0	0	0	113.1
536	E	26.7	Very low	27.9	Very low	190 Å²	190	137.8 Å²	137.8	89%	0.888	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-72.2	150.9	161.2	-72	-174.7	143.1	0	0	111.1
537	R	29.5	Very low	27.6	Very low	142 Å²	142	140.3 Å²	140.3	54%	0.536	81%	0.812	S	S	.	*	P	Polyproline II helix	trans	-78.9	129.3	-170.5	-66.5	167.4	167.1	-169	-19.8	111.4	Q227	Q227-R537 VanDerWaalsContact CB-NH2 3.27Å; Q227-R537 VanDerWaalsContact O-CZ 3.24Å; Q227-R537 PolarHBondContact O-NH1 3.5Å; Q227-R537 PolarHBondContact O-NH2 3.15Å
538	L	27.1	Very low	27.4	Very low	172 Å²	172	142 Å²	142	90%	0.901	81%	0.813	S	S	*	*			trans	-124.2	127.6	158.4	-94.3	153.6	0	0	0	108.7
539	F	25	Very low	27.3	Very low	200 Å²	200	143.5 Å²	143.5	88%	0.877	81%	0.811	S	S	*	*			trans	-68.7	140.8	174.3	-76.3	-100.8	0	0	0	109.5
540	D	25.6	Very low	27.1	Very low	163 Å²	163	144 Å²	144	87%	0.872	81%	0.81	S	S	*	*			trans	-127.6	124	171.1	-149.7	3.8	0	0	0	110.3
541	S	28.1	Very low	26.7	Very low	116 Å²	116	143.5 Å²	143.5	81%	0.811	81%	0.805	S	S	*	*			trans	-91.7	119.2	172.3	-74.1	0	0	0	0	107.3
542	G	27	Very low	26.6	Very low	72 Å²	72	146.7 Å²	146.7	74%	0.742	81%	0.807	S	S	*	*			trans	-71.1	142.8	-175.1	0	0	0	0	0	114.3
543	V	27.7	Very low	26.3	Very low	138 Å²	138	149.3 Å²	149.3	84%	0.836	81%	0.81	S	S	*	*			trans	-141.2	119.8	145.5	-174	0	0	0	0	107.1
544	V	28	Very low	26.2	Very low	133 Å²	133	148.5 Å²	148.5	81%	0.806	81%	0.813	S	S	*	*			trans	-89.7	129.9	178.7	173.2	0	0	0	0	108.6
545	L	26.2	Very low	26.1	Very low	162 Å²	162	145.3 Å²	145.3	85%	0.848	82%	0.816	S	S	*	*			trans	-129.1	130	161.6	-84	168	0	0	0	109.9
546	N	27.1	Very low	25.6	Very low	156 Å²	156	146.5 Å²	146.5	83%	0.834	82%	0.815	S	S	*	*			trans	-70.2	127.5	179.7	-126.3	14.3	0	0	0	109.5
547	E	27.8	Very low	25.5	Very low	193 Å²	193	145.1 Å²	145.1	90%	0.902	81%	0.814	S	S	*	*			trans	-108.4	129.5	168.6	-74.7	-158.8	159	0	0	112.1
548	V	23	Very low	25.5	Very low	129 Å²	129	143 Å²	143	78%	0.782	82%	0.818	S	S	*	*			trans	-80.2	129.1	-177.4	170.5	0	0	0	0	109.5	V550	V548-V550 PolarHBondContact O-N 3.4Å
549	L	23.3	Very low	25.6	Very low	157 Å²	157	143.3 Å²	143.3	82%	0.822	82%	0.815	S	S	*	*			trans	-72.9	113.1	175.3	-147.1	99.9	0	0	0	109.8
550	V	23.8	Very low	26.2	Very low	117 Å²	117	138.2 Å²	138.2	71%	0.709	80%	0.802	S	S	*	*			trans	-104.9	107	168.4	177.8	0	0	0	0	108.8	V548	V548-V550 PolarHBondContact O-N 3.4Å
551	C	23	Very low	26.2	Very low	100 Å²	100	136.7 Å²	136.7	68%	0.676	80%	0.799	S	S	*	*			trans	-77.4	125.4	167.5	-70.7	0	0	0	0	109.7
552	Q	26.1	Very low	26.1	Very low	187 Å²	187	136.2 Å²	136.2	87%	0.874	80%	0.802	S	S	*	*			trans	-114.3	114.5	161.3	-90.1	177.5	-5.1	0	0	110
553	H	21.7	Very low	26	Very low	192 Å²	192	136 Å²	136	89%	0.889	80%	0.8	S	S	*	*			trans	-73.9	135.2	163.5	-87.5	-87.6	0	0	0	109.6
554	A	24.5	Very low	25.9	Very low	103 Å²	103	133.8 Å²	133.8	85%	0.851	80%	0.796	S	S	*	*			trans	-119.5	128.9	160.2	0	0	0	0	0	109
555	A	24.1	Very low	25.9	Very low	104 Å²	104	134.4 Å²	134.4	86%	0.86	80%	0.795	S	S	*	*			trans	-85.9	162.8	-170	0	0	0	0	0	113.7
556	D	22.7	Very low	25.7	Very low	150 Å²	150	133.8 Å²	133.8	80%	0.802	79%	0.789	S	S	*	*			trans	-50	145.6	178.7	-67.2	-56.9	0	0	0	116.6
557	N	25.2	Very low	25.7	Very low	161 Å²	161	133.9 Å²	133.9	86%	0.861	79%	0.789	S	S	*	*				-170.1	159.3	113.2	-103.6	-15.9	0	0	0	113.3
558	P	29.6	Very low	25.4	Very low	97 Å²	97	132.8 Å²	132.8	63%	0.63	78%	0.782	S	S	*	*			trans	-122.2	157.6	-147.4	40.8	-27.1	0	0	0	115.8
559	H	27.1	Very low	25.5	Very low	179 Å²	179	130.6 Å²	130.6	83%	0.829	78%	0.777	S	S	*	*			trans	65.1	169.1	140.5	-88	-33.9	0	0	0	120.6
560	P	37.9	Very low	26	Very low	94 Å²	94	128.2 Å²	128.2	61%	0.61	77%	0.771	S	S	*	*			cis	-142.5	176.1	-24	31.9	-10.4	0	0	0	116.5
561	T	26.2	Very low	26	Very low	130 Å²	130	130 Å²	130	80%	0.798	78%	0.776	S	S	*	*			trans	70.7	121.9	137.8	46.5	0	0	0	0	123
562	A	26.1	Very low	26.1	Very low	106 Å²	106	130.3 Å²	130.3	88%	0.876	78%	0.779	S	S	*	*				155.3	139.5	110.5	0	0	0	0	0	108
563	G	24.7	Very low	27.4	Very low	68 Å²	68	126 Å²	126	70%	0.701	77%	0.768	S	S	*	*			cis	147.7	141.6	12.1	0	0	0	0	0	107.3
564	A	26.6	Very low	27.6	Very low	92 Å²	92	125.2 Å²	125.2	76%	0.76	76%	0.764	S	S	*	*			trans	68.5	147.2	162.9	0	0	0	0	0	117.8
565	N	26.7	Very low	27.7	Very low	146 Å²	146	124.2 Å²	124.2	78%	0.781	76%	0.755	S	S	*	*			cis	-161.7	131.7	-5.5	-95.9	-19	0	0	0	104.8
566	M	23.3	Very low	27.7	Very low	148 Å²	148	125.7 Å²	125.7	73%	0.729	75%	0.749	S	S	*	*				47.9	125.2	100.8	-99.3	-159.7	-177.2	0	0	117.1	F568	M566-F568 HydrophobicContact CE-CE2 3.65Å; M566-F568 HydrophobicContact CE-CZ 4.37Å; M566-F568 HydrophobicContact CG-CE2 4.34Å; M566-F568 HydrophobicContact SD-CD2 4.33Å; M566-F568 HydrophobicContact SD-CE2 3.87Å
567	L	25.3	Very low	27.9	Very low	159 Å²	159	124.7 Å²	124.7	83%	0.832	74%	0.742	S	S	*	*				169.7	105.2	127.7	-83.4	168.6	0	0	0	107.2
568	F	22.8	Very low	27.8	Very low	169 Å²	169	121.3 Å²	121.3	74%	0.741	73%	0.732	S	S	*	*				47.8	128.8	86.9	-72.8	-69.5	0	0	0	113.1	M566	M566-F568 HydrophobicContact CE-CE2 3.65Å; M566-F568 HydrophobicContact CE-CZ 4.37Å; M566-F568 HydrophobicContact CG-CE2 4.34Å; M566-F568 HydrophobicContact SD-CD2 4.33Å; M566-F568 HydrophobicContact SD-CE2 3.87Å
569	A	24.8	Very low	27.6	Very low	83 Å²	83	126.1 Å²	126.1	69%	0.686	74%	0.743	S	S	*	*			cis	-174.4	-153.9	14.3	0	0	0	0	0	106.4
570	P	33.6	Very low	27.3	Very low	108 Å²	108	121.7 Å²	121.7	70%	0.701	74%	0.737	S	S	*	*			cis	-137.1	178	-47.6	26.4	-3.9	0	0	0	115.7
571	L	23.1	Very low	27.6	Very low	154 Å²	154	122.1 Å²	122.1	81%	0.806	74%	0.74	S	S	*	*			trans	75.8	101.8	143.3	-72.5	150.3	0	0	0	122.2
572	S	26.1	Very low	27.6	Very low	106 Å²	106	123.7 Å²	123.7	74%	0.741	74%	0.736	S	S	*	*				26.8	176.1	111.1	-60.4	0	0	0	0	122.3
573	P	52.4	Low	27.7	Very low	98 Å²	98	127.6 Å²	127.6	64%	0.636	73%	0.728	S	S	*	*				-137.9	-170	-51.6	39.9	-22.1	0	0	0	111.6
574	H	27.1	Very low	27.9	Very low	174 Å²	174	130.1 Å²	130.1	81%	0.806	73%	0.725	S	S	*	*			trans	160.3	114.2	143.2	-83.4	-62.3	0	0	0	108.7
575	A	26	Very low	27.9	Very low	82 Å²	82	133.2 Å²	133.2	68%	0.678	72%	0.724	S	S	*	*				67.9	137.6	81	0	0	0	0	0	112.2
576	N	24.7	Very low	27.9	Very low	135 Å²	135	134.2 Å²	134.2	72%	0.722	72%	0.724	S	S	*	*			cis	-177.8	157.4	5.9	-128.1	-5.5	0	0	0	108.9
577	I	26.5	Very low	28.1	Very low	129 Å²	129	135.7 Å²	135.7	66%	0.662	73%	0.729	S	S	*	*			trans	68.7	108.6	133.1	-68.3	171.7	0	0	0	119.6
578	S	23.5	Very low	28.8	Very low	91 Å²	91	133.3 Å²	133.3	64%	0.636	72%	0.723	S	S	*	*				101.8	163	100.5	73	0	0	0	0	112.5
579	F	24.4	Very low	29.1	Very low	197 Å²	197	129.5 Å²	129.5	86%	0.864	72%	0.723	S	S	*	*			cis	-152.2	163.3	19.4	-111.1	-81	0	0	0	109.3
580	A	22.2	Very low	30	Very low	86 Å²	86	132 Å²	132	71%	0.711	73%	0.732	S	S	*	*			trans	-79.9	-152.3	-178.3	0	0	0	0	0	114
581	P	42.7	Very low	29.5	Very low	104 Å²	104	130.1 Å²	130.1	68%	0.675	73%	0.733	S	S	*	*			cis	-145.7	-170.1	-17.7	29.2	-3.4	0	0	0	116.2
582	K	26.3	Very low	29.8	Very low	162 Å²	162	131.5 Å²	131.5	70%	0.704	74%	0.735	S	S	*	*			trans	88.5	143.7	151.4	-64.5	-170.2	179.3	174.3	0	118.7
583	R	29.5	Very low	29.9	Very low	188 Å²	188	132.2 Å²	132.2	71%	0.709	74%	0.735	S	S	*	*			cis	-171.9	154.6	1.6	-112.3	-173.8	176.3	159	-5.4	109.8
584	D	27.6	Very low	28.6	Very low	121 Å²	121	136.5 Å²	136.5	65%	0.647	75%	0.746	S	S	*	*			trans	35.9	146.8	135	-47.7	-26	0	0	0	120.1
585	E	28	Very low	28.6	Very low	157 Å²	157	136.5 Å²	136.5	73%	0.734	75%	0.746	S	S	*	*			cis	-173.9	155.5	25.3	-138.4	175.2	96.1	0	0	110.3
586	E	26.3	Very low	29.1	Very low	167 Å²	167	138.5 Å²	138.5	78%	0.78	75%	0.752	S	S	*	*			trans	71.1	133.6	137.8	-129.6	86.3	137.4	0	0	125.9
587	Q	27.2	Very low	29.2	Very low	179 Å²	179	135 Å²	135	84%	0.836	75%	0.749	S	S	*	*			trans	-73.3	-168.5	172.1	-113.8	169.4	-91.5	0	0	113.6
588	P	39.6	Very low	29.1	Very low	110 Å²	110	134.7 Å²	134.7	71%	0.714	76%	0.758	S	S	*	*			cis	-140.7	179.5	6.3	26.1	1.4	0	0	0	117.3
589	A	28.8	Very low	29.2	Very low	89 Å²	89	135.4 Å²	135.4	74%	0.736	76%	0.763	S	S	*	*			trans	-79.7	176.5	163.4	0	0	0	0	0	111.5
590	P	43.8	Very low	29.2	Very low	135 Å²	135	129.6 Å²	129.6	88%	0.877	76%	0.759	S	S	*	*				-158	-176.6	58.4	39	-14.7	0	0	0	117.6
591	G	24.1	Very low	30.1	Very low	69 Å²	69	131 Å²	131	71%	0.711	76%	0.761	S	S	*	*			trans	140.2	95.2	147.9	0	0	0	0	0	121.1
592	H	29.6	Very low	29.4	Very low	183 Å²	183	133 Å²	133	85%	0.847	77%	0.766	S	S	*	*				35.6	133.9	130	-79.4	-80.8	0	0	0	126.4
593	T	26.8	Very low	29.7	Very low	121 Å²	121	131.5 Å²	131.5	74%	0.742	77%	0.77	S	S	*	*			trans	94.4	137.3	135.4	14.6	0	0	0	0	125.2
594	E	26.8	Very low	30.2	Very low	188 Å²	188	128 Å²	128	88%	0.879	77%	0.771	S	S	*	*			trans	95.3	121.6	145.6	-74	179	152.6	0	0	122.6
595	E	27.3	Very low	30.9	Very low	173 Å²	173	127.3 Å²	127.3	81%	0.808	77%	0.774	S	S	*	*			trans	-73.3	159	158.7	-98.5	-108.1	140.3	0	0	110.3
596	P	36.4	Very low	31.2	Very low	124 Å²	124	125.8 Å²	125.8	81%	0.805	78%	0.777	S	S	*	*				-160.4	160.4	72.1	38.9	-16.2	0	0	0	119.7
597	G	24.8	Very low	31.5	Very low	63 Å²	63	128.7 Å²	128.7	65%	0.649	78%	0.781	S	S	*	*				92.5	140.8	123.7	0	0	0	0	0	123.7
598	S	24.9	Very low	31.5	Very low	121 Å²	121	126.7 Å²	126.7	85%	0.846	78%	0.776	S	S	*	*			trans	82.1	137.5	153.8	-159.2	0	0	0	0	117.4
599	S	25.9	Very low	31	Very low	107 Å²	107	126.5 Å²	126.5	75%	0.748	78%	0.777	S	S	*	*			cis	-175.3	153.8	6.4	30.4	0	0	0	0	108.1
600	G	24.5	Very low	31	Very low	75 Å²	75	125.9 Å²	125.9	77%	0.773	78%	0.779	S	S	*	*			trans	-67.5	-146.1	-172.2	0	0	0	0	0	118.2
601	P	42.3	Very low	30.4	Very low	116 Å²	116	127.1 Å²	127.1	75%	0.753	78%	0.777	S	S	*	*			cis	-139.2	171.6	11.3	39.4	-18.6	0	0	0	118.1
602	D	27.4	Very low	30.8	Very low	146 Å²	146	134.3 Å²	134.3	78%	0.781	78%	0.784	S	S	*	*			trans	18.2	152.1	145.2	-45.6	-44.6	0	0	0	122.1
603	V	31.9	Very low	30.9	Very low	130 Å²	130	132.1 Å²	132.1	79%	0.788	78%	0.779	S	S	*	*			cis	-168.2	-173.7	36	-148.4	0	0	0	0	108.5
604	P	40.6	Very low	31.1	Very low	113 Å²	113	130 Å²	130	73%	0.734	77%	0.769	S	S	*	*				-130.4	-145.4	-100.1	51.1	-30.4	0	0	0	113.8
605	P	42	Very low	31.3	Very low	108 Å²	108	126 Å²	126	70%	0.701	76%	0.762	S	S	*	*				-121.3	-169.6	-129	34	-9.1	0	0	0	113.7
606	P	34	Very low	31.5	Very low	124 Å²	124	124.1 Å²	124.1	81%	0.805	76%	0.762	S	S	*	*			trans	-112.4	133.3	145	25.7	-11.3	0	0	0	112.3
607	R	32.2	Very low	31.3	Very low	229 Å²	229	123.5 Å²	123.5	86%	0.864	76%	0.758	S	S	*	*			trans	-55.1	158.9	158.5	-60.3	174.6	167.2	170.7	-5.4	108.9
608	D	28.3	Very low	31.5	Very low	136 Å²	136	126 Å²	126	73%	0.727	77%	0.766	S	S	*	*			cis	-172.9	151.5	46.6	-151.9	-16.8	0	0	0	110.8
609	S	28.9	Very low	31.8	Very low	106 Å²	106	125.6 Å²	125.6	74%	0.741	76%	0.763	S	S	*	*			trans	49.8	131.9	147.7	22.1	0	0	0	0	123.8
610	G	28.8	Very low	32.1	Very low	76 Å²	76	129.5 Å²	129.5	78%	0.784	77%	0.769	S	S	*	*			trans	164	51.9	153.8	0	0	0	0	0	115.2	Y612	G610-Y612 PolarHBondContact O-N 2.72Å
611	I	31.5	Very low	32.2	Very low	162 Å²	162	134.1 Å²	134.1	83%	0.831	78%	0.775	S	S	*	*			trans	-65.8	122	172.4	-66	165.8	0	0	0	109.1
612	Y	32.6	Very low	31.6	Very low	220 Å²	220	133.9 Å²	133.9	86%	0.863	78%	0.776	S	S	*	*			trans	-140.2	115.1	147.8	-135.3	-91.3	0	0	0	109.1	G610 S614	G610-Y612 PolarHBondContact O-N 2.72Å; Y612-S614 WeakPolarHBondContact CD1-OG 3.25Å; Y612-S614 WeakPolarHBondContact CE1-OG 3.31Å
613	D	31.6	Very low	31.9	Very low	136 Å²	136	134.5 Å²	134.5	73%	0.727	78%	0.778	S	S	*	*			trans	-108.7	123	174.4	-167.5	-2.2	0	0	0	106.3
614	S	30.3	Very low	31.8	Very low	78 Å²	78	133.8 Å²	133.8	55%	0.545	78%	0.776	S	S	.	*			trans	-162.7	83	163	-11.9	0	0	0	0	110.9	Y612	Y612-S614 WeakPolarHBondContact CD1-OG 3.25Å; Y612-S614 WeakPolarHBondContact CE1-OG 3.31Å
615	S	30.3	Very low	31.2	Very low	104 Å²	104	136.8 Å²	136.8	73%	0.727	79%	0.785	S	S	*	*				-10.3	124.7	127.8	29.1	0	0	0	0	116
616	V	32.3	Very low	30.5	Very low	132 Å²	132	140.1 Å²	140.1	80%	0.8	79%	0.793	S	S	*	*			trans	-117	116.5	165.4	-178.2	0	0	0	0	107.9
617	P	32.5	Very low	30.3	Very low	112 Å²	112	143.1 Å²	143.1	73%	0.727	80%	0.796	S	S	*	*			trans	-93.2	126.1	160.7	14.2	3.1	0	0	0	110.1
618	S	28.6	Very low	30.1	Very low	116 Å²	116	135.4 Å²	135.4	81%	0.811	79%	0.788	S	S	*	*			trans	-67.5	130.2	163.4	-51.9	0	0	0	0	110
619	S	30.6	Very low	30.1	Very low	112 Å²	112	137.5 Å²	137.5	78%	0.783	80%	0.799	S	S	*	*			trans	-128.7	105.6	163.4	-67.5	0	0	0	0	108.8
620	E	32.2	Very low	29.9	Very low	188 Å²	188	137.5 Å²	137.5	88%	0.879	80%	0.799	S	S	*	*			trans	-78.3	128.6	160.4	-65.7	-172	133	0	0	108.2
621	L	27.5	Very low	29.9	Very low	173 Å²	173	142.7 Å²	142.7	91%	0.906	80%	0.802	S	S	*	*			trans	-91.7	109.4	174.4	-93.6	151	0	0	0	108.7
622	S	30	Very low	29.8	Very low	110 Å²	110	141.4 Å²	141.4	77%	0.769	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-93.2	123.2	167.8	-46.5	0	0	0	0	109.5
623	I	32.8	Very low	29.6	Very low	160 Å²	160	138.7 Å²	138.7	82%	0.821	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-78.9	136.4	172.8	-60.3	167.2	0	0	0	108.6
624	P	30.7	Very low	29.5	Very low	115 Å²	115	137 Å²	137	75%	0.747	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-80.9	132.8	173.2	30.7	-29.6	0	0	0	111.5
625	L	27.4	Very low	29.4	Very low	175 Å²	175	140 Å²	140	92%	0.916	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-79.2	127	168	-105.5	144.9	0	0	0	109.1
626	M	27.7	Very low	29.3	Very low	178 Å²	178	140.9 Å²	140.9	88%	0.877	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-89.8	134.8	175.2	-91.7	-85.5	-62.3	0	0	110.5
627	E	30.1	Very low	29.1	Very low	187 Å²	187	140.1 Å²	140.1	87%	0.874	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-74.9	147.5	171.3	-135.7	103.1	-159	0	0	111.8
628	G	27.6	Very low	28.9	Very low	68 Å²	68	140.7 Å²	140.7	70%	0.701	82%	0.82	S	S	*	*			trans	124.8	110.1	155.2	0	0	0	0	0	114.3
629	L	27.4	Very low	29	Very low	180 Å²	180	143.7 Å²	143.7	94%	0.942	83%	0.826	S	S	*	*				-174	123.4	124.9	-89.6	-178.8	0	0	0	109.4
630	S	25.6	Very low	29.1	Very low	106 Å²	106	143.1 Å²	143.1	74%	0.741	83%	0.829	S	S	*	*			trans	-77.8	148.9	172.6	49.5	0	0	0	0	112.6
631	H	29.3	Very low	28.9	Very low	185 Å²	185	141.6 Å²	141.6	86%	0.856	83%	0.826	S	S	*	*			trans	-155.9	158	145	-135.1	55.4	0	0	0	113.6
632	D	29.4	Very low	28.9	Very low	134 Å²	134	139.4 Å²	139.4	72%	0.717	83%	0.825	S	S	*	*			trans	-75.6	160.6	-151.4	-79.9	-53.1	0	0	0	119.9
633	Q	27.4	Very low	28.9	Very low	163 Å²	163	142.7 Å²	142.7	76%	0.762	83%	0.828	S	S	*	*			trans	-32.7	144.4	154.1	-165.6	175.1	26.5	0	0	118
634	A	28.8	Very low	28.5	Very low	102 Å²	102	140 Å²	140	84%	0.843	82%	0.824	S	S	*	*			trans	-162	132.7	142.7	0	0	0	0	0	112.4
635	D	28.4	Very low	28.4	Very low	140 Å²	140	140.2 Å²	140.2	75%	0.749	83%	0.828	S	S	*	*			trans	-71.3	160.9	-178.7	-61	-62.5	0	0	0	115.1
636	S	28.2	Very low	28.4	Very low	123 Å²	123	136.6 Å²	136.6	86%	0.86	82%	0.818	S	S	*	*			trans	-170.6	134	131.2	26.4	0	0	0	0	112.9
637	S	28	Very low	28.5	Very low	115 Å²	115	134 Å²	134	80%	0.804	82%	0.817	S	S	*	*			trans	-91.6	163.1	-180	48.7	0	0	0	0	112.5
638	S	28.4	Very low	28.4	Very low	124 Å²	124	128.8 Å²	128.8	87%	0.867	81%	0.813	S	S	*	*			trans	-172.3	146.8	130.2	52.6	0	0	0	0	112.9
639	L	31.5	Very low	28.6	Very low	180 Å²	180	134 Å²	134	94%	0.942	82%	0.824	S	S	*	*			trans	-92.1	156.3	-178	-67.9	155.8	0	0	0	111.2
640	A	32.3	Very low	28.7	Very low	100 Å²	100	129.2 Å²	129.2	83%	0.826	82%	0.818	S	S	*	*			trans	-167.3	141.1	139.4	0	0	0	0	0	112.4
641	D	28	Very low	29.1	Very low	156 Å²	156	131.4 Å²	131.4	83%	0.834	82%	0.822	S	S	*	*			trans	-68.4	163.8	-175.7	-57	-68.8	0	0	0	116
642	S	28.8	Very low	29.1	Very low	126 Å²	126	131.8 Å²	131.8	88%	0.881	82%	0.824	S	S	*	*				175.8	158.4	122.2	-75.7	0	0	0	0	113.6
643	E	28.2	Very low	29	Very low	179 Å²	179	133.9 Å²	133.9	84%	0.836	83%	0.829	S	S	*	*			trans	-97.8	159.3	-150	-51.6	-178.5	107.6	0	0	117.7
644	S	25.8	Very low	29.5	Very low	105 Å²	105	131 Å²	131	73%	0.734	83%	0.825	S	S	*	*				80.9	143.2	129.5	-74.5	0	0	0	0	126
645	S	28.5	Very low	29.9	Very low	119 Å²	119	131.9 Å²	131.9	83%	0.832	82%	0.822	S	S	*	*			trans	91.5	144	158.2	-53.8	0	0	0	0	118.5
646	S	26.3	Very low	29.7	Very low	99 Å²	99	129.8 Å²	129.8	69%	0.692	82%	0.824	S	S	*	*			cis	-179.2	156	-39	63.5	0	0	0	0	106.5
647	S	30.4	Very low	29.7	Very low	124 Å²	124	131 Å²	131	87%	0.867	83%	0.826	S	S	*	*			trans	80.5	138.2	162.6	-41.7	0	0	0	0	116.6
648	G	28.7	Very low	29.5	Very low	77 Å²	77	130.7 Å²	130.7	79%	0.794	82%	0.824	S	S	*	*			cis	175.5	153.9	5.8	0	0	0	0	0	109.4
649	L	32.2	Very low	29.2	Very low	178 Å²	178	130.5 Å²	130.5	93%	0.932	82%	0.823	S	S	*	*			trans	-60.6	161.6	-175.6	-77.9	133.4	0	0	0	116.6
650	G	29.5	Very low	29.1	Very low	79 Å²	79	129.7 Å²	129.7	81%	0.814	82%	0.818	S	S	*	*			trans	177.6	98.6	157.2	0	0	0	0	0	114.9
651	D	32.4	Very low	28.8	Very low	151 Å²	151	136 Å²	136	81%	0.807	82%	0.821	S	S	*	*			trans	-69.6	150.5	164.6	-68.4	-55.3	0	0	0	112.2
652	E	29	Very low	28.9	Very low	194 Å²	194	135.1 Å²	135.1	91%	0.907	83%	0.825	S	S	*	*				178.7	134.1	129.8	-114.5	180	71.1	0	0	114.2
653	E	27.9	Very low	29.2	Very low	177 Å²	177	134.2 Å²	134.2	83%	0.827	82%	0.819	S	S	*	*			trans	-121.9	143.4	164.4	161.3	174.8	156.6	0	0	106.6
654	P	38.4	Very low	30	Very low	104 Å²	104	128.2 Å²	128.2	68%	0.675	80%	0.8	S	S	*	*				-164.4	-162.2	102.4	42	-18.9	0	0	0	114.7
655	P	37.2	Very low	31.4	Very low	119 Å²	119	127.4 Å²	127.4	77%	0.773	80%	0.799	S	S	*	*			cis	-128.5	173.1	-21.7	20.2	4.3	0	0	0	115.4
656	A	24.9	Very low	33.1	Very low	97 Å²	97	123.5 Å²	123.5	80%	0.802	77%	0.771	S	S	*	*			trans	-82.8	156	175.6	0	0	0	0	0	115.7
657	V	26.4	Very low	35.2	Very low	148 Å²	148	125.8 Å²	125.8	90%	0.897	77%	0.769	S	S	*	*			trans	-130.3	137.6	160.7	-178.3	0	0	0	0	110
658	S	23.9	Very low	36.9	Very low	108 Å²	108	124.3 Å²	124.3	76%	0.755	76%	0.757	S	S	*	*			trans	-85.4	144.6	-167.6	47.3	0	0	0	0	115.1
659	S	23.4	Very low	38	Very low	121 Å²	121	124.4 Å²	124.4	85%	0.846	74%	0.736	S	S	*	*			trans	-152.5	113.2	159	164.1	0	0	0	0	110.3
660	L	28.1	Very low	38.5	Very low	162 Å²	162	121.3 Å²	121.3	85%	0.848	72%	0.72	S	S	*	*			trans	-77.4	127.7	176.8	-82.2	113.9	0	0	0	112.8
661	R	26.4	Very low	38.6	Very low	234 Å²	234	125.4 Å²	125.4	88%	0.883	72%	0.718	S	S	*	*				169	123	114.3	-93.5	-177.9	-177.8	-178.6	1.8	110.9
662	C	30.6	Very low	38.3	Very low	136 Å²	136	124.4 Å²	124.4	92%	0.919	71%	0.708	S	S	*	*			trans	36.4	89.6	164.7	-63.3	0	0	0	0	117.7
663	S	35.9	Very low	38.1	Very low	108 Å²	108	124 Å²	124	76%	0.755	71%	0.708	S	S	*	*			trans	-138.1	123.7	140.4	42.8	0	0	0	0	106.5	A665	S663-A665 PolarHBondContact O-N 2.49Å; S663-A665 VanDerWaalsContact O-N 3.15Å
664	A	43.6	Very low	37.9	Very low	53 Å²	53	122.4 Å²	122.4	44%	0.438	70%	0.701	S	S	.	*			trans	-52.8	122.6	158.2	0	0	0	0	0	105.5	C666	A664-C666 VanDerWaalsContact C-N 3.3Å; A664-C666 PolarHBondContact O-N 2.8Å; A664-C666 PolarHBondContact O-SG 2.91Å
665	A	55.4	Low	37.2	Very low	87 Å²	87	128 Å²	128	72%	0.719	71%	0.709	S	S	*	*			trans	-70.2	90.3	-172.9	0	0	0	0	0	108.6	S663 K667	S663-A665 PolarHBondContact O-N 2.49Å; S663-A665 VanDerWaalsContact O-N 3.15Å; A665-K667 PolarHBondContact O-N 2.76Å
666	C	63.5	Low	36.7	Very low	37 Å²	37	127.6 Å²	127.6	25%	0.25	71%	0.709	C	S	.	*	P	Polyproline II helix	trans	-64.8	120.8	177	-55.1	0	0	0	0	108.6	L29 A30 C31 A664	L29-C666 HydrophobicContact CB-CB 4.15Å; L29-C666 HydrophobicContact CD1-CB 4.08Å; A30-C666 CarbonylContact O-C 3.54Å; A30-C666 VanDerWaalsContact O-CA 3.22Å; A30-C666 WeakPolarHBondContact O-CA 3.36Å; C31-C666 HydrophobicContact CB-CB 4.15Å; C31-C666 WeakPolarHBondContact CB-SG 3.25Å; C31-C666 WeakPolarHBondContact SG-CB 3.45Å; C31-C666 CovalentContact SG-SG 2.02Å; C31-C666 PolarHBondContact SG-SG 3.21Å; A664-C666 VanDerWaalsContact C-N 3.3Å; A664-C666 PolarHBondContact O-N 2.8Å; A664-C666 PolarHBondContact O-SG 2.91Å
667	K	70.4	Confident	36.6	Very low	147 Å²	147	130 Å²	130	64%	0.639	71%	0.708	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-85.9	136.8	-177.2	-68.9	-179.2	-179.7	177.4	0	109.6	L29 A30 A665	L29-K667 WeakPolarHBondContact CA-O 3.33Å; A30-K667 PolarHBondContact N-O 3.1Å; A30-K667 VanDerWaalsContact N-O 3.11Å; A30-K667 PolarHBondContact O-N 2.95Å; A665-K667 PolarHBondContact O-N 2.76Å
668	P	67	Low	36.7	Very low	94 Å²	94	127.6 Å²	127.6	61%	0.61	70%	0.704	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-68.5	158.2	169.4	30.4	-33.3	0	0	0	111.1	L29 L670	L29-P668 HydrophobicContact CD2-CB 3.94Å; P668-L670 PolarHBondContact O-N 3.2Å
669	Q	51	Low	36.9	Very low	78 Å²	78	131.9 Å²	131.9	36%	0.364	71%	0.712	S	S	.	*			trans	-42.7	122.7	177.8	-178.4	175.1	-14	0	0	112.2	I130 H671	I130-Q669 HydrophobicContact CG2-CG 4.45Å; Q669-H671 PolarHBondContact O-N 3.33Å
670	L	42.7	Very low	37.1	Very low	114 Å²	114	131 Å²	131	60%	0.597	71%	0.712	S	S	*	*			trans	-71.4	108.5	173.4	-117.7	101.5	0	0	0	108.8	P668 Q672	P668-L670 PolarHBondContact O-N 3.2Å; L670-Q672 PolarHBondContact O-N 3.15Å
671	H	32.4	Very low	37	Very low	164 Å²	164	128.1 Å²	128.1	76%	0.759	71%	0.711	S	S	*	*			trans	-85.9	92	161.1	-87.9	-91.3	0	0	0	108.3	Q669	Q669-H671 PolarHBondContact O-N 3.33Å
672	Q	26.6	Very low	37.2	Very low	131 Å²	131	122.1 Å²	122.1	61%	0.612	71%	0.705	S	S	*	*			trans	-96.8	87.8	167.8	-158.1	164.5	-3.5	0	0	108	L670 E674	L670-Q672 PolarHBondContact O-N 3.15Å; Q672-E674 VanDerWaalsContact C-N 3.3Å; Q672-E674 HydrophobicContact CG-CG 4.14Å; Q672-E674 PolarHBondContact NE2-OE2 3.1Å; Q672-E674 PolarHBondContact O-N 3.44Å
673	M	24.4	Very low	37.2	Very low	184 Å²	184	126.8 Å²	126.8	91%	0.906	72%	0.72	S	S	*	*			trans	-86.3	77.5	163.1	-170.2	93	139.6	0	0	106.6	R675	M673-R675 PolarHBondContact O-N 2.79Å; M673-R675 VanDerWaalsContact O-N 3.09Å
674	E	23.9	Very low	37.2	Very low	145 Å²	145	127.8 Å²	127.8	68%	0.678	72%	0.718	S	S	*	*			trans	-75.9	92.4	168.4	-99.8	174.4	127.6	0	0	108.8	Q672 S676	Q672-E674 VanDerWaalsContact C-N 3.3Å; Q672-E674 HydrophobicContact CG-CG 4.14Å; Q672-E674 PolarHBondContact NE2-OE2 3.1Å; Q672-E674 PolarHBondContact O-N 3.44Å; E674-S676 PolarHBondContact O-N 3.1Å
675	R	24.3	Very low	36.9	Very low	222 Å²	222	131.7 Å²	131.7	84%	0.838	73%	0.733	S	S	*	*			trans	-73.9	103.7	158	-164.3	175.3	-170.2	162	1.3	106.1	M673 D677	M673-R675 PolarHBondContact O-N 2.79Å; M673-R675 VanDerWaalsContact O-N 3.09Å; R675-D677 PolarHBondContact O-N 3.29Å
676	S	24.9	Very low	35.8	Very low	109 Å²	109	134.2 Å²	134.2	76%	0.762	73%	0.734	S	S	*	*			trans	-66.5	94.1	172.6	-71.7	0	0	0	0	109.8	E674	E674-S676 PolarHBondContact O-N 3.1Å
677	D	24.6	Very low	34.2	Very low	148 Å²	148	139.9 Å²	139.9	79%	0.791	76%	0.762	S	S	*	*			trans	-101.1	92.3	147.6	-81.5	-39.6	0	0	0	106.6	R675	R675-D677 PolarHBondContact O-N 3.29Å
678	A	27.4	Very low	32	Very low	98 Å²	98	139.4 Å²	139.4	81%	0.81	77%	0.77	S	S	*	*			trans	-91.6	95.7	170.3	0	0	0	0	0	108.3
679	Q	27.7	Very low	29.6	Very low	197 Å²	197	142.5 Å²	142.5	92%	0.921	78%	0.781	S	S	*	*			trans	-110.7	108.5	146.1	-96.7	-175.1	-20.6	0	0	108.2
680	A	28.2	Very low	28.1	Very low	103 Å²	103	147.1 Å²	147.1	85%	0.851	81%	0.81	S	S	*	*			trans	-66.9	133.3	160.9	0	0	0	0	0	109
681	A	26.4	Very low	27	Very low	101 Å²	101	149.6 Å²	149.6	84%	0.835	83%	0.827	S	S	*	*			trans	-121.2	116.5	150.4	0	0	0	0	0	107.4
682	S	29.7	Very low	26.5	Very low	108 Å²	108	148.4 Å²	148.4	76%	0.755	83%	0.832	S	S	*	*			trans	-56.2	128.5	166.4	158.1	0	0	0	0	109.7
683	L	30.2	Very low	26.5	Very low	235 Å²	235	150 Å²	150	100%	1.23	85%	0.852	S	S	*	*				-106.9	0	100.5	-89.7	163.3	0	0	0	107.9

Retrieved 683 of 683 residues in 750.3 ms (Link to these results)

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