RBM28_HUMAN Loading...

RNA-binding protein 28

Nucleolar component of the spliceosomal ribonucleoprotein complexes.

AlphaFold DB , UniProt , Accession Q9NW13, Species HUMAN (Homo sapiens, Human), Gene RBM28, Length 759 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	51.9	Low	84.2	Confident	163 Å²	163	52.2 Å²	52.2	80%	0.803	28%	0.275	S	S	*	.				0	-62	0	-52.3	-38.3	-82	0	0	113.3	G3 L4	M1-G3 PolarHBondContact O-N 2.77Å; M1-L4 PolarHBondContact O-N 2.93Å; M1-L4 HydrophobicContact SD-CD1 4.15Å
2	A	61.8	Low	84.5	Confident	76 Å²	76	49.2 Å²	49.2	63%	0.628	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	45.7	-171.9	0	0	0	0	0	115.6	K80	A2-K80 HydrophobicContact CB-CB 4.24Å; A2-K80 HydrophobicContact CB-CD 4.02Å
3	G	77.7	Confident	84.5	Confident	19 Å²	19	52.7 Å²	52.7	20%	0.196	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	176.5	6	-175.3	0	0	0	0	0	112.8	M1	M1-G3 PolarHBondContact O-N 2.77Å
4	L	90.6	Very high	84.8	Confident	27 Å²	27	53.4 Å²	53.4	14%	0.141	30%	0.298	C	S	.	.	S	Bend	trans	-100.6	-5.6	173	-65.2	172.3	0	0	0	112.3	M1 T51 F52 M54 L55	M1-L4 PolarHBondContact O-N 2.93Å; M1-L4 HydrophobicContact SD-CD1 4.15Å; L4-T51 HydrophobicContact CB-CG2 4.41Å; L4-T51 CarbonylContact O-C 3.47Å; L4-T51 WeakPolarHBondContact O-CA 3.47Å; L4-F52 PolarHBondContact O-N 3.36Å; L4-M54 VanDerWaalsContact CD2-C 3.43Å; L4-M54 WeakPolarHBondContact CD2-O 3.47Å; L4-L55 HydrophobicContact CD2-CB 4.09Å
5	T	91.9	Very high	84.9	Confident	32 Å²	32	49.8 Å²	49.8	20%	0.196	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	129.5	-177.1	-52.7	0	0	0	0	109.5	Y49 V50 T51 A78	T5-Y49 HydrophobicContact CG2-CD1 4.28Å; T5-V50 CarbonylContact C-O 3.59Å; T5-V50 WeakPolarHBondContact CA-O 3.47Å; T5-T51 WeakPolarHBondContact CG2-OG1 3.46Å; T5-T51 WeakPolarHBondContact OG1-CG2 3.43Å; T5-T51 PolarHBondContact OG1-OG1 3.11Å; T5-A78 HydrophobicContact CG2-CB 3.82Å; T5-A78 VanDerWaalsContact O-CB 3.26Å; T5-A78 WeakPolarHBondContact O-CB 3.35Å; T5-A78 PolarHBondContact O-N 3.5Å
6	L	92.9	Very high	85.2	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	148.9	168	-65.5	174.2	0	0	0	110.2	F24 Y49 V50 F52 V58 A61 L62 V75 T76 V77	L6-F24 HydrophobicContact CD1-CD1 4.39Å; L6-F24 HydrophobicContact CD1-CE1 3.89Å; L6-Y49 VanDerWaalsContact O-CA 3.25Å; L6-Y49 WeakPolarHBondContact O-CA 3.31Å; L6-V50 PolarHBondContact N-O 3.23Å; L6-V50 PolarHBondContact O-N 2.72Å; L6-F52 HydrophobicContact CD1-CD2 4.21Å; L6-F52 HydrophobicContact CD1-CE2 3.81Å; L6-V58 HydrophobicContact CD1-CG1 4.43Å; L6-V58 HydrophobicContact CD2-CG1 3.49Å; L6-V58 VanDerWaalsContact CD2-CG1 3.49Å; L6-V58 HydrophobicContact CG-CG1 3.92Å; L6-A61 HydrophobicContact CD1-CB 3.82Å; L6-L62 HydrophobicContact CD2-CD1 3.95Å; L6-L62 HydrophobicContact CD2-CD2 3.84Å; L6-L62 HydrophobicContact CD2-CG 3.72Å; L6-V75 HydrophobicContact CB-CG1 4.18Å; L6-V75 HydrophobicContact CD1-CG1 3.71Å; L6-V75 HydrophobicContact CD2-CG1 4.13Å; L6-V75 HydrophobicContact CG-CG1 4.23Å; L6-T76 CarbonylContact C-O 3.6Å; L6-T76 VanDerWaalsContact CA-O 3.3Å; L6-T76 WeakPolarHBondContact CA-O 3.34Å; L6-T76 WeakPolarHBondContact CD2-O 3.37Å; L6-V77 HydrophobicContact CD2-CG2 4.42Å
7	F	92.9	Very high	85.6	Confident	57 Å²	57	56.5 Å²	56.5	25%	0.25	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	128.4	162.5	169.1	-99.3	0	0	0	107.3	F47 Y49 V75 T76 A78	F7-F47 HydrophobicContact CD2-CB 4.48Å; F7-F47 HydrophobicContact CD2-CD2 4.33Å; F7-F47 HydrophobicContact CE2-CB 3.6Å; F7-F47 AromaticContact CE2-CD2 3.55Å; F7-F47 HydrophobicContact CE2-CD2 3.55Å; F7-F47 HydrophobicContact CE2-CE2 4.33Å; F7-F47 AromaticContact CE2-CG 3.66Å; F7-F47 HydrophobicContact CE2-CG 3.66Å; F7-F47 HydrophobicContact CZ-CB 3.75Å; F7-F47 HydrophobicContact CZ-CD2 4.38Å; F7-F47 HydrophobicContact CZ-CG 4.05Å; F7-Y49 HydrophobicContact CB-CD1 4.16Å; F7-Y49 HydrophobicContact CB-CE1 4.02Å; F7-Y49 HydrophobicContact CD2-CD1 4.19Å; F7-Y49 AromaticContact CD2-CE1 3.58Å; F7-Y49 HydrophobicContact CD2-CE1 3.58Å; F7-Y49 HydrophobicContact CD2-CE2 4.4Å; F7-Y49 AromaticContact CD2-CZ 3.7Å; F7-Y49 HydrophobicContact CG-CE1 4.28Å; F7-V75 WeakPolarHBondContact O-CA 3.21Å; F7-T76 PolarHBondContact N-O 3.25Å; F7-T76 PolarHBondContact O-N 3.23Å; F7-A78 HydrophobicContact CB-CB 4.25Å
8	V	92.8	Very high	85.9	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	108.1	178.5	-174.5	0	0	0	0	107.5	L11 L20 F24 F47 G48 V50 I73 V75	V8-L11 HydrophobicContact CG1-CD1 4.5Å; V8-L11 HydrophobicContact CG1-CD2 3.95Å; V8-L11 HydrophobicContact CG1-CG 4.17Å; V8-L20 HydrophobicContact CG1-CD1 4.3Å; V8-F24 HydrophobicContact CG1-CZ 4.46Å; V8-F24 HydrophobicContact CG2-CE1 4.23Å; V8-F24 HydrophobicContact CG2-CE2 3.96Å; V8-F24 HydrophobicContact CG2-CZ 3.52Å; V8-F47 CarbonylContact O-C 3.56Å; V8-F47 WeakPolarHBondContact O-CA 3.38Å; V8-F47 WeakPolarHBondContact O-CB 3.22Å; V8-G48 PolarHBondContact N-O 2.73Å; V8-G48 PolarHBondContact O-N 2.69Å; V8-V50 HydrophobicContact CG2-CG2 4.16Å; V8-I73 HydrophobicContact CG1-CB 4.21Å; V8-I73 HydrophobicContact CG1-CD1 3.89Å; V8-V75 HydrophobicContact CG1-CG2 4.34Å; V8-V75 HydrophobicContact CG2-CG1 4.47Å; V8-V75 HydrophobicContact CG2-CG2 4.46Å
9	G	91.6	Very high	86.2	Confident	6 Å²	6	60.9 Å²	60.9	6%	0.062	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	170.8	176.5	0	0	0	0	0	113	L11 G46 I73 N74	G9-L11 VanDerWaalsContact C-N 3.28Å; G9-L11 PolarHBondContact O-N 3Å; G9-G46 CarbonylContact C-O 3.57Å; G9-I73 WeakPolarHBondContact O-CA 3.15Å; G9-N74 PolarHBondContact N-O 2.62Å; G9-N74 PolarHBondContact O-N 2.75Å
10	R	91.2	Very high	86.4	Confident	185 Å²	185	57.9 Å²	57.9	70%	0.698	30%	0.303	S	S	*	.			trans	60.6	31.6	-173.3	-61.3	-175.6	174	-178.9	-2.3	114	G46	R10-G46 PolarHBondContact N-O 3.46Å
11	L	91	Very high	86.7	Confident	9 Å²	9	58.9 Å²	58.9	5%	0.047	31%	0.306	C	S	.	.			trans	-67.4	139.9	167	-67.6	171.8	0	0	0	109.8	V8 G9 A15 L20 V35 G46 F68 I73	V8-L11 HydrophobicContact CG1-CD1 4.5Å; V8-L11 HydrophobicContact CG1-CD2 3.95Å; V8-L11 HydrophobicContact CG1-CG 4.17Å; G9-L11 VanDerWaalsContact C-N 3.28Å; G9-L11 PolarHBondContact O-N 3Å; L11-A15 HydrophobicContact CB-CB 3.9Å; L11-A15 HydrophobicContact CD2-CB 4.23Å; L11-A15 HydrophobicContact CG-CB 4.47Å; L11-L20 HydrophobicContact CD1-CD2 4.01Å; L11-L20 HydrophobicContact CD2-CD1 3.92Å; L11-V35 HydrophobicContact CD1-CG1 4.16Å; L11-V35 HydrophobicContact CD1-CG2 3.93Å; L11-G46 PolarHBondContact N-O 2.86Å; L11-G46 WeakPolarHBondContact O-CA 3.15Å; L11-F68 HydrophobicContact CD2-CD1 4.11Å; L11-F68 HydrophobicContact CD2-CG 4.15Å; L11-I73 HydrophobicContact CD2-CG2 3.97Å
12	P	87.9	Confident	88.7	Confident	16 Å²	16	57.9 Å²	57.9	10%	0.104	30%	0.3	C	S	.	.			trans	-66.8	159	172.9	28.8	-34.7	0	0	0	111.3	S14 A15 F68 E69	P12-S14 WeakPolarHBondContact CB-OG 3.41Å; P12-S14 WeakPolarHBondContact CG-OG 3.48Å; P12-S14 PolarHBondContact O-N 3.21Å; P12-A15 HydrophobicContact CG-CB 4.12Å; P12-A15 VanDerWaalsContact O-CB 3.29Å; P12-A15 WeakPolarHBondContact O-CB 3.39Å; P12-A15 PolarHBondContact O-N 3.12Å; P12-F68 HydrophobicContact CG-CD1 3.98Å; P12-F68 HydrophobicContact CG-CE1 4.07Å; P12-E69 HydrophobicContact CG-CB 4.18Å; P12-E69 VanDerWaalsContact CG-OE2 3.32Å; P12-E69 WeakPolarHBondContact CG-OE2 3.43Å
13	P	85	Confident	90.1	Very high	95 Å²	95	56.2 Å²	56.2	62%	0.617	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-15.3	-177.6	25.7	-34.7	0	0	0	114	C44	P13-C44 PolarHBondContact O-N 2.78Å
14	S	88.3	Confident	90.8	Very high	62 Å²	62	55.3 Å²	55.3	43%	0.434	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-27.7	172.2	41.2	0	0	0	0	115	P12 R16 E69	P12-S14 WeakPolarHBondContact CB-OG 3.41Å; P12-S14 WeakPolarHBondContact CG-OG 3.48Å; P12-S14 PolarHBondContact O-N 3.21Å; S14-R16 PolarHBondContact O-N 3.27Å; S14-E69 WeakPolarHBondContact CB-OE2 3.28Å; S14-E69 PolarHBondContact OG-OE2 2.9Å
15	A	86.9	Confident	90.9	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	29%	0.287	C	S	.	.			trans	-66.5	106.2	-157.8	0	0	0	0	0	115	L11 P12 C44 F68	L11-A15 HydrophobicContact CB-CB 3.9Å; L11-A15 HydrophobicContact CD2-CB 4.23Å; L11-A15 HydrophobicContact CG-CB 4.47Å; P12-A15 HydrophobicContact CG-CB 4.12Å; P12-A15 VanDerWaalsContact O-CB 3.29Å; P12-A15 WeakPolarHBondContact O-CB 3.39Å; P12-A15 PolarHBondContact O-N 3.12Å; A15-C44 PolarHBondContact O-SG 2.81Å; A15-F68 HydrophobicContact CB-CD1 4.21Å; A15-F68 HydrophobicContact CB-CE1 3.36Å; A15-F68 HydrophobicContact CB-CZ 3.81Å
16	R	89.5	Confident	90.9	Very high	162 Å²	162	63.1 Å²	63.1	61%	0.611	31%	0.312	S	S	*	.			trans	-81.9	155.4	178.5	-59	-174.2	-174.1	162.1	7.5	112.6	S14 E18 Q19 L20	S14-R16 PolarHBondContact O-N 3.27Å; R16-E18 PolarHBondContact O-N 2.94Å; R16-Q19 HydrophobicContact CB-CG 4.4Å; R16-Q19 PolarHBondContact O-N 3.32Å; R16-L20 PolarHBondContact O-N 2.92Å; R16-L20 VanDerWaalsContact O-N 3.12Å
17	S	91.3	Very high	90.9	Very high	51 Å²	51	63.6 Å²	63.6	36%	0.357	32%	0.315	S	S	.	.	H	α-helix	trans	-57.5	-36.3	173.2	49.6	0	0	0	0	112.9	L20 E21 C33	S17-L20 PolarHBondContact O-N 2.91Å; S17-E21 VanDerWaalsContact O-CB 3.31Å; S17-E21 WeakPolarHBondContact O-CB 3.37Å; S17-E21 PolarHBondContact O-N 3.48Å; S17-C33 PolarHBondContact O-SG 3.38Å; S17-C33 VanDerWaalsContact O-SG 3.34Å
18	E	91.7	Very high	90.7	Very high	134 Å²	134	61.4 Å²	61.4	63%	0.626	31%	0.309	S	S	*	.	H	α-helix	trans	-60.6	-51	178.3	-62.5	165.5	158	0	0	111.3	R16 L20 E21 E22	R16-E18 PolarHBondContact O-N 2.94Å; E18-L20 VanDerWaalsContact C-N 3.32Å; E18-L20 PolarHBondContact O-N 2.87Å; E18-E21 PolarHBondContact O-N 3.46Å; E18-E22 PolarHBondContact O-N 3.28Å
19	Q	90.7	Very high	90.8	Very high	64 Å²	64	65.2 Å²	65.2	30%	0.299	33%	0.333	S	S	.	.	H	α-helix	trans	-64.2	-37	178.4	-59.8	169.7	-77.4	0	0	112	R16 L23 F68 E69	R16-Q19 HydrophobicContact CB-CG 4.4Å; R16-Q19 PolarHBondContact O-N 3.32Å; Q19-L23 PolarHBondContact O-N 3.43Å; Q19-F68 HydrophobicContact CB-CE2 3.96Å; Q19-F68 HydrophobicContact CB-CZ 3.78Å; Q19-E69 PolarHBondContact NE2-OE1 3.35Å
20	L	91.3	Very high	90.8	Very high	0 Å²	0	66.3 Å²	66.3	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-71	-35.3	177.1	-169.2	67.4	0	0	0	111.6	V8 L11 R16 S17 E18 F24 V35 V50 F68	V8-L20 HydrophobicContact CG1-CD1 4.3Å; L11-L20 HydrophobicContact CD1-CD2 4.01Å; L11-L20 HydrophobicContact CD2-CD1 3.92Å; R16-L20 PolarHBondContact O-N 2.92Å; R16-L20 VanDerWaalsContact O-N 3.12Å; S17-L20 PolarHBondContact O-N 2.91Å; E18-L20 VanDerWaalsContact C-N 3.32Å; E18-L20 PolarHBondContact O-N 2.87Å; L20-F24 HydrophobicContact CD1-CD2 3.83Å; L20-F24 HydrophobicContact CD1-CE2 3.57Å; L20-F24 HydrophobicContact CG-CD2 4.17Å; L20-F24 HydrophobicContact CG-CE2 4.29Å; L20-F24 VanDerWaalsContact O-CD2 3.32Å; L20-F24 WeakPolarHBondContact O-CD2 3.36Å; L20-F24 PolarHBondContact O-N 3.23Å; L20-V35 HydrophobicContact CB-CG2 4.32Å; L20-V35 HydrophobicContact CD2-CG2 3.68Å; L20-V50 HydrophobicContact CD2-CG2 4.03Å; L20-V50 HydrophobicContact CG-CG2 4.13Å; L20-F68 HydrophobicContact CB-CE2 4.41Å; L20-F68 HydrophobicContact CD1-CD2 4.13Å; L20-F68 HydrophobicContact CD1-CE2 4.22Å
21	E	93.1	Very high	90.8	Very high	78 Å²	78	63.3 Å²	63.3	36%	0.364	33%	0.33	S	S	.	.	H	α-helix	trans	-68.5	-42.3	175.3	-167.6	151.9	-154.7	0	0	111.4	S17 E18 L23 F24 S25 V30 C33	S17-E21 VanDerWaalsContact O-CB 3.31Å; S17-E21 WeakPolarHBondContact O-CB 3.37Å; S17-E21 PolarHBondContact O-N 3.48Å; E18-E21 PolarHBondContact O-N 3.46Å; E21-L23 PolarHBondContact O-N 2.95Å; E21-F24 PolarHBondContact O-N 3.47Å; E21-S25 WeakPolarHBondContact O-CB 3.33Å; E21-S25 PolarHBondContact O-N 2.78Å; E21-V30 HydrophobicContact CG-CG1 4.38Å; E21-C33 HydrophobicContact CB-CB 3.65Å; E21-C33 HydrophobicContact CG-CB 3.85Å
22	E	92.8	Very high	90.8	Very high	143 Å²	143	68.1 Å²	68.1	67%	0.668	35%	0.353	S	S	*	.	H	α-helix	trans	-58.7	-46.8	175	-175.4	172.2	-156.2	0	0	112.5	E18 S25	E18-E22 PolarHBondContact O-N 3.28Å; E22-S25 PolarHBondContact O-N 2.84Å
23	L	91.4	Very high	91	Very high	40 Å²	40	68.1 Å²	68.1	21%	0.209	35%	0.353	C	S	.	.	H	α-helix	trans	-63.8	-48.2	178.6	-176.5	64.9	0	0	0	112.1	Q19 E21 S25 Q26 I65 F68	Q19-L23 PolarHBondContact O-N 3.43Å; E21-L23 PolarHBondContact O-N 2.95Å; L23-S25 VanDerWaalsContact C-N 3.32Å; L23-S25 PolarHBondContact O-N 3.03Å; L23-Q26 WeakPolarHBondContact O-CB 3.17Å; L23-Q26 PolarHBondContact O-N 3.17Å; L23-I65 HydrophobicContact CD2-CG2 3.84Å; L23-I65 HydrophobicContact CG-CD1 4.22Å; L23-I65 HydrophobicContact CG-CG1 4.47Å; L23-I65 HydrophobicContact CG-CG2 4.38Å; L23-F68 HydrophobicContact CD2-CB 4.39Å; L23-F68 HydrophobicContact CD2-CD2 3.86Å
24	F	92.8	Very high	91.3	Very high	0 Å²	0	67.4 Å²	67.4	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-74	-22.8	-178.3	-80.5	-100.2	0	0	0	113	L6 V8 L20 E21 Q26 V27 V30 V50 F52 A61 I65 V75	L6-F24 HydrophobicContact CD1-CD1 4.39Å; L6-F24 HydrophobicContact CD1-CE1 3.89Å; V8-F24 HydrophobicContact CG1-CZ 4.46Å; V8-F24 HydrophobicContact CG2-CE1 4.23Å; V8-F24 HydrophobicContact CG2-CE2 3.96Å; V8-F24 HydrophobicContact CG2-CZ 3.52Å; L20-F24 HydrophobicContact CD1-CD2 3.83Å; L20-F24 HydrophobicContact CD1-CE2 3.57Å; L20-F24 HydrophobicContact CG-CD2 4.17Å; L20-F24 HydrophobicContact CG-CE2 4.29Å; L20-F24 VanDerWaalsContact O-CD2 3.32Å; L20-F24 WeakPolarHBondContact O-CD2 3.36Å; L20-F24 PolarHBondContact O-N 3.23Å; E21-F24 PolarHBondContact O-N 3.47Å; F24-Q26 PolarHBondContact O-N 3.39Å; F24-V27 PolarHBondContact O-N 3.39Å; F24-V30 HydrophobicContact CB-CG2 4.14Å; F24-V50 HydrophobicContact CB-CG1 3.82Å; F24-V50 HydrophobicContact CB-CG2 4.49Å; F24-V50 HydrophobicContact CD1-CB 4.28Å; F24-V50 HydrophobicContact CD1-CG1 4Å; F24-V50 HydrophobicContact CD1-CG2 4.27Å; F24-V50 HydrophobicContact CD2-CG2 4.08Å; F24-V50 HydrophobicContact CE2-CG2 4.39Å; F24-V50 HydrophobicContact CG-CB 4.38Å; F24-V50 HydrophobicContact CG-CG1 3.97Å; F24-V50 HydrophobicContact CG-CG2 4.01Å; F24-F52 HydrophobicContact CB-CZ 4.04Å; F24-F52 AromaticContact CD1-CE2 3.82Å; F24-F52 HydrophobicContact CD1-CE2 3.82Å; F24-F52 AromaticContact CD1-CZ 3.8Å; F24-F52 HydrophobicContact CD1-CZ 3.8Å; F24-F52 HydrophobicContact CG-CZ 4.43Å; F24-F52 WeakPolarHBondContact O-CE1 3.44Å; F24-F52 WeakPolarHBondContact O-CZ 3.23Å; F24-A61 HydrophobicContact CD1-CB 4.02Å; F24-A61 HydrophobicContact CE1-CB 4.01Å; F24-I65 HydrophobicContact CB-CD1 4.34Å; F24-I65 HydrophobicContact CD1-CD1 3.66Å; F24-I65 HydrophobicContact CD2-CD1 4Å; F24-I65 HydrophobicContact CE1-CB 4.41Å; F24-I65 HydrophobicContact CE1-CD1 3.85Å; F24-I65 HydrophobicContact CE1-CG2 4.26Å; F24-I65 HydrophobicContact CE2-CD1 4.18Å; F24-I65 HydrophobicContact CE2-CG2 3.74Å; F24-I65 HydrophobicContact CG-CD1 3.75Å; F24-I65 HydrophobicContact CZ-CB 4.2Å; F24-I65 HydrophobicContact CZ-CD1 4.11Å; F24-I65 HydrophobicContact CZ-CG2 3.59Å; F24-V75 HydrophobicContact CE1-CG1 4.25Å; F24-V75 HydrophobicContact CZ-CG1 4.33Å; F24-V75 HydrophobicContact CZ-CG2 4.07Å
25	S	93.2	Very high	91.5	Very high	69 Å²	69	65.4 Å²	65.4	48%	0.483	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-15.2	173.9	-171.6	0	0	0	0	113.8	E21 E22 L23 V27	E21-S25 WeakPolarHBondContact O-CB 3.33Å; E21-S25 PolarHBondContact O-N 2.78Å; E22-S25 PolarHBondContact O-N 2.84Å; L23-S25 VanDerWaalsContact C-N 3.32Å; L23-S25 PolarHBondContact O-N 3.03Å; S25-V27 VanDerWaalsContact C-N 3.29Å
26	Q	91.8	Very high	91.7	Very high	154 Å²	154	67.1 Å²	67.1	72%	0.72	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-30.1	174.4	-60.1	-179.4	14.1	0	0	112	L23 F24	L23-Q26 WeakPolarHBondContact O-CB 3.17Å; L23-Q26 PolarHBondContact O-N 3.17Å; F24-Q26 PolarHBondContact O-N 3.39Å
27	V	92.1	Very high	91.7	Very high	11 Å²	11	63 Å²	63	7%	0.067	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.6	-34.4	-176.9	-176.1	0	0	0	0	112.1	F24 S25 F52 R60 A61 I65	F24-V27 PolarHBondContact O-N 3.39Å; S25-V27 VanDerWaalsContact C-N 3.29Å; V27-F52 HydrophobicContact CB-CE1 4.49Å; V27-F52 HydrophobicContact CB-CZ 4.29Å; V27-R60 HydrophobicContact CG1-CB 3.41Å; V27-R60 VanDerWaalsContact CG1-CB 3.41Å; V27-R60 PolarHBondContact O-NH2 2.77Å; V27-A61 HydrophobicContact CB-CB 4.4Å; V27-A61 HydrophobicContact CG1-CB 4.09Å; V27-A61 HydrophobicContact CG2-CB 4.31Å; V27-I65 HydrophobicContact CG2-CD1 3.64Å; V27-I65 HydrophobicContact CG2-CG1 4.18Å
28	G	89.6	Confident	91.4	Very high	11 Å²	11	65.6 Å²	65.6	11%	0.113	34%	0.335	C	S	.	.	S	Bend	trans	176.3	172.8	-179.2	0	0	0	0	0	114.1	V30 F52	G28-V30 PolarHBondContact O-N 3.09Å; G28-V30 VanDerWaalsContact O-N 3.15Å; G28-F52 WeakPolarHBondContact O-CE1 3.49Å
29	P	93.2	Very high	90.9	Very high	80 Å²	80	63.8 Å²	63.8	52%	0.519	33%	0.325	S	S	.	.			trans	-67.4	112.1	-175.9	25	-33.3	0	0	0	112.4	S53	P29-S53 WeakPolarHBondContact O-CB 3.45Å; P29-S53 PolarHBondContact O-N 2.95Å
30	V	92	Very high	90.4	Very high	28 Å²	28	65.5 Å²	65.5	17%	0.17	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	136.1	172.7	179.2	0	0	0	0	110	E21 F24 G28 C33 V50 F52	E21-V30 HydrophobicContact CG-CG1 4.38Å; F24-V30 HydrophobicContact CB-CG2 4.14Å; G28-V30 PolarHBondContact O-N 3.09Å; G28-V30 VanDerWaalsContact O-N 3.15Å; V30-C33 HydrophobicContact CG1-CB 4.3Å; V30-V50 HydrophobicContact CG1-CG1 3.97Å; V30-V50 HydrophobicContact CG2-CG1 3.92Å; V30-F52 HydrophobicContact CG2-CD1 4.24Å; V30-F52 HydrophobicContact CG2-CE1 3.94Å
31	K	91.3	Very high	89.9	Confident	122 Å²	122	67.8 Å²	67.8	53%	0.53	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	-27.7	173.9	-76.8	178.4	172.8	146.1	0	113.1	T51 S53	K31-T51 HydrophobicContact CB-CG2 4.42Å; K31-T51 PolarHBondContact N-O 3.38Å; K31-S53 WeakPolarHBondContact CE-OG 3.1Å; K31-S53 VanDerWaalsContact NZ-CA 3.29Å; K31-S53 PolarHBondContact NZ-O 2.94Å; K31-S53 PolarHBondContact NZ-OG 2.97Å
32	Q	90.2	Very high	89.2	Confident	110 Å²	110	73.8 Å²	73.8	51%	0.514	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.8	119.3	177.4	-174.7	179.7	3.6	0	0	109.9	F34 T51	Q32-F34 HydrophobicContact CG-CD1 4.37Å; Q32-T51 PolarHBondContact N-O 3.3Å; Q32-T51 PolarHBondContact O-N 2.82Å
33	C	92.5	Very high	88.8	Confident	16 Å²	16	68.7 Å²	68.7	11%	0.108	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	141.4	162.5	-172.6	0	0	0	0	110	S17 E21 V30	S17-C33 PolarHBondContact O-SG 3.38Å; S17-C33 VanDerWaalsContact O-SG 3.34Å; E21-C33 HydrophobicContact CB-CB 3.65Å; E21-C33 HydrophobicContact CG-CB 3.85Å; V30-C33 HydrophobicContact CG1-CB 4.3Å
34	F	91.6	Very high	88.5	Confident	81 Å²	81	67.7 Å²	67.7	36%	0.355	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	136.9	159.3	68.3	-83.6	0	0	0	112.2	Q32 V36 G48 Y49	Q32-F34 HydrophobicContact CG-CD1 4.37Å; F34-V36 HydrophobicContact CD2-CG2 4.11Å; F34-V36 HydrophobicContact CE2-CG2 3.88Å; F34-G48 CarbonylContact O-C 3.58Å; F34-G48 WeakPolarHBondContact O-CA 3.45Å; F34-Y49 HydrophobicContact CD2-CD2 4.35Å; F34-Y49 HydrophobicContact CE1-CD2 4.12Å; F34-Y49 HydrophobicContact CE1-CG 4.22Å; F34-Y49 AromaticContact CE2-CD2 3.51Å; F34-Y49 HydrophobicContact CE2-CD2 3.51Å; F34-Y49 HydrophobicContact CE2-CE2 4.18Å; F34-Y49 HydrophobicContact CE2-CG 4.39Å; F34-Y49 AromaticContact CZ-CD2 3.37Å; F34-Y49 HydrophobicContact CZ-CD2 3.37Å; F34-Y49 HydrophobicContact CZ-CE2 4.17Å; F34-Y49 AromaticContact CZ-CG 3.88Å; F34-Y49 HydrophobicContact CZ-CG 3.88Å; F34-Y49 PolarHBondContact N-O 3.47Å; F34-Y49 PolarHBondContact O-N 3Å
35	V	92.3	Very high	88.2	Confident	20 Å²	20	74.4 Å²	74.4	12%	0.121	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	140.7	167.5	177.4	0	0	0	0	108.4	L11 L20 C44	L11-V35 HydrophobicContact CD1-CG1 4.16Å; L11-V35 HydrophobicContact CD1-CG2 3.93Å; L20-V35 HydrophobicContact CB-CG2 4.32Å; L20-V35 HydrophobicContact CD2-CG2 3.68Å; V35-C44 HydrophobicContact CG1-CB 3.77Å
36	V	91.1	Very high	88	Confident	36 Å²	36	72.2 Å²	72.2	22%	0.218	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	109.8	176.8	178.7	0	0	0	0	108.4	F34 R45 F47 Y49	F34-V36 HydrophobicContact CD2-CG2 4.11Å; F34-V36 HydrophobicContact CE2-CG2 3.88Å; V36-R45 HydrophobicContact CG1-CB 4.32Å; V36-R45 VanDerWaalsContact O-CB 3.29Å; V36-R45 WeakPolarHBondContact O-CB 3.48Å; V36-R45 PolarHBondContact O-N 2.9Å; V36-F47 HydrophobicContact CB-CD2 4.03Å; V36-F47 HydrophobicContact CB-CE2 3.74Å; V36-F47 HydrophobicContact CB-CZ 4.2Å; V36-F47 HydrophobicContact CG1-CE2 4Å; V36-F47 HydrophobicContact CG1-CZ 4.04Å; V36-F47 HydrophobicContact CG2-CD2 3.92Å; V36-F47 HydrophobicContact CG2-CE2 3.61Å; V36-F47 HydrophobicContact CG2-CZ 4.47Å; V36-F47 PolarHBondContact N-O 3.47Å; V36-Y49 HydrophobicContact CG2-CD2 4.35Å; V36-Y49 HydrophobicContact CG2-CE2 4.18Å
37	T	89.4	Confident	88	Confident	76 Å²	76	67.1 Å²	67.1	47%	0.466	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	158.2	169.2	56.7	0	0	0	0	111.1	A43	T37-A43 WeakPolarHBondContact CA-O 3.26Å; T37-A43 WeakPolarHBondContact CB-O 3.41Å
38	E	86.2	Confident	88.1	Confident	105 Å²	105	66.6 Å²	66.6	49%	0.491	37%	0.365	S	S	.	.	P	Polyproline II helix	trans	-72	155.9	167.9	-179.3	168.9	-125.3	0	0	111.2	G40 S41 A43	E38-G40 PolarHBondContact O-N 2.82Å; E38-S41 PolarHBondContact O-N 2.99Å; E38-S41 VanDerWaalsContact O-O 3.09Å; E38-A43 PolarHBondContact N-O 3.42Å
39	K	80.7	Confident	88.3	Confident	96 Å²	96	69.5 Å²	69.5	42%	0.417	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.1	132.3	-179.6	-63.5	177.7	-176.6	-180	0	110.5	S41 E286 D287	K39-S41 PolarHBondContact O-N 2.79Å; K39-E286 WeakPolarHBondContact CE-OE2 3.37Å; K39-E286 IonicContact NZ-OE2 3.62Å; K39-E286 PolarHBondContact NZ-OE2 2.92Å; K39-D287 IonicContact NZ-OD1 2.61Å; K39-D287 PolarHBondContact NZ-OD1 2.69Å; K39-D287 IonicContact NZ-OD2 3.58Å
40	G	79.6	Confident	88.3	Confident	99 Å²	99	65.7 Å²	65.7	100%	1.021	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.8	-9.9	-179.7	0	0	0	0	0	115.3	E38	E38-G40 PolarHBondContact O-N 2.82Å
41	S	81.3	Confident	88.4	Confident	49 Å²	49	65 Å²	65	34%	0.343	34%	0.344	S	S	.	.			trans	-106.7	155.7	177	-172.9	0	0	0	0	111.2	E38 K39 A43	E38-S41 PolarHBondContact O-N 2.99Å; E38-S41 VanDerWaalsContact O-O 3.09Å; K39-S41 PolarHBondContact O-N 2.79Å; S41-A43 WeakPolarHBondContact OG-CB 3.43Å; S41-A43 PolarHBondContact OG-N 2.84Å; S41-A43 VanDerWaalsContact OG-N 3.07Å
42	K	78.5	Confident	88.5	Confident	204 Å²	204	59.2 Å²	59.2	89%	0.887	32%	0.319	S	S	*	.	S	Bend	trans	-90.4	-3.8	166.4	-68.3	-176.7	179.2	178.1	0	112.5
43	A	84.3	Confident	88.6	Confident	35 Å²	35	55.9 Å²	55.9	29%	0.289	31%	0.308	S	S	.	.	S	Bend	trans	-73	149.7	175.9	0	0	0	0	0	111.4	T37 E38 S41	T37-A43 WeakPolarHBondContact CA-O 3.26Å; T37-A43 WeakPolarHBondContact CB-O 3.41Å; E38-A43 PolarHBondContact N-O 3.42Å; S41-A43 WeakPolarHBondContact OG-CB 3.43Å; S41-A43 PolarHBondContact OG-N 2.84Å; S41-A43 VanDerWaalsContact OG-N 3.07Å
44	C	84.1	Confident	88.7	Confident	19 Å²	19	59.5 Å²	59.5	13%	0.128	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	134.6	-177.2	-56.3	0	0	0	0	110.9	P13 A15 V35 G46	P13-C44 PolarHBondContact O-N 2.78Å; A15-C44 PolarHBondContact O-SG 2.81Å; V35-C44 HydrophobicContact CG1-CB 3.77Å; C44-G46 PolarHBondContact O-N 3.2Å
45	R	87.3	Confident	88.7	Confident	141 Å²	141	59.5 Å²	59.5	53%	0.532	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	24.4	179	-160.3	-175	158	122.7	-3	112.6	V36 F47	V36-R45 HydrophobicContact CG1-CB 4.32Å; V36-R45 VanDerWaalsContact O-CB 3.29Å; V36-R45 WeakPolarHBondContact O-CB 3.48Å; V36-R45 PolarHBondContact O-N 2.9Å; R45-F47 VanDerWaalsContact C-N 3.29Å; R45-F47 HydrophobicContact CB-CE1 4.19Å; R45-F47 HydrophobicContact CG-CE1 3.91Å; R45-F47 WeakPolarHBondContact O-CD1 3.49Å; R45-F47 WeakPolarHBondContact O-CE1 3.49Å; R45-F47 PolarHBondContact O-N 2.73Å
46	G	88.7	Confident	88.7	Confident	23 Å²	23	63.9 Å²	63.9	24%	0.237	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	73.5	3.8	179.6	0	0	0	0	0	116.5	G9 R10 L11 C44	G9-G46 CarbonylContact C-O 3.57Å; R10-G46 PolarHBondContact N-O 3.46Å; L11-G46 PolarHBondContact N-O 2.86Å; L11-G46 WeakPolarHBondContact O-CA 3.15Å; C44-G46 PolarHBondContact O-N 3.2Å
47	F	92.8	Very high	88.8	Confident	48 Å²	48	62.5 Å²	62.5	21%	0.211	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	160.3	178.9	64.8	-92.5	0	0	0	115.4	F7 V8 V36 R45 Y49	F7-F47 HydrophobicContact CD2-CB 4.48Å; F7-F47 HydrophobicContact CD2-CD2 4.33Å; F7-F47 HydrophobicContact CE2-CB 3.6Å; F7-F47 AromaticContact CE2-CD2 3.55Å; F7-F47 HydrophobicContact CE2-CD2 3.55Å; F7-F47 HydrophobicContact CE2-CE2 4.33Å; F7-F47 AromaticContact CE2-CG 3.66Å; F7-F47 HydrophobicContact CE2-CG 3.66Å; F7-F47 HydrophobicContact CZ-CB 3.75Å; F7-F47 HydrophobicContact CZ-CD2 4.38Å; F7-F47 HydrophobicContact CZ-CG 4.05Å; V8-F47 CarbonylContact O-C 3.56Å; V8-F47 WeakPolarHBondContact O-CA 3.38Å; V8-F47 WeakPolarHBondContact O-CB 3.22Å; V36-F47 HydrophobicContact CB-CD2 4.03Å; V36-F47 HydrophobicContact CB-CE2 3.74Å; V36-F47 HydrophobicContact CB-CZ 4.2Å; V36-F47 HydrophobicContact CG1-CE2 4Å; V36-F47 HydrophobicContact CG1-CZ 4.04Å; V36-F47 HydrophobicContact CG2-CD2 3.92Å; V36-F47 HydrophobicContact CG2-CE2 3.61Å; V36-F47 HydrophobicContact CG2-CZ 4.47Å; V36-F47 PolarHBondContact N-O 3.47Å; R45-F47 VanDerWaalsContact C-N 3.29Å; R45-F47 HydrophobicContact CB-CE1 4.19Å; R45-F47 HydrophobicContact CG-CE1 3.91Å; R45-F47 WeakPolarHBondContact O-CD1 3.49Å; R45-F47 WeakPolarHBondContact O-CE1 3.49Å; R45-F47 PolarHBondContact O-N 2.73Å; F47-Y49 HydrophobicContact CD2-CE2 4.14Å; F47-Y49 HydrophobicContact CE2-CE2 4.15Å
48	G	92.6	Very high	89	Confident	0 Å²	0	59 Å²	59	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	-178.2	175.7	0	0	0	0	0	112.6	V8 F34	V8-G48 PolarHBondContact N-O 2.73Å; V8-G48 PolarHBondContact O-N 2.69Å; F34-G48 CarbonylContact O-C 3.58Å; F34-G48 WeakPolarHBondContact O-CA 3.45Å
49	Y	94.2	Very high	89.3	Confident	71 Å²	71	59.3 Å²	59.3	28%	0.278	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	136.8	178.1	-61.8	-91.5	0	0	0	110.9	T5 L6 F7 F34 V36 F47 A78	T5-Y49 HydrophobicContact CG2-CD1 4.28Å; L6-Y49 VanDerWaalsContact O-CA 3.25Å; L6-Y49 WeakPolarHBondContact O-CA 3.31Å; F7-Y49 HydrophobicContact CB-CD1 4.16Å; F7-Y49 HydrophobicContact CB-CE1 4.02Å; F7-Y49 HydrophobicContact CD2-CD1 4.19Å; F7-Y49 AromaticContact CD2-CE1 3.58Å; F7-Y49 HydrophobicContact CD2-CE1 3.58Å; F7-Y49 HydrophobicContact CD2-CE2 4.4Å; F7-Y49 AromaticContact CD2-CZ 3.7Å; F7-Y49 HydrophobicContact CG-CE1 4.28Å; F34-Y49 HydrophobicContact CD2-CD2 4.35Å; F34-Y49 HydrophobicContact CE1-CD2 4.12Å; F34-Y49 HydrophobicContact CE1-CG 4.22Å; F34-Y49 AromaticContact CE2-CD2 3.51Å; F34-Y49 HydrophobicContact CE2-CD2 3.51Å; F34-Y49 HydrophobicContact CE2-CE2 4.18Å; F34-Y49 HydrophobicContact CE2-CG 4.39Å; F34-Y49 AromaticContact CZ-CD2 3.37Å; F34-Y49 HydrophobicContact CZ-CD2 3.37Å; F34-Y49 HydrophobicContact CZ-CE2 4.17Å; F34-Y49 AromaticContact CZ-CG 3.88Å; F34-Y49 HydrophobicContact CZ-CG 3.88Å; F34-Y49 PolarHBondContact N-O 3.47Å; F34-Y49 PolarHBondContact O-N 3Å; V36-Y49 HydrophobicContact CG2-CD2 4.35Å; V36-Y49 HydrophobicContact CG2-CE2 4.18Å; F47-Y49 HydrophobicContact CD2-CE2 4.14Å; F47-Y49 HydrophobicContact CE2-CE2 4.15Å; Y49-A78 HydrophobicContact CD1-CB 4.01Å; Y49-A78 HydrophobicContact CE1-CB 4.16Å
50	V	93.5	Very high	89.9	Confident	0 Å²	0	60 Å²	60	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	121.3	178.3	-178.4	0	0	0	0	108.4	T5 L6 V8 L20 F24 V30 F52	T5-V50 CarbonylContact C-O 3.59Å; T5-V50 WeakPolarHBondContact CA-O 3.47Å; L6-V50 PolarHBondContact N-O 3.23Å; L6-V50 PolarHBondContact O-N 2.72Å; V8-V50 HydrophobicContact CG2-CG2 4.16Å; L20-V50 HydrophobicContact CD2-CG2 4.03Å; L20-V50 HydrophobicContact CG-CG2 4.13Å; F24-V50 HydrophobicContact CB-CG1 3.82Å; F24-V50 HydrophobicContact CB-CG2 4.49Å; F24-V50 HydrophobicContact CD1-CB 4.28Å; F24-V50 HydrophobicContact CD1-CG1 4Å; F24-V50 HydrophobicContact CD1-CG2 4.27Å; F24-V50 HydrophobicContact CD2-CG2 4.08Å; F24-V50 HydrophobicContact CE2-CG2 4.39Å; F24-V50 HydrophobicContact CG-CB 4.38Å; F24-V50 HydrophobicContact CG-CG1 3.97Å; F24-V50 HydrophobicContact CG-CG2 4.01Å; V30-V50 HydrophobicContact CG1-CG1 3.97Å; V30-V50 HydrophobicContact CG2-CG1 3.92Å; V50-F52 HydrophobicContact CG1-CE2 4.26Å
51	T	93.6	Very high	90.5	Very high	14 Å²	14	55.3 Å²	55.3	9%	0.086	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	115.5	177.3	-58.3	0	0	0	0	110.1	L4 T5 K31 Q32	L4-T51 HydrophobicContact CB-CG2 4.41Å; L4-T51 CarbonylContact O-C 3.47Å; L4-T51 WeakPolarHBondContact O-CA 3.47Å; T5-T51 WeakPolarHBondContact CG2-OG1 3.46Å; T5-T51 WeakPolarHBondContact OG1-CG2 3.43Å; T5-T51 PolarHBondContact OG1-OG1 3.11Å; K31-T51 HydrophobicContact CB-CG2 4.42Å; K31-T51 PolarHBondContact N-O 3.38Å; Q32-T51 PolarHBondContact N-O 3.3Å; Q32-T51 PolarHBondContact O-N 2.82Å
52	F	94.3	Very high	91	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	166.1	177.4	-82.8	-73.1	0	0	0	113.3	L4 L6 F24 V27 G28 V30 V50 D57 V58 A61	L4-F52 PolarHBondContact O-N 3.36Å; L6-F52 HydrophobicContact CD1-CD2 4.21Å; L6-F52 HydrophobicContact CD1-CE2 3.81Å; F24-F52 HydrophobicContact CB-CZ 4.04Å; F24-F52 AromaticContact CD1-CE2 3.82Å; F24-F52 HydrophobicContact CD1-CE2 3.82Å; F24-F52 AromaticContact CD1-CZ 3.8Å; F24-F52 HydrophobicContact CD1-CZ 3.8Å; F24-F52 HydrophobicContact CG-CZ 4.43Å; F24-F52 WeakPolarHBondContact O-CE1 3.44Å; F24-F52 WeakPolarHBondContact O-CZ 3.23Å; V27-F52 HydrophobicContact CB-CE1 4.49Å; V27-F52 HydrophobicContact CB-CZ 4.29Å; G28-F52 WeakPolarHBondContact O-CE1 3.49Å; V30-F52 HydrophobicContact CG2-CD1 4.24Å; V30-F52 HydrophobicContact CG2-CE1 3.94Å; V50-F52 HydrophobicContact CG1-CE2 4.26Å; F52-D57 HydrophobicContact CB-CB 3.94Å; F52-D57 HydrophobicContact CD1-CB 3.47Å; F52-D57 VanDerWaalsContact CD1-CB 3.47Å; F52-D57 HydrophobicContact CD2-CB 4.29Å; F52-D57 HydrophobicContact CE1-CB 3.97Å; F52-D57 HydrophobicContact CG-CB 3.65Å; F52-V58 HydrophobicContact CB-CG2 3.91Å; F52-V58 HydrophobicContact CD2-CG2 3.99Å; F52-V58 HydrophobicContact CG-CG2 4.35Å; F52-A61 HydrophobicContact CE2-CB 3.55Å; F52-A61 HydrophobicContact CZ-CB 3.77Å
53	S	93	Very high	91.6	Very high	40 Å²	40	54.2 Å²	54.2	28%	0.28	26%	0.262	S	S	.	.	S	Bend	trans	-74.1	-49.3	173.1	-161.1	0	0	0	0	112.9	P29 K31	P29-S53 WeakPolarHBondContact O-CB 3.45Å; P29-S53 PolarHBondContact O-N 2.95Å; K31-S53 WeakPolarHBondContact CE-OG 3.1Å; K31-S53 VanDerWaalsContact NZ-CA 3.29Å; K31-S53 PolarHBondContact NZ-O 2.94Å; K31-S53 PolarHBondContact NZ-OG 2.97Å
54	M	92.9	Very high	91.8	Very high	93 Å²	93	58.3 Å²	58.3	46%	0.458	27%	0.274	S	S	.	.	S	Bend	trans	-107.3	169.7	-177.3	-61	-69.9	-76.5	0	0	111.8	L4 D57 V58	L4-M54 VanDerWaalsContact CD2-C 3.43Å; L4-M54 WeakPolarHBondContact CD2-O 3.47Å; M54-D57 WeakPolarHBondContact CB-OD2 3.34Å; M54-D57 PolarHBondContact N-OD2 3.1Å; M54-V58 WeakPolarHBondContact O-CG2 3.44Å
55	L	92.4	Very high	92	Very high	81 Å²	81	58 Å²	58	42%	0.424	27%	0.271	S	S	.	.	H	α-helix	trans	-87.8	-29.7	176.4	-168.1	146.7	0	0	0	112.1	L4 D57 V58 Q59	L4-L55 HydrophobicContact CD2-CB 4.09Å; L55-D57 VanDerWaalsContact C-N 3.32Å; L55-D57 PolarHBondContact O-N 3.43Å; L55-V58 WeakPolarHBondContact O-CB 3.16Å; L55-V58 PolarHBondContact O-N 2.81Å; L55-Q59 HydrophobicContact CD2-CG 4.2Å; L55-Q59 PolarHBondContact O-N 3.11Å
56	E	92.4	Very high	92	Very high	112 Å²	112	55 Å²	55	52%	0.523	27%	0.269	S	S	.	.	H	α-helix	trans	-59.7	-40.5	172.7	-63.1	102.4	-111.8	0	0	112.2	V58 Q59 R60	E56-V58 VanDerWaalsContact C-N 3.3Å; E56-V58 PolarHBondContact O-N 2.91Å; E56-Q59 PolarHBondContact O-N 2.78Å; E56-Q59 VanDerWaalsContact O-N 3.1Å; E56-R60 PolarHBondContact O-N 2.94Å
57	D	93.7	Very high	92	Very high	6 Å²	6	57.6 Å²	57.6	3%	0.032	28%	0.28	C	S	.	.	H	α-helix	trans	-58.2	-42	176.9	-50.4	-23.7	0	0	0	111.8	F52 M54 L55 Q59 R60 A61	F52-D57 HydrophobicContact CB-CB 3.94Å; F52-D57 HydrophobicContact CD1-CB 3.47Å; F52-D57 VanDerWaalsContact CD1-CB 3.47Å; F52-D57 HydrophobicContact CD2-CB 4.29Å; F52-D57 HydrophobicContact CE1-CB 3.97Å; F52-D57 HydrophobicContact CG-CB 3.65Å; M54-D57 WeakPolarHBondContact CB-OD2 3.34Å; M54-D57 PolarHBondContact N-OD2 3.1Å; L55-D57 VanDerWaalsContact C-N 3.32Å; L55-D57 PolarHBondContact O-N 3.43Å; D57-Q59 VanDerWaalsContact C-N 3.3Å; D57-Q59 PolarHBondContact O-N 2.79Å; D57-R60 PolarHBondContact O-N 3.45Å; D57-R60 IonicContact OD1-CZ 3.25Å; D57-R60 IonicContact OD1-NH2 2.98Å; D57-R60 PolarHBondContact OD1-NH2 2.81Å; D57-A61 WeakPolarHBondContact O-CB 3.23Å; D57-A61 PolarHBondContact O-N 2.75Å
58	V	92.9	Very high	91.6	Very high	3 Å²	3	55.9 Å²	55.9	2%	0.018	27%	0.273	C	S	.	.	H	α-helix	trans	-59.8	-42	176.4	-179.1	0	0	0	0	110.7	L6 F52 M54 L55 E56 L62 V77	L6-V58 HydrophobicContact CD1-CG1 4.43Å; L6-V58 HydrophobicContact CD2-CG1 3.49Å; L6-V58 VanDerWaalsContact CD2-CG1 3.49Å; L6-V58 HydrophobicContact CG-CG1 3.92Å; F52-V58 HydrophobicContact CB-CG2 3.91Å; F52-V58 HydrophobicContact CD2-CG2 3.99Å; F52-V58 HydrophobicContact CG-CG2 4.35Å; M54-V58 WeakPolarHBondContact O-CG2 3.44Å; L55-V58 WeakPolarHBondContact O-CB 3.16Å; L55-V58 PolarHBondContact O-N 2.81Å; E56-V58 VanDerWaalsContact C-N 3.3Å; E56-V58 PolarHBondContact O-N 2.91Å; V58-L62 HydrophobicContact CG1-CD1 4.23Å; V58-L62 WeakPolarHBondContact O-CB 3.36Å; V58-L62 WeakPolarHBondContact O-CD1 3.42Å; V58-L62 VanDerWaalsContact O-CG 3.24Å; V58-L62 WeakPolarHBondContact O-CG 3.4Å; V58-L62 PolarHBondContact O-N 3.26Å; V58-L62 VanDerWaalsContact O-N 3.15Å; V58-V77 HydrophobicContact CG1-CG2 4.47Å
59	Q	92.4	Very high	91.1	Very high	112 Å²	112	60.4 Å²	60.4	52%	0.523	29%	0.294	S	S	.	.	H	α-helix	trans	-75.2	-28.7	-179.1	-67.9	-175.2	-14.1	0	0	113.3	L55 E56 D57 K63	L55-Q59 HydrophobicContact CD2-CG 4.2Å; L55-Q59 PolarHBondContact O-N 3.11Å; E56-Q59 PolarHBondContact O-N 2.78Å; E56-Q59 VanDerWaalsContact O-N 3.1Å; D57-Q59 VanDerWaalsContact C-N 3.3Å; D57-Q59 PolarHBondContact O-N 2.79Å; Q59-K63 WeakPolarHBondContact O-CG 3.07Å
60	R	93.4	Very high	90.5	Very high	111 Å²	111	60.7 Å²	60.7	42%	0.419	32%	0.319	S	S	.	.	H	α-helix	trans	-72	-48.4	171	-72.8	-173.6	-74.5	169.7	-0.5	111.4	V27 E56 D57 L62 K63 E64	V27-R60 HydrophobicContact CG1-CB 3.41Å; V27-R60 VanDerWaalsContact CG1-CB 3.41Å; V27-R60 PolarHBondContact O-NH2 2.77Å; E56-R60 PolarHBondContact O-N 2.94Å; D57-R60 PolarHBondContact O-N 3.45Å; D57-R60 IonicContact OD1-CZ 3.25Å; D57-R60 IonicContact OD1-NH2 2.98Å; D57-R60 PolarHBondContact OD1-NH2 2.81Å; R60-L62 VanDerWaalsContact C-N 3.25Å; R60-L62 PolarHBondContact O-N 3.14Å; R60-K63 WeakPolarHBondContact O-CA 3.47Å; R60-K63 WeakPolarHBondContact O-CB 3.32Å; R60-K63 PolarHBondContact O-N 3.33Å; R60-E64 PolarHBondContact O-N 3.33Å
61	A	92.8	Very high	90.1	Very high	0 Å²	0	63.4 Å²	63.4	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-62.9	-30.4	-179.7	0	0	0	0	0	113	L6 F24 V27 F52 D57 K63 I65	L6-A61 HydrophobicContact CD1-CB 3.82Å; F24-A61 HydrophobicContact CD1-CB 4.02Å; F24-A61 HydrophobicContact CE1-CB 4.01Å; V27-A61 HydrophobicContact CB-CB 4.4Å; V27-A61 HydrophobicContact CG1-CB 4.09Å; V27-A61 HydrophobicContact CG2-CB 4.31Å; F52-A61 HydrophobicContact CE2-CB 3.55Å; F52-A61 HydrophobicContact CZ-CB 3.77Å; D57-A61 WeakPolarHBondContact O-CB 3.23Å; D57-A61 PolarHBondContact O-N 2.75Å; A61-K63 PolarHBondContact O-N 3.07Å; A61-I65 HydrophobicContact CB-CD1 4.37Å; A61-I65 PolarHBondContact O-N 2.86Å
62	L	91.6	Very high	89.9	Confident	59 Å²	59	70.8 Å²	70.8	31%	0.309	37%	0.368	S	S	.	.	H	α-helix	trans	-66.7	-16.2	171.4	-79.9	165.1	0	0	0	114.8	L6 V58 R60 V75 V77	L6-L62 HydrophobicContact CD2-CD1 3.95Å; L6-L62 HydrophobicContact CD2-CD2 3.84Å; L6-L62 HydrophobicContact CD2-CG 3.72Å; V58-L62 HydrophobicContact CG1-CD1 4.23Å; V58-L62 WeakPolarHBondContact O-CB 3.36Å; V58-L62 WeakPolarHBondContact O-CD1 3.42Å; V58-L62 VanDerWaalsContact O-CG 3.24Å; V58-L62 WeakPolarHBondContact O-CG 3.4Å; V58-L62 PolarHBondContact O-N 3.26Å; V58-L62 VanDerWaalsContact O-N 3.15Å; R60-L62 VanDerWaalsContact C-N 3.25Å; R60-L62 PolarHBondContact O-N 3.14Å; L62-V75 HydrophobicContact CD2-CB 4.26Å; L62-V75 HydrophobicContact CD2-CG1 3.86Å; L62-V75 WeakPolarHBondContact CD2-O 3.29Å; L62-V75 HydrophobicContact CG-CG1 4.48Å; L62-V77 HydrophobicContact CD1-CG2 3.85Å
63	K	90.5	Very high	89.7	Confident	171 Å²	171	71.5 Å²	71.5	74%	0.743	37%	0.372	S	S	*	.	H	α-helix	trans	-106.6	-42.7	-179.7	-65.4	176.8	-179.9	-177.2	0	112.1	Q59 R60 A61	Q59-K63 WeakPolarHBondContact O-CG 3.07Å; R60-K63 WeakPolarHBondContact O-CA 3.47Å; R60-K63 WeakPolarHBondContact O-CB 3.32Å; R60-K63 PolarHBondContact O-N 3.33Å; A61-K63 PolarHBondContact O-N 3.07Å
64	E	89.7	Confident	89.6	Confident	120 Å²	120	73.6 Å²	73.6	56%	0.561	38%	0.38	S	S	*	.	H	α-helix	trans	-82.4	-40.9	-173	-69.3	158.6	-151.7	0	0	112	R60 T66	R60-E64 PolarHBondContact O-N 3.33Å; E64-T66 PolarHBondContact O-N 2.75Å
65	I	87.7	Confident	89.6	Confident	12 Å²	12	70.1 Å²	70.1	6%	0.062	36%	0.364	C	S	.	.			trans	-96.5	101.9	-172.8	-63.4	171.1	0	0	0	110.6	L23 F24 V27 A61 I73 V75	L23-I65 HydrophobicContact CD2-CG2 3.84Å; L23-I65 HydrophobicContact CG-CD1 4.22Å; L23-I65 HydrophobicContact CG-CG1 4.47Å; L23-I65 HydrophobicContact CG-CG2 4.38Å; F24-I65 HydrophobicContact CB-CD1 4.34Å; F24-I65 HydrophobicContact CD1-CD1 3.66Å; F24-I65 HydrophobicContact CD2-CD1 4Å; F24-I65 HydrophobicContact CE1-CB 4.41Å; F24-I65 HydrophobicContact CE1-CD1 3.85Å; F24-I65 HydrophobicContact CE1-CG2 4.26Å; F24-I65 HydrophobicContact CE2-CD1 4.18Å; F24-I65 HydrophobicContact CE2-CG2 3.74Å; F24-I65 HydrophobicContact CG-CD1 3.75Å; F24-I65 HydrophobicContact CZ-CB 4.2Å; F24-I65 HydrophobicContact CZ-CD1 4.11Å; F24-I65 HydrophobicContact CZ-CG2 3.59Å; V27-I65 HydrophobicContact CG2-CD1 3.64Å; V27-I65 HydrophobicContact CG2-CG1 4.18Å; A61-I65 HydrophobicContact CB-CD1 4.37Å; A61-I65 PolarHBondContact O-N 2.86Å; I65-I73 HydrophobicContact CG2-CD1 3.6Å; I65-V75 HydrophobicContact CG2-CG2 4.49Å; I65-V75 WeakPolarHBondContact O-CG2 3.27Å
66	T	87.3	Confident	89.5	Confident	78 Å²	78	69.1 Å²	69.1	48%	0.479	36%	0.361	S	S	.	.			trans	-125.7	-6.1	175.4	60.5	0	0	0	0	114.2	E64 K72 I73	E64-T66 PolarHBondContact O-N 2.75Å; T66-K72 WeakPolarHBondContact O-CA 3.34Å; T66-I73 VanDerWaalsContact C-CG1 3.49Å; T66-I73 WeakPolarHBondContact O-CG1 3.26Å; T66-I73 PolarHBondContact O-N 3.4Å
67	T	88.2	Confident	89.5	Confident	78 Å²	78	67.1 Å²	67.1	48%	0.479	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	148.3	179.5	49.2	0	0	0	0	112.5	C71 K72	T67-C71 CarbonylContact C-O 3.47Å; T67-C71 VanDerWaalsContact CA-O 3.24Å; T67-C71 WeakPolarHBondContact CA-O 3.45Å; T67-K72 HydrophobicContact CG2-CG 4.28Å
68	F	85.4	Confident	89.3	Confident	12 Å²	12	67.6 Å²	67.6	5%	0.053	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	129.9	176.9	177	-82	0	0	0	108.9	L11 P12 A15 Q19 L20 L23 G70 C71 I73	L11-F68 HydrophobicContact CD2-CD1 4.11Å; L11-F68 HydrophobicContact CD2-CG 4.15Å; P12-F68 HydrophobicContact CG-CD1 3.98Å; P12-F68 HydrophobicContact CG-CE1 4.07Å; A15-F68 HydrophobicContact CB-CD1 4.21Å; A15-F68 HydrophobicContact CB-CE1 3.36Å; A15-F68 HydrophobicContact CB-CZ 3.81Å; Q19-F68 HydrophobicContact CB-CE2 3.96Å; Q19-F68 HydrophobicContact CB-CZ 3.78Å; L20-F68 HydrophobicContact CB-CE2 4.41Å; L20-F68 HydrophobicContact CD1-CD2 4.13Å; L20-F68 HydrophobicContact CD1-CE2 4.22Å; L23-F68 HydrophobicContact CD2-CB 4.39Å; L23-F68 HydrophobicContact CD2-CD2 3.86Å; F68-G70 PolarHBondContact O-N 3.46Å; F68-G70 VanDerWaalsContact O-N 3.11Å; F68-C71 PolarHBondContact N-O 2.85Å; F68-C71 WeakPolarHBondContact O-CA 3.23Å; F68-C71 WeakPolarHBondContact O-CB 3.48Å; F68-C71 PolarHBondContact O-N 3.28Å; F68-I73 HydrophobicContact CB-CD1 3.97Å; F68-I73 HydrophobicContact CB-CG1 4.35Å; F68-I73 HydrophobicContact CB-CG2 3.81Å
69	E	81.4	Confident	88.8	Confident	95 Å²	95	77.3 Å²	77.3	44%	0.444	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	46.2	39.2	-174.5	-69.6	-175.4	152.5	0	0	113.3	P12 S14 Q19 C71	P12-E69 HydrophobicContact CG-CB 4.18Å; P12-E69 VanDerWaalsContact CG-OE2 3.32Å; P12-E69 WeakPolarHBondContact CG-OE2 3.43Å; S14-E69 WeakPolarHBondContact CB-OE2 3.28Å; S14-E69 PolarHBondContact OG-OE2 2.9Å; Q19-E69 PolarHBondContact NE2-OE1 3.35Å; E69-C71 PolarHBondContact O-N 2.8Å; E69-C71 VanDerWaalsContact O-N 3.12Å
70	G	82.4	Confident	88.2	Confident	78 Å²	78	79.6 Å²	79.6	80%	0.804	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.7	-12.9	-176.3	0	0	0	0	0	115.7	F68	F68-G70 PolarHBondContact O-N 3.46Å; F68-G70 VanDerWaalsContact O-N 3.11Å
71	C	84.3	Confident	87	Confident	57 Å²	57	83.8 Å²	83.8	39%	0.385	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	146.5	176.4	-64.2	0	0	0	0	111.5	T67 F68 E69	T67-C71 CarbonylContact C-O 3.47Å; T67-C71 VanDerWaalsContact CA-O 3.24Å; T67-C71 WeakPolarHBondContact CA-O 3.45Å; F68-C71 PolarHBondContact N-O 2.85Å; F68-C71 WeakPolarHBondContact O-CA 3.23Å; F68-C71 WeakPolarHBondContact O-CB 3.48Å; F68-C71 PolarHBondContact O-N 3.28Å; E69-C71 PolarHBondContact O-N 2.8Å; E69-C71 VanDerWaalsContact O-N 3.12Å
72	K	88.5	Confident	85.6	Confident	169 Å²	169	91 Å²	91	74%	0.735	47%	0.47	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.6	113.5	174.1	-68.5	-177	179.3	-179.2	0	110.6	T66 T67	T66-K72 WeakPolarHBondContact O-CA 3.34Å; T67-K72 HydrophobicContact CG2-CG 4.28Å
73	I	91.3	Very high	83.8	Confident	15 Å²	15	96.4 Å²	96.4	8%	0.077	49%	0.486	C	S	.	.			trans	-94.2	154.5	-179.1	51.5	166.5	0	0	0	111.9	V8 G9 L11 I65 T66 F68 V75	V8-I73 HydrophobicContact CG1-CB 4.21Å; V8-I73 HydrophobicContact CG1-CD1 3.89Å; G9-I73 WeakPolarHBondContact O-CA 3.15Å; L11-I73 HydrophobicContact CD2-CG2 3.97Å; I65-I73 HydrophobicContact CG2-CD1 3.6Å; T66-I73 VanDerWaalsContact C-CG1 3.49Å; T66-I73 WeakPolarHBondContact O-CG1 3.26Å; T66-I73 PolarHBondContact O-N 3.4Å; F68-I73 HydrophobicContact CB-CD1 3.97Å; F68-I73 HydrophobicContact CB-CG1 4.35Å; F68-I73 HydrophobicContact CB-CG2 3.81Å; I73-V75 HydrophobicContact CD1-CG2 4.09Å; I73-V75 HydrophobicContact CG1-CG2 4.4Å
74	N	90.9	Very high	81.8	Confident	84 Å²	84	95.3 Å²	95.3	45%	0.449	49%	0.489	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	106.5	179.5	-176.2	-6	0	0	0	109.8	G9	G9-N74 PolarHBondContact N-O 2.62Å; G9-N74 PolarHBondContact O-N 2.75Å
75	V	92.2	Very high	80	Confident	20 Å²	20	97.7 Å²	97.7	12%	0.121	50%	0.497	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	125.4	-177.6	-171.3	0	0	0	0	109.6	L6 F7 V8 F24 L62 I65 I73	L6-V75 HydrophobicContact CB-CG1 4.18Å; L6-V75 HydrophobicContact CD1-CG1 3.71Å; L6-V75 HydrophobicContact CD2-CG1 4.13Å; L6-V75 HydrophobicContact CG-CG1 4.23Å; F7-V75 WeakPolarHBondContact O-CA 3.21Å; V8-V75 HydrophobicContact CG1-CG2 4.34Å; V8-V75 HydrophobicContact CG2-CG1 4.47Å; V8-V75 HydrophobicContact CG2-CG2 4.46Å; F24-V75 HydrophobicContact CE1-CG1 4.25Å; F24-V75 HydrophobicContact CZ-CG1 4.33Å; F24-V75 HydrophobicContact CZ-CG2 4.07Å; L62-V75 HydrophobicContact CD2-CB 4.26Å; L62-V75 HydrophobicContact CD2-CG1 3.86Å; L62-V75 WeakPolarHBondContact CD2-O 3.29Å; L62-V75 HydrophobicContact CG-CG1 4.48Å; I65-V75 HydrophobicContact CG2-CG2 4.49Å; I65-V75 WeakPolarHBondContact O-CG2 3.27Å; I73-V75 HydrophobicContact CD1-CG2 4.09Å; I73-V75 HydrophobicContact CG1-CG2 4.4Å
76	T	91.5	Very high	77.9	Confident	59 Å²	59	103.2 Å²	103.2	36%	0.362	53%	0.532	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	159.9	179.6	56.3	0	0	0	0	112	L6 F7 A78	L6-T76 CarbonylContact C-O 3.6Å; L6-T76 VanDerWaalsContact CA-O 3.3Å; L6-T76 WeakPolarHBondContact CA-O 3.34Å; L6-T76 WeakPolarHBondContact CD2-O 3.37Å; F7-T76 PolarHBondContact N-O 3.25Å; F7-T76 PolarHBondContact O-N 3.23Å; T76-A78 PolarHBondContact O-N 2.85Å
77	V	91.5	Very high	75.9	Confident	70 Å²	70	109.1 Å²	109.1	42%	0.424	55%	0.551	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-69.3	123.8	175.4	-176.2	0	0	0	0	110.4	L6 V58 L62 K79	L6-V77 HydrophobicContact CD2-CG2 4.42Å; V58-V77 HydrophobicContact CG1-CG2 4.47Å; L62-V77 HydrophobicContact CD1-CG2 3.85Å; V77-K79 PolarHBondContact O-N 2.87Å
78	A	89.3	Confident	74	Confident	16 Å²	16	111.5 Å²	111.5	13%	0.132	56%	0.556	C	S	.	*			trans	-68.2	114.2	-172.4	0	0	0	0	0	112.4	T5 F7 Y49 T76 K80	T5-A78 HydrophobicContact CG2-CB 3.82Å; T5-A78 VanDerWaalsContact O-CB 3.26Å; T5-A78 WeakPolarHBondContact O-CB 3.35Å; T5-A78 PolarHBondContact O-N 3.5Å; F7-A78 HydrophobicContact CB-CB 4.25Å; Y49-A78 HydrophobicContact CD1-CB 4.01Å; Y49-A78 HydrophobicContact CE1-CB 4.16Å; T76-A78 PolarHBondContact O-N 2.85Å; A78-K80 PolarHBondContact O-N 3.02Å
79	K	83.5	Confident	71.9	Confident	207 Å²	207	120.9 Å²	120.9	90%	0.9	60%	0.597	S	S	*	*			trans	-62.4	116.1	175.6	-65.2	174.1	-177.3	171.1	0	110.1	V77 K81	V77-K79 PolarHBondContact O-N 2.87Å; K79-K81 PolarHBondContact O-N 3.3Å
80	K	78	Confident	70	Confident	160 Å²	160	120.1 Å²	120.1	70%	0.696	61%	0.614	S	S	*	*			trans	-63.4	107.1	179.6	-180	-174.9	173	-173.6	0	111.4	A2 A78 L82	A2-K80 HydrophobicContact CB-CB 4.24Å; A2-K80 HydrophobicContact CB-CD 4.02Å; A78-K80 PolarHBondContact O-N 3.02Å; K80-L82 PolarHBondContact O-N 3.37Å; K80-L82 VanDerWaalsContact O-N 3.15Å
81	K	68.5	Low	68.1	Low	200 Å²	200	126.2 Å²	126.2	87%	0.87	62%	0.619	S	S	*	*			trans	-56.7	115.9	175.2	-155.5	168.5	-172.7	174	0	110.3	K79 R83	K79-K81 PolarHBondContact O-N 3.3Å; K81-R83 PolarHBondContact O-N 2.92Å
82	L	63.8	Low	65.9	Low	152 Å²	152	130.2 Å²	130.2	80%	0.796	64%	0.636	S	S	*	*			trans	-75.3	86.6	-179.1	-82.8	159.7	0	0	0	110.5	K80 N84	K80-L82 PolarHBondContact O-N 3.37Å; K80-L82 VanDerWaalsContact O-N 3.15Å; L82-N84 PolarHBondContact O-N 3.19Å
83	R	53.4	Low	63.7	Low	171 Å²	171	130 Å²	130	65%	0.645	64%	0.638	S	S	*	*			trans	-63.9	101.8	173.1	173.3	165.2	148.6	-165	-4.8	110.3	K81 K85 E88	K81-R83 PolarHBondContact O-N 2.92Å; R83-K85 PolarHBondContact O-N 2.9Å; R83-E88 IonicContact CZ-OE1 2.81Å; R83-E88 IonicContact CZ-OE2 2.67Å; R83-E88 IonicContact NE-OE1 2.7Å; R83-E88 IonicContact NE-OE2 2.87Å; R83-E88 PolarHBondContact NE-OE2 3.49Å; R83-E88 IonicContact NH2-OE1 3.21Å; R83-E88 PolarHBondContact NH2-OE1 3.4Å; R83-E88 IonicContact NH2-OE2 3.96Å; R83-E88 PolarHBondContact NH2-OE2 3.37Å
84	N	48.3	Very low	61.3	Low	148 Å²	148	137.1 Å²	137.1	79%	0.791	68%	0.676	S	S	*	*			trans	-56.9	105.1	172.4	-81.1	-22.9	0	0	0	109.9	L82 T86	L82-N84 PolarHBondContact O-N 3.19Å; N84-T86 PolarHBondContact O-N 3.3Å
85	K	51.8	Low	59.2	Low	171 Å²	171	138 Å²	138	74%	0.743	69%	0.689	S	S	*	*			trans	-86	35	-160.4	-147.7	-179.9	-176	-174.9	0	114	R83	R83-K85 PolarHBondContact O-N 2.9Å
86	T	44.8	Very low	56.8	Low	127 Å²	127	146.8 Å²	146.8	78%	0.779	73%	0.728	S	S	*	*			trans	-108.4	12.3	-159.6	-24.9	0	0	0	0	114.1	N84	N84-T86 PolarHBondContact O-N 3.3Å
87	K	45.5	Very low	54	Low	203 Å²	203	149.1 Å²	149.1	88%	0.883	75%	0.746	S	S	*	*			trans	-142.1	14.1	-171.1	-110	-174.2	179.2	-172.6	0	117.8
88	E	47.2	Very low	51.6	Low	127 Å²	127	151.6 Å²	151.6	59%	0.593	76%	0.764	S	S	*	*			trans	-109.4	76.8	-178.8	-68.1	170.6	123.1	0	0	111.6	R83	R83-E88 IonicContact CZ-OE1 2.81Å; R83-E88 IonicContact CZ-OE2 2.67Å; R83-E88 IonicContact NE-OE1 2.7Å; R83-E88 IonicContact NE-OE2 2.87Å; R83-E88 PolarHBondContact NE-OE2 3.49Å; R83-E88 IonicContact NH2-OE1 3.21Å; R83-E88 PolarHBondContact NH2-OE1 3.4Å; R83-E88 IonicContact NH2-OE2 3.96Å; R83-E88 PolarHBondContact NH2-OE2 3.37Å
89	K	41.8	Very low	49.2	Very low	210 Å²	210	159.9 Å²	159.9	91%	0.913	80%	0.797	S	S	*	*	S	Bend	trans	-147.1	119.1	158.8	-94.4	-163	174.2	-171.6	0	109.5
90	G	42.3	Very low	47.1	Very low	78 Å²	78	160.3 Å²	160.3	80%	0.804	80%	0.799	S	S	*	*			trans	84.1	98.8	166.2	0	0	0	0	0	116
91	K	41.5	Very low	45.8	Very low	207 Å²	207	161.5 Å²	161.5	90%	0.9	81%	0.807	S	S	*	*			trans	-165.3	112.1	137.6	-113.6	-172.6	176.7	-160.8	0	110
92	N	39.5	Very low	44.5	Very low	140 Å²	140	157.6 Å²	157.6	75%	0.749	80%	0.801	S	S	*	*			trans	-88.6	127	150.7	-90.4	57.9	0	0	0	107.3
93	E	41.6	Very low	43.3	Very low	166 Å²	166	159.6 Å²	159.6	78%	0.776	80%	0.804	S	S	*	*				45.5	124.9	128.8	-62.6	165	156.8	0	0	121
94	N	41.3	Very low	42.6	Very low	164 Å²	164	156.6 Å²	156.6	88%	0.877	82%	0.816	S	S	*	*			trans	108.4	151.4	135.5	-138	-4.1	0	0	0	119.2
95	S	46.7	Very low	42.7	Very low	101 Å²	101	158.3 Å²	158.3	71%	0.706	82%	0.816	S	S	*	*			trans	78.7	72.9	172.2	-52	0	0	0	0	119.8
96	E	41.5	Very low	42.5	Very low	205 Å²	205	159.8 Å²	159.8	96%	0.958	82%	0.822	S	S	*	*			trans	57.7	175.8	132.6	-92.5	-179.8	122.8	0	0	124.2
97	C	31.8	Very low	42.4	Very low	109 Å²	109	157.8 Å²	157.8	74%	0.736	82%	0.819	S	S	*	*			trans	-123.2	-179.7	-157.8	-122.4	0	0	0	0	111.6
98	P	40.8	Very low	42.8	Very low	121 Å²	121	155.4 Å²	155.4	79%	0.786	81%	0.808	S	S	*	*			cis	-141.4	159.9	34.9	40	-19	0	0	0	120.4
99	K	39	Very low	43.2	Very low	191 Å²	191	154.9 Å²	154.9	83%	0.83	81%	0.814	S	S	*	*			trans	-9.7	136	159.7	-55.4	177.9	-179.9	-177.8	0	120.5
100	K	41.3	Very low	43.7	Very low	216 Å²	216	148.2 Å²	148.2	94%	0.939	80%	0.798	S	S	*	*			trans	-149.2	158.9	137.9	-110	176.3	-176.4	178.1	0	110
101	E	50.4	Low	44.5	Very low	185 Å²	185	149.2 Å²	149.2	86%	0.864	79%	0.785	S	S	*	*			trans	-91.2	166.7	-150.4	-86.9	173.9	-176.2	0	0	117.8
102	P	39.4	Very low	45.7	Very low	117 Å²	117	144.5 Å²	144.5	76%	0.76	76%	0.764	S	S	*	*			trans	-97.8	155.5	-148.3	37.3	-36.9	0	0	0	115.6
103	K	39.9	Very low	47.7	Very low	195 Å²	195	146 Å²	146	85%	0.848	76%	0.764	S	S	*	*			trans	-142.6	129.8	163.4	-65.4	-165.5	177.2	-171.8	0	112.5
104	A	39.1	Very low	50	Low	108 Å²	108	138.3 Å²	138.3	89%	0.893	73%	0.729	S	S	*	*			trans	-70.4	135.8	-174.6	0	0	0	0	0	113.8
105	K	50.3	Low	52.5	Low	184 Å²	184	131.8 Å²	131.8	80%	0.8	69%	0.692	S	S	*	*			trans	-144.6	1.4	-179.6	-69.1	-168.7	177.8	179.1	0	117.2
106	K	46.3	Very low	54.8	Low	201 Å²	201	127 Å²	127	87%	0.874	66%	0.659	S	S	*	*	S	Bend	trans	-84	-15.7	-167.7	-75.8	177.8	-178.3	163.3	0	116.8
107	A	44.3	Very low	57.4	Low	86 Å²	86	118.6 Å²	118.6	71%	0.711	62%	0.62	S	S	*	*	S	Bend	trans	-70.5	-32.6	-178.1	0	0	0	0	0	114.5	V109	A107-V109 PolarHBondContact O-N 2.89Å
108	K	52.8	Low	60.3	Low	152 Å²	152	113.4 Å²	113.4	66%	0.661	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.3	39.4	-167.5	-59.2	-162.5	174	-160.6	0	116.1	K112	K108-K112 WeakPolarHBondContact O-CE 3.36Å; K108-K112 PolarHBondContact O-NZ 2.83Å
109	V	55.5	Low	62.9	Low	116 Å²	116	113 Å²	113	70%	0.703	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.6	-32.8	178.1	-174.2	0	0	0	0	111.6	A107	A107-V109 PolarHBondContact O-N 2.89Å
110	A	53.3	Low	65.5	Low	70 Å²	70	108 Å²	108	58%	0.579	55%	0.55	S	S	*	.	S	Bend	trans	-70.2	-40	-177.6	0	0	0	0	0	113.2	K112	A110-K112 PolarHBondContact O-N 2.92Å; A110-K112 VanDerWaalsContact O-N 3.17Å
111	D	58.5	Low	67.9	Low	99 Å²	99	98 Å²	98	53%	0.529	51%	0.506	S	S	.	.	G	3₁₀ helix	trans	-68.5	-19.3	-168.2	-36.1	-54.5	0	0	0	113.5	K113 Q160	D111-K113 PolarHBondContact O-N 3.2Å; D111-Q160 PolarHBondContact O-NE2 3.46Å
112	K	67.5	Low	69.9	Low	109 Å²	109	89.7 Å²	89.7	47%	0.474	47%	0.469	S	S	.	.	G	3₁₀ helix	trans	-75.6	7.7	-169.4	-66.6	178.8	177.4	167.1	0	115	K108 A110	K108-K112 WeakPolarHBondContact O-CE 3.36Å; K108-K112 PolarHBondContact O-NZ 2.83Å; A110-K112 PolarHBondContact O-N 2.92Å; A110-K112 VanDerWaalsContact O-N 3.17Å
113	K	80.8	Confident	72.3	Confident	170 Å²	170	89.8 Å²	89.8	74%	0.739	46%	0.458	S	S	*	.	G	3₁₀ helix	trans	-66.4	-36.8	175.8	-69.1	-177.1	178.7	-177.7	0	112.8	D111 R115 L164	D111-K113 PolarHBondContact O-N 3.2Å; K113-R115 VanDerWaalsContact C-N 3.29Å; K113-R115 PolarHBondContact O-N 2.7Å; K113-L164 WeakPolarHBondContact O-CD1 3.32Å
114	A	90.6	Very high	74.7	Confident	5 Å²	5	89 Å²	89	4%	0.041	45%	0.454	C	S	.	.	G	3₁₀ helix	trans	-93	34	-178.6	0	0	0	0	0	113.2	F161 L164 A167	A114-F161 HydrophobicContact CB-CB 4.33Å; A114-F161 PolarHBondContact O-N 3.15Å; A114-L164 HydrophobicContact CB-CD1 4.48Å; A114-A167 HydrophobicContact CB-CB 4.38Å
115	R	93.2	Very high	77.1	Confident	28 Å²	28	84 Å²	84	11%	0.106	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	128	-179.9	-161.8	179.5	-171.4	100.4	-2.3	110.7	K113 E142 F158 V159 Q160 A189	K113-R115 VanDerWaalsContact C-N 3.29Å; K113-R115 PolarHBondContact O-N 2.7Å; R115-E142 IonicContact CZ-OE1 2.77Å; R115-E142 IonicContact CZ-OE2 3.45Å; R115-E142 VanDerWaalsContact NH1-CD 3.31Å; R115-E142 IonicContact NH1-OE1 2.89Å; R115-E142 PolarHBondContact NH1-OE1 3.15Å; R115-E142 IonicContact NH1-OE2 3.49Å; R115-E142 PolarHBondContact NH1-OE2 3.02Å; R115-E142 IonicContact NH2-OE1 3.84Å; R115-E142 PolarHBondContact NH2-OE1 3.28Å; R115-E142 IonicContact NH2-OE2 3.56Å; R115-F158 HydrophobicContact CG-CB 4.48Å; R115-V159 CarbonylContact C-O 3.56Å; R115-V159 WeakPolarHBondContact CA-O 3.31Å; R115-Q160 HydrophobicContact CG-CB 4.46Å; R115-A189 HydrophobicContact CB-CB 3.96Å; R115-A189 HydrophobicContact CG-CB 3.86Å; R115-A189 VanDerWaalsContact O-CB 3.29Å; R115-A189 WeakPolarHBondContact O-CB 3.3Å; R115-A189 PolarHBondContact O-N 3.48Å
116	L	95	Very high	79.1	Confident	0 Å²	0	77.3 Å²	77.3	0%	0	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	150.1	171.7	-57.8	-178.6	0	0	0	110.4	F134 F158 V159 F161 A167 A170 L171 V186 D187 W188	L116-F134 HydrophobicContact CD1-CE1 4.46Å; L116-F158 VanDerWaalsContact O-CA 3.32Å; L116-F158 WeakPolarHBondContact O-CA 3.47Å; L116-V159 PolarHBondContact N-O 2.98Å; L116-V159 PolarHBondContact O-N 2.83Å; L116-V159 VanDerWaalsContact O-N 3.07Å; L116-F161 HydrophobicContact CD1-CD2 4.31Å; L116-F161 HydrophobicContact CD1-CE2 3.9Å; L116-A167 HydrophobicContact CD1-CB 4.42Å; L116-A167 HydrophobicContact CD2-CB 4.14Å; L116-A167 HydrophobicContact CG-CB 4.18Å; L116-A170 HydrophobicContact CD1-CB 3.94Å; L116-L171 HydrophobicContact CD2-CB 4.47Å; L116-L171 HydrophobicContact CD2-CD1 4.17Å; L116-V186 HydrophobicContact CB-CG1 4.17Å; L116-V186 HydrophobicContact CD1-CG1 3.79Å; L116-V186 HydrophobicContact CG-CG1 4.43Å; L116-D187 CarbonylContact C-O 3.55Å; L116-D187 VanDerWaalsContact CA-O 3.23Å; L116-D187 WeakPolarHBondContact CA-O 3.48Å; L116-W188 HydrophobicContact CD2-CD2 4.06Å; L116-W188 HydrophobicContact CD2-CE3 3.61Å; L116-W188 HydrophobicContact CD2-CH2 4.42Å; L116-W188 HydrophobicContact CD2-CZ3 3.81Å
117	I	94.7	Very high	81.2	Confident	28 Å²	28	71.4 Å²	71.4	14%	0.144	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	137	164.8	-173.7	175.3	0	0	0	108.4	F156 F158 D187 A189	I117-F156 HydrophobicContact CD1-CD2 4.26Å; I117-F156 HydrophobicContact CG1-CD2 4.47Å; I117-F158 HydrophobicContact CB-CD1 3.86Å; I117-F158 HydrophobicContact CB-CE1 3.76Å; I117-F158 HydrophobicContact CD1-CE1 3.73Å; I117-F158 HydrophobicContact CD1-CZ 3.99Å; I117-F158 HydrophobicContact CG1-CD1 4.02Å; I117-F158 HydrophobicContact CG1-CE1 3.68Å; I117-F158 HydrophobicContact CG1-CZ 4.25Å; I117-D187 HydrophobicContact CG2-CB 3.79Å; I117-D187 PolarHBondContact N-O 2.83Å; I117-D187 PolarHBondContact O-N 3.13Å; I117-A189 HydrophobicContact CB-CB 4.18Å
118	I	94.4	Very high	83.5	Confident	0 Å²	0	72.4 Å²	72.4	0%	0	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	111.5	-171.4	-55.8	172.7	0	0	0	107.1	L121 L130 F134 F156 G157 V159 V184 A185 V186	I118-L121 HydrophobicContact CB-CD1 4.22Å; I118-L121 HydrophobicContact CG2-CD1 3.93Å; I118-L121 HydrophobicContact CG2-CD2 3.67Å; I118-L121 HydrophobicContact CG2-CG 3.79Å; I118-L130 HydrophobicContact CD1-CD1 4.49Å; I118-L130 HydrophobicContact CD1-CD2 4.34Å; I118-F134 HydrophobicContact CD1-CD2 4.17Å; I118-F134 HydrophobicContact CD1-CE1 3.98Å; I118-F134 HydrophobicContact CD1-CE2 3.6Å; I118-F134 HydrophobicContact CD1-CZ 3.5Å; I118-F134 HydrophobicContact CG1-CZ 4.1Å; I118-F156 CarbonylContact O-C 3.54Å; I118-F156 WeakPolarHBondContact O-CA 3.4Å; I118-F156 VanDerWaalsContact O-CB 3.23Å; I118-F156 WeakPolarHBondContact O-CB 3.09Å; I118-G157 PolarHBondContact N-O 3.49Å; I118-G157 PolarHBondContact O-N 2.97Å; I118-V159 HydrophobicContact CD1-CB 3.94Å; I118-V159 HydrophobicContact CD1-CG2 3.39Å; I118-V184 HydrophobicContact CG2-CG1 3.19Å; I118-A185 CarbonylContact C-O 3.55Å; I118-V186 HydrophobicContact CG1-CG1 4.42Å; I118-V186 HydrophobicContact CG2-CG2 4.49Å
119	R	93.9	Very high	85.4	Confident	114 Å²	114	67 Å²	67	43%	0.43	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	161.1	-173.7	-41.1	-172.9	-160.2	-168.6	9.5	111.8	L121 A185 D187	R119-L121 VanDerWaalsContact C-N 3.27Å; R119-L121 PolarHBondContact O-N 2.87Å; R119-A185 HydrophobicContact CB-CB 4.34Å; R119-A185 PolarHBondContact N-O 2.68Å; R119-A185 PolarHBondContact O-N 2.94Å; R119-A185 VanDerWaalsContact O-N 3.11Å; R119-D187 IonicContact CZ-OD2 3.58Å; R119-D187 IonicContact NE-OD2 2.75Å; R119-D187 PolarHBondContact NE-OD2 2.98Å; R119-D187 IonicContact NH2-OD2 3.34Å; R119-D187 PolarHBondContact NH2-OD2 3.4Å
120	N	93.5	Very high	87.2	Confident	85 Å²	85	61.5 Å²	61.5	46%	0.455	30%	0.303	S	S	.	.	S	Bend	trans	59.1	32	-175.8	-162.6	35.8	0	0	0	114.4	S122 G155 T183	N120-S122 PolarHBondContact O-N 2.77Å; N120-G155 PolarHBondContact N-O 3.42Å; N120-G155 VanDerWaalsContact N-O 3.1Å; N120-T183 PolarHBondContact ND2-O 3.2Å
121	L	92.5	Very high	89.1	Confident	5 Å²	5	63.9 Å²	63.9	3%	0.026	30%	0.301	C	S	.	.			trans	-64.9	136.3	176.2	-75.7	175.2	0	0	0	111.5	I118 R119 F123 L130 G155 I179 V184	I118-L121 HydrophobicContact CB-CD1 4.22Å; I118-L121 HydrophobicContact CG2-CD1 3.93Å; I118-L121 HydrophobicContact CG2-CD2 3.67Å; I118-L121 HydrophobicContact CG2-CG 3.79Å; R119-L121 VanDerWaalsContact C-N 3.27Å; R119-L121 PolarHBondContact O-N 2.87Å; L121-F123 PolarHBondContact O-N 3.49Å; L121-L130 HydrophobicContact CD1-CD1 3.86Å; L121-L130 HydrophobicContact CD1-CD2 4.11Å; L121-L130 HydrophobicContact CD2-CD2 3.77Å; L121-G155 PolarHBondContact N-O 3.15Å; L121-I179 HydrophobicContact CD2-CD1 4.44Å; L121-V184 HydrophobicContact CD2-CG1 4.11Å; L121-V184 HydrophobicContact CD2-CG2 3.92Å
122	S	92.1	Very high	90.8	Very high	11 Å²	11	64.4 Å²	64.4	8%	0.077	31%	0.307	C	S	.	.			trans	-58.6	134.4	170.9	-169.1	0	0	0	0	110	N120 K124 C125 K180	N120-S122 PolarHBondContact O-N 2.77Å; S122-K124 PolarHBondContact O-N 3.04Å; S122-C125 WeakPolarHBondContact O-CB 3.29Å; S122-C125 PolarHBondContact O-N 2.65Å; S122-K180 WeakPolarHBondContact CB-O 3.29Å; S122-K180 PolarHBondContact OG-O 3.17Å
123	F	90.9	Very high	92	Very high	120 Å²	120	61 Å²	61	53%	0.526	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	1.1	179.6	-53.9	-56.4	0	0	0	113.3	L121 M153 R182	L121-F123 PolarHBondContact O-N 3.49Å; F123-M153 HydrophobicContact CD1-CB 4.41Å; F123-R182 VanDerWaalsContact CD2-NH1 3.33Å; F123-R182 VanDerWaalsContact CE2-NH1 3.31Å
124	K	89.6	Confident	92.6	Very high	177 Å²	177	53 Å²	53	77%	0.77	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.5	3.5	172.1	-62.5	-174.5	177.2	-176.7	0	113.6	S122 K180	S122-K124 PolarHBondContact O-N 3.04Å; K124-K180 HydrophobicContact CB-CD 4.36Å; K124-K180 WeakPolarHBondContact O-CD 3.25Å; K124-K180 PolarHBondContact O-NZ 3.2Å
125	C	89.8	Confident	92.7	Very high	3 Å²	3	55.3 Å²	55.3	2%	0.02	28%	0.28	C	S	.	.			trans	-87	126	176.1	-64.2	0	0	0	0	111.7	S122 D129 M153	S122-C125 WeakPolarHBondContact O-CB 3.29Å; S122-C125 PolarHBondContact O-N 2.65Å; C125-D129 VanDerWaalsContact CA-OD2 3.28Å; C125-D129 WeakPolarHBondContact CA-OD2 3.44Å; C125-M153 WeakPolarHBondContact O-CE 3.48Å
126	S	91.1	Very high	92.7	Very high	45 Å²	45	60 Å²	60	32%	0.315	30%	0.304	S	S	.	.			trans	-83.9	177.2	167.5	75.7	0	0	0	0	111.7	D128 D129	S126-D128 VanDerWaalsContact C-N 3.3Å; S126-D128 PolarHBondContact OG-N 2.98Å; S126-D129 PolarHBondContact N-OD2 2.82Å; S126-D129 PolarHBondContact OG-N 2.87Å; S126-D129 VanDerWaalsContact OG-N 3.12Å; S126-D129 PolarHBondContact OG-OD2 3.07Å
127	E	92.2	Very high	92.5	Very high	76 Å²	76	62 Å²	62	36%	0.355	31%	0.312	S	S	.	.	H	α-helix	trans	-71.8	-28.2	172.7	-64.1	-178.4	150.2	0	0	111.3	L130 K131 V143 N144 I145	E127-L130 PolarHBondContact O-N 3.44Å; E127-K131 WeakPolarHBondContact O-CB 3.24Å; E127-K131 PolarHBondContact O-N 3.28Å; E127-V143 HydrophobicContact CB-CB 4.31Å; E127-V143 HydrophobicContact CB-CG1 3.88Å; E127-V143 HydrophobicContact CG-CG1 4.17Å; E127-N144 WeakPolarHBondContact OE1-CA 3.44Å; E127-I145 HydrophobicContact CG-CB 4.27Å; E127-I145 HydrophobicContact CG-CD1 3.67Å; E127-I145 HydrophobicContact CG-CG1 3.83Å; E127-I145 PolarHBondContact OE1-N 2.83Å
128	D	92.2	Very high	92.3	Very high	107 Å²	107	61.6 Å²	61.6	57%	0.572	32%	0.315	S	S	*	.	H	α-helix	trans	-73.9	-34.4	176	-48.6	-72.8	0	0	0	113.1	S126 L130 K131 T132	S126-D128 VanDerWaalsContact C-N 3.3Å; S126-D128 PolarHBondContact OG-N 2.98Å; D128-L130 VanDerWaalsContact C-N 3.33Å; D128-K131 PolarHBondContact O-N 3.07Å; D128-T132 WeakPolarHBondContact O-CB 3.39Å; D128-T132 PolarHBondContact O-N 2.81Å; D128-T132 PolarHBondContact O-OG1 3Å
129	D	92.4	Very high	92.2	Very high	40 Å²	40	63.9 Å²	63.9	21%	0.214	33%	0.334	C	S	.	.	H	α-helix	trans	-59.3	-47.7	171	-66	-56.7	0	0	0	110.2	C125 S126 T132 V133 K180	C125-D129 VanDerWaalsContact CA-OD2 3.28Å; C125-D129 WeakPolarHBondContact CA-OD2 3.44Å; S126-D129 PolarHBondContact N-OD2 2.82Å; S126-D129 PolarHBondContact OG-N 2.87Å; S126-D129 VanDerWaalsContact OG-N 3.12Å; S126-D129 PolarHBondContact OG-OD2 3.07Å; D129-T132 PolarHBondContact O-N 3.04Å; D129-V133 WeakPolarHBondContact O-CB 3.48Å; D129-V133 WeakPolarHBondContact O-CG2 3.32Å; D129-V133 PolarHBondContact O-N 3Å; D129-K180 VanDerWaalsContact CG-CE 3.46Å; D129-K180 WeakPolarHBondContact OD1-CE 3.45Å; D129-K180 IonicContact OD1-NZ 2.75Å; D129-K180 PolarHBondContact OD1-NZ 2.94Å; D129-K180 WeakPolarHBondContact OD2-CE 3.28Å; D129-K180 IonicContact OD2-NZ 2.62Å; D129-K180 PolarHBondContact OD2-NZ 2.88Å
130	L	92.7	Very high	92.1	Very high	0 Å²	0	59.9 Å²	59.9	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-64	-42.3	176.5	-70	-175.4	0	0	0	111.6	I118 L121 E127 D128 T132 V133 F134 V143 I145 I179	I118-L130 HydrophobicContact CD1-CD1 4.49Å; I118-L130 HydrophobicContact CD1-CD2 4.34Å; L121-L130 HydrophobicContact CD1-CD1 3.86Å; L121-L130 HydrophobicContact CD1-CD2 4.11Å; L121-L130 HydrophobicContact CD2-CD2 3.77Å; E127-L130 PolarHBondContact O-N 3.44Å; D128-L130 VanDerWaalsContact C-N 3.33Å; L130-T132 VanDerWaalsContact C-N 3.34Å; L130-T132 PolarHBondContact O-N 2.87Å; L130-V133 PolarHBondContact O-N 2.97Å; L130-F134 HydrophobicContact CD2-CD2 4.46Å; L130-F134 HydrophobicContact CD2-CE2 4.2Å; L130-F134 WeakPolarHBondContact O-CB 3.46Å; L130-F134 WeakPolarHBondContact O-CD2 3.47Å; L130-F134 PolarHBondContact O-N 3.28Å; L130-V143 HydrophobicContact CB-CG1 3.85Å; L130-V143 HydrophobicContact CD1-CG1 3.85Å; L130-V143 HydrophobicContact CG-CG1 4.48Å; L130-I145 HydrophobicContact CD1-CD1 3.65Å; L130-I145 HydrophobicContact CD1-CG1 3.75Å; L130-I145 HydrophobicContact CG-CD1 4.35Å; L130-I179 HydrophobicContact CD2-CD1 4.41Å
131	K	93.7	Very high	92	Very high	120 Å²	120	61.3 Å²	61.3	52%	0.522	33%	0.329	S	S	.	.	H	α-helix	trans	-58.9	-47	177.9	-167.6	-179.3	178.1	-172.9	0	110.9	E127 D128 A135 V143	E127-K131 WeakPolarHBondContact O-CB 3.24Å; E127-K131 PolarHBondContact O-N 3.28Å; D128-K131 PolarHBondContact O-N 3.07Å; K131-A135 WeakPolarHBondContact O-CB 3.47Å; K131-A135 PolarHBondContact O-N 3.12Å; K131-V143 HydrophobicContact CB-CG2 4.08Å; K131-V143 HydrophobicContact CG-CG2 4.48Å
132	T	93.5	Very high	91.9	Very high	109 Å²	109	64.5 Å²	64.5	67%	0.669	34%	0.344	S	S	*	.	H	α-helix	trans	-62.7	-48.4	176.9	-57.2	0	0	0	0	111.8	D128 D129 L130 F134	D128-T132 WeakPolarHBondContact O-CB 3.39Å; D128-T132 PolarHBondContact O-N 2.81Å; D128-T132 PolarHBondContact O-OG1 3Å; D129-T132 PolarHBondContact O-N 3.04Å; L130-T132 VanDerWaalsContact C-N 3.34Å; L130-T132 PolarHBondContact O-N 2.87Å; T132-F134 PolarHBondContact O-N 2.61Å
133	V	92.9	Very high	92	Very high	39 Å²	39	65.2 Å²	65.2	24%	0.236	35%	0.348	C	S	.	.	H	α-helix	trans	-67.7	-34.9	-178.7	172.5	0	0	0	0	112.6	D129 L130 Q136 M174 I179	D129-V133 WeakPolarHBondContact O-CB 3.48Å; D129-V133 WeakPolarHBondContact O-CG2 3.32Å; D129-V133 PolarHBondContact O-N 3Å; L130-V133 PolarHBondContact O-N 2.97Å; V133-Q136 WeakPolarHBondContact O-CG 3.47Å; V133-Q136 PolarHBondContact O-NE2 3.03Å; V133-M174 HydrophobicContact CG1-CE 4.45Å; V133-M174 HydrophobicContact CG1-SD 3.62Å; V133-I179 HydrophobicContact CG1-CD1 3.99Å
134	F	93.7	Very high	92	Very high	0 Å²	0	62.5 Å²	62.5	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-90.2	-19	-178	-78.2	-98.1	0	0	0	114	L116 I118 L130 T132 Q136 F137 V140 V159 F161 A170 M174 I179 V186	L116-F134 HydrophobicContact CD1-CE1 4.46Å; I118-F134 HydrophobicContact CD1-CD2 4.17Å; I118-F134 HydrophobicContact CD1-CE1 3.98Å; I118-F134 HydrophobicContact CD1-CE2 3.6Å; I118-F134 HydrophobicContact CD1-CZ 3.5Å; I118-F134 HydrophobicContact CG1-CZ 4.1Å; L130-F134 HydrophobicContact CD2-CD2 4.46Å; L130-F134 HydrophobicContact CD2-CE2 4.2Å; L130-F134 WeakPolarHBondContact O-CB 3.46Å; L130-F134 WeakPolarHBondContact O-CD2 3.47Å; L130-F134 PolarHBondContact O-N 3.28Å; T132-F134 PolarHBondContact O-N 2.61Å; F134-Q136 PolarHBondContact O-N 2.86Å; F134-F137 PolarHBondContact O-N 3.49Å; F134-V140 HydrophobicContact CB-CG2 4.03Å; F134-V159 HydrophobicContact CB-CG1 4.16Å; F134-V159 HydrophobicContact CD1-CG1 4.38Å; F134-V159 HydrophobicContact CG-CG1 4.34Å; F134-V159 HydrophobicContact CG-CG2 4.42Å; F134-F161 HydrophobicContact CB-CZ 3.97Å; F134-F161 HydrophobicContact CD1-CE2 4.05Å; F134-F161 AromaticContact CD1-CZ 3.97Å; F134-F161 HydrophobicContact CD1-CZ 3.97Å; F134-F161 HydrophobicContact CG-CZ 4.49Å; F134-A170 HydrophobicContact CD1-CB 4.02Å; F134-A170 HydrophobicContact CE1-CB 4.28Å; F134-M174 HydrophobicContact CE1-CB 4.11Å; F134-M174 HydrophobicContact CE1-CG 4.19Å; F134-M174 HydrophobicContact CZ-CB 3.96Å; F134-M174 HydrophobicContact CZ-CG 4.13Å; F134-I179 HydrophobicContact CE2-CD1 4.15Å; F134-V186 HydrophobicContact CE1-CG1 4.4Å; F134-V186 HydrophobicContact CZ-CG2 4.16Å
135	A	92.8	Very high	92.2	Very high	54 Å²	54	54.5 Å²	54.5	45%	0.446	30%	0.304	S	S	.	.	H	α-helix	trans	-59	-29.4	175.5	0	0	0	0	0	113.7	K131 F137 G138	K131-A135 WeakPolarHBondContact O-CB 3.47Å; K131-A135 PolarHBondContact O-N 3.12Å; A135-F137 PolarHBondContact O-N 3.11Å; A135-G138 PolarHBondContact O-N 2.91Å
136	Q	92.8	Very high	92.2	Very high	128 Å²	128	56.2 Å²	56.2	60%	0.598	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-12.5	178.6	78.8	-171.3	-74.4	0	0	114.3	V133 F134	V133-Q136 WeakPolarHBondContact O-CG 3.47Å; V133-Q136 PolarHBondContact O-NE2 3.03Å; F134-Q136 PolarHBondContact O-N 2.86Å
137	F	92.1	Very high	92.2	Very high	40 Å²	40	61.8 Å²	61.8	18%	0.175	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.3	-11.9	178.5	-59.9	-78.1	0	0	0	114.4	F134 A135 F161 K169 A170 M174	F134-F137 PolarHBondContact O-N 3.49Å; A135-F137 PolarHBondContact O-N 3.11Å; F137-F161 HydrophobicContact CB-CE1 4.35Å; F137-F161 HydrophobicContact CB-CZ 4.38Å; F137-K169 HydrophobicContact CD1-CB 4.24Å; F137-A170 HydrophobicContact CB-CB 3.75Å; F137-A170 HydrophobicContact CD2-CB 3.9Å; F137-A170 HydrophobicContact CG-CB 3.8Å; F137-M174 HydrophobicContact CD2-CG 4.27Å; F137-M174 HydrophobicContact CE2-CE 3.66Å; F137-M174 HydrophobicContact CE2-CG 3.34Å; F137-M174 HydrophobicContact CE2-SD 4.19Å; F137-M174 HydrophobicContact CZ-CE 3.66Å; F137-M174 HydrophobicContact CZ-CG 3.81Å
138	G	90.1	Very high	92	Very high	21 Å²	21	62.3 Å²	62.3	22%	0.216	33%	0.331	C	S	.	.	S	Bend	trans	155.2	-175.4	-175.5	0	0	0	0	0	114.9	A135 V140 E166	A135-G138 PolarHBondContact O-N 2.91Å; G138-V140 PolarHBondContact O-N 3.12Å; G138-E166 WeakPolarHBondContact CA-OE2 3.35Å
139	A	91.7	Very high	91.7	Very high	48 Å²	48	64.1 Å²	64.1	40%	0.397	35%	0.348	S	S	.	.			trans	-82.1	105.2	-172.7	0	0	0	0	0	111.5	F161 K162 E166	A139-F161 CarbonylContact O-C 3.59Å; A139-F161 WeakPolarHBondContact O-CA 3.26Å; A139-K162 HydrophobicContact CB-CB 4.02Å; A139-K162 HydrophobicContact CB-CD 4.38Å; A139-K162 PolarHBondContact O-N 3Å; A139-E166 PolarHBondContact N-OE2 2.94Å
140	V	92.8	Very high	91.3	Very high	30 Å²	30	66.7 Å²	66.7	18%	0.182	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	119.4	175.6	177.5	0	0	0	0	110.8	F134 G138 V143 V159 Q160 F161	F134-V140 HydrophobicContact CB-CG2 4.03Å; G138-V140 PolarHBondContact O-N 3.12Å; V140-V143 HydrophobicContact CG1-CG2 3.59Å; V140-V159 HydrophobicContact CG1-CG1 3.9Å; V140-V159 HydrophobicContact CG2-CG1 3.93Å; V140-Q160 CarbonylContact C-O 3.53Å; V140-Q160 WeakPolarHBondContact CA-O 3.25Å; V140-F161 HydrophobicContact CG2-CD1 4.22Å; V140-F161 HydrophobicContact CG2-CE1 3.79Å; V140-F161 HydrophobicContact CG2-CZ 4.06Å
141	L	90.7	Very high	91	Very high	115 Å²	115	68.9 Å²	68.9	60%	0.602	38%	0.384	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.7	-36.8	-179.7	-63.9	178.5	0	0	0	113.8	Q160 K162	L141-Q160 HydrophobicContact CB-CG 4.02Å; L141-Q160 HydrophobicContact CD1-CG 4.31Å; L141-Q160 PolarHBondContact N-O 3.07Å; L141-K162 HydrophobicContact CD1-CB 4.29Å; L141-K162 HydrophobicContact CD2-CB 4.42Å; L141-K162 HydrophobicContact CG-CB 4.25Å
142	E	90.1	Very high	90.6	Very high	71 Å²	71	69.1 Å²	69.1	33%	0.332	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	129.2	-179.3	-170.9	-160.1	144	0	0	109	R115 N144 V159 Q160	R115-E142 IonicContact CZ-OE1 2.77Å; R115-E142 IonicContact CZ-OE2 3.45Å; R115-E142 VanDerWaalsContact NH1-CD 3.31Å; R115-E142 IonicContact NH1-OE1 2.89Å; R115-E142 PolarHBondContact NH1-OE1 3.15Å; R115-E142 IonicContact NH1-OE2 3.49Å; R115-E142 PolarHBondContact NH1-OE2 3.02Å; R115-E142 IonicContact NH2-OE1 3.84Å; R115-E142 PolarHBondContact NH2-OE1 3.28Å; R115-E142 IonicContact NH2-OE2 3.56Å; E142-N144 WeakPolarHBondContact OE1-CB 2.96Å; E142-N144 PolarHBondContact OE1-ND2 3.18Å; E142-V159 WeakPolarHBondContact O-CA 3.17Å; E142-Q160 HydrophobicContact CB-CB 3.85Å; E142-Q160 PolarHBondContact O-N 2.96Å
143	V	93.7	Very high	90.3	Very high	27 Å²	27	65.7 Å²	65.7	16%	0.164	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	141.3	161.7	-174.1	0	0	0	0	107.5	E127 L130 K131 V140 F158 V159	E127-V143 HydrophobicContact CB-CB 4.31Å; E127-V143 HydrophobicContact CB-CG1 3.88Å; E127-V143 HydrophobicContact CG-CG1 4.17Å; L130-V143 HydrophobicContact CB-CG1 3.85Å; L130-V143 HydrophobicContact CD1-CG1 3.85Å; L130-V143 HydrophobicContact CG-CG1 4.48Å; K131-V143 HydrophobicContact CB-CG2 4.08Å; K131-V143 HydrophobicContact CG-CG2 4.48Å; V140-V143 HydrophobicContact CG1-CG2 3.59Å; V143-F158 WeakPolarHBondContact CA-O 3.48Å; V143-V159 HydrophobicContact CG1-CG2 4.3Å; V143-V159 HydrophobicContact CG2-CG2 4.29Å
144	N	92.2	Very high	90	Very high	62 Å²	62	70.9 Å²	70.9	33%	0.332	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.6	113.5	-175.1	-173	-38.9	0	0	0	110.2	E127 E142 P146 G157 F158	E127-N144 WeakPolarHBondContact OE1-CA 3.44Å; E142-N144 WeakPolarHBondContact OE1-CB 2.96Å; E142-N144 PolarHBondContact OE1-ND2 3.18Å; N144-P146 WeakPolarHBondContact O-CD 3.13Å; N144-G157 CarbonylContact O-C 3.56Å; N144-G157 WeakPolarHBondContact O-CA 3.36Å; N144-F158 PolarHBondContact N-O 3.06Å; N144-F158 PolarHBondContact O-N 2.89Å
145	I	93.5	Very high	89.9	Confident	9 Å²	9	71.6 Å²	71.6	5%	0.046	39%	0.385	C	S	.	.			trans	-111.4	100.7	178.7	-56.1	168.7	0	0	0	110.4	E127 L130 R147 M153	E127-I145 HydrophobicContact CG-CB 4.27Å; E127-I145 HydrophobicContact CG-CD1 3.67Å; E127-I145 HydrophobicContact CG-CG1 3.83Å; E127-I145 PolarHBondContact OE1-N 2.83Å; L130-I145 HydrophobicContact CD1-CD1 3.65Å; L130-I145 HydrophobicContact CD1-CG1 3.75Å; L130-I145 HydrophobicContact CG-CD1 4.35Å; I145-R147 PolarHBondContact O-N 3.29Å; I145-M153 HydrophobicContact CB-CE 4.13Å; I145-M153 HydrophobicContact CD1-CE 3.89Å; I145-M153 HydrophobicContact CG2-CE 3.49Å; I145-M153 VanDerWaalsContact CG2-CE 3.49Å
146	P	90.2	Very high	89.9	Confident	39 Å²	39	72.1 Å²	72.1	25%	0.253	38%	0.377	S	S	.	.	P	Polyproline II helix	trans	-58.1	127.6	178.3	-27.4	36.4	0	0	0	113.3	N144 R154 F156 F158	N144-P146 WeakPolarHBondContact O-CD 3.13Å; P146-R154 WeakPolarHBondContact O-CB 3.48Å; P146-R154 PolarHBondContact O-N 2.83Å; P146-R154 VanDerWaalsContact O-N 3.11Å; P146-F156 HydrophobicContact CB-CE2 4.45Å; P146-F156 HydrophobicContact CG-CE2 4.01Å; P146-F158 HydrophobicContact CG-CD2 4.23Å; P146-F158 HydrophobicContact CG-CE2 4Å
147	R	91.4	Very high	90	Very high	163 Å²	163	66 Å²	66	62%	0.615	35%	0.349	S	S	*	.	B	Isolated β-bridge	trans	-98.1	153.1	173	-54.7	-171.2	-170.3	-158.6	3.4	110.2	I145 M153	I145-R147 PolarHBondContact O-N 3.29Å; R147-M153 HydrophobicContact CG-CG 4.37Å
148	K	86.1	Confident	90.1	Very high	87 Å²	87	66.2 Å²	66.2	38%	0.378	35%	0.35	S	S	.	.	P	Polyproline II helix	trans	-66.4	160.2	167.3	-68.8	-177.4	-179.5	-179.5	0	109.3	D150 G151 K152	K148-D150 HydrophobicContact CB-CB 4.23Å; K148-D150 PolarHBondContact O-N 3.16Å; K148-G151 PolarHBondContact O-N 2.86Å; K148-K152 WeakPolarHBondContact CB-O 3.46Å; K148-K152 WeakPolarHBondContact CG-O 3.45Å; K148-K152 PolarHBondContact N-O 3.38Å
149	P	86	Confident	90.3	Very high	144 Å²	144	65.2 Å²	65.2	94%	0.935	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-29.9	169.1	23.9	-34.5	0	0	0	112.4	G151	P149-G151 PolarHBondContact O-N 3.47Å; P149-G151 VanDerWaalsContact O-N 3.09Å
150	D	85.9	Confident	90.4	Very high	95 Å²	95	63.4 Å²	63.4	51%	0.508	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	14.7	169.8	173.9	46.4	0	0	0	113.9	K148 K152	K148-D150 HydrophobicContact CB-CB 4.23Å; K148-D150 PolarHBondContact O-N 3.16Å; D150-K152 PolarHBondContact O-N 2.74Å; D150-K152 IonicContact OD1-NZ 2.73Å; D150-K152 PolarHBondContact OD1-NZ 3.38Å; D150-K152 VanDerWaalsContact OD2-CD 3.23Å; D150-K152 WeakPolarHBondContact OD2-CD 3.46Å; D150-K152 WeakPolarHBondContact OD2-CE 3.34Å; D150-K152 IonicContact OD2-NZ 2.69Å; D150-K152 PolarHBondContact OD2-NZ 2.95Å
151	G	84.9	Confident	90.5	Very high	45 Å²	45	62 Å²	62	46%	0.464	31%	0.314	S	S	.	.	S	Bend	trans	69.4	-29.7	-179.8	0	0	0	0	0	116.1	K148 P149	K148-G151 PolarHBondContact O-N 2.86Å; P149-G151 PolarHBondContact O-N 3.47Å; P149-G151 VanDerWaalsContact O-N 3.09Å
152	K	85.4	Confident	90.5	Very high	125 Å²	125	63.2 Å²	63.2	54%	0.543	32%	0.315	S	S	.	.			trans	-60.9	135	-178.1	-58.8	-174.6	-173.5	76.9	0	111.5	K148 D150	K148-K152 WeakPolarHBondContact CB-O 3.46Å; K148-K152 WeakPolarHBondContact CG-O 3.45Å; K148-K152 PolarHBondContact N-O 3.38Å; D150-K152 PolarHBondContact O-N 2.74Å; D150-K152 IonicContact OD1-NZ 2.73Å; D150-K152 PolarHBondContact OD1-NZ 3.38Å; D150-K152 VanDerWaalsContact OD2-CD 3.23Å; D150-K152 WeakPolarHBondContact OD2-CD 3.46Å; D150-K152 WeakPolarHBondContact OD2-CE 3.34Å; D150-K152 IonicContact OD2-NZ 2.69Å; D150-K152 PolarHBondContact OD2-NZ 2.95Å
153	M	87	Confident	90.6	Very high	38 Å²	38	63.6 Å²	63.6	19%	0.187	32%	0.319	C	S	.	.	B	Isolated β-bridge	trans	-67	144	-175.9	-58.4	179.1	73.8	0	0	111.4	F123 C125 I145 R147 G155	F123-M153 HydrophobicContact CD1-CB 4.41Å; C125-M153 WeakPolarHBondContact O-CE 3.48Å; I145-M153 HydrophobicContact CB-CE 4.13Å; I145-M153 HydrophobicContact CD1-CE 3.89Å; I145-M153 HydrophobicContact CG2-CE 3.49Å; I145-M153 VanDerWaalsContact CG2-CE 3.49Å; R147-M153 HydrophobicContact CG-CG 4.37Å; M153-G155 VanDerWaalsContact C-N 3.31Å; M153-G155 PolarHBondContact O-N 2.88Å
154	R	87.8	Confident	90.5	Very high	147 Å²	147	66.9 Å²	66.9	56%	0.555	34%	0.335	S	S	*	.			trans	-80	-6.3	-171.8	-162.2	68.2	-173	-152.5	4.3	114.4	P146 F156	P146-R154 WeakPolarHBondContact O-CB 3.48Å; P146-R154 PolarHBondContact O-N 2.83Å; P146-R154 VanDerWaalsContact O-N 3.11Å; R154-F156 HydrophobicContact CB-CD1 4.27Å; R154-F156 HydrophobicContact CB-CE1 4.04Å; R154-F156 HydrophobicContact CG-CD1 3.9Å; R154-F156 HydrophobicContact CG-CE1 3.33Å; R154-F156 HydrophobicContact CG-CZ 3.96Å
155	G	90.4	Very high	90.5	Very high	15 Å²	15	70.8 Å²	70.8	16%	0.155	36%	0.355	C	S	.	.	S	Bend	trans	83	9.1	-179	0	0	0	0	0	114.6	N120 L121 M153	N120-G155 PolarHBondContact N-O 3.42Å; N120-G155 VanDerWaalsContact N-O 3.1Å; L121-G155 PolarHBondContact N-O 3.15Å; M153-G155 VanDerWaalsContact C-N 3.31Å; M153-G155 PolarHBondContact O-N 2.88Å
156	F	94.1	Very high	90.5	Very high	66 Å²	66	72.1 Å²	72.1	29%	0.289	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	157.2	170.7	68	-100	0	0	0	110.8	I117 I118 P146 R154 F158	I117-F156 HydrophobicContact CD1-CD2 4.26Å; I117-F156 HydrophobicContact CG1-CD2 4.47Å; I118-F156 CarbonylContact O-C 3.54Å; I118-F156 WeakPolarHBondContact O-CA 3.4Å; I118-F156 VanDerWaalsContact O-CB 3.23Å; I118-F156 WeakPolarHBondContact O-CB 3.09Å; P146-F156 HydrophobicContact CB-CE2 4.45Å; P146-F156 HydrophobicContact CG-CE2 4.01Å; R154-F156 HydrophobicContact CB-CD1 4.27Å; R154-F156 HydrophobicContact CB-CE1 4.04Å; R154-F156 HydrophobicContact CG-CD1 3.9Å; R154-F156 HydrophobicContact CG-CE1 3.33Å; R154-F156 HydrophobicContact CG-CZ 3.96Å; F156-F158 HydrophobicContact CD2-CE2 4.31Å; F156-F158 AromaticContact CE2-CE2 3.93Å; F156-F158 HydrophobicContact CE2-CE2 3.93Å; F156-F158 HydrophobicContact CE2-CZ 4.17Å
157	G	93.8	Very high	90.7	Very high	0 Å²	0	70.3 Å²	70.3	0%	0	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	177.2	176.9	0	0	0	0	0	112	I118 N144	I118-G157 PolarHBondContact N-O 3.49Å; I118-G157 PolarHBondContact O-N 2.97Å; N144-G157 CarbonylContact O-C 3.56Å; N144-G157 WeakPolarHBondContact O-CA 3.36Å
158	F	95.2	Very high	90.8	Very high	43 Å²	43	63.5 Å²	63.5	19%	0.189	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	142.2	175.8	-61.5	-83.1	0	0	0	110.8	R115 L116 I117 V143 N144 P146 F156 A189	R115-F158 HydrophobicContact CG-CB 4.48Å; L116-F158 VanDerWaalsContact O-CA 3.32Å; L116-F158 WeakPolarHBondContact O-CA 3.47Å; I117-F158 HydrophobicContact CB-CD1 3.86Å; I117-F158 HydrophobicContact CB-CE1 3.76Å; I117-F158 HydrophobicContact CD1-CE1 3.73Å; I117-F158 HydrophobicContact CD1-CZ 3.99Å; I117-F158 HydrophobicContact CG1-CD1 4.02Å; I117-F158 HydrophobicContact CG1-CE1 3.68Å; I117-F158 HydrophobicContact CG1-CZ 4.25Å; V143-F158 WeakPolarHBondContact CA-O 3.48Å; N144-F158 PolarHBondContact N-O 3.06Å; N144-F158 PolarHBondContact O-N 2.89Å; P146-F158 HydrophobicContact CG-CD2 4.23Å; P146-F158 HydrophobicContact CG-CE2 4Å; F156-F158 HydrophobicContact CD2-CE2 4.31Å; F156-F158 AromaticContact CE2-CE2 3.93Å; F156-F158 HydrophobicContact CE2-CE2 3.93Å; F156-F158 HydrophobicContact CE2-CZ 4.17Å; F158-A189 HydrophobicContact CD1-CB 3.82Å; F158-A189 HydrophobicContact CE1-CB 3.98Å
159	V	94.7	Very high	91.2	Very high	0 Å²	0	66.1 Å²	66.1	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	126	173.7	168.3	0	0	0	0	108.5	R115 L116 I118 F134 V140 E142 V143 F161	R115-V159 CarbonylContact C-O 3.56Å; R115-V159 WeakPolarHBondContact CA-O 3.31Å; L116-V159 PolarHBondContact N-O 2.98Å; L116-V159 PolarHBondContact O-N 2.83Å; L116-V159 VanDerWaalsContact O-N 3.07Å; I118-V159 HydrophobicContact CD1-CB 3.94Å; I118-V159 HydrophobicContact CD1-CG2 3.39Å; F134-V159 HydrophobicContact CB-CG1 4.16Å; F134-V159 HydrophobicContact CD1-CG1 4.38Å; F134-V159 HydrophobicContact CG-CG1 4.34Å; F134-V159 HydrophobicContact CG-CG2 4.42Å; V140-V159 HydrophobicContact CG1-CG1 3.9Å; V140-V159 HydrophobicContact CG2-CG1 3.93Å; E142-V159 WeakPolarHBondContact O-CA 3.17Å; V143-V159 HydrophobicContact CG1-CG2 4.3Å; V143-V159 HydrophobicContact CG2-CG2 4.29Å; V159-F161 HydrophobicContact CG1-CD2 4.05Å; V159-F161 HydrophobicContact CG1-CE2 3.67Å; V159-F161 HydrophobicContact CG1-CZ 4.22Å
160	Q	93.8	Very high	91.6	Very high	11 Å²	11	59.3 Å²	59.3	5%	0.051	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	119	175.5	175.3	74.2	57.9	0	0	109	D111 R115 V140 L141 E142	D111-Q160 PolarHBondContact O-NE2 3.46Å; R115-Q160 HydrophobicContact CG-CB 4.46Å; V140-Q160 CarbonylContact C-O 3.53Å; V140-Q160 WeakPolarHBondContact CA-O 3.25Å; L141-Q160 HydrophobicContact CB-CG 4.02Å; L141-Q160 HydrophobicContact CD1-CG 4.31Å; L141-Q160 PolarHBondContact N-O 3.07Å; E142-Q160 HydrophobicContact CB-CB 3.85Å; E142-Q160 PolarHBondContact O-N 2.96Å
161	F	94.8	Very high	92	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	163	168.3	-76.2	-87.7	0	0	0	111.6	A114 L116 F134 F137 A139 V140 V159 E166 A167 A170	A114-F161 HydrophobicContact CB-CB 4.33Å; A114-F161 PolarHBondContact O-N 3.15Å; L116-F161 HydrophobicContact CD1-CD2 4.31Å; L116-F161 HydrophobicContact CD1-CE2 3.9Å; F134-F161 HydrophobicContact CB-CZ 3.97Å; F134-F161 HydrophobicContact CD1-CE2 4.05Å; F134-F161 AromaticContact CD1-CZ 3.97Å; F134-F161 HydrophobicContact CD1-CZ 3.97Å; F134-F161 HydrophobicContact CG-CZ 4.49Å; F137-F161 HydrophobicContact CB-CE1 4.35Å; F137-F161 HydrophobicContact CB-CZ 4.38Å; A139-F161 CarbonylContact O-C 3.59Å; A139-F161 WeakPolarHBondContact O-CA 3.26Å; V140-F161 HydrophobicContact CG2-CD1 4.22Å; V140-F161 HydrophobicContact CG2-CE1 3.79Å; V140-F161 HydrophobicContact CG2-CZ 4.06Å; V159-F161 HydrophobicContact CG1-CD2 4.05Å; V159-F161 HydrophobicContact CG1-CE2 3.67Å; V159-F161 HydrophobicContact CG1-CZ 4.22Å; F161-E166 HydrophobicContact CB-CB 4.27Å; F161-E166 HydrophobicContact CD1-CB 3.72Å; F161-E166 HydrophobicContact CE1-CB 4.37Å; F161-E166 HydrophobicContact CG-CB 4.16Å; F161-A167 HydrophobicContact CB-CB 4.12Å; F161-A167 HydrophobicContact CD2-CB 3.79Å; F161-A167 HydrophobicContact CG-CB 4.19Å; F161-A170 HydrophobicContact CE2-CB 3.63Å; F161-A170 HydrophobicContact CZ-CB 3.54Å
162	K	90.8	Very high	92.4	Very high	140 Å²	140	63.3 Å²	63.3	61%	0.609	30%	0.299	S	S	*	.	S	Bend	trans	-68.9	-45.7	169	-172.4	178.7	-179.9	-177.8	0	111.5	A139 L141	A139-K162 HydrophobicContact CB-CB 4.02Å; A139-K162 HydrophobicContact CB-CD 4.38Å; A139-K162 PolarHBondContact O-N 3Å; L141-K162 HydrophobicContact CD1-CB 4.29Å; L141-K162 HydrophobicContact CD2-CB 4.42Å; L141-K162 HydrophobicContact CG-CB 4.25Å
163	N	90.9	Very high	92.8	Very high	80 Å²	80	58.2 Å²	58.2	43%	0.428	28%	0.282	S	S	.	.	S	Bend	trans	-115.6	146.9	-177.4	-69.1	-52	0	0	0	113.3	L165 E166 A167	N163-L165 VanDerWaalsContact C-N 3.26Å; N163-L165 PolarHBondContact O-N 3.21Å; N163-E166 HydrophobicContact CB-CB 4.41Å; N163-E166 HydrophobicContact CB-CG 4.04Å; N163-E166 WeakPolarHBondContact CB-OE1 3.46Å; N163-E166 PolarHBondContact ND2-OE1 2.8Å; N163-E166 PolarHBondContact O-N 3Å; N163-A167 PolarHBondContact O-N 3.36Å
164	L	92.2	Very high	93.1	Very high	96 Å²	96	57.1 Å²	57.1	50%	0.503	28%	0.276	S	S	.	.	H	α-helix	trans	-63.8	-32	175.2	-167.3	71.9	0	0	0	112.2	K113 A114 A167 G168 W188	K113-L164 WeakPolarHBondContact O-CD1 3.32Å; A114-L164 HydrophobicContact CB-CD1 4.48Å; L164-A167 PolarHBondContact O-N 3.32Å; L164-G168 PolarHBondContact O-N 3.34Å; L164-W188 HydrophobicContact CD1-CE3 4.4Å; L164-W188 HydrophobicContact CD1-CH2 3.64Å; L164-W188 HydrophobicContact CD1-CZ3 3.52Å; L164-W188 HydrophobicContact CG-CH2 4.12Å; L164-W188 HydrophobicContact CG-CZ3 4.47Å
165	L	92.9	Very high	93.3	Very high	144 Å²	144	53.2 Å²	53.2	75%	0.754	27%	0.267	S	S	*	.	H	α-helix	trans	-68.7	-37.8	177.6	-60.6	178.1	0	0	0	112.3	N163 G168 K169	N163-L165 VanDerWaalsContact C-N 3.26Å; N163-L165 PolarHBondContact O-N 3.21Å; L165-G168 PolarHBondContact O-N 2.86Å; L165-K169 WeakPolarHBondContact O-CG 3.2Å; L165-K169 PolarHBondContact O-N 3.33Å
166	E	93.2	Very high	93.4	Very high	37 Å²	37	59.6 Å²	59.6	17%	0.173	29%	0.294	C	S	.	.	H	α-helix	trans	-65.7	-45.9	174.6	-68.2	162.9	-149.2	0	0	110.6	G138 A139 F161 N163 G168 K169 A170	G138-E166 WeakPolarHBondContact CA-OE2 3.35Å; A139-E166 PolarHBondContact N-OE2 2.94Å; F161-E166 HydrophobicContact CB-CB 4.27Å; F161-E166 HydrophobicContact CD1-CB 3.72Å; F161-E166 HydrophobicContact CE1-CB 4.37Å; F161-E166 HydrophobicContact CG-CB 4.16Å; N163-E166 HydrophobicContact CB-CB 4.41Å; N163-E166 HydrophobicContact CB-CG 4.04Å; N163-E166 WeakPolarHBondContact CB-OE1 3.46Å; N163-E166 PolarHBondContact ND2-OE1 2.8Å; N163-E166 PolarHBondContact O-N 3Å; E166-G168 VanDerWaalsContact C-N 3.29Å; E166-G168 PolarHBondContact O-N 3.12Å; E166-K169 PolarHBondContact O-N 3.04Å; E166-A170 WeakPolarHBondContact O-CB 3.24Å; E166-A170 PolarHBondContact O-N 3.15Å
167	A	93.9	Very high	93.3	Very high	0 Å²	0	61.6 Å²	61.6	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-59.1	-39.3	172.2	0	0	0	0	0	112.2	A114 L116 F161 N163 L164 A170 L171 W188	A114-A167 HydrophobicContact CB-CB 4.38Å; L116-A167 HydrophobicContact CD1-CB 4.42Å; L116-A167 HydrophobicContact CD2-CB 4.14Å; L116-A167 HydrophobicContact CG-CB 4.18Å; F161-A167 HydrophobicContact CB-CB 4.12Å; F161-A167 HydrophobicContact CD2-CB 3.79Å; F161-A167 HydrophobicContact CG-CB 4.19Å; N163-A167 PolarHBondContact O-N 3.36Å; L164-A167 PolarHBondContact O-N 3.32Å; A167-A170 PolarHBondContact O-N 3.38Å; A167-L171 VanDerWaalsContact O-CB 3.27Å; A167-L171 WeakPolarHBondContact O-CB 3.48Å; A167-L171 PolarHBondContact O-N 2.89Å; A167-W188 HydrophobicContact CB-CH2 3.69Å; A167-W188 HydrophobicContact CB-CZ3 3.53Å
168	G	93.8	Very high	93.2	Very high	21 Å²	21	68.2 Å²	68.2	22%	0.216	33%	0.334	C	S	.	.	H	α-helix	trans	-66.6	-36.9	175.4	0	0	0	0	0	113.8	L164 L165 E166 K172	L164-G168 PolarHBondContact O-N 3.34Å; L165-G168 PolarHBondContact O-N 2.86Å; E166-G168 VanDerWaalsContact C-N 3.29Å; E166-G168 PolarHBondContact O-N 3.12Å; G168-K172 PolarHBondContact O-N 3.04Å
169	K	94	Very high	92.9	Very high	142 Å²	142	66.7 Å²	66.7	62%	0.617	33%	0.328	S	S	*	.	H	α-helix	trans	-65.3	-47.1	171.2	-74	-179.4	178.2	-174.4	0	111.1	F137 L165 E166 L171 K172 G173	F137-K169 HydrophobicContact CD1-CB 4.24Å; L165-K169 WeakPolarHBondContact O-CG 3.2Å; L165-K169 PolarHBondContact O-N 3.33Å; E166-K169 PolarHBondContact O-N 3.04Å; K169-L171 PolarHBondContact O-N 2.79Å; K169-K172 PolarHBondContact O-N 3.18Å; K169-G173 PolarHBondContact O-N 2.86Å
170	A	94.6	Very high	92.5	Very high	0 Å²	0	71.9 Å²	71.9	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-62.3	-42.2	177.9	0	0	0	0	0	112.6	L116 F134 F137 F161 E166 A167 G173 M174	L116-A170 HydrophobicContact CD1-CB 3.94Å; F134-A170 HydrophobicContact CD1-CB 4.02Å; F134-A170 HydrophobicContact CE1-CB 4.28Å; F137-A170 HydrophobicContact CB-CB 3.75Å; F137-A170 HydrophobicContact CD2-CB 3.9Å; F137-A170 HydrophobicContact CG-CB 3.8Å; F161-A170 HydrophobicContact CE2-CB 3.63Å; F161-A170 HydrophobicContact CZ-CB 3.54Å; E166-A170 WeakPolarHBondContact O-CB 3.24Å; E166-A170 PolarHBondContact O-N 3.15Å; A167-A170 PolarHBondContact O-N 3.38Å; A170-G173 PolarHBondContact O-N 3.36Å; A170-M174 WeakPolarHBondContact O-CB 3.5Å; A170-M174 PolarHBondContact O-N 3.18Å
171	L	94.5	Very high	92.3	Very high	35 Å²	35	74.3 Å²	74.3	18%	0.183	38%	0.378	C	S	.	.	H	α-helix	trans	-54	-55.7	174.3	-176.3	83.4	0	0	0	111	L116 A167 K169 G173 N175 V186 W188	L116-L171 HydrophobicContact CD2-CB 4.47Å; L116-L171 HydrophobicContact CD2-CD1 4.17Å; A167-L171 VanDerWaalsContact O-CB 3.27Å; A167-L171 WeakPolarHBondContact O-CB 3.48Å; A167-L171 PolarHBondContact O-N 2.89Å; K169-L171 PolarHBondContact O-N 2.79Å; L171-G173 VanDerWaalsContact C-N 3.33Å; L171-G173 PolarHBondContact O-N 3.42Å; L171-N175 VanDerWaalsContact O-CB 3.26Å; L171-N175 WeakPolarHBondContact O-CB 3.5Å; L171-N175 PolarHBondContact O-N 3.42Å; L171-V186 HydrophobicContact CD1-CG1 4.19Å; L171-V186 WeakPolarHBondContact CD1-O 3.35Å; L171-W188 HydrophobicContact CD2-CZ2 4.18Å
172	K	93.4	Very high	92.1	Very high	190 Å²	190	78.5 Å²	78.5	83%	0.826	39%	0.394	S	S	*	.	H	α-helix	trans	-66.5	-33.4	178.9	-68.5	-173.5	177.1	-170.1	0	112.8	G168 K169	G168-K172 PolarHBondContact O-N 3.04Å; K169-K172 PolarHBondContact O-N 3.18Å
173	G	92.6	Very high	92.3	Very high	18 Å²	18	75.3 Å²	75.3	19%	0.186	39%	0.386	C	S	.	.	H	α-helix	trans	-87.2	-20	-172.6	0	0	0	0	0	116.2	K169 A170 L171 K177	K169-G173 PolarHBondContact O-N 2.86Å; A170-G173 PolarHBondContact O-N 3.36Å; L171-G173 VanDerWaalsContact C-N 3.33Å; L171-G173 PolarHBondContact O-N 3.42Å; G173-K177 VanDerWaalsContact O-CD 3.31Å; G173-K177 WeakPolarHBondContact O-CD 3.38Å; G173-K177 VanDerWaalsContact O-CE 3.22Å; G173-K177 WeakPolarHBondContact O-CE 3.22Å; G173-K177 PolarHBondContact O-NZ 3.34Å
174	M	93	Very high	92.4	Very high	14 Å²	14	71.5 Å²	71.5	7%	0.069	37%	0.366	C	S	.	.	H	α-helix	trans	-119.7	-14.3	-176.8	-75.9	-72.1	128	0	0	115.1	V133 F134 F137 A170 M176 K177 V186	V133-M174 HydrophobicContact CG1-CE 4.45Å; V133-M174 HydrophobicContact CG1-SD 3.62Å; F134-M174 HydrophobicContact CE1-CB 4.11Å; F134-M174 HydrophobicContact CE1-CG 4.19Å; F134-M174 HydrophobicContact CZ-CB 3.96Å; F134-M174 HydrophobicContact CZ-CG 4.13Å; F137-M174 HydrophobicContact CD2-CG 4.27Å; F137-M174 HydrophobicContact CE2-CE 3.66Å; F137-M174 HydrophobicContact CE2-CG 3.34Å; F137-M174 HydrophobicContact CE2-SD 4.19Å; F137-M174 HydrophobicContact CZ-CE 3.66Å; F137-M174 HydrophobicContact CZ-CG 3.81Å; A170-M174 WeakPolarHBondContact O-CB 3.5Å; A170-M174 PolarHBondContact O-N 3.18Å; M174-M176 PolarHBondContact O-N 3.18Å; M174-K177 HydrophobicContact CE-CD 3.65Å; M174-K177 PolarHBondContact O-N 2.92Å; M174-K177 VanDerWaalsContact O-N 3.14Å; M174-K177 HydrophobicContact SD-CB 4.42Å; M174-K177 HydrophobicContact SD-CD 4.17Å; M174-V186 HydrophobicContact CB-CG2 4.12Å
175	N	93.6	Very high	92.5	Very high	66 Å²	66	68.7 Å²	68.7	35%	0.353	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	132.2	176.2	-167.6	30.8	0	0	0	110.8	L171 K177 A185 V186	L171-N175 VanDerWaalsContact O-CB 3.26Å; L171-N175 WeakPolarHBondContact O-CB 3.5Å; L171-N175 PolarHBondContact O-N 3.42Å; N175-K177 VanDerWaalsContact C-N 3.26Å; N175-K177 PolarHBondContact O-N 3.15Å; N175-A185 WeakPolarHBondContact OD1-CA 3.38Å; N175-V186 HydrophobicContact CB-CB 4.34Å; N175-V186 PolarHBondContact OD1-N 3.19Å
176	M	91.7	Very high	92.6	Very high	149 Å²	149	61.9 Å²	61.9	73%	0.734	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.6	5.7	-174.7	-52.9	-174.6	-68	0	0	116.7	M174 V184	M174-M176 PolarHBondContact O-N 3.18Å; M176-V184 WeakPolarHBondContact CA-O 3.33Å; M176-V184 PolarHBondContact N-O 2.98Å
177	K	91.4	Very high	92.7	Very high	108 Å²	108	62.7 Å²	62.7	47%	0.47	33%	0.326	S	S	.	.			trans	-80.1	157.2	172.8	-78.3	-173.7	179.4	162.8	0	113	G173 M174 N175 T183 V184	G173-K177 VanDerWaalsContact O-CD 3.31Å; G173-K177 WeakPolarHBondContact O-CD 3.38Å; G173-K177 VanDerWaalsContact O-CE 3.22Å; G173-K177 WeakPolarHBondContact O-CE 3.22Å; G173-K177 PolarHBondContact O-NZ 3.34Å; M174-K177 HydrophobicContact CE-CD 3.65Å; M174-K177 PolarHBondContact O-N 2.92Å; M174-K177 VanDerWaalsContact O-N 3.14Å; M174-K177 HydrophobicContact SD-CB 4.42Å; M174-K177 HydrophobicContact SD-CD 4.17Å; N175-K177 VanDerWaalsContact C-N 3.26Å; N175-K177 PolarHBondContact O-N 3.15Å; K177-T183 WeakPolarHBondContact O-CA 3.34Å; K177-V184 WeakPolarHBondContact O-CB 3.27Å; K177-V184 PolarHBondContact O-N 3.23Å
178	E	92.1	Very high	92.7	Very high	139 Å²	139	67.6 Å²	67.6	65%	0.65	35%	0.345	S	S	*	.	B	Isolated β-bridge	trans	-85.2	133.3	179.6	-65.4	-167.5	-169.7	0	0	113.6	R182 T183	E178-R182 CarbonylContact C-O 3.57Å; E178-R182 VanDerWaalsContact CA-O 3.26Å; E178-R182 WeakPolarHBondContact CA-O 3.47Å; E178-T183 HydrophobicContact CG-CG2 3.7Å
179	I	88.5	Confident	92.6	Very high	11 Å²	11	67.8 Å²	67.8	6%	0.056	34%	0.344	C	S	.	.	S	Bend	trans	-128	114.2	169.8	-49.6	-177.9	0	0	0	108.7	L121 L130 V133 F134 G181 R182 V184	L121-I179 HydrophobicContact CD2-CD1 4.44Å; L130-I179 HydrophobicContact CD2-CD1 4.41Å; V133-I179 HydrophobicContact CG1-CD1 3.99Å; F134-I179 HydrophobicContact CE2-CD1 4.15Å; I179-G181 PolarHBondContact O-N 3.5Å; I179-R182 PolarHBondContact N-O 2.96Å; I179-V184 HydrophobicContact CB-CG2 3.88Å; I179-V184 HydrophobicContact CD1-CB 4.35Å; I179-V184 HydrophobicContact CD1-CG1 4.32Å; I179-V184 HydrophobicContact CD1-CG2 3.98Å; I179-V184 HydrophobicContact CG1-CB 4.39Å; I179-V184 HydrophobicContact CG1-CG2 3.77Å
180	K	87.9	Confident	92.3	Very high	108 Å²	108	65 Å²	65	47%	0.47	34%	0.339	S	S	.	.	S	Bend	trans	48.4	52.5	-174.7	-64.5	-171.3	174.5	177.2	0	113.2	S122 K124 D129	S122-K180 WeakPolarHBondContact CB-O 3.29Å; S122-K180 PolarHBondContact OG-O 3.17Å; K124-K180 HydrophobicContact CB-CD 4.36Å; K124-K180 WeakPolarHBondContact O-CD 3.25Å; K124-K180 PolarHBondContact O-NZ 3.2Å; D129-K180 VanDerWaalsContact CG-CE 3.46Å; D129-K180 WeakPolarHBondContact OD1-CE 3.45Å; D129-K180 IonicContact OD1-NZ 2.75Å; D129-K180 PolarHBondContact OD1-NZ 2.94Å; D129-K180 WeakPolarHBondContact OD2-CE 3.28Å; D129-K180 IonicContact OD2-NZ 2.62Å; D129-K180 PolarHBondContact OD2-NZ 2.88Å
181	G	88.4	Confident	91.8	Very high	62 Å²	62	67.8 Å²	67.8	64%	0.639	36%	0.362	S	S	*	.	S	Bend	trans	74.8	27.6	171.5	0	0	0	0	0	115.5	I179	I179-G181 PolarHBondContact O-N 3.5Å
182	R	91.2	Very high	91.3	Very high	89 Å²	89	73.7 Å²	73.7	34%	0.336	39%	0.386	S	S	.	.	S	Bend	trans	-143.1	137.7	168.9	-67.8	-168.5	-178	156.2	-1.1	110.5	F123 E178 I179	F123-R182 VanDerWaalsContact CD2-NH1 3.33Å; F123-R182 VanDerWaalsContact CE2-NH1 3.31Å; E178-R182 CarbonylContact C-O 3.57Å; E178-R182 VanDerWaalsContact CA-O 3.26Å; E178-R182 WeakPolarHBondContact CA-O 3.47Å; I179-R182 PolarHBondContact N-O 2.96Å
183	T	93.9	Very high	90.7	Very high	72 Å²	72	69.9 Å²	69.9	44%	0.442	38%	0.375	S	S	.	.	B	Isolated β-bridge	trans	-69.3	130.4	171.3	46.9	0	0	0	0	110.9	N120 K177 E178	N120-T183 PolarHBondContact ND2-O 3.2Å; K177-T183 WeakPolarHBondContact O-CA 3.34Å; E178-T183 HydrophobicContact CG-CG2 3.7Å
184	V	94.3	Very high	90.2	Very high	1 Å²	1	75.7 Å²	75.7	1%	0.006	40%	0.395	C	S	.	.			trans	-110.4	127.4	-169.6	172.7	0	0	0	0	110.3	I118 L121 M176 K177 I179 V186	I118-V184 HydrophobicContact CG2-CG1 3.19Å; L121-V184 HydrophobicContact CD2-CG1 4.11Å; L121-V184 HydrophobicContact CD2-CG2 3.92Å; M176-V184 WeakPolarHBondContact CA-O 3.33Å; M176-V184 PolarHBondContact N-O 2.98Å; K177-V184 WeakPolarHBondContact O-CB 3.27Å; K177-V184 PolarHBondContact O-N 3.23Å; I179-V184 HydrophobicContact CB-CG2 3.88Å; I179-V184 HydrophobicContact CD1-CB 4.35Å; I179-V184 HydrophobicContact CD1-CG1 4.32Å; I179-V184 HydrophobicContact CD1-CG2 3.98Å; I179-V184 HydrophobicContact CG1-CB 4.39Å; I179-V184 HydrophobicContact CG1-CG2 3.77Å; V184-V186 HydrophobicContact CG1-CG2 4.15Å
185	A	94.5	Very high	89.6	Confident	36 Å²	36	80 Å²	80	30%	0.298	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	132.2	174.4	0	0	0	0	0	110.2	I118 R119 N175	I118-A185 CarbonylContact C-O 3.55Å; R119-A185 HydrophobicContact CB-CB 4.34Å; R119-A185 PolarHBondContact N-O 2.68Å; R119-A185 PolarHBondContact O-N 2.94Å; R119-A185 VanDerWaalsContact O-N 3.11Å; N175-A185 WeakPolarHBondContact OD1-CA 3.38Å
186	V	95	Very high	89.1	Confident	2 Å²	2	82.8 Å²	82.8	1%	0.012	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	123.7	-176.8	-171.1	0	0	0	0	109.5	L116 I118 F134 L171 M174 N175 V184	L116-V186 HydrophobicContact CB-CG1 4.17Å; L116-V186 HydrophobicContact CD1-CG1 3.79Å; L116-V186 HydrophobicContact CG-CG1 4.43Å; I118-V186 HydrophobicContact CG1-CG1 4.42Å; I118-V186 HydrophobicContact CG2-CG2 4.49Å; F134-V186 HydrophobicContact CE1-CG1 4.4Å; F134-V186 HydrophobicContact CZ-CG2 4.16Å; L171-V186 HydrophobicContact CD1-CG1 4.19Å; L171-V186 WeakPolarHBondContact CD1-O 3.35Å; M174-V186 HydrophobicContact CB-CG2 4.12Å; N175-V186 HydrophobicContact CB-CB 4.34Å; N175-V186 PolarHBondContact OD1-N 3.19Å; V184-V186 HydrophobicContact CG1-CG2 4.15Å
187	D	95.1	Very high	88.6	Confident	54 Å²	54	80.3 Å²	80.3	29%	0.289	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	171.8	176.9	-51.7	-72.3	0	0	0	111.9	L116 I117 R119	L116-D187 CarbonylContact C-O 3.55Å; L116-D187 VanDerWaalsContact CA-O 3.23Å; L116-D187 WeakPolarHBondContact CA-O 3.48Å; I117-D187 HydrophobicContact CG2-CB 3.79Å; I117-D187 PolarHBondContact N-O 2.83Å; I117-D187 PolarHBondContact O-N 3.13Å; R119-D187 IonicContact CZ-OD2 3.58Å; R119-D187 IonicContact NE-OD2 2.75Å; R119-D187 PolarHBondContact NE-OD2 2.98Å; R119-D187 IonicContact NH2-OD2 3.34Å; R119-D187 PolarHBondContact NH2-OD2 3.4Å
188	W	93.6	Very high	87.9	Confident	103 Å²	103	78.9 Å²	78.9	39%	0.39	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68	134.4	163.5	-63.9	107	0	0	0	111.9	L116 L164 A167 L171 V190	L116-W188 HydrophobicContact CD2-CD2 4.06Å; L116-W188 HydrophobicContact CD2-CE3 3.61Å; L116-W188 HydrophobicContact CD2-CH2 4.42Å; L116-W188 HydrophobicContact CD2-CZ3 3.81Å; L164-W188 HydrophobicContact CD1-CE3 4.4Å; L164-W188 HydrophobicContact CD1-CH2 3.64Å; L164-W188 HydrophobicContact CD1-CZ3 3.52Å; L164-W188 HydrophobicContact CG-CH2 4.12Å; L164-W188 HydrophobicContact CG-CZ3 4.47Å; A167-W188 HydrophobicContact CB-CH2 3.69Å; A167-W188 HydrophobicContact CB-CZ3 3.53Å; L171-W188 HydrophobicContact CD2-CZ2 4.18Å; W188-V190 PolarHBondContact O-N 2.67Å
189	A	91.7	Very high	87	Confident	24 Å²	24	77.1 Å²	77.1	20%	0.198	40%	0.402	C	S	.	.			trans	-78.5	109.5	-178.5	0	0	0	0	0	112.2	R115 I117 F158	R115-A189 HydrophobicContact CB-CB 3.96Å; R115-A189 HydrophobicContact CG-CB 3.86Å; R115-A189 VanDerWaalsContact O-CB 3.29Å; R115-A189 WeakPolarHBondContact O-CB 3.3Å; R115-A189 PolarHBondContact O-N 3.48Å; I117-A189 HydrophobicContact CB-CB 4.18Å; F158-A189 HydrophobicContact CD1-CB 3.82Å; F158-A189 HydrophobicContact CE1-CB 3.98Å
190	V	87.1	Confident	86	Confident	83 Å²	83	79.7 Å²	79.7	50%	0.503	42%	0.421	S	S	.	.			trans	-75	143.5	173.2	-179.7	0	0	0	0	110.8	W188 K194	W188-V190 PolarHBondContact O-N 2.67Å; V190-K194 HydrophobicContact CG1-CB 3.58Å; V190-K194 HydrophobicContact CG1-CD 4.47Å
191	A	84.1	Confident	84.8	Confident	59 Å²	59	79.6 Å²	79.6	49%	0.488	43%	0.429	S	S	.	.			trans	-60.9	141.7	175.1	0	0	0	0	0	111.6	D193 K194 Y195	A191-D193 PolarHBondContact O-N 3.21Å; A191-K194 PolarHBondContact O-N 3.2Å; A191-K194 VanDerWaalsContact O-N 3.15Å; A191-Y195 PolarHBondContact O-N 3.39Å
192	K	83.5	Confident	83.4	Confident	159 Å²	159	79.8 Å²	79.8	69%	0.691	42%	0.421	S	S	*	.	H	α-helix	trans	-54.9	-33.6	-171.8	-171.9	174.8	-177.4	178	0	113.9	K196	K192-K196 WeakPolarHBondContact O-CG 3.49Å; K192-K196 PolarHBondContact O-N 3.23Å; K192-K196 VanDerWaalsContact O-N 3.12Å
193	D	81.6	Confident	81.6	Confident	110 Å²	110	78.9 Å²	78.9	59%	0.588	43%	0.432	S	S	*	.	H	α-helix	trans	-71.8	-53.5	-179.7	-45.6	-61.5	0	0	0	110.2	A191 Y195 K196 D197	A191-D193 PolarHBondContact O-N 3.21Å; D193-Y195 PolarHBondContact O-N 2.72Å; D193-Y195 VanDerWaalsContact O-N 3.15Å; D193-K196 WeakPolarHBondContact O-CA 3.47Å; D193-K196 WeakPolarHBondContact O-CB 3.34Å; D193-K196 PolarHBondContact O-N 2.88Å; D193-D197 VanDerWaalsContact O-CG 3.24Å; D193-D197 PolarHBondContact O-N 2.69Å
194	K	82.2	Confident	79.7	Confident	141 Å²	141	81.9 Å²	81.9	61%	0.613	44%	0.444	S	S	*	.	H	α-helix	trans	-53.3	-36.9	171.7	-72.4	-168.6	174.1	-165.9	0	113.3	V190 A191 D197 T198	V190-K194 HydrophobicContact CG1-CB 3.58Å; V190-K194 HydrophobicContact CG1-CD 4.47Å; A191-K194 PolarHBondContact O-N 3.2Å; A191-K194 VanDerWaalsContact O-N 3.15Å; K194-D197 WeakPolarHBondContact CA-OD2 3.16Å; K194-D197 PolarHBondContact O-N 3.4Å; K194-T198 PolarHBondContact O-N 2.99Å; K194-T198 PolarHBondContact O-OG1 3.18Å
195	Y	81	Confident	77.3	Confident	105 Å²	105	82.8 Å²	82.8	41%	0.412	45%	0.453	S	S	.	.	H	α-helix	trans	-68	-38.5	177.4	-175.8	-101.5	0	0	0	112.5	A191 D193 T198 Q199	A191-Y195 PolarHBondContact O-N 3.39Å; D193-Y195 PolarHBondContact O-N 2.72Å; D193-Y195 VanDerWaalsContact O-N 3.15Å; Y195-T198 WeakPolarHBondContact CA-OG1 3.48Å; Y195-T198 PolarHBondContact O-N 2.97Å; Y195-T198 PolarHBondContact O-OG1 3Å; Y195-Q199 HydrophobicContact CD1-CG 4.39Å; Y195-Q199 VanDerWaalsContact CE1-CD 3.49Å; Y195-Q199 HydrophobicContact CE1-CG 3.94Å; Y195-Q199 WeakPolarHBondContact O-CG 3.36Å; Y195-Q199 PolarHBondContact O-N 2.79Å; Y195-Q199 PolarHBondContact OH-NE2 2.95Å
196	K	82.4	Confident	74.9	Confident	124 Å²	124	88.5 Å²	88.5	54%	0.539	47%	0.474	S	S	.	.	H	α-helix	trans	-63.5	-44.3	170.7	-75.2	174.7	162.3	-165.6	0	111.3	K192 D193 T198 Q199 S200	K192-K196 WeakPolarHBondContact O-CG 3.49Å; K192-K196 PolarHBondContact O-N 3.23Å; K192-K196 VanDerWaalsContact O-N 3.12Å; D193-K196 WeakPolarHBondContact O-CA 3.47Å; D193-K196 WeakPolarHBondContact O-CB 3.34Å; D193-K196 PolarHBondContact O-N 2.88Å; K196-T198 VanDerWaalsContact C-N 3.31Å; K196-T198 PolarHBondContact O-N 2.94Å; K196-Q199 PolarHBondContact O-N 3Å; K196-Q199 VanDerWaalsContact O-N 3.15Å; K196-S200 PolarHBondContact O-N 2.79Å
197	D	80.4	Confident	72.3	Confident	96 Å²	96	97.4 Å²	97.4	51%	0.513	52%	0.516	S	S	.	.	H	α-helix	trans	-56.5	-49.1	178.4	-55.3	-28.7	0	0	0	109.4	D193 K194 Q199 S200 V201	D193-D197 VanDerWaalsContact O-CG 3.24Å; D193-D197 PolarHBondContact O-N 2.69Å; K194-D197 WeakPolarHBondContact CA-OD2 3.16Å; K194-D197 PolarHBondContact O-N 3.4Å; D197-Q199 PolarHBondContact O-N 3.2Å; D197-S200 PolarHBondContact O-N 2.83Å; D197-S200 PolarHBondContact O-OG 2.78Å; D197-V201 PolarHBondContact O-N 3.41Å
198	T	78	Confident	69.7	Low	78 Å²	78	104 Å²	104	48%	0.479	54%	0.542	S	S	.	.	H	α-helix	trans	-61.8	-41.3	174.9	50.5	0	0	0	0	113.8	K194 Y195 K196 S200 V201 S202	K194-T198 PolarHBondContact O-N 2.99Å; K194-T198 PolarHBondContact O-OG1 3.18Å; Y195-T198 WeakPolarHBondContact CA-OG1 3.48Å; Y195-T198 PolarHBondContact O-N 2.97Å; Y195-T198 PolarHBondContact O-OG1 3Å; K196-T198 VanDerWaalsContact C-N 3.31Å; K196-T198 PolarHBondContact O-N 2.94Å; T198-S200 VanDerWaalsContact C-N 3.29Å; T198-S200 PolarHBondContact O-N 2.83Å; T198-V201 PolarHBondContact O-N 2.96Å; T198-S202 PolarHBondContact O-N 3.23Å; T198-S202 PolarHBondContact O-OG 3.3Å
199	Q	73.4	Confident	66.7	Low	103 Å²	103	102.5 Å²	102.5	48%	0.481	55%	0.546	S	S	.	.	H	α-helix	trans	-64.6	-33	176.1	-76.4	-162.4	-48.3	0	0	112.6	Y195 K196 D197 V201 S202 A203	Y195-Q199 HydrophobicContact CD1-CG 4.39Å; Y195-Q199 VanDerWaalsContact CE1-CD 3.49Å; Y195-Q199 HydrophobicContact CE1-CG 3.94Å; Y195-Q199 WeakPolarHBondContact O-CG 3.36Å; Y195-Q199 PolarHBondContact O-N 2.79Å; Y195-Q199 PolarHBondContact OH-NE2 2.95Å; K196-Q199 PolarHBondContact O-N 3Å; K196-Q199 VanDerWaalsContact O-N 3.15Å; D197-Q199 PolarHBondContact O-N 3.2Å; Q199-V201 VanDerWaalsContact C-N 3.3Å; Q199-V201 PolarHBondContact O-N 2.78Å; Q199-S202 PolarHBondContact O-N 2.88Å; Q199-A203 WeakPolarHBondContact O-CB 3.28Å; Q199-A203 PolarHBondContact O-N 3.29Å
200	S	66.7	Low	64	Low	64 Å²	64	110.5 Å²	110.5	45%	0.448	58%	0.579	S	S	.	*	H	α-helix	trans	-67.3	-31.2	175.4	74.4	0	0	0	0	112.5	K196 D197 T198 I204	K196-S200 PolarHBondContact O-N 2.79Å; D197-S200 PolarHBondContact O-N 2.83Å; D197-S200 PolarHBondContact O-OG 2.78Å; T198-S200 VanDerWaalsContact C-N 3.29Å; T198-S200 PolarHBondContact O-N 2.83Å; S200-I204 WeakPolarHBondContact O-CD1 3.36Å; S200-I204 VanDerWaalsContact O-CG1 3.27Å; S200-I204 WeakPolarHBondContact O-CG1 3.5Å; S200-I204 PolarHBondContact O-N 2.78Å
201	V	63.7	Low	61.5	Low	106 Å²	106	114 Å²	114	64%	0.642	59%	0.59	S	S	*	*	H	α-helix	trans	-74.1	-43.9	172.8	179.3	0	0	0	0	111	D197 T198 Q199 I204 G205	D197-V201 PolarHBondContact O-N 3.41Å; T198-V201 PolarHBondContact O-N 2.96Å; Q199-V201 VanDerWaalsContact C-N 3.3Å; Q199-V201 PolarHBondContact O-N 2.78Å; V201-I204 PolarHBondContact O-N 2.9Å; V201-G205 PolarHBondContact O-N 2.84Å; V201-G205 VanDerWaalsContact O-N 3.08Å
202	S	59.2	Low	58.9	Low	67 Å²	67	116.4 Å²	116.4	47%	0.469	60%	0.604	S	S	.	*	H	α-helix	trans	-58.6	-50.3	176.6	-58.8	0	0	0	0	112.4	T198 Q199 I204 G205 E206	T198-S202 PolarHBondContact O-N 3.23Å; T198-S202 PolarHBondContact O-OG 3.3Å; Q199-S202 PolarHBondContact O-N 2.88Å; S202-I204 PolarHBondContact O-N 2.86Å; S202-G205 PolarHBondContact O-N 3.46Å; S202-E206 PolarHBondContact O-N 3.5Å; S202-E206 VanDerWaalsContact O-N 3.13Å
203	A	53.5	Low	56.7	Low	70 Å²	70	117.8 Å²	117.8	58%	0.579	61%	0.61	S	S	*	*	H	α-helix	trans	-68	-16	-177.4	0	0	0	0	0	114.3	Q199	Q199-A203 WeakPolarHBondContact O-CB 3.28Å; Q199-A203 PolarHBondContact O-N 3.29Å
204	I	52.4	Low	54.2	Low	135 Å²	135	121 Å²	121	69%	0.692	62%	0.621	S	S	*	*	H	α-helix	trans	-92.7	-20.6	172.4	-67.3	172.5	0	0	0	111.1	S200 V201 S202	S200-I204 WeakPolarHBondContact O-CD1 3.36Å; S200-I204 VanDerWaalsContact O-CG1 3.27Å; S200-I204 WeakPolarHBondContact O-CG1 3.5Å; S200-I204 PolarHBondContact O-N 2.78Å; V201-I204 PolarHBondContact O-N 2.9Å; S202-I204 PolarHBondContact O-N 2.86Å
205	G	44.7	Very low	52	Low	19 Å²	19	121.9 Å²	121.9	20%	0.196	63%	0.627	C	S	.	*	H	α-helix	trans	-83.1	-27.6	176.4	0	0	0	0	0	114.6	V201 S202 E207 K208 S209	V201-G205 PolarHBondContact O-N 2.84Å; V201-G205 VanDerWaalsContact O-N 3.08Å; S202-G205 PolarHBondContact O-N 3.46Å; G205-E207 VanDerWaalsContact C-N 3.25Å; G205-E207 PolarHBondContact O-N 3.24Å; G205-K208 CarbonylContact O-C 3.45Å; G205-K208 PolarHBondContact O-N 2.91Å; G205-S209 PolarHBondContact O-N 3.46Å; G205-S209 PolarHBondContact O-OG 3.25Å; G205-S209 VanDerWaalsContact O-OG 3.06Å
206	E	42.9	Very low	49.6	Very low	156 Å²	156	123.7 Å²	123.7	73%	0.729	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.2	-19.4	-172.7	-76.9	170.3	176.7	0	0	114.4	S202	S202-E206 PolarHBondContact O-N 3.5Å; S202-E206 VanDerWaalsContact O-N 3.13Å
207	E	41.3	Very low	46.9	Very low	190 Å²	190	123 Å²	123	89%	0.888	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.5	-1.9	168.7	-66.3	-169.5	151.5	0	0	114.1	G205	G205-E207 VanDerWaalsContact C-N 3.25Å; G205-E207 PolarHBondContact O-N 3.24Å
208	K	40.5	Very low	44.5	Very low	193 Å²	193	123.6 Å²	123.6	84%	0.839	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-138.7	10.1	-174.8	-85.5	-165	174	-177.7	0	117.3	G205	G205-K208 CarbonylContact O-C 3.45Å; G205-K208 PolarHBondContact O-N 2.91Å
209	S	30.4	Very low	42.1	Very low	70 Å²	70	127 Å²	127	49%	0.49	67%	0.665	S	S	.	*			trans	-153.5	106.5	171.3	54	0	0	0	0	113	G205	G205-S209 PolarHBondContact O-N 3.46Å; G205-S209 PolarHBondContact O-OG 3.25Å; G205-S209 VanDerWaalsContact O-OG 3.06Å
210	H	36.1	Very low	39.9	Very low	192 Å²	192	131.3 Å²	131.3	89%	0.889	68%	0.682	S	S	*	*			trans	-135.3	23.3	165.9	-137.6	-61.3	0	0	0	114
211	E	33	Very low	38.1	Very low	156 Å²	156	138 Å²	138	73%	0.729	70%	0.703	S	S	*	*			trans	-128	111.5	169.2	-168.3	81.7	-108.8	0	0	107.3
212	S	30.2	Very low	36.4	Very low	110 Å²	110	136.4 Å²	136.4	77%	0.769	71%	0.708	S	S	*	*			trans	-160	66.4	-178	-75.7	0	0	0	0	111.7
213	K	36.4	Very low	34.9	Very low	189 Å²	189	143.8 Å²	143.8	82%	0.822	73%	0.726	S	S	*	*			trans	-121.9	111.4	153.8	-73.4	-177.6	176.8	-179.4	0	106
214	H	30.8	Very low	33.8	Very low	177 Å²	177	147.7 Å²	147.7	82%	0.819	73%	0.732	S	S	*	*				82.4	146.5	75.1	-163.4	74.8	0	0	0	110.4
215	Q	35.4	Very low	32.7	Very low	160 Å²	160	150.1 Å²	150.1	75%	0.748	74%	0.741	S	S	*	*			trans	64.9	158.7	-160.5	-64.9	-171.2	-78.3	0	0	114.9
216	E	29.3	Very low	32.1	Very low	143 Å²	143	158.2 Å²	158.2	67%	0.668	77%	0.773	S	S	*	*			cis	168.4	128.9	-29.5	171.3	176.5	-179	0	0	106.8
217	S	26.9	Very low	31.5	Very low	109 Å²	109	158 Å²	158	76%	0.762	78%	0.777	S	S	*	*			trans	63.9	174.4	163.3	89.8	0	0	0	0	115.8
218	V	29.5	Very low	31.2	Very low	108 Å²	108	157.9 Å²	157.9	66%	0.655	78%	0.779	S	S	*	*			cis	-157.1	154.4	-14.4	99.5	0	0	0	0	112.4
219	K	27.9	Very low	30.8	Very low	151 Å²	151	155.4 Å²	155.4	66%	0.657	77%	0.77	S	S	*	*			trans	46.8	138.6	156.9	-68.9	160.1	-168.6	163	0	122.3
220	K	27.9	Very low	31	Very low	193 Å²	193	161.5 Å²	161.5	84%	0.839	79%	0.791	S	S	*	*				32.2	133.4	125.6	-53	-176.9	176.2	-173	0	117.6
221	K	29.1	Very low	30.8	Very low	203 Å²	203	158 Å²	158	88%	0.883	78%	0.775	S	S	*	*				-151	153.4	68.7	-89.5	177.1	177.1	-178.3	0	113
222	G	26.1	Very low	31	Very low	73 Å²	73	160 Å²	160	75%	0.753	78%	0.784	S	S	*	*			trans	-90	152.3	154.3	0	0	0	0	0	110
223	R	29.6	Very low	31.1	Very low	223 Å²	223	160.2 Å²	160.2	84%	0.842	78%	0.777	S	S	*	*			trans	-154.5	103.9	159.2	-161	166.2	-166.4	-165.9	-5.7	103.7
224	E	28.6	Very low	31.2	Very low	152 Å²	152	159.4 Å²	159.4	71%	0.71	78%	0.782	S	S	*	*				61.2	98.2	89.2	-61.2	163.8	170.2	0	0	111.3
225	E	30	Very low	31.4	Very low	186 Å²	186	157.3 Å²	157.3	87%	0.869	78%	0.776	S	S	*	*			trans	76.4	165.3	138.7	-58.1	-178.3	155.3	0	0	120.3
226	E	31.7	Very low	31.7	Very low	189 Å²	189	157.9 Å²	157.9	88%	0.883	79%	0.785	S	S	*	*			trans	75.6	120.4	174.2	-56.8	-171.4	168.2	0	0	118.4
227	D	30.6	Very low	32.2	Very low	151 Å²	151	158 Å²	158	81%	0.807	79%	0.79	S	S	*	*			trans	-70.7	144.3	177.8	-51.6	-89.9	0	0	0	112.3
228	M	36	Very low	32.9	Very low	188 Å²	188	160.9 Å²	160.9	93%	0.926	80%	0.797	S	S	*	*				-161	149	121.7	-114.1	162.8	-75.8	0	0	111.6
229	E	30.5	Very low	33.4	Very low	140 Å²	140	162.7 Å²	162.7	65%	0.654	80%	0.803	S	S	*	*			trans	-83.8	138.4	166	-50.9	-167	97.5	0	0	109	R600	E229-R600 IonicContact OE1-CZ 3.81Å; E229-R600 IonicContact OE1-NH1 2.73Å; E229-R600 PolarHBondContact OE1-NH1 3.47Å; E229-R600 IonicContact OE1-NH2 3.07Å; E229-R600 PolarHBondContact OE1-NH2 2.89Å; E229-R600 IonicContact OE2-NH2 2.74Å
230	E	35.1	Very low	34.1	Very low	198 Å²	198	162.9 Å²	162.9	93%	0.925	81%	0.811	S	S	*	*			trans	-149.3	139	146.2	-120.8	159.3	-150.6	0	0	109.1
231	E	32.6	Very low	34.7	Very low	118 Å²	118	161.1 Å²	161.1	55%	0.551	81%	0.811	S	S	*	*			trans	-97.9	134	179.2	-60.7	-177.9	164.6	0	0	108.3	R600	E231-R600 VanDerWaalsContact OE1-CD 3.24Å; E231-R600 WeakPolarHBondContact OE1-CD 3.35Å; E231-R600 IonicContact OE1-CZ 3.47Å; E231-R600 IonicContact OE1-NE 3.77Å; E231-R600 IonicContact OE1-NH1 2.72Å; E231-R600 PolarHBondContact OE1-NH1 3.09Å
232	E	37.4	Very low	35	Very low	199 Å²	199	161.2 Å²	161.2	93%	0.93	81%	0.814	S	S	*	*			trans	-137.7	129	156.4	-115.5	167.6	-162.2	0	0	108.4
233	N	30.9	Very low	35.5	Very low	115 Å²	115	166.9 Å²	166.9	62%	0.615	82%	0.821	S	S	*	*			trans	-92.3	152.2	172.4	-44.5	-81.3	0	0	0	107.4
234	D	39.3	Very low	35.8	Very low	172 Å²	172	164 Å²	164	92%	0.92	82%	0.823	S	S	*	*			trans	-124.5	120.5	144.3	-89.2	-46.7	0	0	0	106.1
235	D	35.9	Very low	36	Very low	132 Å²	132	159.7 Å²	159.7	71%	0.706	82%	0.818	S	S	*	*			trans	-82.2	142.7	169.6	-59.7	-71.2	0	0	0	108.5
236	D	41.7	Very low	36.3	Very low	172 Å²	172	156.6 Å²	156.6	92%	0.92	81%	0.812	S	S	*	*			trans	-136.1	107.2	161.1	-107.7	-34.4	0	0	0	105.9
237	D	39.2	Very low	36.4	Very low	145 Å²	145	157.3 Å²	157.3	78%	0.775	81%	0.813	S	S	*	*			trans	-73.9	142.6	179	-66	-61.4	0	0	0	111.1
238	D	41.9	Very low	36.6	Very low	171 Å²	171	155.8 Å²	155.8	91%	0.914	80%	0.804	S	S	*	*			trans	-140.7	113.4	150.7	-110.2	-30.4	0	0	0	106.3
239	D	39.2	Very low	36.5	Very low	146 Å²	146	155 Å²	155	78%	0.781	80%	0.804	S	S	*	*			trans	-64	143.7	176.7	-69.8	-66.1	0	0	0	111.3
240	D	42.3	Very low	36.7	Very low	155 Å²	155	155.8 Å²	155.8	83%	0.829	81%	0.808	S	S	*	*			trans	-167.6	132.4	134.5	-104.1	-20	0	0	0	111.8
241	D	42.1	Very low	36.6	Very low	156 Å²	156	152.7 Å²	152.7	83%	0.834	80%	0.798	S	S	*	*			trans	52.7	112.8	164.9	-69.2	-27.9	0	0	0	121.5
242	E	33.7	Very low	36.9	Very low	204 Å²	204	156.4 Å²	156.4	95%	0.953	82%	0.815	S	S	*	*			trans	-70.3	122.4	160.4	-57.4	179.6	134.6	0	0	111.6
243	E	38.3	Very low	36.6	Very low	192 Å²	192	155.4 Å²	155.4	90%	0.897	81%	0.81	S	S	*	*			trans	-144.3	118.2	151.8	-151.2	177.2	-138.4	0	0	110.8	G245	E243-G245 VanDerWaalsContact C-N 3.29Å; E243-G245 PolarHBondContact O-N 3.27Å
244	D	34.1	Very low	36.9	Very low	164 Å²	164	157.2 Å²	157.2	88%	0.877	82%	0.815	S	S	*	*			trans	-73.5	75.2	-172.5	-103.7	-39.7	0	0	0	112.5	V246	D244-V246 VanDerWaalsContact C-N 3.27Å; D244-V246 PolarHBondContact O-N 3.46Å
245	G	34.2	Very low	36.7	Very low	60 Å²	60	156.9 Å²	156.9	62%	0.619	81%	0.808	S	S	*	*			trans	-69.5	70.9	178.9	0	0	0	0	0	114.3	E243 F247	E243-G245 VanDerWaalsContact C-N 3.29Å; E243-G245 PolarHBondContact O-N 3.27Å; G245-F247 VanDerWaalsContact C-N 3.31Å; G245-F247 PolarHBondContact O-N 3.35Å
246	V	35.7	Very low	36.4	Very low	122 Å²	122	158.1 Å²	158.1	74%	0.739	81%	0.814	S	S	*	*			trans	-65.9	90.2	165.8	-178.7	0	0	0	0	109	D244 D248	D244-V246 VanDerWaalsContact C-N 3.27Å; D244-V246 PolarHBondContact O-N 3.46Å; V246-D248 PolarHBondContact O-N 2.89Å
247	F	34.5	Very low	36.1	Very low	203 Å²	203	156.7 Å²	156.7	89%	0.89	81%	0.806	S	S	*	*			trans	-72	96	168.8	-97.9	-87.7	0	0	0	109.7	G245	G245-F247 VanDerWaalsContact C-N 3.31Å; G245-F247 PolarHBondContact O-N 3.35Å
248	D	34.7	Very low	35.9	Very low	119 Å²	119	158.4 Å²	158.4	64%	0.636	81%	0.809	S	S	*	*			trans	-71.9	162.7	172	-139.4	-34.2	0	0	0	111.8	V246 E250	V246-D248 PolarHBondContact O-N 2.89Å; D248-E250 PolarHBondContact O-N 3.3Å
249	D	32.6	Very low	35.5	Very low	172 Å²	172	155.5 Å²	155.5	92%	0.92	80%	0.802	S	S	*	*			trans	-90.8	67.1	-176.8	-90.6	-57.2	0	0	0	111.7
250	E	35.4	Very low	35.3	Very low	156 Å²	156	157.9 Å²	157.9	73%	0.729	81%	0.805	S	S	*	*			trans	-128.3	133.8	174.7	-64.4	-174.9	156.7	0	0	109.2	D248	D248-E250 PolarHBondContact O-N 3.3Å
251	D	33.9	Very low	35	Very low	134 Å²	134	156.7 Å²	156.7	72%	0.717	80%	0.803	S	S	*	*			cis	-125.9	-166.8	-8.4	-57.5	-64.5	0	0	0	109.2
252	E	37.3	Very low	34.6	Very low	195 Å²	195	154.5 Å²	154.5	91%	0.911	80%	0.796	S	S	*	*			cis	-128.6	132.4	46.4	-69.3	174.4	142	0	0	112.3
253	E	32.9	Very low	34.6	Very low	178 Å²	178	154.3 Å²	154.3	83%	0.832	79%	0.792	S	S	*	*			trans	-78.2	138.4	166.5	-57	-170	122.1	0	0	111.1
254	E	36.1	Very low	34.2	Very low	154 Å²	154	150.9 Å²	150.9	72%	0.72	79%	0.786	S	S	*	*			trans	-123.4	128.5	158.3	-87.8	-170.1	175.4	0	0	108.8	R468	E254-R468 IonicContact OE1-NH2 3.63Å; E254-R468 IonicContact OE2-CZ 2.71Å; E254-R468 IonicContact OE2-NH1 3.82Å; E254-R468 IonicContact OE2-NH2 3.45Å; E254-R468 PolarHBondContact OE2-NH2 2.97Å
255	E	34.9	Very low	34.2	Very low	165 Å²	165	150.3 Å²	150.3	77%	0.771	79%	0.788	S	S	*	*			trans	-73.2	144.4	-161.3	-62.3	-175.4	129.7	0	0	115.3	I257	E255-I257 HydrophobicContact CB-CD1 4.31Å; E255-I257 HydrophobicContact CB-CG1 3.96Å; E255-I257 PolarHBondContact O-N 3.41Å
256	N	29.6	Very low	34.4	Very low	157 Å²	157	155.3 Å²	155.3	84%	0.84	80%	0.796	S	S	*	*			trans	-85.8	77.1	175.6	178.1	40.3	0	0	0	111.9	E258	N256-E258 PolarHBondContact O-N 3.1Å
257	I	36.1	Very low	34.2	Very low	143 Å²	143	156.1 Å²	156.1	73%	0.733	79%	0.794	S	S	*	*			trans	-97.7	72	179.5	-46.6	-179.3	0	0	0	111.5	E255	E255-I257 HydrophobicContact CB-CD1 4.31Å; E255-I257 HydrophobicContact CB-CG1 3.96Å; E255-I257 PolarHBondContact O-N 3.41Å
258	E	33.8	Very low	34.3	Very low	181 Å²	181	155.9 Å²	155.9	85%	0.846	80%	0.796	S	S	*	*			trans	-151.3	79.2	168.1	-152.6	172.2	-126.6	0	0	114	N256	N256-E258 PolarHBondContact O-N 3.1Å
259	S	33.3	Very low	34.2	Very low	109 Å²	109	159.7 Å²	159.7	76%	0.762	81%	0.807	S	S	*	*			trans	-164.9	142.3	150.6	56.8	0	0	0	0	115.6
260	K	36.6	Very low	34.4	Very low	196 Å²	196	163.9 Å²	163.9	85%	0.852	81%	0.81	S	S	*	*			trans	91.7	143.9	164.8	-54.2	178.1	179.7	174.6	0	118.9
261	V	35.1	Very low	34.3	Very low	130 Å²	130	160.9 Å²	160.9	79%	0.788	81%	0.812	S	S	*	*			trans	72.1	128.3	165.5	-164.3	0	0	0	0	117.5
262	T	34.6	Very low	34.5	Very low	111 Å²	111	161 Å²	161	68%	0.681	82%	0.817	S	S	*	*			cis	-163.4	137.5	-41.1	34	0	0	0	0	110.3
263	K	33.5	Very low	34.4	Very low	199 Å²	199	161.4 Å²	161.4	87%	0.865	82%	0.816	S	S	*	*			trans	61.6	145.7	152.3	-64.1	-179.4	178.5	-178.7	0	119.8
264	P	30	Very low	34.5	Very low	121 Å²	121	164.2 Å²	164.2	79%	0.786	82%	0.819	S	S	*	*			trans	-102.8	160.4	-176.5	39.8	-35.4	0	0	0	114.9
265	V	34	Very low	34.5	Very low	152 Å²	152	162.9 Å²	162.9	92%	0.921	82%	0.823	S	S	*	*			trans	-136.6	163.9	168	-178.3	0	0	0	0	109.9
266	Q	36.9	Very low	34.5	Very low	165 Å²	165	159.2 Å²	159.2	77%	0.771	82%	0.821	S	S	*	*			trans	-106	147.2	-155.3	-65.4	171.6	-8.5	0	0	115.9
267	I	32.2	Very low	34.9	Very low	138 Å²	138	157.5 Å²	157.5	71%	0.708	82%	0.818	S	S	*	*			trans	34.6	119.3	130.3	-44.9	163.6	0	0	0	118.3
268	Q	37.6	Very low	34.9	Very low	198 Å²	198	154.7 Å²	154.7	93%	0.925	82%	0.817	S	S	*	*				-169.2	163.2	120.3	-105.9	167.6	92.9	0	0	114.7
269	K	32.2	Very low	35	Very low	200 Å²	200	155.4 Å²	155.4	87%	0.87	82%	0.817	S	S	*	*			trans	-107.5	144.7	-171.2	-55.9	170.8	-178.2	173.5	0	111.7
270	R	35.8	Very low	35.1	Very low	260 Å²	260	154.6 Å²	154.6	98%	0.981	81%	0.811	S	S	*	*			trans	-165.1	159.3	139.1	-110.7	165.8	-179.9	-176.4	-1	110.5
271	A	33.3	Very low	34.9	Very low	93 Å²	93	150.3 Å²	150.3	77%	0.769	81%	0.806	S	S	*	*			trans	-133.5	161.5	-176.4	0	0	0	0	0	110.3
272	V	37.7	Very low	34.7	Very low	136 Å²	136	150.5 Å²	150.5	82%	0.824	80%	0.803	S	S	*	*			trans	-179.2	136.1	143.5	138.8	0	0	0	0	112.7
273	K	37.2	Very low	34.9	Very low	203 Å²	203	152 Å²	152	88%	0.883	80%	0.802	S	S	*	*			trans	59.1	152.2	158.8	-77.9	178.1	176	178.8	0	123.3
274	R	33.8	Very low	35.1	Very low	238 Å²	238	147 Å²	147	90%	0.898	79%	0.792	S	S	*	*			trans	-83.9	179.8	171.2	-65.9	-178.9	173.6	-163.7	-0.7	110.6
275	P	35.9	Very low	35.5	Very low	125 Å²	125	147.5 Å²	147.5	81%	0.812	78%	0.784	S	S	*	*			cis	-135.7	-171.9	10.2	38.7	-16.9	0	0	0	116.9
276	A	35.6	Very low	35.5	Very low	88 Å²	88	147.9 Å²	147.9	73%	0.727	78%	0.775	S	S	*	*			trans	-83.4	177.6	177.2	0	0	0	0	0	113.3
277	P	38.6	Very low	35.7	Very low	121 Å²	121	146 Å²	146	79%	0.786	77%	0.771	S	S	*	*				-152.3	-176.1	88.8	42	-24.5	0	0	0	116.9
278	A	35.6	Very low	36	Very low	85 Å²	85	144.1 Å²	144.1	70%	0.702	77%	0.77	S	S	*	*			trans	73.1	155.9	161.4	0	0	0	0	0	118.5
279	K	35.1	Very low	36.1	Very low	195 Å²	195	140.9 Å²	140.9	85%	0.848	76%	0.759	S	S	*	*			cis	-173.6	157.3	-18.9	-99.6	172	-174.5	178.9	0	104.9
280	S	34.7	Very low	36.3	Very low	92 Å²	92	139.1 Å²	139.1	64%	0.643	76%	0.758	S	S	*	*			cis	-174.2	155.1	-13.9	49.5	0	0	0	0	110.8
281	S	32.4	Very low	36.6	Very low	107 Å²	107	134.5 Å²	134.5	75%	0.748	75%	0.748	S	S	*	*			trans	58.3	156.3	138.6	59.9	0	0	0	0	123.9
282	D	32.6	Very low	36.9	Very low	134 Å²	134	138 Å²	138	72%	0.717	75%	0.748	S	S	*	*			cis	-179.8	-174.5	-25.3	-159.8	-3.9	0	0	0	109.6
283	H	37.5	Very low	36.9	Very low	142 Å²	142	135.9 Å²	135.9	66%	0.657	74%	0.739	S	S	*	*			trans	79.9	150.2	161.1	-60.3	-58.2	0	0	0	119.4	E285	H283-E285 IonicContact CE1-OE1 2.7Å; H283-E285 IonicContact CG-OE1 2.75Å; H283-E285 IonicContact ND1-OE1 3.75Å; H283-E285 PolarHBondContact ND1-OE1 3.28Å
284	S	38.1	Very low	37	Very low	93 Å²	93	133.4 Å²	133.4	65%	0.65	74%	0.736	S	S	*	*			cis	-156.7	134.2	-1.9	47.5	0	0	0	0	110.2
285	E	37.8	Very low	37.2	Very low	133 Å²	133	126 Å²	126	62%	0.621	72%	0.72	S	S	*	*				64.2	138.4	95	-51.4	135.7	-126.8	0	0	115.8	H283	H283-E285 IonicContact CE1-OE1 2.7Å; H283-E285 IonicContact CG-OE1 2.75Å; H283-E285 IonicContact ND1-OE1 3.75Å; H283-E285 PolarHBondContact ND1-OE1 3.28Å
286	E	34.6	Very low	37.4	Very low	159 Å²	159	127.5 Å²	127.5	74%	0.743	72%	0.72	S	S	*	*			cis	104	174.2	16.9	-77.8	-158	140.2	0	0	117.7	K39	K39-E286 WeakPolarHBondContact CE-OE2 3.37Å; K39-E286 IonicContact NZ-OE2 3.62Å; K39-E286 PolarHBondContact NZ-OE2 2.92Å
287	D	40.2	Very low	37.4	Very low	125 Å²	125	130.2 Å²	130.2	67%	0.668	72%	0.722	S	S	*	*			trans	76.9	145.5	178.3	-60.6	0.2	0	0	0	116.9	K39	K39-D287 IonicContact NZ-OD1 2.61Å; K39-D287 PolarHBondContact NZ-OD1 2.69Å; K39-D287 IonicContact NZ-OD2 3.58Å
288	S	39.6	Very low	37.2	Very low	99 Å²	99	132.2 Å²	132.2	69%	0.692	73%	0.726	S	S	*	*			cis	-168.1	-160.4	-13.2	50.5	0	0	0	0	109.2
289	D	39.7	Very low	37.3	Very low	130 Å²	130	131.7 Å²	131.7	70%	0.695	73%	0.729	S	S	*	*				-150	-134	-85.1	-74.7	-38.1	0	0	0	109.4
290	L	36.8	Very low	37.3	Very low	163 Å²	163	131.8 Å²	131.8	85%	0.853	73%	0.733	S	S	*	*			trans	78.2	115.2	-169.3	-58.9	168.9	0	0	0	114.5
291	E	42.7	Very low	37.4	Very low	163 Å²	163	135.9 Å²	135.9	76%	0.762	74%	0.742	S	S	*	*			cis	79.4	137.1	45.9	-57.6	-55.1	166.9	0	0	112.9
292	E	39.4	Very low	37.6	Very low	168 Å²	168	137.8 Å²	137.8	79%	0.785	74%	0.743	S	S	*	*			cis	-130.3	165.8	-0.1	-90.7	155.1	122.8	0	0	109.5
293	S	38	Very low	37.7	Very low	91 Å²	91	135.2 Å²	135.2	64%	0.636	74%	0.74	S	S	*	*			cis	74.3	143.6	42.1	133	0	0	0	0	115.1
294	D	37.8	Very low	37.7	Very low	150 Å²	150	137.2 Å²	137.2	80%	0.802	75%	0.75	S	S	*	*			cis	179.5	169.2	-27.5	-110.9	-49.7	0	0	0	106.2
295	S	38.2	Very low	37.5	Very low	83 Å²	83	136.9 Å²	136.9	58%	0.58	75%	0.747	S	S	*	*			cis	-169.7	-171.1	-5.3	52.7	0	0	0	0	108.7
296	I	40.3	Very low	37.4	Very low	156 Å²	156	137.1 Å²	137.1	80%	0.8	75%	0.753	S	S	*	*			trans	74	146.3	156.4	-74.3	164.6	0	0	0	117.9
297	D	35.1	Very low	37.4	Very low	145 Å²	145	135.6 Å²	135.6	78%	0.775	75%	0.754	S	S	*	*			cis	-164.2	168.3	-23.5	-168.5	18.8	0	0	0	109.3
298	D	34.4	Very low	37.2	Very low	163 Å²	163	134.5 Å²	134.5	87%	0.872	76%	0.757	S	S	*	*			trans	-88.8	159.2	-170.7	-83.9	-70.1	0	0	0	115.7
299	G	37.4	Very low	37	Very low	74 Å²	74	135.5 Å²	135.5	76%	0.763	76%	0.759	S	S	*	*			trans	-163.5	134.8	170.3	0	0	0	0	0	112.4
300	E	35.4	Very low	36.8	Very low	197 Å²	197	137.6 Å²	137.6	92%	0.921	76%	0.764	S	S	*	*			trans	-99.3	147.2	-169.1	-54.2	-178.2	136.4	0	0	113.2
301	E	37.1	Very low	36.9	Very low	178 Å²	178	138.3 Å²	138.3	83%	0.832	76%	0.763	S	S	*	*				-166.4	137.7	120.2	-108.3	-168	145.2	0	0	115.8
302	L	36.9	Very low	36.6	Very low	148 Å²	148	138.9 Å²	138.9	78%	0.775	77%	0.766	S	S	*	*			trans	18.6	117	147.7	-61.2	172.2	0	0	0	124.1
303	A	35	Very low	36.5	Very low	79 Å²	79	138.5 Å²	138.5	65%	0.653	76%	0.764	S	S	*	*				90.2	136.9	111.9	0	0	0	0	0	123.7
304	Q	37.6	Very low	36.2	Very low	184 Å²	184	142 Å²	142	86%	0.86	78%	0.776	S	S	*	*			trans	65.4	159	156.9	-63.7	165.1	24	0	0	119.2
305	S	32.9	Very low	36.3	Very low	86 Å²	86	142.7 Å²	142.7	60%	0.601	77%	0.772	S	S	*	*				-156.5	163.7	-53	63.4	0	0	0	0	110.9
306	D	36.2	Very low	36.1	Very low	139 Å²	139	143.7 Å²	143.7	74%	0.743	79%	0.785	S	S	*	*			trans	72.4	146.8	154	-56.8	-51.3	0	0	0	123.9
307	T	33.8	Very low	35.9	Very low	126 Å²	126	142.7 Å²	142.7	77%	0.773	79%	0.786	S	S	*	*			trans	69.5	95.3	155.1	45.4	0	0	0	0	122.4
308	S	36.4	Very low	36.2	Very low	103 Å²	103	144.2 Å²	144.2	72%	0.72	79%	0.788	S	S	*	*				94.5	135.6	111.2	-59.2	0	0	0	0	122.4
309	T	36.2	Very low	36.5	Very low	119 Å²	119	143.3 Å²	143.3	73%	0.73	79%	0.788	S	S	*	*			trans	79.1	114.6	153.7	-47.9	0	0	0	0	118.9
310	E	35	Very low	36.8	Very low	174 Å²	174	144 Å²	144	81%	0.813	78%	0.781	S	S	*	*			trans	17.6	138.1	130.4	-41.8	179.1	150	0	0	117.7
311	E	39.3	Very low	37	Very low	178 Å²	178	142.4 Å²	142.4	83%	0.832	78%	0.779	S	S	*	*			cis	-141.5	-143.7	33.3	-66.1	-171.7	107.3	0	0	114.5
312	Q	35.5	Very low	37.4	Very low	176 Å²	176	142.5 Å²	142.5	82%	0.822	78%	0.777	S	S	*	*			trans	-76.5	144.1	-161.8	-55.9	162.6	14.5	0	0	114.7
313	E	37.2	Very low	38	Very low	160 Å²	160	145 Å²	145	75%	0.748	78%	0.781	S	S	*	*				-169.1	145.1	128.8	-118	-171	-152.2	0	0	113.7	K315	E313-K315 PolarHBondContact O-N 3.41Å; E313-K315 IonicContact OE2-NZ 2.77Å; E313-K315 PolarHBondContact OE2-NZ 2.82Å
314	D	33.5	Very low	38.8	Very low	165 Å²	165	151 Å²	151	88%	0.882	79%	0.793	S	S	*	*			trans	-77.4	107.9	-176.9	-76.9	-68	0	0	0	113.9
315	K	39.6	Very low	39.5	Very low	164 Å²	164	153.7 Å²	153.7	71%	0.713	80%	0.795	S	S	*	*			trans	-134.3	134.3	164.4	-64.7	-171.8	178	77.7	0	112.4	E313 V317	E313-K315 PolarHBondContact O-N 3.41Å; E313-K315 IonicContact OE2-NZ 2.77Å; E313-K315 PolarHBondContact OE2-NZ 2.82Å; K315-V317 PolarHBondContact O-N 3.14Å
316	A	33.7	Very low	40.5	Very low	103 Å²	103	159.1 Å²	159.1	85%	0.851	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-73.9	118.9	-163.9	0	0	0	0	0	113.8	Q318	A316-Q318 PolarHBondContact O-N 2.97Å
317	V	36.4	Very low	41.6	Very low	135 Å²	135	160.1 Å²	160.1	82%	0.818	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-74.7	119.2	178.3	-179.9	0	0	0	0	111.2	K315 V319	K315-V317 PolarHBondContact O-N 3.14Å; V317-V319 PolarHBondContact O-N 2.9Å
318	Q	40.5	Very low	43	Very low	177 Å²	177	159.4 Å²	159.4	83%	0.827	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-67.2	127.2	170.6	-60.5	-178.5	8.8	0	0	110.1	A316 S320	A316-Q318 PolarHBondContact O-N 2.97Å; Q318-S320 VanDerWaalsContact C-N 3.27Å; Q318-S320 PolarHBondContact O-N 3.19Å
319	V	41.3	Very low	44.3	Very low	145 Å²	145	157.7 Å²	157.7	88%	0.879	80%	0.798	S	S	*	*			trans	-77.6	78.5	179.9	-174.1	0	0	0	0	110.1	V317	V317-V319 PolarHBondContact O-N 2.9Å
320	S	42.7	Very low	46	Very low	88 Å²	88	154.3 Å²	154.3	62%	0.615	78%	0.775	S	S	*	*			trans	-65.1	138.1	172.3	63.6	0	0	0	0	110.5	Q318 K322	Q318-S320 VanDerWaalsContact C-N 3.27Å; Q318-S320 PolarHBondContact O-N 3.19Å; S320-K322 VanDerWaalsContact C-N 3.26Å; S320-K322 PolarHBondContact O-N 3.25Å
321	N	39.7	Very low	48	Very low	163 Å²	163	147.7 Å²	147.7	87%	0.872	75%	0.747	S	S	*	*			trans	-82.7	68.1	-164.2	-151.7	-8.2	0	0	0	111.3	K323	N321-K323 PolarHBondContact O-N 3.39Å
322	K	45.7	Very low	49.8	Very low	181 Å²	181	145 Å²	145	79%	0.787	74%	0.738	S	S	*	*			trans	-52.3	108.4	-178.3	-80.3	-175.9	175.5	176.4	0	110.5	S320 K324	S320-K322 VanDerWaalsContact C-N 3.26Å; S320-K322 PolarHBondContact O-N 3.25Å; K322-K324 PolarHBondContact O-N 2.93Å
323	K	49.9	Very low	52	Low	200 Å²	200	141.2 Å²	141.2	87%	0.87	72%	0.721	S	S	*	*			trans	-50	113.4	171.8	-68	170.3	-177.2	164.1	0	108	N321 R325	N321-K323 PolarHBondContact O-N 3.39Å; K323-R325 PolarHBondContact O-N 3.25Å
324	K	51.7	Low	54.3	Low	205 Å²	205	134.5 Å²	134.5	89%	0.891	69%	0.694	S	S	*	*			trans	-54.6	114.7	179.3	-70	-171.1	176	-171.9	0	108.8	K322 K326	K322-K324 PolarHBondContact O-N 2.93Å; K324-K326 PolarHBondContact O-N 3.07Å
325	R	52.1	Low	57.1	Low	240 Å²	240	129.4 Å²	129.4	91%	0.906	66%	0.664	S	S	*	*	P	Polyproline II helix	trans	-54.1	129.9	174.8	-61.9	178.7	93.1	174	6.2	107.1	K323 L327	K323-R325 PolarHBondContact O-N 3.25Å; R325-L327 PolarHBondContact O-N 3.08Å; R325-L327 VanDerWaalsContact O-N 3.16Å
326	K	54.6	Low	59.6	Low	200 Å²	200	121.8 Å²	121.8	87%	0.87	63%	0.631	S	S	*	*	P	Polyproline II helix	trans	-63	119.4	173.5	-69.5	-176.2	-179.7	-178.7	0	107	K324	K324-K326 PolarHBondContact O-N 3.07Å
327	L	58.2	Low	62.4	Low	160 Å²	160	116.9 Å²	116.9	84%	0.838	59%	0.59	S	S	*	*	P	Polyproline II helix	trans	-60.1	144.8	165.8	-71.2	160.4	0	0	0	108.4	R325	R325-L327 PolarHBondContact O-N 3.08Å; R325-L327 VanDerWaalsContact O-N 3.16Å
328	P	63.1	Low	65.1	Low	112 Å²	112	113 Å²	113	73%	0.727	56%	0.563	S	S	*	*	P	Polyproline II helix	trans	-59.3	148.5	173.2	27.5	-34.6	0	0	0	110	D330	P328-D330 PolarHBondContact O-N 3.33Å
329	S	63.7	Low	67.7	Low	67 Å²	67	104.6 Å²	104.6	47%	0.469	52%	0.524	S	S	.	.			trans	-90.1	99.6	-178.8	51.4	0	0	0	0	111.3	V331 N332	S329-V331 PolarHBondContact O-N 3.06Å; S329-N332 PolarHBondContact O-N 2.84Å; S329-N332 PolarHBondContact OG-OD1 2.9Å
330	D	72.8	Confident	70.1	Confident	47 Å²	47	102.6 Å²	102.6	25%	0.251	50%	0.5	S	S	.	.	G	3₁₀ helix	trans	-45.8	-23.1	171.2	-70.7	-85.7	0	0	0	114.5	P328 N332 E333 T336 K362 Q382	P328-D330 PolarHBondContact O-N 3.33Å; D330-N332 VanDerWaalsContact C-N 3.26Å; D330-N332 PolarHBondContact O-N 2.83Å; D330-E333 PolarHBondContact O-N 2.76Å; D330-T336 HydrophobicContact CB-CG2 3.87Å; D330-K362 IonicContact OD1-NZ 3.2Å; D330-K362 PolarHBondContact OD1-NZ 3.37Å; D330-Q382 PolarHBondContact OD1-NE2 3.34Å; D330-Q382 PolarHBondContact OD1-OE1 2.95Å
331	V	76	Confident	72.4	Confident	36 Å²	36	102.3 Å²	102.3	22%	0.218	49%	0.492	C	S	.	.	G	3₁₀ helix	trans	-58.7	-33.6	-176.6	-174.9	0	0	0	0	113.5	S329 E333 G334 T336 A417 T419	S329-V331 PolarHBondContact O-N 3.06Å; V331-E333 PolarHBondContact O-N 2.97Å; V331-E333 VanDerWaalsContact O-N 3.13Å; V331-G334 PolarHBondContact O-N 3.49Å; V331-G334 VanDerWaalsContact O-N 3.17Å; V331-T336 WeakPolarHBondContact CA-OG1 3.34Å; V331-A417 HydrophobicContact CG1-CB 4.24Å; V331-A417 VanDerWaalsContact CG1-O 3.23Å; V331-A417 WeakPolarHBondContact CG1-O 3.49Å; V331-A417 HydrophobicContact CG2-CB 4.42Å; V331-T419 HydrophobicContact CB-CG2 4.3Å; V331-T419 HydrophobicContact CG1-CG2 4.09Å
332	N	78	Confident	74.9	Confident	122 Å²	122	94.8 Å²	94.8	65%	0.652	45%	0.451	S	S	*	.	G	3₁₀ helix	trans	-67.4	-16.8	-173.2	-62.4	15.1	0	0	0	113.1	S329 D330	S329-N332 PolarHBondContact O-N 2.84Å; S329-N332 PolarHBondContact OG-OD1 2.9Å; D330-N332 VanDerWaalsContact C-N 3.26Å; D330-N332 PolarHBondContact O-N 2.83Å
333	E	82.4	Confident	77.1	Confident	96 Å²	96	86.5 Å²	86.5	45%	0.449	42%	0.417	S	S	.	.	G	3₁₀ helix	trans	-84.4	-5.4	179.1	-62.7	-178.9	-142.8	0	0	113.5	D330 V331 K335	D330-E333 PolarHBondContact O-N 2.76Å; V331-E333 PolarHBondContact O-N 2.97Å; V331-E333 VanDerWaalsContact O-N 3.13Å; E333-K335 HydrophobicContact CB-CD 4.08Å; E333-K335 HydrophobicContact CB-CG 4.14Å; E333-K335 PolarHBondContact O-N 2.9Å; E333-K335 WeakPolarHBondContact OE2-CD 3.17Å; E333-K335 VanDerWaalsContact OE2-CE 3.28Å; E333-K335 WeakPolarHBondContact OE2-CE 3.49Å; E333-K335 IonicContact OE2-NZ 2.68Å; E333-K335 PolarHBondContact OE2-NZ 2.9Å
334	G	85.4	Confident	79.2	Confident	18 Å²	18	82.8 Å²	82.8	19%	0.186	40%	0.401	C	S	.	.	S	Bend	trans	68.2	0.5	-178.1	0	0	0	0	0	115.4	V331	V331-G334 PolarHBondContact O-N 3.49Å; V331-G334 VanDerWaalsContact O-N 3.17Å
335	K	90.9	Very high	81	Confident	58 Å²	58	79 Å²	79	25%	0.252	39%	0.39	S	S	.	.			trans	-79.7	-15.3	179.6	-65.2	173.5	-174.5	167.7	0	114.4	E333 Q382 F383 M384 Q386	E333-K335 HydrophobicContact CB-CD 4.08Å; E333-K335 HydrophobicContact CB-CG 4.14Å; E333-K335 PolarHBondContact O-N 2.9Å; E333-K335 WeakPolarHBondContact OE2-CD 3.17Å; E333-K335 VanDerWaalsContact OE2-CE 3.28Å; E333-K335 WeakPolarHBondContact OE2-CE 3.49Å; E333-K335 IonicContact OE2-NZ 2.68Å; E333-K335 PolarHBondContact OE2-NZ 2.9Å; K335-Q382 HydrophobicContact CB-CG 4.35Å; K335-F383 WeakPolarHBondContact CB-O 3.47Å; K335-F383 PolarHBondContact O-N 3.01Å; K335-M384 WeakPolarHBondContact CD-O 3.39Å; K335-M384 WeakPolarHBondContact CE-O 3.42Å; K335-Q386 HydrophobicContact CG-CB 4.37Å
336	T	92.3	Very high	82.7	Confident	4 Å²	4	67.8 Å²	67.8	3%	0.025	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	129.3	-177.9	52.9	0	0	0	0	111.6	D330 V331 A381 Q382 A417	D330-T336 HydrophobicContact CB-CG2 3.87Å; V331-T336 WeakPolarHBondContact CA-OG1 3.34Å; T336-A381 CarbonylContact C-O 3.51Å; T336-A381 VanDerWaalsContact CA-O 3.3Å; T336-A381 WeakPolarHBondContact CA-O 3.25Å; T336-Q382 HydrophobicContact CG2-CB 3.91Å; T336-Q382 HydrophobicContact CG2-CG 3.72Å; T336-A417 VanDerWaalsContact O-CB 3.28Å; T336-A417 WeakPolarHBondContact O-CB 3.44Å; T336-A417 PolarHBondContact O-N 3.42Å; T336-A417 WeakPolarHBondContact OG1-CB 3.46Å
337	V	93.2	Very high	84.4	Confident	0 Å²	0	64.2 Å²	64.2	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	142.9	179.7	-113.5	0	0	0	0	110.1	F380 A381 F383 A389 L393 V414 D415	V337-F380 WeakPolarHBondContact O-CA 3.48Å; V337-A381 PolarHBondContact N-O 2.94Å; V337-A381 PolarHBondContact O-N 3.42Å; V337-F383 HydrophobicContact CG2-CD2 3.66Å; V337-F383 HydrophobicContact CG2-CE2 3.6Å; V337-A389 HydrophobicContact CG2-CB 4.07Å; V337-L393 HydrophobicContact CG1-CD1 3.86Å; V337-L393 HydrophobicContact CG1-CG 3.95Å; V337-V414 HydrophobicContact CB-CG1 3.91Å; V337-V414 HydrophobicContact CG1-CG1 3.48Å; V337-V414 VanDerWaalsContact CG1-CG1 3.48Å; V337-D415 WeakPolarHBondContact CG1-O 3.47Å
338	F	93.8	Very high	86	Confident	55 Å²	55	61 Å²	61	24%	0.241	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	123.6	-179.5	178.6	-126.4	0	0	0	109.5	R340 C378 A379 F380 V414 D415 A417	F338-R340 HydrophobicContact CD1-CG 4Å; F338-R340 HydrophobicContact CE1-CG 3.6Å; F338-R340 HydrophobicContact CZ-CG 4.02Å; F338-C378 HydrophobicContact CE2-CB 3.86Å; F338-C378 HydrophobicContact CZ-CB 4.06Å; F338-A379 VanDerWaalsContact CD2-O 3.3Å; F338-A379 WeakPolarHBondContact CD2-O 3.4Å; F338-F380 HydrophobicContact CB-CD1 4.09Å; F338-F380 HydrophobicContact CB-CE1 3.93Å; F338-F380 AromaticContact CD2-CD1 3.73Å; F338-F380 HydrophobicContact CD2-CD1 3.73Å; F338-F380 HydrophobicContact CD2-CD2 4.29Å; F338-F380 AromaticContact CD2-CE1 3.34Å; F338-F380 HydrophobicContact CD2-CE1 3.34Å; F338-F380 AromaticContact CD2-CE2 3.94Å; F338-F380 HydrophobicContact CD2-CE2 3.94Å; F338-F380 HydrophobicContact CD2-CG 4.2Å; F338-F380 AromaticContact CD2-CZ 3.46Å; F338-F380 HydrophobicContact CD2-CZ 3.46Å; F338-F380 VanDerWaalsContact CD2-CZ 3.46Å; F338-F380 HydrophobicContact CE2-CE1 4.08Å; F338-F380 AromaticContact CE2-CE2 3.97Å; F338-F380 HydrophobicContact CE2-CE2 3.97Å; F338-F380 AromaticContact CE2-CZ 3.69Å; F338-F380 HydrophobicContact CE2-CZ 3.69Å; F338-F380 HydrophobicContact CG-CD1 4.33Å; F338-F380 AromaticContact CG-CE1 3.87Å; F338-F380 HydrophobicContact CG-CE1 3.87Å; F338-F380 HydrophobicContact CG-CZ 4.3Å; F338-V414 WeakPolarHBondContact O-CA 3.2Å; F338-D415 PolarHBondContact N-O 2.92Å; F338-D415 PolarHBondContact O-N 2.88Å; F338-A417 HydrophobicContact CB-CB 4.35Å
339	I	93.3	Very high	87.3	Confident	0 Å²	0	63 Å²	63	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	130.9	-171.3	-53.6	-178	0	0	0	108.2	L342 L351 L355 C378 A379 A381 L412 V414	I339-L342 HydrophobicContact CB-CD1 4.47Å; I339-L342 HydrophobicContact CG2-CD1 4.07Å; I339-L342 HydrophobicContact CG2-CD2 4.27Å; I339-L342 HydrophobicContact CG2-CG 4.09Å; I339-L351 HydrophobicContact CD1-CD1 4.01Å; I339-L351 HydrophobicContact CD1-CD2 4.41Å; I339-L355 HydrophobicContact CD1-CD1 3.59Å; I339-L355 HydrophobicContact CD1-CD2 3.9Å; I339-L355 HydrophobicContact CD1-CG 4.28Å; I339-C378 CarbonylContact O-C 3.56Å; I339-C378 WeakPolarHBondContact O-CA 3.45Å; I339-C378 WeakPolarHBondContact O-CB 3.28Å; I339-A379 HydrophobicContact CB-CB 4.49Å; I339-A379 PolarHBondContact N-O 3.35Å; I339-A379 PolarHBondContact O-N 2.89Å; I339-A381 HydrophobicContact CD1-CB 4.46Å; I339-L412 HydrophobicContact CG2-CB 4.27Å; I339-L412 HydrophobicContact CG2-CD1 4.11Å; I339-V414 HydrophobicContact CG1-CG1 4.37Å; I339-V414 HydrophobicContact CG1-CG2 4.21Å; I339-V414 HydrophobicContact CG2-CG2 4.43Å
340	R	92.3	Very high	88.6	Confident	102 Å²	102	63.7 Å²	63.7	39%	0.385	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	156.3	-178.4	-57.1	-174.5	-80.8	169.3	-3.8	110.3	F338 K413 D415	F338-R340 HydrophobicContact CD1-CG 4Å; F338-R340 HydrophobicContact CE1-CG 3.6Å; F338-R340 HydrophobicContact CZ-CG 4.02Å; R340-K413 HydrophobicContact CB-CB 4.27Å; R340-K413 PolarHBondContact N-O 2.91Å; R340-K413 PolarHBondContact O-N 3.27Å; R340-D415 IonicContact CZ-OD1 2.83Å; R340-D415 IonicContact CZ-OD2 2.68Å; R340-D415 IonicContact NE-OD2 3.51Å; R340-D415 PolarHBondContact NE-OD2 3.12Å; R340-D415 IonicContact NH2-OD1 3.5Å; R340-D415 PolarHBondContact NH2-OD1 3.4Å; R340-D415 IonicContact NH2-OD2 2.7Å; R340-D415 PolarHBondContact NH2-OD2 3.07Å
341	N	92.2	Very high	89.5	Confident	82 Å²	82	61.4 Å²	61.4	44%	0.439	30%	0.299	S	S	.	.	S	Bend	trans	71	29.3	176.8	-160.2	63.3	0	0	0	115	G377 Q411	N341-G377 PolarHBondContact N-O 3.35Å; N341-Q411 PolarHBondContact ND2-O 2.97Å
342	L	92	Very high	90.3	Very high	5 Å²	5	60.4 Å²	60.4	3%	0.026	30%	0.296	C	S	.	.			trans	-63.5	171.3	164.7	-68.1	155.3	0	0	0	110.7	I339 L351 G377 A379 L407 R410 L412	I339-L342 HydrophobicContact CB-CD1 4.47Å; I339-L342 HydrophobicContact CG2-CD1 4.07Å; I339-L342 HydrophobicContact CG2-CD2 4.27Å; I339-L342 HydrophobicContact CG2-CG 4.09Å; L342-L351 HydrophobicContact CD1-CD2 3.95Å; L342-L351 HydrophobicContact CD2-CD1 3.87Å; L342-L351 HydrophobicContact CD2-CD2 4Å; L342-L351 HydrophobicContact CD2-CG 4.46Å; L342-G377 PolarHBondContact N-O 2.92Å; L342-A379 HydrophobicContact CD1-CB 3.52Å; L342-L407 HydrophobicContact CD2-CD2 3.68Å; L342-R410 PolarHBondContact O-NH1 3.46Å; L342-L412 HydrophobicContact CD2-CD1 4.08Å; L342-L412 HydrophobicContact CD2-CD2 3.61Å; L342-L412 HydrophobicContact CG-CD2 3.99Å
343	S	92.2	Very high	90.9	Very high	8 Å²	8	62.2 Å²	62.2	6%	0.056	30%	0.3	C	S	.	.			trans	-71.5	172.3	162.2	-149.3	0	0	0	0	110.9	D345 S346 D408 R410	S343-D345 VanDerWaalsContact C-N 3.28Å; S343-D345 PolarHBondContact OG-OD2 2.98Å; S343-S346 VanDerWaalsContact CA-OG 3.32Å; S343-S346 WeakPolarHBondContact CA-OG 3.23Å; S343-S346 WeakPolarHBondContact CB-OG 3.49Å; S343-S346 PolarHBondContact N-OG 3.22Å; S343-D408 WeakPolarHBondContact CB-OD2 3.26Å; S343-R410 PolarHBondContact OG-NE 3.29Å; S343-R410 PolarHBondContact OG-NH2 2.82Å
344	F	92.4	Very high	91.2	Very high	122 Å²	122	59.2 Å²	59.2	54%	0.535	29%	0.287	S	S	.	.	S	Bend	trans	-82.9	-20.3	167.7	-60	-56.4	0	0	0	111.2	S375	F344-S375 WeakPolarHBondContact CD1-O 3.41Å; F344-S375 WeakPolarHBondContact O-CB 3.49Å; F344-S375 PolarHBondContact O-OG 3.2Å
345	D	89.7	Confident	91.5	Very high	124 Å²	124	58.4 Å²	58.4	66%	0.663	28%	0.279	S	S	*	.	S	Bend	trans	-101.9	-10.2	-171.8	-23.5	-89.2	0	0	0	112	S343	S343-D345 VanDerWaalsContact C-N 3.28Å; S343-D345 PolarHBondContact OG-OD2 2.98Å
346	S	89	Confident	91.5	Very high	6 Å²	6	60.3 Å²	60.3	4%	0.042	29%	0.288	C	S	.	.			trans	-67.1	139.1	176.5	-31.3	0	0	0	0	110.7	S343 E350 I366 D408	S343-S346 VanDerWaalsContact CA-OG 3.32Å; S343-S346 WeakPolarHBondContact CA-OG 3.23Å; S343-S346 WeakPolarHBondContact CB-OG 3.49Å; S343-S346 PolarHBondContact N-OG 3.22Å; S346-E350 VanDerWaalsContact CA-OE2 3.26Å; S346-E350 WeakPolarHBondContact CA-OE2 3.42Å; S346-I366 VanDerWaalsContact O-CD1 3.23Å; S346-I366 WeakPolarHBondContact O-CD1 3.37Å; S346-D408 WeakPolarHBondContact CB-OD2 3.25Å; S346-D408 PolarHBondContact OG-OD2 3.29Å
347	E	90	Very high	91.4	Very high	125 Å²	125	66.1 Å²	66.1	58%	0.584	32%	0.315	S	S	*	.			trans	-99.4	171.4	-179.3	-60.8	-156.9	166.4	0	0	113.2	E349 E350 L351	E347-E349 VanDerWaalsContact C-N 3.33Å; E347-E350 PolarHBondContact N-OE2 2.87Å; E347-L351 PolarHBondContact O-N 2.86Å
348	E	91.6	Very high	91.2	Very high	92 Å²	92	67.9 Å²	67.9	43%	0.43	32%	0.323	S	S	.	.	H	α-helix	trans	-72.2	-29.4	-177	-167.9	161.8	122.2	0	0	112.3	G352 V364 R365 I366	E348-G352 PolarHBondContact O-N 2.73Å; E348-V364 HydrophobicContact CG-CB 3.73Å; E348-V364 HydrophobicContact CG-CG1 3.83Å; E348-V364 VanDerWaalsContact OE1-O 3.1Å; E348-R365 VanDerWaalsContact OE2-CA 3.28Å; E348-R365 WeakPolarHBondContact OE2-CA 3.35Å; E348-I366 PolarHBondContact OE2-N 3.13Å
349	E	91.2	Very high	91.1	Very high	154 Å²	154	66.3 Å²	66.3	72%	0.72	32%	0.323	S	S	*	.	H	α-helix	trans	-69.3	-50.1	-179.9	-57.8	-172.5	173.6	0	0	111.4	E347 L351 G352 E353	E347-E349 VanDerWaalsContact C-N 3.33Å; E349-L351 VanDerWaalsContact C-N 3.27Å; E349-L351 PolarHBondContact O-N 3.09Å; E349-G352 CarbonylContact O-C 3.54Å; E349-G352 WeakPolarHBondContact O-CA 3.42Å; E349-G352 PolarHBondContact O-N 2.84Å; E349-E353 PolarHBondContact O-N 2.75Å
350	E	90.4	Very high	91	Very high	81 Å²	81	72.4 Å²	72.4	38%	0.379	35%	0.351	S	S	.	.	H	α-helix	trans	-57.2	-40.3	176.6	-52.4	175.3	128.1	0	0	112.2	S346 E347 L354 L407	S346-E350 VanDerWaalsContact CA-OE2 3.26Å; S346-E350 WeakPolarHBondContact CA-OE2 3.42Å; E347-E350 PolarHBondContact N-OE2 2.87Å; E350-L354 PolarHBondContact O-N 3.48Å; E350-L407 HydrophobicContact CB-CD1 4.3Å
351	L	91.6	Very high	91	Very high	0 Å²	0	69.3 Å²	69.3	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-72.6	-32.8	176.3	-175.9	56.8	0	0	0	111.7	I339 L342 E347 E349 L355 V364 A379 L412	I339-L351 HydrophobicContact CD1-CD1 4.01Å; I339-L351 HydrophobicContact CD1-CD2 4.41Å; L342-L351 HydrophobicContact CD1-CD2 3.95Å; L342-L351 HydrophobicContact CD2-CD1 3.87Å; L342-L351 HydrophobicContact CD2-CD2 4Å; L342-L351 HydrophobicContact CD2-CG 4.46Å; E347-L351 PolarHBondContact O-N 2.86Å; E349-L351 VanDerWaalsContact C-N 3.27Å; E349-L351 PolarHBondContact O-N 3.09Å; L351-L355 HydrophobicContact CD1-CD1 3.91Å; L351-L355 HydrophobicContact CD1-CG 4.18Å; L351-L355 HydrophobicContact CG-CD1 3.9Å; L351-L355 WeakPolarHBondContact O-CB 3.15Å; L351-L355 WeakPolarHBondContact O-CD1 3.33Å; L351-L355 WeakPolarHBondContact O-CG 3.38Å; L351-L355 PolarHBondContact O-N 3.39Å; L351-V364 HydrophobicContact CB-CG1 4.38Å; L351-V364 HydrophobicContact CD2-CG1 3.77Å; L351-V364 HydrophobicContact CG-CG1 3.98Å; L351-A379 HydrophobicContact CD2-CB 3.53Å; L351-L412 HydrophobicContact CD1-CD1 4.19Å
352	G	91.7	Very high	90.9	Very high	15 Å²	15	70.8 Å²	70.8	16%	0.155	35%	0.345	C	S	.	.	H	α-helix	trans	-61.1	-53.3	171.6	0	0	0	0	0	112	E348 E349 L354 L355 Q356 L361	E348-G352 PolarHBondContact O-N 2.73Å; E349-G352 CarbonylContact O-C 3.54Å; E349-G352 WeakPolarHBondContact O-CA 3.42Å; E349-G352 PolarHBondContact O-N 2.84Å; G352-L354 VanDerWaalsContact C-N 3.35Å; G352-L354 PolarHBondContact O-N 3.15Å; G352-L355 PolarHBondContact O-N 3.06Å; G352-L355 VanDerWaalsContact O-N 3.09Å; G352-Q356 WeakPolarHBondContact O-CB 3.3Å; G352-Q356 PolarHBondContact O-N 2.85Å; G352-L361 WeakPolarHBondContact O-CD1 3.41Å
353	E	91.3	Very high	90.9	Very high	159 Å²	159	74.6 Å²	74.6	74%	0.743	36%	0.359	S	S	*	.	H	α-helix	trans	-56.1	-46.8	177.8	-67.9	-171.1	165.4	0	0	112	E349 L355 Q356	E349-E353 PolarHBondContact O-N 2.75Å; E353-L355 PolarHBondContact O-N 2.81Å; E353-Q356 PolarHBondContact O-N 2.85Å
354	L	89.5	Confident	91	Very high	34 Å²	34	74.9 Å²	74.9	18%	0.178	36%	0.361	C	S	.	.	H	α-helix	trans	-64.1	-25.6	179.5	-175.4	64.5	0	0	0	113.2	E350 G352 Q357 L405 L407 L412	E350-L354 PolarHBondContact O-N 3.48Å; G352-L354 VanDerWaalsContact C-N 3.35Å; G352-L354 PolarHBondContact O-N 3.15Å; L354-Q357 PolarHBondContact O-NE2 3.09Å; L354-L405 HydrophobicContact CD1-CD2 4.09Å; L354-L405 HydrophobicContact CG-CD2 4.24Å; L354-L407 HydrophobicContact CB-CD1 4.46Å; L354-L407 HydrophobicContact CD2-CB 4.14Å; L354-L407 HydrophobicContact CD2-CD1 3.85Å; L354-L412 HydrophobicContact CD2-CD1 3.76Å
355	L	91	Very high	91	Very high	1 Å²	1	77.2 Å²	77.2	1%	0.005	37%	0.366	C	S	.	.	H	α-helix	trans	-94.8	-32.1	-178.8	-69.9	171.8	0	0	0	113.3	I339 L351 G352 E353 Q357 F358 L361 V364 A381 F383 C392	I339-L355 HydrophobicContact CD1-CD1 3.59Å; I339-L355 HydrophobicContact CD1-CD2 3.9Å; I339-L355 HydrophobicContact CD1-CG 4.28Å; L351-L355 HydrophobicContact CD1-CD1 3.91Å; L351-L355 HydrophobicContact CD1-CG 4.18Å; L351-L355 HydrophobicContact CG-CD1 3.9Å; L351-L355 WeakPolarHBondContact O-CB 3.15Å; L351-L355 WeakPolarHBondContact O-CD1 3.33Å; L351-L355 WeakPolarHBondContact O-CG 3.38Å; L351-L355 PolarHBondContact O-N 3.39Å; G352-L355 PolarHBondContact O-N 3.06Å; G352-L355 VanDerWaalsContact O-N 3.09Å; E353-L355 PolarHBondContact O-N 2.81Å; L355-Q357 PolarHBondContact O-N 3.23Å; L355-Q357 VanDerWaalsContact O-N 3.11Å; L355-F358 WeakPolarHBondContact O-CD2 3.31Å; L355-F358 PolarHBondContact O-N 3.02Å; L355-L361 HydrophobicContact CB-CD1 3.84Å; L355-L361 HydrophobicContact CB-CD2 4.12Å; L355-L361 HydrophobicContact CB-CG 4.49Å; L355-V364 HydrophobicContact CD1-CG2 4.39Å; L355-A381 HydrophobicContact CD1-CB 3.64Å; L355-F383 HydrophobicContact CB-CZ 4.1Å; L355-F383 HydrophobicContact CD2-CZ 4.29Å; L355-F383 WeakPolarHBondContact O-CE1 3.46Å; L355-C392 WeakPolarHBondContact CD2-SG 3.32Å
356	Q	91.6	Very high	91.2	Very high	97 Å²	97	72.5 Å²	72.5	45%	0.453	34%	0.341	S	S	.	.	H	α-helix	trans	-58.8	-26.2	-177.4	-173.1	68.9	8.8	0	0	112.5	G352 E353 F358 G359 L361	G352-Q356 WeakPolarHBondContact O-CB 3.3Å; G352-Q356 PolarHBondContact O-N 2.85Å; E353-Q356 PolarHBondContact O-N 2.85Å; Q356-F358 PolarHBondContact O-N 3.15Å; Q356-F358 VanDerWaalsContact O-N 3.15Å; Q356-G359 PolarHBondContact O-N 2.85Å; Q356-G359 VanDerWaalsContact O-N 3.14Å; Q356-L361 HydrophobicContact CB-CD1 4.29Å
357	Q	89.3	Confident	91.4	Very high	126 Å²	126	74.1 Å²	74.1	59%	0.589	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-20.7	173.9	75.7	-177.5	-55.5	0	0	114.4	L354 L355	L354-Q357 PolarHBondContact O-NE2 3.09Å; L355-Q357 PolarHBondContact O-N 3.23Å; L355-Q357 VanDerWaalsContact O-N 3.11Å
358	F	89.9	Confident	91.5	Very high	37 Å²	37	72.2 Å²	72.2	16%	0.162	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.7	-14.7	178.6	-58.2	-67.1	0	0	0	113.5	L355 Q356 F383 A388 K391 C392 A395 L405	L355-F358 WeakPolarHBondContact O-CD2 3.31Å; L355-F358 PolarHBondContact O-N 3.02Å; Q356-F358 PolarHBondContact O-N 3.15Å; Q356-F358 VanDerWaalsContact O-N 3.15Å; F358-F383 HydrophobicContact CB-CE1 4.22Å; F358-F383 HydrophobicContact CB-CZ 4.24Å; F358-A388 WeakPolarHBondContact O-CA 3.37Å; F358-A388 VanDerWaalsContact O-CB 3.26Å; F358-A388 WeakPolarHBondContact O-CB 3.47Å; F358-K391 HydrophobicContact CB-CB 4.35Å; F358-K391 HydrophobicContact CD1-CB 4.22Å; F358-C392 HydrophobicContact CB-CB 4.24Å; F358-C392 HydrophobicContact CD2-CB 3.99Å; F358-C392 HydrophobicContact CG-CB 4.07Å; F358-A395 HydrophobicContact CD1-CB 4.35Å; F358-A395 HydrophobicContact CE1-CB 3.39Å; F358-A395 HydrophobicContact CE2-CB 4.44Å; F358-A395 HydrophobicContact CZ-CB 3.45Å; F358-A395 VanDerWaalsContact CZ-CB 3.45Å; F358-L405 HydrophobicContact CE2-CD1 4.14Å; F358-L405 HydrophobicContact CE2-CD2 3.81Å; F358-L405 HydrophobicContact CZ-CD2 3.85Å
359	G	90	Very high	91.3	Very high	23 Å²	23	71.9 Å²	71.9	24%	0.237	34%	0.342	C	S	.	.	S	Bend	trans	146.8	173.5	-179.7	0	0	0	0	0	112.4	Q356 F383	Q356-G359 PolarHBondContact O-N 2.85Å; Q356-G359 VanDerWaalsContact O-N 3.14Å; G359-F383 WeakPolarHBondContact O-CD1 3.36Å; G359-F383 WeakPolarHBondContact O-CE1 3.28Å
360	E	92.4	Very high	91.2	Very high	127 Å²	127	69.5 Å²	69.5	59%	0.593	34%	0.34	S	S	*	.			trans	-67.5	133.9	-173.3	-63.8	171.4	169.8	0	0	113.2	F383 M384	E360-F383 CarbonylContact O-C 3.46Å; E360-F383 WeakPolarHBondContact O-CA 3.38Å; E360-M384 HydrophobicContact CB-CB 4.43Å; E360-M384 HydrophobicContact CB-CG 3.97Å; E360-M384 HydrophobicContact CB-SD 4.42Å; E360-M384 PolarHBondContact O-N 2.6Å
361	L	91.6	Very high	90.9	Very high	38 Å²	38	72.5 Å²	72.5	20%	0.199	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	131.4	178.5	-65.4	162.4	0	0	0	111.6	G352 L355 Q356 V364 A381 F383	G352-L361 WeakPolarHBondContact O-CD1 3.41Å; L355-L361 HydrophobicContact CB-CD1 3.84Å; L355-L361 HydrophobicContact CB-CD2 4.12Å; L355-L361 HydrophobicContact CB-CG 4.49Å; Q356-L361 HydrophobicContact CB-CD1 4.29Å; L361-V364 HydrophobicContact CD1-CG2 3.92Å; L361-V364 HydrophobicContact CD2-CG2 4.38Å; L361-A381 HydrophobicContact CD2-CB 4.24Å; L361-F383 HydrophobicContact CD2-CD1 3.73Å; L361-F383 HydrophobicContact CD2-CD2 4.38Å; L361-F383 HydrophobicContact CD2-CE1 3.57Å; L361-F383 HydrophobicContact CD2-CE2 4.23Å; L361-F383 HydrophobicContact CD2-CG 4.16Å; L361-F383 HydrophobicContact CD2-CZ 3.84Å; L361-F383 HydrophobicContact CG-CD1 4.34Å; L361-F383 HydrophobicContact CG-CE1 4.16Å
362	K	90.8	Very high	90.9	Very high	112 Å²	112	76.2 Å²	76.2	49%	0.487	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	-34.5	170.3	174.4	175	158.6	-140	0	111.9	D330 Q382 M384	D330-K362 IonicContact OD1-NZ 3.2Å; D330-K362 PolarHBondContact OD1-NZ 3.37Å; K362-Q382 HydrophobicContact CB-CB 4.41Å; K362-Q382 HydrophobicContact CB-CG 4.35Å; K362-Q382 HydrophobicContact CD-CG 4.45Å; K362-Q382 PolarHBondContact N-O 3.33Å; K362-M384 HydrophobicContact CB-CG 4.35Å
363	Y	92.1	Very high	90.6	Very high	85 Å²	85	83 Å²	83	33%	0.333	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-163	156.6	163.9	63.9	-104.8	0	0	0	110.8	R365 A381 Q382	Y363-R365 HydrophobicContact CD2-CB 4.3Å; Y363-R365 HydrophobicContact CE2-CB 4.5Å; Y363-A381 WeakPolarHBondContact O-CA 3.3Å; Y363-Q382 HydrophobicContact CD1-CB 4.1Å; Y363-Q382 HydrophobicContact CD2-CB 4.44Å; Y363-Q382 HydrophobicContact CE1-CB 3.83Å; Y363-Q382 HydrophobicContact CE2-CB 4.16Å; Y363-Q382 HydrophobicContact CG-CB 4.39Å; Y363-Q382 PolarHBondContact O-N 3.14Å
364	V	93.5	Very high	90.5	Very high	14 Å²	14	82 Å²	82	9%	0.085	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	162.8	156.2	-174.3	0	0	0	0	107.3	E348 L351 L355 L361 F380 A381	E348-V364 HydrophobicContact CG-CB 3.73Å; E348-V364 HydrophobicContact CG-CG1 3.83Å; E348-V364 VanDerWaalsContact OE1-O 3.1Å; L351-V364 HydrophobicContact CB-CG1 4.38Å; L351-V364 HydrophobicContact CD2-CG1 3.77Å; L351-V364 HydrophobicContact CG-CG1 3.98Å; L355-V364 HydrophobicContact CD1-CG2 4.39Å; L361-V364 HydrophobicContact CD1-CG2 3.92Å; L361-V364 HydrophobicContact CD2-CG2 4.38Å; V364-F380 CarbonylContact C-O 3.49Å; V364-A381 HydrophobicContact CG2-CB 4.34Å
365	R	92.2	Very high	90.6	Very high	171 Å²	171	81.4 Å²	81.4	65%	0.645	40%	0.403	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-160.3	112.6	174.7	-168.5	173	-175.6	158.6	8.8	112.9	E348 Y363 A379 F380	E348-R365 VanDerWaalsContact OE2-CA 3.28Å; E348-R365 WeakPolarHBondContact OE2-CA 3.35Å; Y363-R365 HydrophobicContact CD2-CB 4.3Å; Y363-R365 HydrophobicContact CE2-CB 4.5Å; R365-A379 CarbonylContact O-C 3.55Å; R365-A379 VanDerWaalsContact O-CA 3.25Å; R365-A379 WeakPolarHBondContact O-CA 3.29Å; R365-A379 WeakPolarHBondContact O-CB 3.23Å; R365-F380 PolarHBondContact N-O 3.27Å; R365-F380 PolarHBondContact O-N 3.17Å
366	I	94.1	Very high	90.6	Very high	26 Å²	26	85.3 Å²	85.3	13%	0.133	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	138.7	171.4	-59.3	-176.7	0	0	0	110.9	S346 E348 L368 A379	S346-I366 VanDerWaalsContact O-CD1 3.23Å; S346-I366 WeakPolarHBondContact O-CD1 3.37Å; E348-I366 PolarHBondContact OE2-N 3.13Å; I366-L368 HydrophobicContact CG2-CD2 4.06Å; I366-L368 PolarHBondContact O-N 3.04Å; I366-A379 HydrophobicContact CG1-CB 4.27Å
367	V	93.4	Very high	90.6	Very high	39 Å²	39	81 Å²	81	24%	0.236	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	98.4	-178.4	-170.6	0	0	0	0	110.6	K376 C378 F380	V367-K376 HydrophobicContact CG1-CD 4.01Å; V367-K376 WeakPolarHBondContact O-CB 3.37Å; V367-K376 VanDerWaalsContact O-CG 3.25Å; V367-K376 WeakPolarHBondContact O-CG 3.27Å; V367-K376 PolarHBondContact O-N 3.44Å; V367-C378 WeakPolarHBondContact CB-O 3.45Å; V367-C378 WeakPolarHBondContact CG2-O 3.33Å; V367-C378 PolarHBondContact N-O 3.47Å; V367-F380 HydrophobicContact CG2-CD2 3.63Å; V367-F380 HydrophobicContact CG2-CE2 3.66Å
368	L	92.7	Very high	90.8	Very high	86 Å²	86	76.4 Å²	76.4	45%	0.45	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	159.8	178.1	-51.3	-177	0	0	0	113.3	I366 H374 K376	I366-L368 HydrophobicContact CG2-CD2 4.06Å; I366-L368 PolarHBondContact O-N 3.04Å; L368-H374 CarbonylContact C-O 3.51Å; L368-H374 WeakPolarHBondContact CA-O 3.48Å; L368-K376 PolarHBondContact O-NZ 3.38Å
369	H	88	Confident	91	Very high	84 Å²	84	74.7 Å²	74.7	39%	0.389	38%	0.375	S	S	.	.			trans	-74.4	135.2	166.2	-98.2	-89.9	0	0	0	111.4	D371 T372 E373 H374 K376	H369-D371 VanDerWaalsContact C-N 3.29Å; H369-D371 PolarHBondContact O-N 3.35Å; H369-T372 WeakPolarHBondContact CB-OG1 3.4Å; H369-E373 VanDerWaalsContact O-CA 3.25Å; H369-E373 WeakPolarHBondContact O-CA 3.41Å; H369-E373 PolarHBondContact O-N 3.3Å; H369-H374 PolarHBondContact N-O 3.27Å; H369-K376 WeakPolarHBondContact CD2-CG 3.4Å
370	P	87.6	Confident	91.2	Very high	105 Å²	105	77 Å²	77	68%	0.682	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.4	-19.3	-177.1	31.4	-36	0	0	0	113.9
371	D	84.8	Confident	91.3	Very high	143 Å²	143	71 Å²	71	77%	0.765	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.3	-17.6	-175.1	-46.4	-70.8	0	0	0	113.5	H369	H369-D371 VanDerWaalsContact C-N 3.29Å; H369-D371 PolarHBondContact O-N 3.35Å
372	T	90.5	Very high	91.3	Very high	79 Å²	79	69.3 Å²	69.3	49%	0.485	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-132	-5.8	-174.6	64.3	0	0	0	0	113.8	H369 H374	H369-T372 WeakPolarHBondContact CB-OG1 3.4Å; T372-H374 PolarHBondContact O-N 3.37Å; T372-H374 PolarHBondContact O-ND1 2.74Å
373	E	86.6	Confident	91.5	Very high	158 Å²	158	64 Å²	64	74%	0.738	32%	0.319	S	S	*	.			trans	58.5	1.7	-178.3	-61.2	177.6	159.5	0	0	115.5	H369	H369-E373 VanDerWaalsContact O-CA 3.25Å; H369-E373 WeakPolarHBondContact O-CA 3.41Å; H369-E373 PolarHBondContact O-N 3.3Å
374	H	88.2	Confident	91.5	Very high	137 Å²	137	64.7 Å²	64.7	63%	0.634	33%	0.326	S	S	*	.			trans	-73.2	144.3	176.9	-71.5	40.3	0	0	0	112.5	L368 H369 T372	L368-H374 CarbonylContact C-O 3.51Å; L368-H374 WeakPolarHBondContact CA-O 3.48Å; H369-H374 PolarHBondContact N-O 3.27Å; T372-H374 PolarHBondContact O-N 3.37Å; T372-H374 PolarHBondContact O-ND1 2.74Å
375	S	91.8	Very high	91.4	Very high	22 Å²	22	67.5 Å²	67.5	15%	0.154	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-54.3	140	172.7	-57.1	0	0	0	0	113.2	F344	F344-S375 WeakPolarHBondContact CD1-O 3.41Å; F344-S375 WeakPolarHBondContact O-CB 3.49Å; F344-S375 PolarHBondContact O-OG 3.2Å
376	K	91.4	Very high	91.4	Very high	82 Å²	82	64.2 Å²	64.2	36%	0.357	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	2.5	173.5	-70	-176.7	-177.7	120.2	0	114.7	V367 L368 H369 C378	V367-K376 HydrophobicContact CG1-CD 4.01Å; V367-K376 WeakPolarHBondContact O-CB 3.37Å; V367-K376 VanDerWaalsContact O-CG 3.25Å; V367-K376 WeakPolarHBondContact O-CG 3.27Å; V367-K376 PolarHBondContact O-N 3.44Å; L368-K376 PolarHBondContact O-NZ 3.38Å; H369-K376 WeakPolarHBondContact CD2-CG 3.4Å; K376-C378 PolarHBondContact O-N 2.88Å
377	G	91.5	Very high	91.3	Very high	7 Å²	7	68.7 Å²	68.7	7%	0.072	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	67.9	21.8	-169.5	0	0	0	0	0	113.3	N341 L342	N341-G377 PolarHBondContact N-O 3.35Å; L342-G377 PolarHBondContact N-O 2.92Å
378	C	93.9	Very high	91.3	Very high	30 Å²	30	66.9 Å²	66.9	20%	0.203	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	147.3	177.4	-58.2	0	0	0	0	111	F338 I339 V367 K376	F338-C378 HydrophobicContact CE2-CB 3.86Å; F338-C378 HydrophobicContact CZ-CB 4.06Å; I339-C378 CarbonylContact O-C 3.56Å; I339-C378 WeakPolarHBondContact O-CA 3.45Å; I339-C378 WeakPolarHBondContact O-CB 3.28Å; V367-C378 WeakPolarHBondContact CB-O 3.45Å; V367-C378 WeakPolarHBondContact CG2-O 3.33Å; V367-C378 PolarHBondContact N-O 3.47Å; K376-C378 PolarHBondContact O-N 2.88Å
379	A	94.4	Very high	91.2	Very high	0 Å²	0	62.8 Å²	62.8	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	165.2	177.2	0	0	0	0	0	111.6	F338 I339 L342 L351 R365 I366	F338-A379 VanDerWaalsContact CD2-O 3.3Å; F338-A379 WeakPolarHBondContact CD2-O 3.4Å; I339-A379 HydrophobicContact CB-CB 4.49Å; I339-A379 PolarHBondContact N-O 3.35Å; I339-A379 PolarHBondContact O-N 2.89Å; L342-A379 HydrophobicContact CD1-CB 3.52Å; L351-A379 HydrophobicContact CD2-CB 3.53Å; R365-A379 CarbonylContact O-C 3.55Å; R365-A379 VanDerWaalsContact O-CA 3.25Å; R365-A379 WeakPolarHBondContact O-CA 3.29Å; R365-A379 WeakPolarHBondContact O-CB 3.23Å; I366-A379 HydrophobicContact CG1-CB 4.27Å
380	F	94.6	Very high	91.4	Very high	73 Å²	73	63.5 Å²	63.5	32%	0.32	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	139.7	165.8	-68.2	-86.4	0	0	0	109.1	V337 F338 V364 R365 V367 A417	V337-F380 WeakPolarHBondContact O-CA 3.48Å; F338-F380 HydrophobicContact CB-CD1 4.09Å; F338-F380 HydrophobicContact CB-CE1 3.93Å; F338-F380 AromaticContact CD2-CD1 3.73Å; F338-F380 HydrophobicContact CD2-CD1 3.73Å; F338-F380 HydrophobicContact CD2-CD2 4.29Å; F338-F380 AromaticContact CD2-CE1 3.34Å; F338-F380 HydrophobicContact CD2-CE1 3.34Å; F338-F380 AromaticContact CD2-CE2 3.94Å; F338-F380 HydrophobicContact CD2-CE2 3.94Å; F338-F380 HydrophobicContact CD2-CG 4.2Å; F338-F380 AromaticContact CD2-CZ 3.46Å; F338-F380 HydrophobicContact CD2-CZ 3.46Å; F338-F380 VanDerWaalsContact CD2-CZ 3.46Å; F338-F380 HydrophobicContact CE2-CE1 4.08Å; F338-F380 AromaticContact CE2-CE2 3.97Å; F338-F380 HydrophobicContact CE2-CE2 3.97Å; F338-F380 AromaticContact CE2-CZ 3.69Å; F338-F380 HydrophobicContact CE2-CZ 3.69Å; F338-F380 HydrophobicContact CG-CD1 4.33Å; F338-F380 AromaticContact CG-CE1 3.87Å; F338-F380 HydrophobicContact CG-CE1 3.87Å; F338-F380 HydrophobicContact CG-CZ 4.3Å; V364-F380 CarbonylContact C-O 3.49Å; R365-F380 PolarHBondContact N-O 3.27Å; R365-F380 PolarHBondContact O-N 3.17Å; V367-F380 HydrophobicContact CG2-CD2 3.63Å; V367-F380 HydrophobicContact CG2-CE2 3.66Å; F380-A417 HydrophobicContact CD1-CB 4.11Å; F380-A417 HydrophobicContact CE1-CB 4.13Å
381	A	93.6	Very high	91.5	Very high	0 Å²	0	63.5 Å²	63.5	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	142.3	170.3	0	0	0	0	0	109.5	T336 V337 I339 L355 L361 Y363 V364	T336-A381 CarbonylContact C-O 3.51Å; T336-A381 VanDerWaalsContact CA-O 3.3Å; T336-A381 WeakPolarHBondContact CA-O 3.25Å; V337-A381 PolarHBondContact N-O 2.94Å; V337-A381 PolarHBondContact O-N 3.42Å; I339-A381 HydrophobicContact CD1-CB 4.46Å; L355-A381 HydrophobicContact CD1-CB 3.64Å; L361-A381 HydrophobicContact CD2-CB 4.24Å; Y363-A381 WeakPolarHBondContact O-CA 3.3Å; V364-A381 HydrophobicContact CG2-CB 4.34Å
382	Q	92.6	Very high	91.8	Very high	2 Å²	2	56.7 Å²	56.7	1%	0.009	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	119.1	171.5	-171	173.6	33.6	0	0	109.4	D330 K335 T336 K362 Y363	D330-Q382 PolarHBondContact OD1-NE2 3.34Å; D330-Q382 PolarHBondContact OD1-OE1 2.95Å; K335-Q382 HydrophobicContact CB-CG 4.35Å; T336-Q382 HydrophobicContact CG2-CB 3.91Å; T336-Q382 HydrophobicContact CG2-CG 3.72Å; K362-Q382 HydrophobicContact CB-CB 4.41Å; K362-Q382 HydrophobicContact CB-CG 4.35Å; K362-Q382 HydrophobicContact CD-CG 4.45Å; K362-Q382 PolarHBondContact N-O 3.33Å; Y363-Q382 HydrophobicContact CD1-CB 4.1Å; Y363-Q382 HydrophobicContact CD2-CB 4.44Å; Y363-Q382 HydrophobicContact CE1-CB 3.83Å; Y363-Q382 HydrophobicContact CE2-CB 4.16Å; Y363-Q382 HydrophobicContact CG-CB 4.39Å; Y363-Q382 PolarHBondContact O-N 3.14Å
383	F	94	Very high	91.7	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	157.5	168.8	-72.5	-83.1	0	0	0	110.9	K335 V337 L355 F358 G359 E360 L361 T385 A388 A389 C392	K335-F383 WeakPolarHBondContact CB-O 3.47Å; K335-F383 PolarHBondContact O-N 3.01Å; V337-F383 HydrophobicContact CG2-CD2 3.66Å; V337-F383 HydrophobicContact CG2-CE2 3.6Å; L355-F383 HydrophobicContact CB-CZ 4.1Å; L355-F383 HydrophobicContact CD2-CZ 4.29Å; L355-F383 WeakPolarHBondContact O-CE1 3.46Å; F358-F383 HydrophobicContact CB-CE1 4.22Å; F358-F383 HydrophobicContact CB-CZ 4.24Å; G359-F383 WeakPolarHBondContact O-CD1 3.36Å; G359-F383 WeakPolarHBondContact O-CE1 3.28Å; E360-F383 CarbonylContact O-C 3.46Å; E360-F383 WeakPolarHBondContact O-CA 3.38Å; L361-F383 HydrophobicContact CD2-CD1 3.73Å; L361-F383 HydrophobicContact CD2-CD2 4.38Å; L361-F383 HydrophobicContact CD2-CE1 3.57Å; L361-F383 HydrophobicContact CD2-CE2 4.23Å; L361-F383 HydrophobicContact CD2-CG 4.16Å; L361-F383 HydrophobicContact CD2-CZ 3.84Å; L361-F383 HydrophobicContact CG-CD1 4.34Å; L361-F383 HydrophobicContact CG-CE1 4.16Å; F383-T385 WeakPolarHBondContact CB-O 3.39Å; F383-A388 HydrophobicContact CB-CB 3.91Å; F383-A388 HydrophobicContact CD1-CB 3.48Å; F383-A388 VanDerWaalsContact CD1-CB 3.48Å; F383-A388 HydrophobicContact CE1-CB 4.11Å; F383-A388 HydrophobicContact CG-CB 3.74Å; F383-A389 HydrophobicContact CD2-CB 3.91Å; F383-C392 HydrophobicContact CE2-CB 3.92Å; F383-C392 HydrophobicContact CZ-CB 4.02Å
384	M	91.7	Very high	91.8	Very high	100 Å²	100	52.7 Å²	52.7	49%	0.493	26%	0.26	S	S	.	.	S	Bend	trans	-71.7	-33.9	173	-57.4	-145.2	78.6	0	0	111.8	K335 E360 K362	K335-M384 WeakPolarHBondContact CD-O 3.39Å; K335-M384 WeakPolarHBondContact CE-O 3.42Å; E360-M384 HydrophobicContact CB-CB 4.43Å; E360-M384 HydrophobicContact CB-CG 3.97Å; E360-M384 HydrophobicContact CB-SD 4.42Å; E360-M384 PolarHBondContact O-N 2.6Å; K362-M384 HydrophobicContact CB-CG 4.35Å
385	T	92.7	Very high	91.7	Very high	73 Å²	73	47.3 Å²	47.3	45%	0.448	24%	0.239	S	C	.	.	S	Bend	trans	-112	149.9	178.9	67	0	0	0	0	112.3	F383 E387 A388	F383-T385 WeakPolarHBondContact CB-O 3.39Å; T385-E387 VanDerWaalsContact C-N 3.33Å; T385-A388 WeakPolarHBondContact OG1-CB 3.4Å; T385-A388 PolarHBondContact OG1-N 2.81Å
386	Q	91.1	Very high	91.2	Very high	102 Å²	102	46.9 Å²	46.9	48%	0.477	24%	0.237	S	C	.	.	H	α-helix	trans	-69.8	-32.8	176	-172.1	179.1	3.7	0	0	111.6	K335 A388 A389 Q390	K335-Q386 HydrophobicContact CG-CB 4.37Å; Q386-A388 PolarHBondContact O-N 3.21Å; Q386-A389 PolarHBondContact O-N 3.19Å; Q386-Q390 WeakPolarHBondContact O-CG 3.34Å; Q386-Q390 PolarHBondContact O-N 2.97Å
387	E	92.7	Very high	90.6	Very high	121 Å²	121	45.1 Å²	45.1	57%	0.565	24%	0.235	S	C	*	.	H	α-helix	trans	-62.1	-38.8	176.8	-64.1	-176.9	-165	0	0	113	T385 Q390 K391	T385-E387 VanDerWaalsContact C-N 3.33Å; E387-Q390 PolarHBondContact O-N 2.8Å; E387-K391 WeakPolarHBondContact O-CB 3.5Å; E387-K391 VanDerWaalsContact O-CG 3.29Å; E387-K391 WeakPolarHBondContact O-CG 3.43Å; E387-K391 PolarHBondContact O-N 2.61Å; E387-K391 IonicContact OE2-NZ 2.65Å; E387-K391 PolarHBondContact OE2-NZ 3.3Å
388	A	93	Very high	89.5	Confident	1 Å²	1	50.2 Å²	50.2	1%	0.008	27%	0.267	C	S	.	.	H	α-helix	trans	-65.2	-40.4	178.1	0	0	0	0	0	111.6	F358 F383 T385 Q386 Q390 K391 C392	F358-A388 WeakPolarHBondContact O-CA 3.37Å; F358-A388 VanDerWaalsContact O-CB 3.26Å; F358-A388 WeakPolarHBondContact O-CB 3.47Å; F383-A388 HydrophobicContact CB-CB 3.91Å; F383-A388 HydrophobicContact CD1-CB 3.48Å; F383-A388 VanDerWaalsContact CD1-CB 3.48Å; F383-A388 HydrophobicContact CE1-CB 4.11Å; F383-A388 HydrophobicContact CG-CB 3.74Å; T385-A388 WeakPolarHBondContact OG1-CB 3.4Å; T385-A388 PolarHBondContact OG1-N 2.81Å; Q386-A388 PolarHBondContact O-N 3.21Å; A388-Q390 VanDerWaalsContact C-N 3.34Å; A388-Q390 PolarHBondContact O-N 3.43Å; A388-K391 PolarHBondContact O-N 3.44Å; A388-C392 WeakPolarHBondContact O-CB 3.33Å; A388-C392 PolarHBondContact O-N 2.96Å
389	A	91.6	Very high	88.2	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-61.3	-41.1	172	0	0	0	0	0	112	V337 F383 Q386 C392 L393	V337-A389 HydrophobicContact CG2-CB 4.07Å; F383-A389 HydrophobicContact CD2-CB 3.91Å; Q386-A389 PolarHBondContact O-N 3.19Å; A389-C392 PolarHBondContact O-N 2.57Å; A389-L393 WeakPolarHBondContact O-CD1 3.07Å; A389-L393 PolarHBondContact O-N 2.99Å
390	Q	91.7	Very high	86.9	Confident	99 Å²	99	61.1 Å²	61.1	46%	0.463	32%	0.317	S	S	.	.	H	α-helix	trans	-67.1	-41	175.5	-71.3	175.8	-13.6	0	0	112.9	Q386 E387 A388 C392 L393 L394	Q386-Q390 WeakPolarHBondContact O-CG 3.34Å; Q386-Q390 PolarHBondContact O-N 2.97Å; E387-Q390 PolarHBondContact O-N 2.8Å; A388-Q390 VanDerWaalsContact C-N 3.34Å; A388-Q390 PolarHBondContact O-N 3.43Å; Q390-C392 PolarHBondContact O-N 3.18Å; Q390-L393 WeakPolarHBondContact O-CB 3.11Å; Q390-L393 PolarHBondContact O-N 3.11Å; Q390-L394 WeakPolarHBondContact O-CG 3.46Å; Q390-L394 PolarHBondContact O-N 2.94Å
391	K	90.3	Very high	85.3	Confident	105 Å²	105	67.2 Å²	67.2	46%	0.457	35%	0.347	S	S	.	.	H	α-helix	trans	-60.3	-43.9	173.7	-72.6	164.6	-172.1	164.6	0	111.2	F358 E387 A388 L393 L394 A395	F358-K391 HydrophobicContact CB-CB 4.35Å; F358-K391 HydrophobicContact CD1-CB 4.22Å; E387-K391 WeakPolarHBondContact O-CB 3.5Å; E387-K391 VanDerWaalsContact O-CG 3.29Å; E387-K391 WeakPolarHBondContact O-CG 3.43Å; E387-K391 PolarHBondContact O-N 2.61Å; E387-K391 IonicContact OE2-NZ 2.65Å; E387-K391 PolarHBondContact OE2-NZ 3.3Å; A388-K391 PolarHBondContact O-N 3.44Å; K391-L393 PolarHBondContact O-N 3.24Å; K391-L394 PolarHBondContact O-N 3.02Å; K391-A395 WeakPolarHBondContact O-CB 3.5Å; K391-A395 PolarHBondContact O-N 3.39Å
392	C	90.3	Very high	83.8	Confident	0 Å²	0	71.2 Å²	71.2	0%	0	38%	0.38	C	S	.	.	H	α-helix	trans	-61.1	-41.2	174.7	-177.2	0	0	0	0	112.5	L355 F358 F383 A388 A389 Q390 A395 A396	L355-C392 WeakPolarHBondContact CD2-SG 3.32Å; F358-C392 HydrophobicContact CB-CB 4.24Å; F358-C392 HydrophobicContact CD2-CB 3.99Å; F358-C392 HydrophobicContact CG-CB 4.07Å; F383-C392 HydrophobicContact CE2-CB 3.92Å; F383-C392 HydrophobicContact CZ-CB 4.02Å; A388-C392 WeakPolarHBondContact O-CB 3.33Å; A388-C392 PolarHBondContact O-N 2.96Å; A389-C392 PolarHBondContact O-N 2.57Å; Q390-C392 PolarHBondContact O-N 3.18Å; C392-A395 PolarHBondContact O-N 2.92Å; C392-A396 WeakPolarHBondContact O-CB 3.13Å; C392-A396 PolarHBondContact O-N 3.21Å
393	L	88.7	Confident	82.4	Confident	37 Å²	37	72.3 Å²	72.3	19%	0.194	39%	0.392	C	S	.	.	H	α-helix	trans	-62.3	-47.1	174.2	-86.8	151.7	0	0	0	112.5	V337 A389 Q390 K391 A395 A396 S397 V414 L416	V337-L393 HydrophobicContact CG1-CD1 3.86Å; V337-L393 HydrophobicContact CG1-CG 3.95Å; A389-L393 WeakPolarHBondContact O-CD1 3.07Å; A389-L393 PolarHBondContact O-N 2.99Å; Q390-L393 WeakPolarHBondContact O-CB 3.11Å; Q390-L393 PolarHBondContact O-N 3.11Å; K391-L393 PolarHBondContact O-N 3.24Å; L393-A395 VanDerWaalsContact C-N 3.31Å; L393-A395 PolarHBondContact O-N 2.81Å; L393-A396 PolarHBondContact O-N 3.38Å; L393-A396 VanDerWaalsContact O-N 3.1Å; L393-S397 PolarHBondContact O-N 2.77Å; L393-S397 VanDerWaalsContact O-N 3.13Å; L393-S397 PolarHBondContact O-OG 3.23Å; L393-V414 HydrophobicContact CD2-CG1 4.34Å; L393-V414 WeakPolarHBondContact CD2-O 3.45Å; L393-V414 HydrophobicContact CG-CG1 4.34Å; L393-L416 HydrophobicContact CD1-CD2 3.55Å; L393-L416 HydrophobicContact CD1-CG 3.63Å
394	L	87.7	Confident	81.7	Confident	115 Å²	115	72.9 Å²	72.9	60%	0.602	40%	0.398	S	S	*	.	H	α-helix	trans	-62.4	-37.6	177.6	-68.8	169.7	0	0	0	112.1	Q390 K391 A396 N400	Q390-L394 WeakPolarHBondContact O-CG 3.46Å; Q390-L394 PolarHBondContact O-N 2.94Å; K391-L394 PolarHBondContact O-N 3.02Å; L394-A396 VanDerWaalsContact C-N 3.32Å; L394-N400 PolarHBondContact O-ND2 3.34Å
395	A	85.6	Confident	81.3	Confident	24 Å²	24	68.8 Å²	68.8	20%	0.198	38%	0.378	C	S	.	.	H	α-helix	trans	-72.3	-22.7	174.7	0	0	0	0	0	113.7	F358 K391 C392 L393 L405	F358-A395 HydrophobicContact CD1-CB 4.35Å; F358-A395 HydrophobicContact CE1-CB 3.39Å; F358-A395 HydrophobicContact CE2-CB 4.44Å; F358-A395 HydrophobicContact CZ-CB 3.45Å; F358-A395 VanDerWaalsContact CZ-CB 3.45Å; K391-A395 WeakPolarHBondContact O-CB 3.5Å; K391-A395 PolarHBondContact O-N 3.39Å; C392-A395 PolarHBondContact O-N 2.92Å; L393-A395 VanDerWaalsContact C-N 3.31Å; L393-A395 PolarHBondContact O-N 2.81Å; A395-L405 PolarHBondContact O-N 2.94Å
396	A	82.2	Confident	80.9	Confident	13 Å²	13	70 Å²	70	11%	0.107	38%	0.377	C	S	.	.	H	α-helix	trans	-84.4	-20.5	176.3	0	0	0	0	0	113.9	C392 L393 L394 L405 V414	C392-A396 WeakPolarHBondContact O-CB 3.13Å; C392-A396 PolarHBondContact O-N 3.21Å; L393-A396 PolarHBondContact O-N 3.38Å; L393-A396 VanDerWaalsContact O-N 3.1Å; L394-A396 VanDerWaalsContact C-N 3.32Å; A396-L405 HydrophobicContact CB-CD1 4.15Å; A396-V414 HydrophobicContact CB-CB 3.52Å; A396-V414 HydrophobicContact CB-CG2 3.54Å
397	S	78.7	Confident	80.7	Confident	45 Å²	45	66.1 Å²	66.1	32%	0.315	36%	0.359	S	S	.	.			trans	-56.8	133.6	-179.7	-74.4	0	0	0	0	112	L393 E399 N400	L393-S397 PolarHBondContact O-N 2.77Å; L393-S397 VanDerWaalsContact O-N 3.13Å; L393-S397 PolarHBondContact O-OG 3.23Å; S397-E399 PolarHBondContact O-N 2.96Å; S397-E399 VanDerWaalsContact O-N 3.17Å; S397-N400 WeakPolarHBondContact O-CB 3.34Å; S397-N400 PolarHBondContact O-N 3.12Å
398	P	69.4	Low	80.3	Confident	115 Å²	115	64.2 Å²	64.2	75%	0.747	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.9	-10.8	-177	31	-36.8	0	0	0	113.6	N400	P398-N400 VanDerWaalsContact C-N 3.33Å
399	E	66.5	Low	79.8	Confident	181 Å²	181	67 Å²	67	85%	0.846	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.7	-10.8	178.7	-62.2	172.1	171.2	0	0	112.6	S397	S397-E399 PolarHBondContact O-N 2.96Å; S397-E399 VanDerWaalsContact O-N 3.17Å
400	N	67.1	Low	79.6	Confident	78 Å²	78	71.1 Å²	71.1	42%	0.417	40%	0.397	S	S	.	.	S	Bend	trans	-85.5	131	-174.8	-147.1	-21.8	0	0	0	110.8	L394 S397 P398 A402 G403	L394-N400 PolarHBondContact O-ND2 3.34Å; S397-N400 WeakPolarHBondContact O-CB 3.34Å; S397-N400 PolarHBondContact O-N 3.12Å; P398-N400 VanDerWaalsContact C-N 3.33Å; N400-A402 PolarHBondContact O-N 3.4Å; N400-G403 PolarHBondContact O-N 2.99Å
401	E	59.2	Low	79.4	Confident	200 Å²	200	71.5 Å²	71.5	94%	0.935	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-24.4	-163.7	-62	-173.9	152.2	0	0	114.7	G403	E401-G403 PolarHBondContact O-N 2.78Å
402	A	62.2	Low	79.4	Confident	85 Å²	85	66.8 Å²	66.8	70%	0.702	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-7.4	171	0	0	0	0	0	114.1	N400 K406	N400-A402 PolarHBondContact O-N 3.4Å; A402-K406 PolarHBondContact O-NZ 3.34Å
403	G	64.9	Low	79.5	Confident	25 Å²	25	72.9 Å²	72.9	26%	0.258	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.6	31.4	178.4	0	0	0	0	0	113.5	N400 E401 K406 Q411	N400-G403 PolarHBondContact O-N 2.99Å; E401-G403 PolarHBondContact O-N 2.78Å; G403-K406 VanDerWaalsContact C-NZ 3.35Å; G403-K406 VanDerWaalsContact O-CE 3.27Å; G403-K406 WeakPolarHBondContact O-CE 3.45Å; G403-K406 PolarHBondContact O-NZ 3.46Å; G403-Q411 PolarHBondContact O-NE2 3.47Å
404	G	78.3	Confident	79.6	Confident	12 Å²	12	71.9 Å²	71.9	12%	0.124	40%	0.4	C	S	.	.	S	Bend	trans	70.2	165	178.5	0	0	0	0	0	115.7	K406	G404-K406 PolarHBondContact O-NZ 3.14Å
405	L	83.6	Confident	79.8	Confident	14 Å²	14	69 Å²	69	7%	0.073	39%	0.386	C	S	.	.			trans	-57.7	136.5	173.3	-76.2	173.1	0	0	0	112	L354 F358 A395 A396 Q411 L412 V414	L354-L405 HydrophobicContact CD1-CD2 4.09Å; L354-L405 HydrophobicContact CG-CD2 4.24Å; F358-L405 HydrophobicContact CE2-CD1 4.14Å; F358-L405 HydrophobicContact CE2-CD2 3.81Å; F358-L405 HydrophobicContact CZ-CD2 3.85Å; A395-L405 PolarHBondContact O-N 2.94Å; A396-L405 HydrophobicContact CB-CD1 4.15Å; L405-Q411 CarbonylContact O-C 3.48Å; L405-Q411 WeakPolarHBondContact O-CA 3.12Å; L405-L412 HydrophobicContact CB-CB 4.28Å; L405-L412 PolarHBondContact O-N 2.9Å; L405-V414 HydrophobicContact CD1-CG2 4.23Å
406	K	85.2	Confident	80.1	Confident	98 Å²	98	72.1 Å²	72.1	43%	0.426	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	133.7	-178.1	-62	172.5	-160.8	75	0	111	A402 G403 G404 R410 Q411	A402-K406 PolarHBondContact O-NZ 3.34Å; G403-K406 VanDerWaalsContact C-NZ 3.35Å; G403-K406 VanDerWaalsContact O-CE 3.27Å; G403-K406 WeakPolarHBondContact O-CE 3.45Å; G403-K406 PolarHBondContact O-NZ 3.46Å; G404-K406 PolarHBondContact O-NZ 3.14Å; K406-R410 WeakPolarHBondContact CA-O 3.46Å; K406-Q411 HydrophobicContact CD-CG 4.5Å; K406-Q411 HydrophobicContact CG-CG 3.94Å
407	L	86.3	Confident	80.6	Confident	20 Å²	20	72 Å²	72	11%	0.105	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	138.9	170	-160.9	77	0	0	0	106.8	L342 E350 L354 G409 R410 L412	L342-L407 HydrophobicContact CD2-CD2 3.68Å; E350-L407 HydrophobicContact CB-CD1 4.3Å; L354-L407 HydrophobicContact CB-CD1 4.46Å; L354-L407 HydrophobicContact CD2-CB 4.14Å; L354-L407 HydrophobicContact CD2-CD1 3.85Å; L407-G409 PolarHBondContact O-N 3.07Å; L407-R410 PolarHBondContact N-O 3.33Å; L407-R410 WeakPolarHBondContact O-CA 3.44Å; L407-R410 WeakPolarHBondContact O-CB 3.48Å; L407-R410 PolarHBondContact O-N 3.23Å; L407-R410 VanDerWaalsContact O-O 3.07Å; L407-L412 HydrophobicContact CB-CD1 4.14Å; L407-L412 HydrophobicContact CB-CD2 4.07Å; L407-L412 HydrophobicContact CB-CG 4.27Å
408	D	83.7	Confident	81.2	Confident	82 Å²	82	72.6 Å²	72.6	44%	0.439	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.7	26.6	-178.3	-46.4	-35.3	0	0	0	115	S343 S346 R410	S343-D408 WeakPolarHBondContact CB-OD2 3.26Å; S346-D408 WeakPolarHBondContact CB-OD2 3.25Å; S346-D408 PolarHBondContact OG-OD2 3.29Å; D408-R410 PolarHBondContact O-N 3.15Å
409	G	82.9	Confident	82.1	Confident	59 Å²	59	68.6 Å²	68.6	61%	0.608	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.3	12.7	-172.3	0	0	0	0	0	114.9	L407	L407-G409 PolarHBondContact O-N 3.07Å
410	R	87.4	Confident	83	Confident	86 Å²	86	70.5 Å²	70.5	33%	0.325	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	139.5	169.4	-52.9	-179	-174.8	-151.3	0.7	109	L342 S343 K406 L407 D408	L342-R410 PolarHBondContact O-NH1 3.46Å; S343-R410 PolarHBondContact OG-NE 3.29Å; S343-R410 PolarHBondContact OG-NH2 2.82Å; K406-R410 WeakPolarHBondContact CA-O 3.46Å; L407-R410 PolarHBondContact N-O 3.33Å; L407-R410 WeakPolarHBondContact O-CA 3.44Å; L407-R410 WeakPolarHBondContact O-CB 3.48Å; L407-R410 PolarHBondContact O-N 3.23Å; L407-R410 VanDerWaalsContact O-O 3.07Å; D408-R410 PolarHBondContact O-N 3.15Å
411	Q	88.6	Confident	83.8	Confident	108 Å²	108	72 Å²	72	51%	0.505	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	126.3	170	-75.6	167.1	-51.9	0	0	109.8	N341 G403 L405 K406	N341-Q411 PolarHBondContact ND2-O 2.97Å; G403-Q411 PolarHBondContact O-NE2 3.47Å; L405-Q411 CarbonylContact O-C 3.48Å; L405-Q411 WeakPolarHBondContact O-CA 3.12Å; K406-Q411 HydrophobicContact CD-CG 4.5Å; K406-Q411 HydrophobicContact CG-CG 3.94Å
412	L	90.1	Very high	85	Confident	5 Å²	5	66.5 Å²	66.5	3%	0.026	36%	0.355	C	S	.	.	P	Polyproline II helix	trans	-77.9	146.8	175	-56.5	-172.8	0	0	0	110	I339 L342 L351 L354 L405 L407	I339-L412 HydrophobicContact CG2-CB 4.27Å; I339-L412 HydrophobicContact CG2-CD1 4.11Å; L342-L412 HydrophobicContact CD2-CD1 4.08Å; L342-L412 HydrophobicContact CD2-CD2 3.61Å; L342-L412 HydrophobicContact CG-CD2 3.99Å; L351-L412 HydrophobicContact CD1-CD1 4.19Å; L354-L412 HydrophobicContact CD2-CD1 3.76Å; L405-L412 HydrophobicContact CB-CB 4.28Å; L405-L412 PolarHBondContact O-N 2.9Å; L407-L412 HydrophobicContact CB-CD1 4.14Å; L407-L412 HydrophobicContact CB-CD2 4.07Å; L407-L412 HydrophobicContact CB-CG 4.27Å
413	K	90.5	Very high	86	Confident	129 Å²	129	64.3 Å²	64.3	56%	0.561	34%	0.337	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.8	115.4	171.3	-64.2	-173.9	178.8	-170.1	0	108.2	R340	R340-K413 HydrophobicContact CB-CB 4.27Å; R340-K413 PolarHBondContact N-O 2.91Å; R340-K413 PolarHBondContact O-N 3.27Å
414	V	92	Very high	86.8	Confident	15 Å²	15	66 Å²	66	9%	0.091	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	129.8	-177.6	-173.7	0	0	0	0	108.5	V337 F338 I339 L393 A396 L405	V337-V414 HydrophobicContact CB-CG1 3.91Å; V337-V414 HydrophobicContact CG1-CG1 3.48Å; V337-V414 VanDerWaalsContact CG1-CG1 3.48Å; F338-V414 WeakPolarHBondContact O-CA 3.2Å; I339-V414 HydrophobicContact CG1-CG1 4.37Å; I339-V414 HydrophobicContact CG1-CG2 4.21Å; I339-V414 HydrophobicContact CG2-CG2 4.43Å; L393-V414 HydrophobicContact CD2-CG1 4.34Å; L393-V414 WeakPolarHBondContact CD2-O 3.45Å; L393-V414 HydrophobicContact CG-CG1 4.34Å; A396-V414 HydrophobicContact CB-CB 3.52Å; A396-V414 HydrophobicContact CB-CG2 3.54Å; L405-V414 HydrophobicContact CD1-CG2 4.23Å
415	D	91.8	Very high	87	Confident	55 Å²	55	72.8 Å²	72.8	29%	0.294	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	154	176.1	-49.4	-102.3	0	0	0	108.2	V337 F338 R340 A417	V337-D415 WeakPolarHBondContact CG1-O 3.47Å; F338-D415 PolarHBondContact N-O 2.92Å; F338-D415 PolarHBondContact O-N 2.88Å; R340-D415 IonicContact CZ-OD1 2.83Å; R340-D415 IonicContact CZ-OD2 2.68Å; R340-D415 IonicContact NE-OD2 3.51Å; R340-D415 PolarHBondContact NE-OD2 3.12Å; R340-D415 IonicContact NH2-OD1 3.5Å; R340-D415 PolarHBondContact NH2-OD1 3.4Å; R340-D415 IonicContact NH2-OD2 2.7Å; R340-D415 PolarHBondContact NH2-OD2 3.07Å; D415-A417 PolarHBondContact O-N 3.11Å
416	L	92.5	Very high	86.6	Confident	89 Å²	89	78 Å²	78	47%	0.466	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.7	138.9	166.2	-76.5	171.7	0	0	0	109.5	L393	L393-L416 HydrophobicContact CD1-CD2 3.55Å; L393-L416 HydrophobicContact CD1-CG 3.63Å
417	A	92.7	Very high	85.9	Confident	11 Å²	11	79 Å²	79	9%	0.091	41%	0.407	C	S	.	.			trans	-64.9	147.6	172.8	0	0	0	0	0	109.9	V331 T336 F338 F380 D415	V331-A417 HydrophobicContact CG1-CB 4.24Å; V331-A417 VanDerWaalsContact CG1-O 3.23Å; V331-A417 WeakPolarHBondContact CG1-O 3.49Å; V331-A417 HydrophobicContact CG2-CB 4.42Å; T336-A417 VanDerWaalsContact O-CB 3.28Å; T336-A417 WeakPolarHBondContact O-CB 3.44Å; T336-A417 PolarHBondContact O-N 3.42Å; T336-A417 WeakPolarHBondContact OG1-CB 3.46Å; F338-A417 HydrophobicContact CB-CB 4.35Å; F380-A417 HydrophobicContact CD1-CB 4.11Å; F380-A417 HydrophobicContact CE1-CB 4.13Å; D415-A417 PolarHBondContact O-N 3.11Å
418	V	89.8	Confident	84.6	Confident	58 Å²	58	83.2 Å²	83.2	35%	0.352	43%	0.434	S	S	.	.			trans	-121.7	142.3	-173.3	174.9	0	0	0	0	108.9	E422 A423 L426	V418-E422 HydrophobicContact CG1-CB 3.3Å; V418-E422 HydrophobicContact CG1-CG 4.45Å; V418-A423 HydrophobicContact CG1-CB 4.42Å; V418-L426 HydrophobicContact CG1-CD1 4.09Å; V418-L426 HydrophobicContact CG2-CD1 4.46Å
419	T	89.2	Confident	83.3	Confident	30 Å²	30	85.5 Å²	85.5	18%	0.184	45%	0.451	C	S	.	.			trans	-62.8	157.4	-177.6	68	0	0	0	0	111	V331 D421 E422 A423	V331-T419 HydrophobicContact CB-CG2 4.3Å; V331-T419 HydrophobicContact CG1-CG2 4.09Å; T419-D421 PolarHBondContact O-N 2.74Å; T419-D421 VanDerWaalsContact O-N 3.15Å; T419-E422 VanDerWaalsContact CB-OE2 3.29Å; T419-E422 WeakPolarHBondContact CB-OE2 3.46Å; T419-E422 VanDerWaalsContact CG2-OE2 3.28Å; T419-E422 WeakPolarHBondContact CG2-OE2 3.26Å; T419-E422 PolarHBondContact N-OE2 3.23Å; T419-E422 VanDerWaalsContact N-OE2 3.14Å; T419-E422 PolarHBondContact O-N 3.01Å; T419-E422 WeakPolarHBondContact OG1-CB 3.48Å; T419-E422 VanDerWaalsContact OG1-CG 3.27Å; T419-E422 WeakPolarHBondContact OG1-CG 3.38Å; T419-E422 PolarHBondContact OG1-N 3.04Å; T419-E422 PolarHBondContact OG1-OE2 2.8Å; T419-A423 VanDerWaalsContact O-CB 3.31Å; T419-A423 WeakPolarHBondContact O-CB 3.42Å; T419-A423 PolarHBondContact O-N 2.83Å
420	R	84.5	Confident	82.1	Confident	221 Å²	221	90.7 Å²	90.7	83%	0.834	46%	0.457	S	S	*	.	H	α-helix	trans	-56.2	-35.4	-178.8	-179.6	174.5	176.6	167.4	0.1	113	A424	R420-A424 PolarHBondContact O-N 2.92Å; R420-A424 VanDerWaalsContact O-N 3.09Å
421	D	83.7	Confident	80.9	Confident	110 Å²	110	92.8 Å²	92.8	59%	0.588	48%	0.479	S	S	*	.	H	α-helix	trans	-83	-32.2	-175.5	-60.5	-31.9	0	0	0	111.5	T419 A424 K425	T419-D421 PolarHBondContact O-N 2.74Å; T419-D421 VanDerWaalsContact O-N 3.15Å; D421-A424 WeakPolarHBondContact O-CB 3.44Å; D421-A424 PolarHBondContact O-N 2.91Å; D421-K425 WeakPolarHBondContact O-CG 3.42Å; D421-K425 PolarHBondContact O-N 2.72Å; D421-K425 VanDerWaalsContact O-N 3.12Å
422	E	84.4	Confident	79.8	Confident	85 Å²	85	97 Å²	97	40%	0.397	50%	0.496	S	S	.	.	H	α-helix	trans	-70.3	-39.2	167.6	-68.9	164.6	139.5	0	0	112.1	V418 T419 A424 K425 L426	V418-E422 HydrophobicContact CG1-CB 3.3Å; V418-E422 HydrophobicContact CG1-CG 4.45Å; T419-E422 VanDerWaalsContact CB-OE2 3.29Å; T419-E422 WeakPolarHBondContact CB-OE2 3.46Å; T419-E422 VanDerWaalsContact CG2-OE2 3.28Å; T419-E422 WeakPolarHBondContact CG2-OE2 3.26Å; T419-E422 PolarHBondContact N-OE2 3.23Å; T419-E422 VanDerWaalsContact N-OE2 3.14Å; T419-E422 PolarHBondContact O-N 3.01Å; T419-E422 WeakPolarHBondContact OG1-CB 3.48Å; T419-E422 VanDerWaalsContact OG1-CG 3.27Å; T419-E422 WeakPolarHBondContact OG1-CG 3.38Å; T419-E422 PolarHBondContact OG1-N 3.04Å; T419-E422 PolarHBondContact OG1-OE2 2.8Å; E422-A424 PolarHBondContact O-N 2.89Å; E422-K425 CarbonylContact O-C 3.55Å; E422-K425 WeakPolarHBondContact O-CA 3.44Å; E422-K425 WeakPolarHBondContact O-CB 3.49Å; E422-K425 PolarHBondContact O-N 2.82Å; E422-L426 WeakPolarHBondContact O-CB 3.29Å; E422-L426 WeakPolarHBondContact O-CG 3.49Å; E422-L426 PolarHBondContact O-N 3.29Å
423	A	83.3	Confident	78.6	Confident	39 Å²	39	105.3 Å²	105.3	32%	0.322	53%	0.532	S	S	.	.	H	α-helix	trans	-64.2	-21.9	172.2	0	0	0	0	0	112.4	V418 T419 Q427	V418-A423 HydrophobicContact CG1-CB 4.42Å; T419-A423 VanDerWaalsContact O-CB 3.31Å; T419-A423 WeakPolarHBondContact O-CB 3.42Å; T419-A423 PolarHBondContact O-N 2.83Å; A423-Q427 WeakPolarHBondContact O-CG 3.32Å; A423-Q427 PolarHBondContact O-N 2.72Å; A423-Q427 PolarHBondContact O-NE2 2.96Å
424	A	83.2	Confident	77.4	Confident	59 Å²	59	102.4 Å²	102.4	49%	0.488	53%	0.526	S	S	.	.	H	α-helix	trans	-79.8	-30.4	169	0	0	0	0	0	112.9	R420 D421 E422	R420-A424 PolarHBondContact O-N 2.92Å; R420-A424 VanDerWaalsContact O-N 3.09Å; D421-A424 WeakPolarHBondContact O-CB 3.44Å; D421-A424 PolarHBondContact O-N 2.91Å; E422-A424 PolarHBondContact O-N 2.89Å
425	K	82.1	Confident	75.9	Confident	156 Å²	156	108.7 Å²	108.7	68%	0.678	56%	0.564	S	S	*	*	H	α-helix	trans	-73.8	-45	171.5	-63.4	166.4	-165.4	170.4	0	112	D421 E422 Q427 T428	D421-K425 WeakPolarHBondContact O-CG 3.42Å; D421-K425 PolarHBondContact O-N 2.72Å; D421-K425 VanDerWaalsContact O-N 3.12Å; E422-K425 CarbonylContact O-C 3.55Å; E422-K425 WeakPolarHBondContact O-CA 3.44Å; E422-K425 WeakPolarHBondContact O-CB 3.49Å; E422-K425 PolarHBondContact O-N 2.82Å; K425-Q427 CarbonylContact O-C 3.43Å; K425-Q427 PolarHBondContact O-N 2.73Å; K425-T428 PolarHBondContact O-N 3.34Å
426	L	74.3	Confident	75.1	Confident	123 Å²	123	108.1 Å²	108.1	64%	0.644	57%	0.572	S	S	*	*	H	α-helix	trans	-70.6	-16.6	176.9	-66.8	-178.7	0	0	0	113	V418 E422 T428	V418-L426 HydrophobicContact CG1-CD1 4.09Å; V418-L426 HydrophobicContact CG2-CD1 4.46Å; E422-L426 WeakPolarHBondContact O-CB 3.29Å; E422-L426 WeakPolarHBondContact O-CG 3.49Å; E422-L426 PolarHBondContact O-N 3.29Å; L426-T428 PolarHBondContact O-N 3.03Å
427	Q	71.3	Confident	74.8	Confident	118 Å²	118	109.1 Å²	109.1	55%	0.551	58%	0.582	S	S	*	*	S	Bend	trans	-68.9	61.9	151.7	-80	178.3	83.5	0	0	110.6	A423 K425 T429	A423-Q427 WeakPolarHBondContact O-CG 3.32Å; A423-Q427 PolarHBondContact O-N 2.72Å; A423-Q427 PolarHBondContact O-NE2 2.96Å; K425-Q427 CarbonylContact O-C 3.43Å; K425-Q427 PolarHBondContact O-N 2.73Å; Q427-T429 PolarHBondContact O-N 2.75Å
428	T	59.7	Low	74.7	Confident	109 Å²	109	110.7 Å²	110.7	67%	0.669	59%	0.586	S	S	*	*			trans	-41.3	130.8	162.5	49.6	0	0	0	0	108.3	K425 L426 K430	K425-T428 PolarHBondContact O-N 3.34Å; L426-T428 PolarHBondContact O-N 3.03Å; T428-K430 WeakPolarHBondContact O-CA 3.21Å; T428-K430 PolarHBondContact O-N 3.24Å
429	T	56.1	Low	74.9	Confident	131 Å²	131	108.5 Å²	108.5	80%	0.804	57%	0.572	S	S	*	*			trans	-51.3	94.9	-163.8	32.7	0	0	0	0	111.2	Q427 V431	Q427-T429 PolarHBondContact O-N 2.75Å; T429-V431 WeakPolarHBondContact O-CA 3.4Å; T429-V431 PolarHBondContact O-N 3.48Å
430	K	57.7	Low	75	Confident	167 Å²	167	111 Å²	111	73%	0.726	58%	0.584	S	S	*	*			trans	-46.7	100.4	-166	-76.3	-173.4	179.5	178.8	0	109.7	T428 K432	T428-K430 WeakPolarHBondContact O-CA 3.21Å; T428-K430 PolarHBondContact O-N 3.24Å; K430-K432 PolarHBondContact O-N 3.43Å
431	V	61.7	Low	75.3	Confident	130 Å²	130	104.6 Å²	104.6	79%	0.788	56%	0.56	S	S	*	*			trans	-59.8	113.4	-169.9	178.9	0	0	0	0	105.8	T429 K433	T429-V431 WeakPolarHBondContact O-CA 3.4Å; T429-V431 PolarHBondContact O-N 3.48Å; V431-K433 PolarHBondContact O-N 3.46Å
432	K	64.7	Low	75.7	Confident	197 Å²	197	99.5 Å²	99.5	86%	0.857	53%	0.533	S	S	*	.			trans	-69.3	85.5	-170.6	-70	-175.3	179.4	179.2	0	108.2	K430 P434	K430-K432 PolarHBondContact O-N 3.43Å; K432-P434 VanDerWaalsContact O-N 3.12Å
433	K	66.4	Low	76.1	Confident	179 Å²	179	96.1 Å²	96.1	78%	0.778	52%	0.52	S	S	*	.			trans	-46	120.8	178.3	-69.9	-169.3	176.4	-173.4	0	107	V431 T435	V431-K433 PolarHBondContact O-N 3.46Å; K433-T435 PolarHBondContact O-N 3.5Å; K433-T435 PolarHBondContact O-OG1 2.99Å; K433-T435 VanDerWaalsContact O-OG1 3.11Å
434	P	65.3	Low	76.5	Confident	68 Å²	68	103.9 Å²	103.9	44%	0.442	54%	0.54	S	S	.	.			trans	-61.1	103.1	-163.4	18.8	-31.1	0	0	0	111.2	K432 G436 Y441	K432-P434 VanDerWaalsContact O-N 3.12Å; P434-G436 PolarHBondContact O-N 3.45Å; P434-G436 VanDerWaalsContact O-N 3.12Å; P434-Y441 HydrophobicContact CB-CD1 3.47Å; P434-Y441 VanDerWaalsContact CB-CD1 3.47Å; P434-Y441 HydrophobicContact CB-CD2 4.31Å; P434-Y441 HydrophobicContact CB-CE1 3.45Å; P434-Y441 VanDerWaalsContact CB-CE1 3.45Å; P434-Y441 HydrophobicContact CB-CE2 4.28Å; P434-Y441 HydrophobicContact CB-CG 3.95Å; P434-Y441 HydrophobicContact CG-CD1 4.22Å; P434-Y441 HydrophobicContact CG-CE1 3.69Å; P434-Y441 HydrophobicContact CG-CE2 4.18Å
435	T	59.6	Low	76.9	Confident	147 Å²	147	103.8 Å²	103.8	90%	0.902	53%	0.53	S	S	*	.			trans	-78.5	98.3	-170.4	-48.8	0	0	0	0	110.6	K433	K433-T435 PolarHBondContact O-N 3.5Å; K433-T435 PolarHBondContact O-OG1 2.99Å; K433-T435 VanDerWaalsContact O-OG1 3.11Å
436	G	75.3	Confident	77.1	Confident	44 Å²	44	97.3 Å²	97.3	45%	0.454	51%	0.508	S	S	.	.			trans	162.3	129.9	168.9	0	0	0	0	0	114.3	P434 R438 N439	P434-G436 PolarHBondContact O-N 3.45Å; P434-G436 VanDerWaalsContact O-N 3.12Å; G436-R438 PolarHBondContact O-N 3.38Å; G436-N439 PolarHBondContact O-N 3.19Å
437	T	85.5	Confident	77.9	Confident	110 Å²	110	94.3 Å²	94.3	68%	0.675	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-7.7	179.3	55	0	0	0	0	114.9	R582	T437-R582 PolarHBondContact O-NH2 3.23Å
438	R	91.5	Very high	78.9	Confident	44 Å²	44	89.6 Å²	89.6	17%	0.166	47%	0.47	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.1	-1.2	179.7	-67.8	-179.1	67.3	-155.2	-3.5	114.6	G436 L440 L477 D479 Q480 I482 F483 V484	G436-R438 PolarHBondContact O-N 3.38Å; R438-L440 HydrophobicContact CB-CD1 4.33Å; R438-L440 HydrophobicContact CB-CD2 3.91Å; R438-L440 HydrophobicContact CB-CG 3.78Å; R438-L440 PolarHBondContact O-N 2.86Å; R438-L440 VanDerWaalsContact O-N 3.1Å; R438-L477 PolarHBondContact NH2-O 2.98Å; R438-D479 PolarHBondContact NH2-O 3.3Å; R438-Q480 WeakPolarHBondContact CD-O 3.47Å; R438-Q480 PolarHBondContact NE-O 3.21Å; R438-I482 PolarHBondContact NE-O 3.43Å; R438-I482 PolarHBondContact NH2-O 2.89Å; R438-F483 HydrophobicContact CB-CB 4.07Å; R438-F483 HydrophobicContact CG-CB 4.27Å; R438-V484 PolarHBondContact O-N 2.87Å
439	N	92.4	Very high	80.3	Confident	12 Å²	12	91.9 Å²	91.9	6%	0.064	47%	0.467	C	S	.	.			trans	51.5	28.2	-178.6	-53.2	-46.3	0	0	0	115.5	G436 Y441 L442 V484 R486	G436-N439 PolarHBondContact O-N 3.19Å; N439-Y441 HydrophobicContact CB-CD1 4.5Å; N439-Y441 HydrophobicContact CB-CE1 4Å; N439-Y441 WeakPolarHBondContact O-CD1 3.45Å; N439-Y441 PolarHBondContact O-N 3.47Å; N439-L442 HydrophobicContact CB-CD1 4.3Å; N439-L442 WeakPolarHBondContact O-CB 3.46Å; N439-L442 PolarHBondContact O-N 3.42Å; N439-V484 HydrophobicContact CB-CB 4.23Å; N439-V484 WeakPolarHBondContact CB-O 3.13Å; N439-V484 PolarHBondContact ND2-O 2.92Å; N439-R486 PolarHBondContact OD1-NE 3.38Å; N439-R486 PolarHBondContact OD1-NH2 3.31Å
440	L	91.7	Very high	82	Confident	82 Å²	82	88.8 Å²	88.8	43%	0.429	45%	0.454	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-12.6	-169.8	-60.3	177.7	0	0	0	115.5	R438 L442 A443 L477	R438-L440 HydrophobicContact CB-CD1 4.33Å; R438-L440 HydrophobicContact CB-CD2 3.91Å; R438-L440 HydrophobicContact CB-CG 3.78Å; R438-L440 PolarHBondContact O-N 2.86Å; R438-L440 VanDerWaalsContact O-N 3.1Å; L440-L442 VanDerWaalsContact C-N 3.32Å; L440-A443 WeakPolarHBondContact O-CB 3.4Å; L440-A443 PolarHBondContact O-N 2.84Å; L440-L477 HydrophobicContact CD2-CD2 3.77Å
441	Y	90.5	Very high	83.5	Confident	87 Å²	87	85 Å²	85	34%	0.341	46%	0.462	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-38	170.9	68.1	-79.1	0	0	0	111.8	P434 N439 A443 R444	P434-Y441 HydrophobicContact CB-CD1 3.47Å; P434-Y441 VanDerWaalsContact CB-CD1 3.47Å; P434-Y441 HydrophobicContact CB-CD2 4.31Å; P434-Y441 HydrophobicContact CB-CE1 3.45Å; P434-Y441 VanDerWaalsContact CB-CE1 3.45Å; P434-Y441 HydrophobicContact CB-CE2 4.28Å; P434-Y441 HydrophobicContact CB-CG 3.95Å; P434-Y441 HydrophobicContact CG-CD1 4.22Å; P434-Y441 HydrophobicContact CG-CE1 3.69Å; P434-Y441 HydrophobicContact CG-CE2 4.18Å; N439-Y441 HydrophobicContact CB-CD1 4.5Å; N439-Y441 HydrophobicContact CB-CE1 4Å; N439-Y441 WeakPolarHBondContact O-CD1 3.45Å; N439-Y441 PolarHBondContact O-N 3.47Å; Y441-A443 PolarHBondContact O-N 3.43Å; Y441-R444 PolarHBondContact O-N 2.98Å
442	L	93.1	Very high	84.9	Confident	2 Å²	2	80.9 Å²	80.9	1%	0.01	44%	0.438	C	S	.	.	G	3₁₀ helix	trans	-68.3	-17.2	177.5	-63.4	-177.4	0	0	0	113.6	N439 L440 R444 E445 V484 R486 F577	N439-L442 HydrophobicContact CB-CD1 4.3Å; N439-L442 WeakPolarHBondContact O-CB 3.46Å; N439-L442 PolarHBondContact O-N 3.42Å; L440-L442 VanDerWaalsContact C-N 3.32Å; L442-R444 PolarHBondContact O-N 3.36Å; L442-R444 VanDerWaalsContact O-N 3.1Å; L442-E445 HydrophobicContact CD2-CG 4.13Å; L442-E445 PolarHBondContact O-N 3.14Å; L442-V484 HydrophobicContact CB-CB 4.26Å; L442-V484 HydrophobicContact CB-CG1 3.63Å; L442-R486 HydrophobicContact CD1-CG 4.11Å; L442-F577 HydrophobicContact CB-CB 4.5Å; L442-F577 HydrophobicContact CB-CD2 3.84Å; L442-F577 HydrophobicContact CB-CE2 4.33Å; L442-F577 HydrophobicContact CB-CG 4.21Å; L442-F577 HydrophobicContact CD1-CD1 4.35Å; L442-F577 HydrophobicContact CD1-CD2 4.4Å; L442-F577 HydrophobicContact CD1-CE1 4.44Å; L442-F577 HydrophobicContact CD1-CE2 4.48Å; L442-F577 HydrophobicContact CD1-CG 4.34Å; L442-F577 HydrophobicContact CD2-CD2 4.22Å; L442-F577 HydrophobicContact CD2-CE2 3.82Å; L442-F577 HydrophobicContact CD2-CZ 4.22Å; L442-F577 HydrophobicContact CG-CD2 4.37Å; L442-F577 HydrophobicContact CG-CE2 4.43Å
443	A	92.8	Very high	86.2	Confident	15 Å²	15	80 Å²	80	12%	0.124	43%	0.434	C	S	.	.	G	3₁₀ helix	trans	-63.6	-15.6	176.7	0	0	0	0	0	113.3	L440 Y441 K473 L477 V484	L440-A443 WeakPolarHBondContact O-CB 3.4Å; L440-A443 PolarHBondContact O-N 2.84Å; Y441-A443 PolarHBondContact O-N 3.43Å; A443-K473 VanDerWaalsContact O-CE 3.28Å; A443-K473 WeakPolarHBondContact O-CE 3.27Å; A443-K473 PolarHBondContact O-NZ 2.78Å; A443-L477 HydrophobicContact CB-CD1 3.71Å; A443-V484 HydrophobicContact CB-CG2 3.96Å
444	R	91	Very high	87.3	Confident	201 Å²	201	73.4 Å²	73.4	76%	0.758	41%	0.413	S	S	*	.	G	3₁₀ helix	trans	-106.2	-11	-180	-67.8	-178.9	173.7	174.5	-2.4	114.5	Y441 L442 L447	Y441-R444 PolarHBondContact O-N 2.98Å; L442-R444 PolarHBondContact O-N 3.36Å; L442-R444 VanDerWaalsContact O-N 3.1Å; R444-L447 PolarHBondContact O-N 3.39Å
445	E	91.5	Very high	88.4	Confident	57 Å²	57	71.1 Å²	71.1	27%	0.266	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	136.1	171.3	-64.9	-69	129.2	0	0	108.8	L442 L447 L554 L557 R558 F577	L442-E445 HydrophobicContact CD2-CG 4.13Å; L442-E445 PolarHBondContact O-N 3.14Å; E445-L447 VanDerWaalsContact C-N 3.34Å; E445-L447 PolarHBondContact O-N 3.22Å; E445-L554 HydrophobicContact CG-CD1 4.15Å; E445-L557 HydrophobicContact CB-CD2 4.37Å; E445-R558 IonicContact OE1-NH2 3.49Å; E445-R558 IonicContact OE2-CZ 3.63Å; E445-R558 IonicContact OE2-NE 2.65Å; E445-R558 PolarHBondContact OE2-NE 3.3Å; E445-R558 IonicContact OE2-NH2 2.72Å; E445-R558 PolarHBondContact OE2-NH2 3.2Å; E445-F577 HydrophobicContact CB-CD2 4.21Å; E445-F577 HydrophobicContact CB-CE2 3.96Å; E445-F577 HydrophobicContact CG-CE2 4.23Å
446	G	87.3	Confident	89.8	Confident	21 Å²	21	70.4 Å²	70.4	22%	0.216	39%	0.386	C	S	.	.	T	Hydrogen-bonded Turn	trans	82.4	-5.4	-178.8	0	0	0	0	0	116.4	I448 N561	G446-I448 PolarHBondContact O-N 3.48Å; G446-N561 VanDerWaalsContact CA-ND2 3.34Å; G446-N561 WeakPolarHBondContact CA-ND2 3.35Å; G446-N561 PolarHBondContact O-ND2 3.32Å
447	L	91.4	Very high	90.4	Very high	60 Å²	60	71.5 Å²	71.5	31%	0.314	40%	0.397	S	S	.	.			trans	-69	115.3	-177.4	178.8	61	0	0	0	112.7	R444 E445 E470	R444-L447 PolarHBondContact O-N 3.39Å; E445-L447 VanDerWaalsContact C-N 3.34Å; E445-L447 PolarHBondContact O-N 3.22Å; L447-E470 HydrophobicContact CD1-CB 4.41Å; L447-E470 HydrophobicContact CD1-CG 4.25Å; L447-E470 WeakPolarHBondContact CD1-OE2 3.35Å; L447-E470 WeakPolarHBondContact CD2-OE1 3.35Å
448	I	91.7	Very high	90.5	Very high	18 Å²	18	67.2 Å²	67.2	9%	0.092	37%	0.371	C	S	.	.			trans	-101	106.4	174.9	-45	-53.8	0	0	0	109.4	G446 A454 A455 M463 N562	G446-I448 PolarHBondContact O-N 3.48Å; I448-A454 HydrophobicContact CD1-CB 3.87Å; I448-A454 HydrophobicContact CG2-CB 4.11Å; I448-A455 HydrophobicContact CG2-CB 4.11Å; I448-M463 HydrophobicContact CG2-SD 4.48Å; I448-N562 HydrophobicContact CD1-CB 4.32Å; I448-N562 HydrophobicContact CG1-CB 4.27Å
449	R	90.2	Very high	90.4	Very high	157 Å²	157	67.1 Å²	67.1	59%	0.592	38%	0.377	S	S	*	.			trans	-97.5	144.1	178.9	-172.3	169.4	56.6	74.8	2.4	111.2	T452	R449-T452 HydrophobicContact CB-CG2 4.18Å; R449-T452 WeakPolarHBondContact O-CB 3.36Å; R449-T452 WeakPolarHBondContact O-CG2 3.46Å; R449-T452 PolarHBondContact O-N 3.12Å; R449-T452 PolarHBondContact O-OG1 2.85Å
450	A	90.7	Very high	90.3	Very high	66 Å²	66	70.7 Å²	70.7	55%	0.545	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.7	141	174.1	0	0	0	0	0	111.9	T452 M463	A450-T452 VanDerWaalsContact C-N 3.29Å; A450-T452 PolarHBondContact O-N 2.82Å; A450-M463 HydrophobicContact CB-CE 4.17Å
451	G	89.4	Confident	90.3	Very high	87 Å²	87	70 Å²	70	90%	0.897	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.5	12.9	-176.3	0	0	0	0	0	115.3
452	T	91.1	Very high	90.3	Very high	45 Å²	45	65.9 Å²	65.9	28%	0.276	40%	0.398	S	S	.	.	S	Bend	trans	-98.8	155	167.1	66	0	0	0	0	110.4	R449 A450 A454 A455	R449-T452 HydrophobicContact CB-CG2 4.18Å; R449-T452 WeakPolarHBondContact O-CB 3.36Å; R449-T452 WeakPolarHBondContact O-CG2 3.46Å; R449-T452 PolarHBondContact O-N 3.12Å; R449-T452 PolarHBondContact O-OG1 2.85Å; A450-T452 VanDerWaalsContact C-N 3.29Å; A450-T452 PolarHBondContact O-N 2.82Å; T452-A454 PolarHBondContact O-N 3.26Å; T452-A454 VanDerWaalsContact O-N 3.08Å; T452-A455 WeakPolarHBondContact O-CB 3.39Å; T452-A455 PolarHBondContact O-N 3.48Å
453	K	91	Very high	90.2	Very high	178 Å²	178	67.4 Å²	67.4	77%	0.774	41%	0.406	S	S	*	.	G	3₁₀ helix	trans	-53.7	-32.3	179.1	-67.4	-163.9	173.2	-165	0	113.9	A455 E456	K453-A455 VanDerWaalsContact C-N 3.26Å; K453-A455 PolarHBondContact O-N 3.45Å; K453-E456 WeakPolarHBondContact CA-OE1 3.44Å; K453-E456 VanDerWaalsContact O-CB 3.3Å; K453-E456 WeakPolarHBondContact O-CB 3.49Å; K453-E456 WeakPolarHBondContact O-CG 3.45Å; K453-E456 PolarHBondContact O-N 3.45Å
454	A	89.5	Confident	90.2	Very high	41 Å²	41	69.4 Å²	69.4	34%	0.339	42%	0.422	S	S	.	.	G	3₁₀ helix	trans	-73.7	-13.3	177.7	0	0	0	0	0	113.8	I448 T452 E456 N562	I448-A454 HydrophobicContact CD1-CB 3.87Å; I448-A454 HydrophobicContact CG2-CB 4.11Å; T452-A454 PolarHBondContact O-N 3.26Å; T452-A454 VanDerWaalsContact O-N 3.08Å; A454-E456 VanDerWaalsContact C-N 3.3Å; A454-N562 PolarHBondContact O-ND2 2.87Å
455	A	90.2	Very high	90.3	Very high	19 Å²	19	63.8 Å²	63.8	16%	0.157	40%	0.403	C	S	.	.	G	3₁₀ helix	trans	-83.1	-5.5	170.9	0	0	0	0	0	112.9	I448 T452 K453 G457 V458 M463	I448-A455 HydrophobicContact CG2-CB 4.11Å; T452-A455 WeakPolarHBondContact O-CB 3.39Å; T452-A455 PolarHBondContact O-N 3.48Å; K453-A455 VanDerWaalsContact C-N 3.26Å; K453-A455 PolarHBondContact O-N 3.45Å; A455-G457 PolarHBondContact O-N 3.29Å; A455-V458 WeakPolarHBondContact O-CB 3.32Å; A455-V458 WeakPolarHBondContact O-CG2 3.34Å; A455-V458 PolarHBondContact O-N 2.83Å; A455-M463 HydrophobicContact CB-CE 4.23Å; A455-M463 HydrophobicContact CB-SD 4.08Å
456	E	89	Confident	90.4	Very high	132 Å²	132	61.8 Å²	61.8	62%	0.617	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	130.9	-179.4	-65.8	170.3	-161	0	0	111.3	K453 A454 V458 R572	K453-E456 WeakPolarHBondContact CA-OE1 3.44Å; K453-E456 VanDerWaalsContact O-CB 3.3Å; K453-E456 WeakPolarHBondContact O-CB 3.49Å; K453-E456 WeakPolarHBondContact O-CG 3.45Å; K453-E456 PolarHBondContact O-N 3.45Å; A454-E456 VanDerWaalsContact C-N 3.3Å; E456-V458 PolarHBondContact O-N 3.22Å; E456-R572 PolarHBondContact O-NH2 2.82Å
457	G	86.5	Confident	90.7	Very high	67 Å²	67	66.9 Å²	66.9	69%	0.691	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.9	9.3	-175.2	0	0	0	0	0	115.7	A455 R572	A455-G457 PolarHBondContact O-N 3.29Å; G457-R572 PolarHBondContact O-NH2 2.92Å
458	V	88.4	Confident	90.8	Very high	20 Å²	20	70.5 Å²	70.5	12%	0.121	42%	0.421	C	S	.	.			trans	-82.4	135.4	173.5	-175.4	0	0	0	0	109.3	A455 E456 D462 M463 R466 N562	A455-V458 WeakPolarHBondContact O-CB 3.32Å; A455-V458 WeakPolarHBondContact O-CG2 3.34Å; A455-V458 PolarHBondContact O-N 2.83Å; E456-V458 PolarHBondContact O-N 3.22Å; V458-D462 HydrophobicContact CG1-CB 3.91Å; V458-M463 HydrophobicContact CB-CG 4.19Å; V458-M463 HydrophobicContact CB-SD 4.01Å; V458-M463 HydrophobicContact CG1-CG 3.77Å; V458-M463 HydrophobicContact CG1-SD 3.67Å; V458-R466 VanDerWaalsContact CG1-NH1 3.33Å; V458-N562 WeakPolarHBondContact CG2-OD1 3.38Å
459	S	89.5	Confident	90.9	Very high	43 Å²	43	72.3 Å²	72.3	30%	0.301	43%	0.428	S	S	.	.			trans	-73.6	150.7	179.6	73.4	0	0	0	0	112	A461 D462 M463	S459-A461 VanDerWaalsContact C-N 3.28Å; S459-A461 PolarHBondContact O-N 3.04Å; S459-D462 WeakPolarHBondContact O-CA 3.3Å; S459-D462 WeakPolarHBondContact O-CB 3.26Å; S459-D462 PolarHBondContact O-N 2.88Å; S459-D462 WeakPolarHBondContact OG-CB 3.42Å; S459-D462 PolarHBondContact OG-N 3.34Å; S459-M463 PolarHBondContact O-N 3.36Å
460	A	90.4	Very high	91	Very high	86 Å²	86	68.6 Å²	68.6	71%	0.711	42%	0.418	S	S	*	.	H	α-helix	trans	-57.1	-40	-178.2	0	0	0	0	0	112.9	D462 M463 A464	A460-D462 VanDerWaalsContact C-N 3.28Å; A460-D462 PolarHBondContact O-N 3.12Å; A460-M463 PolarHBondContact O-N 2.71Å; A460-A464 WeakPolarHBondContact O-CB 3.47Å; A460-A464 PolarHBondContact O-N 3.19Å
461	A	90.8	Very high	91.1	Very high	67 Å²	67	70.8 Å²	70.8	55%	0.554	42%	0.419	S	S	*	.	H	α-helix	trans	-65.7	-28.9	175.4	0	0	0	0	0	113.1	S459 K465	S459-A461 VanDerWaalsContact C-N 3.28Å; S459-A461 PolarHBondContact O-N 3.04Å; A461-K465 WeakPolarHBondContact O-CG 3.33Å; A461-K465 PolarHBondContact O-N 2.89Å
462	D	91.4	Very high	91.3	Very high	1 Å²	1	69.6 Å²	69.6	1%	0.005	39%	0.392	C	S	.	.	H	α-helix	trans	-82.3	-29.4	177	-157.2	54.8	0	0	0	112	V458 S459 A460 R466 N493	V458-D462 HydrophobicContact CG1-CB 3.91Å; S459-D462 WeakPolarHBondContact O-CA 3.3Å; S459-D462 WeakPolarHBondContact O-CB 3.26Å; S459-D462 PolarHBondContact O-N 2.88Å; S459-D462 WeakPolarHBondContact OG-CB 3.42Å; S459-D462 PolarHBondContact OG-N 3.34Å; A460-D462 VanDerWaalsContact C-N 3.28Å; A460-D462 PolarHBondContact O-N 3.12Å; D462-R466 VanDerWaalsContact CG-NH1 3.29Å; D462-R466 PolarHBondContact O-N 3.25Å; D462-R466 PolarHBondContact O-NH1 2.84Å; D462-R466 IonicContact OD2-CZ 3.86Å; D462-R466 IonicContact OD2-NH1 2.69Å; D462-R466 PolarHBondContact OD2-NH1 3.13Å; D462-R466 IonicContact OD2-NH2 2.91Å; D462-R466 PolarHBondContact OD2-NH2 3.1Å; D462-N493 PolarHBondContact OD1-ND2 3.2Å
463	M	91.1	Very high	91.4	Very high	35 Å²	35	68.2 Å²	68.2	17%	0.172	38%	0.382	C	S	.	.	H	α-helix	trans	-67	-46.7	167.1	-72.1	-56.7	-58.8	0	0	111.9	I448 A450 A455 V458 S459 A460 K465 R466 E467	I448-M463 HydrophobicContact CG2-SD 4.48Å; A450-M463 HydrophobicContact CB-CE 4.17Å; A455-M463 HydrophobicContact CB-CE 4.23Å; A455-M463 HydrophobicContact CB-SD 4.08Å; V458-M463 HydrophobicContact CB-CG 4.19Å; V458-M463 HydrophobicContact CB-SD 4.01Å; V458-M463 HydrophobicContact CG1-CG 3.77Å; V458-M463 HydrophobicContact CG1-SD 3.67Å; S459-M463 PolarHBondContact O-N 3.36Å; A460-M463 PolarHBondContact O-N 2.71Å; M463-K465 VanDerWaalsContact C-N 3.27Å; M463-K465 PolarHBondContact O-N 2.93Å; M463-R466 WeakPolarHBondContact O-CB 3.3Å; M463-R466 PolarHBondContact O-N 3.43Å; M463-E467 PolarHBondContact O-N 3Å
464	A	93	Very high	91.5	Very high	56 Å²	56	66 Å²	66	46%	0.463	37%	0.374	S	S	.	.	H	α-helix	trans	-59.2	-36.4	178.2	0	0	0	0	0	112.6	A460 E467 R468	A460-A464 WeakPolarHBondContact O-CB 3.47Å; A460-A464 PolarHBondContact O-N 3.19Å; A464-E467 PolarHBondContact O-N 2.7Å; A464-R468 PolarHBondContact O-N 2.83Å
465	K	92.3	Very high	91.8	Very high	84 Å²	84	69.4 Å²	69.4	37%	0.365	38%	0.384	S	S	.	.	H	α-helix	trans	-60.1	-47.6	170.5	-74.7	169.6	-173.4	169.6	0	112.3	A461 M463 E467 R468 F469 N493 I574	A461-K465 WeakPolarHBondContact O-CG 3.33Å; A461-K465 PolarHBondContact O-N 2.89Å; M463-K465 VanDerWaalsContact C-N 3.27Å; M463-K465 PolarHBondContact O-N 2.93Å; K465-E467 VanDerWaalsContact C-N 3.33Å; K465-E467 PolarHBondContact O-N 2.83Å; K465-R468 PolarHBondContact O-N 3.41Å; K465-F469 HydrophobicContact CB-CD2 4.47Å; K465-F469 HydrophobicContact CB-CE2 4.19Å; K465-F469 WeakPolarHBondContact O-CD2 3.36Å; K465-F469 WeakPolarHBondContact O-CG 3.29Å; K465-F469 PolarHBondContact O-N 3.18Å; K465-N493 PolarHBondContact NZ-OD1 3.47Å; K465-I574 HydrophobicContact CB-CD1 4.12Å
466	R	93.4	Very high	92	Very high	14 Å²	14	74 Å²	74	5%	0.053	40%	0.4	C	S	.	.	H	α-helix	trans	-62.1	-40.7	179	-72.1	-174.9	-171.8	73.7	5.4	111.8	V458 D462 M463 F469 E470 I574	V458-R466 VanDerWaalsContact CG1-NH1 3.33Å; D462-R466 VanDerWaalsContact CG-NH1 3.29Å; D462-R466 PolarHBondContact O-N 3.25Å; D462-R466 PolarHBondContact O-NH1 2.84Å; D462-R466 IonicContact OD2-CZ 3.86Å; D462-R466 IonicContact OD2-NH1 2.69Å; D462-R466 PolarHBondContact OD2-NH1 3.13Å; D462-R466 IonicContact OD2-NH2 2.91Å; D462-R466 PolarHBondContact OD2-NH2 3.1Å; M463-R466 WeakPolarHBondContact O-CB 3.3Å; M463-R466 PolarHBondContact O-N 3.43Å; R466-F469 PolarHBondContact O-N 3.12Å; R466-E470 PolarHBondContact O-N 3.17Å; R466-I574 HydrophobicContact CG-CD1 3.64Å; R466-I574 HydrophobicContact CG-CG1 3.95Å; R466-I574 HydrophobicContact CG-CG2 4.31Å
467	E	93.1	Very high	92.2	Very high	128 Å²	128	69 Å²	69	60%	0.598	38%	0.378	S	S	*	.	H	α-helix	trans	-63.3	-45.1	175	-174.7	166.3	-157	0	0	111.9	M463 A464 K465 F469 E470 L471	M463-E467 PolarHBondContact O-N 3Å; A464-E467 PolarHBondContact O-N 2.7Å; K465-E467 VanDerWaalsContact C-N 3.33Å; K465-E467 PolarHBondContact O-N 2.83Å; E467-F469 VanDerWaalsContact C-N 3.32Å; E467-F469 PolarHBondContact O-N 3.26Å; E467-E470 PolarHBondContact O-N 3.43Å; E467-L471 HydrophobicContact CG-CD1 4.29Å; E467-L471 WeakPolarHBondContact O-CG 3.49Å; E467-L471 PolarHBondContact O-N 2.71Å
468	R	94.1	Very high	92.5	Very high	137 Å²	137	72.8 Å²	72.8	52%	0.517	38%	0.375	S	S	.	.	H	α-helix	trans	-58.5	-42.5	173.4	-171.5	176.2	-178.4	179.3	1.4	112	E254 A464 K465 L472	E254-R468 IonicContact OE1-NH2 3.63Å; E254-R468 IonicContact OE2-CZ 2.71Å; E254-R468 IonicContact OE2-NH1 3.82Å; E254-R468 IonicContact OE2-NH2 3.45Å; E254-R468 PolarHBondContact OE2-NH2 2.97Å; A464-R468 PolarHBondContact O-N 2.83Å; K465-R468 PolarHBondContact O-N 3.41Å; R468-L472 HydrophobicContact CG-CD1 4.13Å; R468-L472 VanDerWaalsContact O-CG 3.31Å; R468-L472 WeakPolarHBondContact O-CG 3.46Å; R468-L472 PolarHBondContact O-N 2.87Å; R468-L472 VanDerWaalsContact O-N 3.09Å
469	F	93	Very high	92.7	Very high	56 Å²	56	75.6 Å²	75.6	25%	0.246	39%	0.389	C	S	.	.	H	α-helix	trans	-66	-42.4	175.8	-68.3	-53.9	0	0	0	112.4	K465 R466 E467 L471 L472 K473 H492 I574	K465-F469 HydrophobicContact CB-CD2 4.47Å; K465-F469 HydrophobicContact CB-CE2 4.19Å; K465-F469 WeakPolarHBondContact O-CD2 3.36Å; K465-F469 WeakPolarHBondContact O-CG 3.29Å; K465-F469 PolarHBondContact O-N 3.18Å; R466-F469 PolarHBondContact O-N 3.12Å; E467-F469 VanDerWaalsContact C-N 3.32Å; E467-F469 PolarHBondContact O-N 3.26Å; F469-L471 PolarHBondContact O-N 3.01Å; F469-L472 PolarHBondContact O-N 2.8Å; F469-K473 WeakPolarHBondContact O-CB 3.33Å; F469-K473 PolarHBondContact O-N 3.16Å; F469-H492 AromaticContact CE1-CE1 3.89Å; F469-H492 AromaticContact CE1-ND1 3.89Å; F469-H492 AromaticContact CE1-NE2 3.99Å; F469-H492 HydrophobicContact CE2-CB 3.92Å; F469-H492 HydrophobicContact CZ-CB 3.89Å; F469-H492 AromaticContact CZ-CG 3.74Å; F469-H492 AromaticContact CZ-ND1 3.85Å; F469-I574 HydrophobicContact CD2-CD1 4.09Å; F469-I574 HydrophobicContact CD2-CG2 4.37Å; F469-I574 HydrophobicContact CE2-CD1 3.98Å
470	E	92.7	Very high	92.8	Very high	79 Å²	79	81.1 Å²	81.1	37%	0.369	41%	0.41	S	S	.	.	H	α-helix	trans	-61.4	-42.4	175.9	-176.5	173.3	-159.3	0	0	111.8	L447 R466 E467 K473 H474	L447-E470 HydrophobicContact CD1-CB 4.41Å; L447-E470 HydrophobicContact CD1-CG 4.25Å; L447-E470 WeakPolarHBondContact CD1-OE2 3.35Å; L447-E470 WeakPolarHBondContact CD2-OE1 3.35Å; R466-E470 PolarHBondContact O-N 3.17Å; E467-E470 PolarHBondContact O-N 3.43Å; E470-K473 PolarHBondContact O-N 2.86Å; E470-H474 VanDerWaalsContact O-CB 3.3Å; E470-H474 WeakPolarHBondContact O-CB 3.42Å; E470-H474 PolarHBondContact O-N 2.86Å
471	L	93.3	Very high	92.9	Very high	111 Å²	111	80.2 Å²	80.2	58%	0.581	39%	0.394	S	S	*	.	H	α-helix	trans	-63	-48.9	177.4	-70.4	171.3	0	0	0	111.9	E467 F469 K473 H474 Q475	E467-L471 HydrophobicContact CG-CD1 4.29Å; E467-L471 WeakPolarHBondContact O-CG 3.49Å; E467-L471 PolarHBondContact O-N 2.71Å; F469-L471 PolarHBondContact O-N 3.01Å; L471-K473 VanDerWaalsContact C-N 3.33Å; L471-K473 PolarHBondContact O-N 3.24Å; L471-H474 PolarHBondContact O-N 3.09Å; L471-Q475 WeakPolarHBondContact O-CB 3.44Å; L471-Q475 PolarHBondContact O-N 3.4Å
472	L	93.6	Very high	93.1	Very high	63 Å²	63	78 Å²	78	33%	0.33	37%	0.372	S	S	.	.	H	α-helix	trans	-62.4	-39.4	176.6	-71.1	170.1	0	0	0	112.1	R468 F469 Q475 K476	R468-L472 HydrophobicContact CG-CD1 4.13Å; R468-L472 VanDerWaalsContact O-CG 3.31Å; R468-L472 WeakPolarHBondContact O-CG 3.46Å; R468-L472 PolarHBondContact O-N 2.87Å; R468-L472 VanDerWaalsContact O-N 3.09Å; F469-L472 PolarHBondContact O-N 2.8Å; L472-Q475 PolarHBondContact O-N 3.43Å; L472-K476 WeakPolarHBondContact O-CB 3.43Å; L472-K476 WeakPolarHBondContact O-CG 3.48Å; L472-K476 PolarHBondContact O-N 2.86Å
473	K	93.9	Very high	93.2	Very high	15 Å²	15	79.1 Å²	79.1	7%	0.065	38%	0.377	C	S	.	.	H	α-helix	trans	-63.4	-45.9	175.1	-174	-170.1	-153.8	174.1	0	111.2	A443 F469 E470 L471 K476 L477 E576 L579	A443-K473 VanDerWaalsContact O-CE 3.28Å; A443-K473 WeakPolarHBondContact O-CE 3.27Å; A443-K473 PolarHBondContact O-NZ 2.78Å; F469-K473 WeakPolarHBondContact O-CB 3.33Å; F469-K473 PolarHBondContact O-N 3.16Å; E470-K473 PolarHBondContact O-N 2.86Å; L471-K473 VanDerWaalsContact C-N 3.33Å; L471-K473 PolarHBondContact O-N 3.24Å; K473-K476 PolarHBondContact O-N 3.1Å; K473-L477 HydrophobicContact CG-CD1 4.18Å; K473-L477 WeakPolarHBondContact O-CB 3.36Å; K473-L477 VanDerWaalsContact O-CG 3.29Å; K473-L477 WeakPolarHBondContact O-CG 3.47Å; K473-L477 PolarHBondContact O-N 3.47Å; K473-E576 VanDerWaalsContact CD-OE2 3.32Å; K473-E576 WeakPolarHBondContact CD-OE2 3.37Å; K473-E576 WeakPolarHBondContact CE-OE2 3.4Å; K473-E576 IonicContact NZ-OE1 3.48Å; K473-E576 PolarHBondContact NZ-OE1 3.04Å; K473-E576 IonicContact NZ-OE2 3.02Å; K473-E576 PolarHBondContact NZ-OE2 3.02Å; K473-L579 HydrophobicContact CB-CD1 4.47Å; K473-L579 HydrophobicContact CG-CD1 4.03Å
474	H	93.2	Very high	93.4	Very high	131 Å²	131	77.4 Å²	77.4	61%	0.606	37%	0.369	S	S	*	.	H	α-helix	trans	-67.6	-36.9	178	-174.6	-110.6	0	0	0	112.2	E470 L471 L477 K478	E470-H474 VanDerWaalsContact O-CB 3.3Å; E470-H474 WeakPolarHBondContact O-CB 3.42Å; E470-H474 PolarHBondContact O-N 2.86Å; L471-H474 PolarHBondContact O-N 3.09Å; H474-L477 PolarHBondContact O-N 2.87Å; H474-K478 PolarHBondContact O-N 2.94Å
475	Q	94.4	Very high	93.5	Very high	114 Å²	114	75 Å²	75	53%	0.533	35%	0.348	S	S	.	.	H	α-helix	trans	-61	-52	172	-177.7	174.3	-2	0	0	111.3	L471 L472 L477 K478	L471-Q475 WeakPolarHBondContact O-CB 3.44Å; L471-Q475 PolarHBondContact O-N 3.4Å; L472-Q475 PolarHBondContact O-N 3.43Å; Q475-L477 VanDerWaalsContact C-N 3.3Å; Q475-L477 PolarHBondContact O-N 3.07Å; Q475-K478 VanDerWaalsContact O-CB 3.26Å; Q475-K478 WeakPolarHBondContact O-CB 3.48Å; Q475-K478 WeakPolarHBondContact O-CG 3.31Å; Q475-K478 PolarHBondContact O-N 2.94Å; Q475-K478 VanDerWaalsContact O-N 3.14Å
476	K	94.4	Very high	93.6	Very high	114 Å²	114	76.7 Å²	76.7	50%	0.496	35%	0.352	S	S	.	.	H	α-helix	trans	-62.7	-33.3	177.7	-71.8	173	-179.3	179.1	0	112.8	L472 K473 K478 D479 I482 L579	L472-K476 WeakPolarHBondContact O-CB 3.43Å; L472-K476 WeakPolarHBondContact O-CG 3.48Å; L472-K476 PolarHBondContact O-N 2.86Å; K473-K476 PolarHBondContact O-N 3.1Å; K476-K478 VanDerWaalsContact C-N 3.25Å; K476-K478 PolarHBondContact O-N 3.47Å; K476-D479 PolarHBondContact O-N 3.3Å; K476-I482 HydrophobicContact CB-CD1 4.15Å; K476-I482 WeakPolarHBondContact O-CD1 3.29Å; K476-L579 HydrophobicContact CB-CD1 3.75Å; K476-L579 HydrophobicContact CD-CD1 4.41Å
477	L	94	Very high	93.7	Very high	29 Å²	29	77.2 Å²	77.2	15%	0.152	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-6.9	177	-74.7	174.3	0	0	0	114.9	R438 L440 A443 K473 H474 Q475 D479 I482 V484 L579	R438-L477 PolarHBondContact NH2-O 2.98Å; L440-L477 HydrophobicContact CD2-CD2 3.77Å; A443-L477 HydrophobicContact CB-CD1 3.71Å; K473-L477 HydrophobicContact CG-CD1 4.18Å; K473-L477 WeakPolarHBondContact O-CB 3.36Å; K473-L477 VanDerWaalsContact O-CG 3.29Å; K473-L477 WeakPolarHBondContact O-CG 3.47Å; K473-L477 PolarHBondContact O-N 3.47Å; H474-L477 PolarHBondContact O-N 2.87Å; Q475-L477 VanDerWaalsContact C-N 3.3Å; Q475-L477 PolarHBondContact O-N 3.07Å; L477-D479 VanDerWaalsContact C-N 3.25Å; L477-D479 PolarHBondContact O-N 2.94Å; L477-I482 HydrophobicContact CD2-CG2 4.36Å; L477-V484 HydrophobicContact CD2-CG2 4.3Å; L477-L579 HydrophobicContact CD1-CD2 4.32Å; L477-L579 HydrophobicContact CD2-CD2 3.76Å; L477-L579 HydrophobicContact CG-CD1 4.24Å; L477-L579 HydrophobicContact CG-CD2 4.05Å
478	K	93	Very high	93.9	Very high	145 Å²	145	73.7 Å²	73.7	63%	0.63	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-39	166.7	-64.8	173.3	-177.2	174.5	0	111	H474 Q475 K476 Q480	H474-K478 PolarHBondContact O-N 2.94Å; Q475-K478 VanDerWaalsContact O-CB 3.26Å; Q475-K478 WeakPolarHBondContact O-CB 3.48Å; Q475-K478 WeakPolarHBondContact O-CG 3.31Å; Q475-K478 PolarHBondContact O-N 2.94Å; Q475-K478 VanDerWaalsContact O-N 3.14Å; K476-K478 VanDerWaalsContact C-N 3.25Å; K476-K478 PolarHBondContact O-N 3.47Å; K478-Q480 PolarHBondContact O-N 3.38Å
479	D	92.4	Very high	94	Very high	80 Å²	80	67.1 Å²	67.1	43%	0.428	31%	0.314	S	S	.	.	S	Bend	trans	-71.4	122.6	-178.3	-71.5	3.1	0	0	0	111.4	R438 K476 L477 N481 I482	R438-D479 PolarHBondContact NH2-O 3.3Å; K476-D479 PolarHBondContact O-N 3.3Å; L477-D479 VanDerWaalsContact C-N 3.25Å; L477-D479 PolarHBondContact O-N 2.94Å; D479-N481 PolarHBondContact O-N 2.85Å; D479-I482 HydrophobicContact CB-CB 4.38Å; D479-I482 HydrophobicContact CB-CD1 4.08Å; D479-I482 HydrophobicContact CB-CG1 4.06Å; D479-I482 PolarHBondContact O-N 3.22Å; D479-I482 VanDerWaalsContact O-N 3.12Å
480	Q	91.8	Very high	94.2	Very high	158 Å²	158	65 Å²	65	74%	0.738	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-23	-175.6	-56.7	-169.2	46	0	0	113.2	R438 K478 I482	R438-Q480 WeakPolarHBondContact CD-O 3.47Å; R438-Q480 PolarHBondContact NE-O 3.21Å; K478-Q480 PolarHBondContact O-N 3.38Å; Q480-I482 VanDerWaalsContact C-N 3.34Å
481	N	92.1	Very high	94.3	Very high	68 Å²	68	61.4 Å²	61.4	36%	0.364	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-22	176.6	-64.7	-34.2	0	0	0	113.3	D479 D581 R582 R583	D479-N481 PolarHBondContact O-N 2.85Å; N481-D581 WeakPolarHBondContact CB-OD1 3.44Å; N481-R582 PolarHBondContact O-N 2.75Å; N481-R583 HydrophobicContact CB-CG 4.47Å; N481-R583 PolarHBondContact ND2-NE 2.81Å
482	I	94.2	Very high	94.3	Very high	20 Å²	20	57.9 Å²	57.9	10%	0.103	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	131.7	178.8	-63.7	-177.7	0	0	0	109.7	R438 K476 L477 D479 Q480 L579 E580 D581	R438-I482 PolarHBondContact NE-O 3.43Å; R438-I482 PolarHBondContact NH2-O 2.89Å; K476-I482 HydrophobicContact CB-CD1 4.15Å; K476-I482 WeakPolarHBondContact O-CD1 3.29Å; L477-I482 HydrophobicContact CD2-CG2 4.36Å; D479-I482 HydrophobicContact CB-CB 4.38Å; D479-I482 HydrophobicContact CB-CD1 4.08Å; D479-I482 HydrophobicContact CB-CG1 4.06Å; D479-I482 PolarHBondContact O-N 3.22Å; D479-I482 VanDerWaalsContact O-N 3.12Å; Q480-I482 VanDerWaalsContact C-N 3.34Å; I482-L579 HydrophobicContact CG2-CB 4Å; I482-L579 HydrophobicContact CG2-CD1 4.38Å; I482-E580 CarbonylContact C-O 3.47Å; I482-E580 VanDerWaalsContact CA-O 3.31Å; I482-E580 WeakPolarHBondContact CA-O 3.25Å; I482-D581 HydrophobicContact CG1-CB 4.1Å
483	F	94.6	Very high	94.2	Very high	24 Å²	24	55.9 Å²	55.9	11%	0.105	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	168.4	179.5	71.4	-75.8	0	0	0	111.6	R438 L579 E580 R582 L585	R438-F483 HydrophobicContact CB-CB 4.07Å; R438-F483 HydrophobicContact CG-CB 4.27Å; F483-L579 WeakPolarHBondContact O-CA 3.08Å; F483-E580 HydrophobicContact CD1-CB 4.23Å; F483-E580 WeakPolarHBondContact CD1-O 3.38Å; F483-E580 HydrophobicContact CE1-CB 3.64Å; F483-E580 WeakPolarHBondContact CE1-O 3.18Å; F483-E580 HydrophobicContact CE2-CB 4.4Å; F483-E580 HydrophobicContact CZ-CB 3.73Å; F483-E580 WeakPolarHBondContact CZ-OE2 3.31Å; F483-E580 PolarHBondContact N-O 2.91Å; F483-E580 PolarHBondContact O-N 3.27Å; F483-R582 HydrophobicContact CD1-CG 3.63Å; F483-R582 HydrophobicContact CE1-CG 3.71Å; F483-L585 HydrophobicContact CE1-CD1 3.71Å; F483-L585 HydrophobicContact CZ-CD1 3.54Å
484	V	95.4	Very high	94.1	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	127.7	177.4	-167.8	0	0	0	0	109.8	R438 N439 L442 A443 L477 F577 L579	R438-V484 PolarHBondContact O-N 2.87Å; N439-V484 HydrophobicContact CB-CB 4.23Å; N439-V484 WeakPolarHBondContact CB-O 3.13Å; N439-V484 PolarHBondContact ND2-O 2.92Å; L442-V484 HydrophobicContact CB-CB 4.26Å; L442-V484 HydrophobicContact CB-CG1 3.63Å; A443-V484 HydrophobicContact CB-CG2 3.96Å; L477-V484 HydrophobicContact CD2-CG2 4.3Å; V484-F577 HydrophobicContact CG1-CB 3.38Å; V484-F577 HydrophobicContact CG1-CG 4.32Å; V484-L579 HydrophobicContact CG2-CD2 4Å
485	S	95.2	Very high	94.1	Very high	5 Å²	5	50.7 Å²	50.7	4%	0.035	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	148.5	174.6	-159.8	0	0	0	0	111.3	R488 F577 S578 E580	S485-R488 VanDerWaalsContact OG-CB 3.27Å; S485-R488 WeakPolarHBondContact OG-CB 3.36Å; S485-R488 PolarHBondContact OG-N 2.94Å; S485-F577 VanDerWaalsContact O-CD1 3.31Å; S485-F577 WeakPolarHBondContact O-CD1 3.28Å; S485-S578 WeakPolarHBondContact CB-O 3.41Å; S485-S578 PolarHBondContact N-O 3.08Å; S485-E580 WeakPolarHBondContact CB-OE1 3.45Å; S485-E580 PolarHBondContact OG-OE1 2.93Å
486	R	94.4	Very high	93.9	Very high	119 Å²	119	51.9 Å²	51.9	45%	0.449	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	-28.8	174.7	-65.8	-172.6	-177.6	171.2	1.5	112.9	N439 L442 H550 F577	N439-R486 PolarHBondContact OD1-NE 3.38Å; N439-R486 PolarHBondContact OD1-NH2 3.31Å; L442-R486 HydrophobicContact CD1-CG 4.11Å; R486-H550 HydrophobicContact CB-CB 4.37Å; R486-H550 PolarHBondContact O-ND1 3Å; R486-F577 WeakPolarHBondContact O-CE1 3.28Å
487	T	95.7	Very high	93.7	Very high	26 Å²	26	50.7 Å²	50.7	16%	0.16	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	-23.1	-171.1	46.1	0	0	0	0	113.2	E546 F547	T487-E546 PolarHBondContact OG1-OE1 3.05Å; T487-F547 VanDerWaalsContact CB-O 3.28Å; T487-F547 WeakPolarHBondContact CB-O 3.36Å; T487-F547 PolarHBondContact O-N 3.01Å
488	R	96.5	Very high	93.6	Very high	53 Å²	53	49.8 Å²	49.8	20%	0.2	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	118.5	-175.7	-153.9	163.2	-176.5	-114.2	3.9	111.8	S485 E521 A545 E546 S578	S485-R488 VanDerWaalsContact OG-CB 3.27Å; S485-R488 WeakPolarHBondContact OG-CB 3.36Å; S485-R488 PolarHBondContact OG-N 2.94Å; R488-E521 IonicContact CZ-OE2 2.76Å; R488-E521 IonicContact NE-OE2 3.37Å; R488-E521 PolarHBondContact NE-OE2 3.46Å; R488-E521 IonicContact NH2-OE1 2.7Å; R488-E521 IonicContact NH2-OE2 3.82Å; R488-E521 PolarHBondContact NH2-OE2 3.41Å; R488-A545 CarbonylContact C-O 3.46Å; R488-A545 WeakPolarHBondContact CA-O 3.42Å; R488-E546 HydrophobicContact CB-CB 4.32Å; R488-E546 HydrophobicContact CB-CG 4.04Å; R488-E546 HydrophobicContact CG-CB 3.99Å; R488-E546 HydrophobicContact CG-CG 4.22Å; R488-S578 WeakPolarHBondContact O-CB 3.27Å; R488-S578 PolarHBondContact O-N 3.09Å; R488-S578 PolarHBondContact O-OG 3.27Å; R488-S578 VanDerWaalsContact O-OG 3.05Å
489	L	96.8	Very high	93.6	Very high	0 Å²	0	45 Å²	45	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	146.2	172.8	-56.9	-175.2	0	0	0	111	F544 A545 F547 A553 A556 L557 V575 E576 F577 S578	L489-F544 WeakPolarHBondContact O-CA 3.35Å; L489-A545 PolarHBondContact N-O 3.19Å; L489-A545 PolarHBondContact O-N 3.42Å; L489-F547 HydrophobicContact CD1-CE2 3.88Å; L489-F547 HydrophobicContact CG-CE2 4.34Å; L489-A553 HydrophobicContact CD2-CB 4.24Å; L489-A553 HydrophobicContact CG-CB 4.35Å; L489-A556 HydrophobicContact CD1-CB 4.16Å; L489-L557 HydrophobicContact CD1-CB 4.22Å; L489-L557 HydrophobicContact CD2-CB 4.25Å; L489-L557 HydrophobicContact CD2-CD1 4.09Å; L489-V575 HydrophobicContact CB-CG1 4.36Å; L489-V575 HydrophobicContact CD1-CG1 3.95Å; L489-E576 CarbonylContact C-O 3.52Å; L489-E576 VanDerWaalsContact CA-O 3.31Å; L489-E576 WeakPolarHBondContact CA-O 3.43Å; L489-F577 HydrophobicContact CD2-CD1 3.62Å; L489-F577 HydrophobicContact CD2-CE1 3.71Å; L489-F577 HydrophobicContact CD2-CG 4.17Å; L489-F577 HydrophobicContact CD2-CZ 4.33Å; L489-S578 VanDerWaalsContact C-OG 3.27Å; L489-S578 PolarHBondContact O-OG 2.88Å
490	C	95.8	Very high	93.6	Very high	12 Å²	12	43 Å²	43	8%	0.081	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	136.6	164.5	-162.9	0	0	0	0	109	H492 F544 E576 S578	C490-H492 PolarHBondContact SG-NE2 3.28Å; C490-F544 HydrophobicContact CB-CD1 4.05Å; C490-F544 HydrophobicContact CB-CE1 3.92Å; C490-F544 WeakPolarHBondContact SG-CE1 3.5Å; C490-E576 PolarHBondContact N-O 3.26Å; C490-E576 PolarHBondContact O-N 3.1Å; C490-S578 PolarHBondContact N-OG 2.96Å
491	L	95.2	Very high	93.7	Very high	2 Å²	2	44 Å²	44	1%	0.01	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	105.3	-168.4	-64.1	161.5	0	0	0	107.8	L494 L503 L507 Y542 A543 A545 V575	L491-L494 HydrophobicContact CB-CD1 4.26Å; L491-L494 HydrophobicContact CB-CD2 4.49Å; L491-L503 HydrophobicContact CD1-CD1 4.22Å; L491-L503 HydrophobicContact CD1-CD2 3.9Å; L491-L503 HydrophobicContact CD1-CG 4.27Å; L491-L507 HydrophobicContact CD1-CD1 4.31Å; L491-L507 HydrophobicContact CD1-CD2 4.4Å; L491-Y542 CarbonylContact O-C 3.51Å; L491-Y542 WeakPolarHBondContact O-CA 3Å; L491-Y542 WeakPolarHBondContact O-CB 3.48Å; L491-A543 HydrophobicContact CB-CB 4.23Å; L491-A543 HydrophobicContact CD1-CB 4.43Å; L491-A543 PolarHBondContact N-O 2.77Å; L491-A543 PolarHBondContact O-N 3.34Å; L491-A545 HydrophobicContact CD1-CB 4.07Å; L491-V575 HydrophobicContact CD2-CB 4.09Å; L491-V575 HydrophobicContact CD2-CG1 3.55Å; L491-V575 HydrophobicContact CD2-CG2 3.58Å
492	H	93.8	Very high	93.8	Very high	37 Å²	37	45.7 Å²	45.7	17%	0.171	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	167.1	-178.3	-65.9	-69.7	0	0	0	112.2	F469 C490 L494 Y542 I574	F469-H492 AromaticContact CE1-CE1 3.89Å; F469-H492 AromaticContact CE1-ND1 3.89Å; F469-H492 AromaticContact CE1-NE2 3.99Å; F469-H492 HydrophobicContact CE2-CB 3.92Å; F469-H492 HydrophobicContact CZ-CB 3.89Å; F469-H492 AromaticContact CZ-CG 3.74Å; F469-H492 AromaticContact CZ-ND1 3.85Å; C490-H492 PolarHBondContact SG-NE2 3.28Å; H492-L494 VanDerWaalsContact C-N 3.31Å; H492-L494 PolarHBondContact O-N 3.23Å; H492-Y542 WeakPolarHBondContact ND1-CB 3.29Å; H492-I574 HydrophobicContact CB-CB 4.17Å; H492-I574 PolarHBondContact N-O 3.07Å; H492-I574 PolarHBondContact O-N 3.42Å; H492-I574 VanDerWaalsContact O-N 3.09Å
493	N	92.2	Very high	93.8	Very high	22 Å²	22	45 Å²	45	12%	0.118	22%	0.223	C	C	.	.	S	Bend	trans	69.3	21.6	178.7	-151.1	40.1	0	0	0	114.5	D462 K465 G541 R572 I574	D462-N493 PolarHBondContact OD1-ND2 3.2Å; K465-N493 PolarHBondContact NZ-OD1 3.47Å; N493-G541 PolarHBondContact N-O 2.84Å; N493-R572 PolarHBondContact ND2-O 3.41Å; N493-I574 HydrophobicContact CB-CD1 4.24Å; N493-I574 HydrophobicContact CB-CG1 4.35Å
494	L	92.1	Very high	93.8	Very high	9 Å²	9	48 Å²	48	5%	0.047	23%	0.234	C	C	.	.			trans	-70.8	138.4	-178.2	-55.4	-179.5	0	0	0	111.4	L491 H492 L503 G541 A543 F567	L491-L494 HydrophobicContact CB-CD1 4.26Å; L491-L494 HydrophobicContact CB-CD2 4.49Å; H492-L494 VanDerWaalsContact C-N 3.31Å; H492-L494 PolarHBondContact O-N 3.23Å; L494-L503 HydrophobicContact CD1-CD1 4.42Å; L494-L503 HydrophobicContact CD1-CD2 4.15Å; L494-L503 HydrophobicContact CD2-CD1 4.46Å; L494-G541 PolarHBondContact N-O 3.07Å; L494-G541 WeakPolarHBondContact O-CA 3.27Å; L494-A543 HydrophobicContact CD1-CB 3.57Å; L494-F567 HydrophobicContact CD2-CE2 3.53Å; L494-F567 HydrophobicContact CD2-CZ 3.96Å
495	P	92	Very high	93.7	Very high	27 Å²	27	55.8 Å²	55.8	18%	0.175	27%	0.268	C	S	.	.			trans	-59.8	139.7	169.8	-21.5	31.2	0	0	0	112	A497 V498 F567 K571	P495-A497 PolarHBondContact O-N 3.46Å; P495-V498 HydrophobicContact CB-CG2 4.11Å; P495-V498 HydrophobicContact CG-CG2 4.18Å; P495-V498 WeakPolarHBondContact O-CB 3.32Å; P495-V498 PolarHBondContact O-N 3.37Å; P495-F567 HydrophobicContact CG-CB 3.93Å; P495-F567 HydrophobicContact CG-CD1 3.73Å; P495-F567 HydrophobicContact CG-CD2 4.39Å; P495-F567 HydrophobicContact CG-CE1 4.37Å; P495-F567 HydrophobicContact CG-CG 3.76Å; P495-K571 HydrophobicContact CG-CD 4.43Å
496	K	90.6	Very high	93.6	Very high	140 Å²	140	58.2 Å²	58.2	61%	0.609	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-21	-178.2	-75.9	-165	167.6	-170.5	0	114.8	S539	K496-S539 WeakPolarHBondContact CE-O 3.49Å; K496-S539 WeakPolarHBondContact O-CB 3.34Å
497	A	90.9	Very high	93.5	Very high	88 Å²	88	52.5 Å²	52.5	73%	0.727	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	-7.7	177.8	0	0	0	0	0	114.4	P495 D499 Q502	P495-A497 PolarHBondContact O-N 3.46Å; A497-D499 PolarHBondContact O-N 2.85Å; A497-Q502 PolarHBondContact O-OE1 3.02Å
498	V	91.3	Very high	93.4	Very high	11 Å²	11	54.7 Å²	54.7	7%	0.067	27%	0.269	C	S	.	.			trans	-76.6	120.2	-178.2	178.5	0	0	0	0	110.8	P495 L503 F567	P495-V498 HydrophobicContact CB-CG2 4.11Å; P495-V498 HydrophobicContact CG-CG2 4.18Å; P495-V498 WeakPolarHBondContact O-CB 3.32Å; P495-V498 PolarHBondContact O-N 3.37Å; V498-L503 HydrophobicContact CG1-CB 4.14Å; V498-F567 HydrophobicContact CG2-CD1 4.27Å; V498-F567 HydrophobicContact CG2-CE1 3.55Å; V498-F567 HydrophobicContact CG2-CZ 4.03Å
499	D	92.2	Very high	93.1	Very high	44 Å²	44	55.6 Å²	55.6	24%	0.235	28%	0.283	C	S	.	.			trans	-103.3	154.9	-178.4	-150.1	50.2	0	0	0	111.2	A497 K501 Q502 L503 R526 K536	A497-D499 PolarHBondContact O-N 2.85Å; D499-K501 PolarHBondContact O-N 3.34Å; D499-Q502 WeakPolarHBondContact O-CA 3.5Å; D499-Q502 WeakPolarHBondContact O-CB 3.5Å; D499-Q502 PolarHBondContact O-N 3.08Å; D499-L503 PolarHBondContact O-N 3.02Å; D499-R526 IonicContact OD1-CZ 3.27Å; D499-R526 IonicContact OD1-NH2 2.71Å; D499-R526 PolarHBondContact OD1-NH2 3.15Å; D499-K536 IonicContact OD1-NZ 2.75Å; D499-K536 PolarHBondContact OD1-NZ 3.45Å; D499-K536 IonicContact OD2-NZ 3.61Å; D499-K536 PolarHBondContact OD2-NZ 2.9Å
500	D	93.9	Very high	92.7	Very high	39 Å²	39	56.3 Å²	56.3	21%	0.209	29%	0.289	C	S	.	.	H	α-helix	trans	-57.2	-32.4	-169.5	-57.7	35.3	0	0	0	112.9	R504 R523 V524 R526	D500-R504 VanDerWaalsContact O-CB 3.24Å; D500-R504 WeakPolarHBondContact O-CB 3.37Å; D500-R504 PolarHBondContact O-N 3.03Å; D500-R523 VanDerWaalsContact OD2-CA 3.3Å; D500-R523 WeakPolarHBondContact OD2-CA 3.31Å; D500-V524 WeakPolarHBondContact OD1-CB 3.35Å; D500-V524 WeakPolarHBondContact OD1-CG2 3.3Å; D500-V524 PolarHBondContact OD1-N 2.74Å; D500-V524 PolarHBondContact OD2-N 2.78Å; D500-V524 VanDerWaalsContact OD2-N 3.07Å; D500-R526 IonicContact OD1-CZ 2.68Å; D500-R526 IonicContact OD1-NH1 3.45Å; D500-R526 PolarHBondContact OD1-NH1 3.06Å; D500-R526 IonicContact OD1-NH2 2.96Å; D500-R526 PolarHBondContact OD1-NH2 3.43Å; D500-R526 IonicContact OD2-NH1 2.75Å
501	K	93.9	Very high	92.4	Very high	177 Å²	177	55.8 Å²	55.8	77%	0.77	29%	0.285	S	S	*	.	H	α-helix	trans	-66.2	-41.7	174.2	-68	-175.8	170.7	-178	0	112.3	D499 K505	D499-K501 PolarHBondContact O-N 3.34Å; K501-K505 PolarHBondContact O-N 3.3Å
502	Q	93.4	Very high	91.5	Very high	104 Å²	104	59.7 Å²	59.7	49%	0.486	31%	0.313	S	S	.	.	H	α-helix	trans	-68.5	-45.4	177.5	-63.8	169.7	-20.1	0	0	110.3	A497 D499 R504 K505 L506	A497-Q502 PolarHBondContact O-OE1 3.02Å; D499-Q502 WeakPolarHBondContact O-CA 3.5Å; D499-Q502 WeakPolarHBondContact O-CB 3.5Å; D499-Q502 PolarHBondContact O-N 3.08Å; Q502-R504 PolarHBondContact O-N 2.61Å; Q502-K505 WeakPolarHBondContact O-CB 3.36Å; Q502-K505 PolarHBondContact O-N 3.03Å; Q502-K505 VanDerWaalsContact O-N 3.13Å; Q502-L506 WeakPolarHBondContact O-CG 3.43Å; Q502-L506 PolarHBondContact O-N 3.14Å
503	L	93.8	Very high	90.5	Very high	6 Å²	6	61.6 Å²	61.6	3%	0.031	34%	0.342	C	S	.	.	H	α-helix	trans	-62.6	-41.9	178.1	-170.1	64.7	0	0	0	112	L491 L494 V498 D499 K505 L506 L507 V524 A543	L491-L503 HydrophobicContact CD1-CD1 4.22Å; L491-L503 HydrophobicContact CD1-CD2 3.9Å; L491-L503 HydrophobicContact CD1-CG 4.27Å; L494-L503 HydrophobicContact CD1-CD1 4.42Å; L494-L503 HydrophobicContact CD1-CD2 4.15Å; L494-L503 HydrophobicContact CD2-CD1 4.46Å; V498-L503 HydrophobicContact CG1-CB 4.14Å; D499-L503 PolarHBondContact O-N 3.02Å; L503-K505 VanDerWaalsContact C-N 3.34Å; L503-K505 PolarHBondContact O-N 3.25Å; L503-L506 PolarHBondContact O-N 3.09Å; L503-L507 HydrophobicContact CG-CD1 4.25Å; L503-L507 WeakPolarHBondContact O-CD1 3.1Å; L503-L507 WeakPolarHBondContact O-CG 3.35Å; L503-L507 PolarHBondContact O-N 3.37Å; L503-V524 HydrophobicContact CD2-CG2 3.86Å; L503-A543 HydrophobicContact CD2-CB 3.35Å
504	R	94.7	Very high	89.9	Confident	87 Å²	87	64.3 Å²	64.3	33%	0.328	35%	0.354	S	S	.	.	H	α-helix	trans	-61.5	-39.1	172.8	-173.6	177.4	-72.2	-97.1	3.8	112	D500 Q502 L508 I519 C522	D500-R504 VanDerWaalsContact O-CB 3.24Å; D500-R504 WeakPolarHBondContact O-CB 3.37Å; D500-R504 PolarHBondContact O-N 3.03Å; Q502-R504 PolarHBondContact O-N 2.61Å; R504-L508 HydrophobicContact CG-CD1 4.26Å; R504-L508 VanDerWaalsContact O-CG 3.3Å; R504-L508 WeakPolarHBondContact O-CG 3.34Å; R504-L508 PolarHBondContact O-N 2.86Å; R504-L508 VanDerWaalsContact O-N 3.11Å; R504-I519 HydrophobicContact CG-CD1 4.46Å; R504-I519 PolarHBondContact NH1-O 3.25Å; R504-C522 HydrophobicContact CB-CB 4.42Å
505	K	93.4	Very high	89.2	Confident	164 Å²	164	73.8 Å²	73.8	71%	0.713	40%	0.395	S	S	*	.	H	α-helix	trans	-63.6	-45.2	174	-170.8	177.8	179.1	-178.1	0	111.6	K501 Q502 L503 L507 L508 S509	K501-K505 PolarHBondContact O-N 3.3Å; Q502-K505 WeakPolarHBondContact O-CB 3.36Å; Q502-K505 PolarHBondContact O-N 3.03Å; Q502-K505 VanDerWaalsContact O-N 3.13Å; L503-K505 VanDerWaalsContact C-N 3.34Å; L503-K505 PolarHBondContact O-N 3.25Å; K505-L507 PolarHBondContact O-N 2.76Å; K505-L508 PolarHBondContact O-N 3.29Å; K505-S509 PolarHBondContact O-N 2.82Å; K505-S509 PolarHBondContact O-OG 2.95Å; K505-S509 VanDerWaalsContact O-OG 3.07Å
506	L	92.6	Very high	88.8	Confident	55 Å²	55	75.1 Å²	75.1	29%	0.288	41%	0.413	S	S	.	.	H	α-helix	trans	-59.7	-44	177.6	-73.2	171.5	0	0	0	112.5	Q502 L503 S509 A510 I566 F567	Q502-L506 WeakPolarHBondContact O-CG 3.43Å; Q502-L506 PolarHBondContact O-N 3.14Å; L503-L506 PolarHBondContact O-N 3.09Å; L506-S509 VanDerWaalsContact CA-OG 3.29Å; L506-S509 WeakPolarHBondContact CA-OG 3.45Å; L506-S509 PolarHBondContact O-N 2.79Å; L506-S509 PolarHBondContact O-OG 3.39Å; L506-A510 PolarHBondContact O-N 3.46Å; L506-I566 HydrophobicContact CD1-CG2 3.98Å; L506-I566 HydrophobicContact CD2-CG2 4.19Å; L506-F567 HydrophobicContact CD1-CE1 3.97Å; L506-F567 HydrophobicContact CD1-CZ 3.89Å
507	L	93.3	Very high	88.8	Confident	0 Å²	0	69.9 Å²	69.9	0%	0	39%	0.393	C	S	.	.	H	α-helix	trans	-62	-43.8	176.2	-71.6	160.9	0	0	0	111.7	L491 L503 K505 A510 T511 I519 A545 F547 A556 I560	L491-L507 HydrophobicContact CD1-CD1 4.31Å; L491-L507 HydrophobicContact CD1-CD2 4.4Å; L503-L507 HydrophobicContact CG-CD1 4.25Å; L503-L507 WeakPolarHBondContact O-CD1 3.1Å; L503-L507 WeakPolarHBondContact O-CG 3.35Å; L503-L507 PolarHBondContact O-N 3.37Å; K505-L507 PolarHBondContact O-N 2.76Å; L507-A510 PolarHBondContact O-N 2.94Å; L507-T511 PolarHBondContact O-N 3.35Å; L507-T511 VanDerWaalsContact O-N 3.16Å; L507-T511 PolarHBondContact O-OG1 3.3Å; L507-T511 VanDerWaalsContact O-OG1 3.1Å; L507-I519 HydrophobicContact CB-CD1 3.75Å; L507-A545 HydrophobicContact CD1-CB 3.55Å; L507-F547 HydrophobicContact CB-CZ 4.22Å; L507-F547 HydrophobicContact CD2-CE2 4.2Å; L507-F547 HydrophobicContact CD2-CZ 3.9Å; L507-A556 HydrophobicContact CD2-CB 4.33Å; L507-I560 HydrophobicContact CD2-CD1 3.67Å; L507-I560 HydrophobicContact CG-CD1 4.35Å
508	L	93	Very high	88.8	Confident	72 Å²	72	74 Å²	74	38%	0.377	39%	0.39	S	S	.	.	H	α-helix	trans	-66.9	-37.6	177.8	-70.6	169.9	0	0	0	112.9	R504 K505 T511 S512 V517 I519	R504-L508 HydrophobicContact CG-CD1 4.26Å; R504-L508 VanDerWaalsContact O-CG 3.3Å; R504-L508 WeakPolarHBondContact O-CG 3.34Å; R504-L508 PolarHBondContact O-N 2.86Å; R504-L508 VanDerWaalsContact O-N 3.11Å; K505-L508 PolarHBondContact O-N 3.29Å; L508-T511 WeakPolarHBondContact CA-OG1 3.35Å; L508-T511 PolarHBondContact O-N 2.89Å; L508-T511 PolarHBondContact O-OG1 2.88Å; L508-T511 VanDerWaalsContact O-OG1 3.06Å; L508-S512 PolarHBondContact O-N 3.47Å; L508-S512 VanDerWaalsContact O-N 3.09Å; L508-S512 PolarHBondContact O-OG 2.82Å; L508-V517 HydrophobicContact CD2-CG1 4.27Å; L508-I519 HydrophobicContact CD2-CD1 3.79Å; L508-I519 HydrophobicContact CD2-CG1 4.31Å; L508-I519 HydrophobicContact CG-CD1 3.86Å
509	S	91	Very high	89	Confident	71 Å²	71	74.2 Å²	74.2	50%	0.497	39%	0.391	S	S	.	.	H	α-helix	trans	-64.3	-39.1	173	42.8	0	0	0	0	112.3	K505 L506 T511 S512	K505-S509 PolarHBondContact O-N 2.82Å; K505-S509 PolarHBondContact O-OG 2.95Å; K505-S509 VanDerWaalsContact O-OG 3.07Å; L506-S509 VanDerWaalsContact CA-OG 3.29Å; L506-S509 WeakPolarHBondContact CA-OG 3.45Å; L506-S509 PolarHBondContact O-N 2.79Å; L506-S509 PolarHBondContact O-OG 3.39Å; S509-T511 VanDerWaalsContact C-N 3.34Å; S509-T511 PolarHBondContact O-N 3.23Å; S509-S512 WeakPolarHBondContact O-CB 3.27Å; S509-S512 PolarHBondContact O-N 3.26Å; S509-S512 PolarHBondContact O-OG 3.31Å
510	A	88.6	Confident	89	Confident	15 Å²	15	78 Å²	78	12%	0.124	41%	0.405	C	S	.	.	H	α-helix	trans	-65.5	-35.9	176.7	0	0	0	0	0	112.3	L506 L507 S512 L559 I560	L506-A510 PolarHBondContact O-N 3.46Å; L507-A510 PolarHBondContact O-N 2.94Å; A510-S512 VanDerWaalsContact C-N 3.35Å; A510-L559 HydrophobicContact CB-CB 4.25Å; A510-L559 WeakPolarHBondContact O-CD1 3.47Å; A510-I560 HydrophobicContact CB-CD1 3.88Å; A510-I560 HydrophobicContact CB-CG1 3.81Å
511	T	88.2	Confident	89	Confident	1 Å²	1	78.7 Å²	78.7	1%	0.006	41%	0.407	C	S	.	.	H	α-helix	trans	-83.8	-3.6	176.3	48.3	0	0	0	0	115	L507 L508 S509 G513 E514 V517 F547 H552 K555 A556	L507-T511 PolarHBondContact O-N 3.35Å; L507-T511 VanDerWaalsContact O-N 3.16Å; L507-T511 PolarHBondContact O-OG1 3.3Å; L507-T511 VanDerWaalsContact O-OG1 3.1Å; L508-T511 WeakPolarHBondContact CA-OG1 3.35Å; L508-T511 PolarHBondContact O-N 2.89Å; L508-T511 PolarHBondContact O-OG1 2.88Å; L508-T511 VanDerWaalsContact O-OG1 3.06Å; S509-T511 VanDerWaalsContact C-N 3.34Å; S509-T511 PolarHBondContact O-N 3.23Å; T511-G513 PolarHBondContact O-N 3.27Å; T511-E514 PolarHBondContact O-N 2.83Å; T511-V517 HydrophobicContact CG2-CG1 4.13Å; T511-F547 HydrophobicContact CG2-CE1 3.84Å; T511-F547 HydrophobicContact CG2-CZ 4.38Å; T511-H552 HydrophobicContact CG2-CB 4.22Å; T511-H552 WeakPolarHBondContact CG2-O 3.13Å; T511-K555 PolarHBondContact O-NZ 2.77Å; T511-K555 VanDerWaalsContact O-NZ 3.16Å; T511-A556 HydrophobicContact CG2-CB 4.14Å
512	S	76.6	Confident	89.1	Confident	84 Å²	84	70.8 Å²	70.8	59%	0.587	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.6	129.5	-176.8	-70.8	0	0	0	0	111.1	L508 S509 A510 K555	L508-S512 PolarHBondContact O-N 3.47Å; L508-S512 VanDerWaalsContact O-N 3.09Å; L508-S512 PolarHBondContact O-OG 2.82Å; S509-S512 WeakPolarHBondContact O-CB 3.27Å; S509-S512 PolarHBondContact O-N 3.26Å; S509-S512 PolarHBondContact O-OG 3.31Å; A510-S512 VanDerWaalsContact C-N 3.35Å; S512-K555 PolarHBondContact O-NZ 2.83Å
513	G	73.5	Confident	89.2	Confident	77 Å²	77	72 Å²	72	79%	0.794	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	118.1	-27.4	-173.5	0	0	0	0	0	114.5	T511	T511-G513 PolarHBondContact O-N 3.27Å
514	E	78.1	Confident	89.2	Confident	80 Å²	80	71.9 Å²	71.9	37%	0.374	37%	0.373	S	S	.	.	S	Bend	trans	-81.3	145	166.8	-82.3	90.8	-125.5	0	0	111.8	T511 V517 H552 K555	T511-E514 PolarHBondContact O-N 2.83Å; E514-V517 HydrophobicContact CB-CG2 3.93Å; E514-H552 WeakPolarHBondContact CB-NE2 3.34Å; E514-H552 IonicContact OE2-CD2 2.64Å; E514-H552 PolarHBondContact OE2-CD2 2.81Å; E514-K555 WeakPolarHBondContact OE1-CD 3.32Å; E514-K555 WeakPolarHBondContact OE1-CE 3.2Å; E514-K555 IonicContact OE1-NZ 2.67Å; E514-K555 PolarHBondContact OE1-NZ 3.11Å; E514-K555 WeakPolarHBondContact OE2-CD 3.01Å; E514-K555 WeakPolarHBondContact OE2-CE 3.44Å; E514-K555 IonicContact OE2-NZ 2.81Å; E514-K555 PolarHBondContact OE2-NZ 2.7Å
515	K	79	Confident	89.2	Confident	208 Å²	208	69.8 Å²	69.8	90%	0.904	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.9	129.9	170.4	-64.6	-178.9	-179.7	179.5	0	109.2
516	G	83.7	Confident	89.2	Confident	54 Å²	54	64.1 Å²	64.1	56%	0.557	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	93.1	11.5	170.8	0	0	0	0	0	116.7	R518	G516-R518 PolarHBondContact O-N 3.07Å; G516-R518 VanDerWaalsContact O-N 3.12Å
517	V	89.6	Confident	89.1	Confident	31 Å²	31	64.8 Å²	64.8	19%	0.188	35%	0.346	C	S	.	.			trans	-54.1	117.8	177.9	-168.2	0	0	0	0	111.8	L508 T511 E514 F547 H552	L508-V517 HydrophobicContact CD2-CG1 4.27Å; T511-V517 HydrophobicContact CG2-CG1 4.13Å; E514-V517 HydrophobicContact CB-CG2 3.93Å; V517-F547 HydrophobicContact CG1-CD1 4.28Å; V517-F547 HydrophobicContact CG1-CE1 4.3Å; V517-H552 HydrophobicContact CG1-CB 4.38Å
518	R	92	Very high	88.8	Confident	173 Å²	173	70.6 Å²	70.6	65%	0.653	38%	0.377	S	S	*	.			trans	-124.3	137.6	171.3	-60.6	-167.8	-172.3	-150.4	1.6	111.5	G516 Q548	G516-R518 PolarHBondContact O-N 3.07Å; G516-R518 VanDerWaalsContact O-N 3.12Å; R518-Q548 HydrophobicContact CB-CB 4.17Å; R518-Q548 PolarHBondContact O-N 2.87Å
519	I	94.1	Very high	88.2	Confident	17 Å²	17	76 Å²	76	9%	0.087	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	103.1	178.6	-60	175.3	0	0	0	107.9	R504 L507 L508 E521 C522 E546 F547	R504-I519 HydrophobicContact CG-CD1 4.46Å; R504-I519 PolarHBondContact NH1-O 3.25Å; L507-I519 HydrophobicContact CB-CD1 3.75Å; L508-I519 HydrophobicContact CD2-CD1 3.79Å; L508-I519 HydrophobicContact CD2-CG1 4.31Å; L508-I519 HydrophobicContact CG-CD1 3.86Å; I519-E521 WeakPolarHBondContact CG2-O 3.31Å; I519-C522 HydrophobicContact CG2-CB 3.97Å; I519-E546 CarbonylContact C-O 3.46Å; I519-E546 WeakPolarHBondContact CA-O 3.47Å; I519-F547 HydrophobicContact CD1-CE1 3.9Å; I519-F547 HydrophobicContact CD1-CZ 4.3Å; I519-F547 HydrophobicContact CG1-CD1 3.8Å; I519-F547 HydrophobicContact CG1-CE1 3.67Å; I519-F547 HydrophobicContact CG1-CZ 4.36Å
520	K	93.7	Very high	87.1	Confident	122 Å²	122	75.9 Å²	75.9	53%	0.53	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.9	-57.7	179.9	-67.3	164.4	164.5	173.2	0	111	E546	K520-E546 HydrophobicContact CB-CB 4.35Å; K520-E546 VanDerWaalsContact CD-CD 3.43Å; K520-E546 HydrophobicContact CD-CG 4.09Å; K520-E546 WeakPolarHBondContact CD-OE1 3.43Å; K520-E546 PolarHBondContact N-O 3.47Å; K520-E546 IonicContact NZ-OE1 3.65Å; K520-E546 PolarHBondContact NZ-OE1 3.4Å
521	E	93.2	Very high	86.1	Confident	54 Å²	54	77.6 Å²	77.6	25%	0.252	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	140.4	-179.7	-169.7	-176.2	-147.3	0	0	109.4	R488 I519 A545 E546	R488-E521 IonicContact CZ-OE2 2.76Å; R488-E521 IonicContact NE-OE2 3.37Å; R488-E521 PolarHBondContact NE-OE2 3.46Å; R488-E521 IonicContact NH2-OE1 2.7Å; R488-E521 IonicContact NH2-OE2 3.82Å; R488-E521 PolarHBondContact NH2-OE2 3.41Å; I519-E521 WeakPolarHBondContact CG2-O 3.31Å; E521-A545 CarbonylContact O-C 3.21Å; E521-A545 VanDerWaalsContact O-CA 3.25Å; E521-A545 WeakPolarHBondContact O-CA 3.29Å; E521-E546 HydrophobicContact CB-CB 4.02Å; E521-E546 PolarHBondContact N-O 2.8Å; E521-E546 PolarHBondContact O-N 3.45Å
522	C	96	Very high	85	Confident	12 Å²	12	85.2 Å²	85.2	8%	0.081	45%	0.451	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	113.8	162.7	-178.6	0	0	0	0	106.6	R504 I519 F544 A545	R504-C522 HydrophobicContact CB-CB 4.42Å; I519-C522 HydrophobicContact CG2-CB 3.97Å; C522-F544 WeakPolarHBondContact CA-O 3.46Å; C522-A545 HydrophobicContact CB-CB 4.48Å
523	R	94.2	Very high	84.8	Confident	130 Å²	130	84.3 Å²	84.3	49%	0.491	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	122	-170.6	179.4	176.5	174.7	171.1	-0.8	110.9	D500 M525 A543 F544	D500-R523 VanDerWaalsContact OD2-CA 3.3Å; D500-R523 WeakPolarHBondContact OD2-CA 3.31Å; R523-M525 HydrophobicContact CG-SD 4.38Å; R523-A543 VanDerWaalsContact O-CA 3.27Å; R523-A543 WeakPolarHBondContact O-CA 3.36Å; R523-A543 VanDerWaalsContact O-CB 3.28Å; R523-A543 WeakPolarHBondContact O-CB 3.37Å; R523-F544 PolarHBondContact N-O 3.34Å; R523-F544 PolarHBondContact O-N 3.45Å
524	V	95.5	Very high	84.6	Confident	2 Å²	2	89.2 Å²	89.2	1%	0.012	46%	0.463	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	129.6	169	-175.9	0	0	0	0	108.8	D500 L503 R526 S539 A543	D500-V524 WeakPolarHBondContact OD1-CB 3.35Å; D500-V524 WeakPolarHBondContact OD1-CG2 3.3Å; D500-V524 PolarHBondContact OD1-N 2.74Å; D500-V524 PolarHBondContact OD2-N 2.78Å; D500-V524 VanDerWaalsContact OD2-N 3.07Å; L503-V524 HydrophobicContact CD2-CG2 3.86Å; V524-R526 PolarHBondContact O-NH1 2.82Å; V524-S539 WeakPolarHBondContact CG1-OG 3.07Å; V524-A543 HydrophobicContact CB-CB 4.36Å; V524-A543 HydrophobicContact CG2-CB 4.08Å
525	M	94.7	Very high	84.3	Confident	43 Å²	43	92 Å²	92	21%	0.212	48%	0.478	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	132.9	-179.7	-64.7	-59.8	-68	0	0	110	R523 L540 Y542 F544	R523-M525 HydrophobicContact CG-SD 4.38Å; M525-L540 HydrophobicContact CB-CD1 4.25Å; M525-L540 PolarHBondContact O-N 2.87Å; M525-Y542 HydrophobicContact CB-CD1 4.23Å; M525-Y542 HydrophobicContact CB-CD2 4.22Å; M525-Y542 HydrophobicContact CB-CE1 3.83Å; M525-Y542 HydrophobicContact CB-CE2 3.84Å; M525-Y542 HydrophobicContact CB-CG 4.4Å; M525-Y542 HydrophobicContact CG-CD2 4Å; M525-Y542 HydrophobicContact CG-CE1 4.45Å; M525-Y542 HydrophobicContact CG-CE2 3.53Å; M525-Y542 PolarHBondContact N-O 3.08Å; M525-F544 HydrophobicContact CG-CD2 4.11Å; M525-F544 HydrophobicContact CG-CE2 4.1Å; M525-F544 HydrophobicContact SD-CD2 4.31Å; M525-F544 HydrophobicContact SD-CE2 4.44Å
526	R	93.5	Very high	84.1	Confident	46 Å²	46	88.7 Å²	88.7	17%	0.174	46%	0.463	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	144.2	-175.7	-69	171.3	-179.2	83.7	-2.4	109.1	D499 D500 V524 G537 Q538	D499-R526 IonicContact OD1-CZ 3.27Å; D499-R526 IonicContact OD1-NH2 2.71Å; D499-R526 PolarHBondContact OD1-NH2 3.15Å; D500-R526 IonicContact OD1-CZ 2.68Å; D500-R526 IonicContact OD1-NH1 3.45Å; D500-R526 PolarHBondContact OD1-NH1 3.06Å; D500-R526 IonicContact OD1-NH2 2.96Å; D500-R526 PolarHBondContact OD1-NH2 3.43Å; D500-R526 IonicContact OD2-NH1 2.75Å; V524-R526 PolarHBondContact O-NH1 2.82Å; R526-G537 VanDerWaalsContact CD-O 3.25Å; R526-G537 WeakPolarHBondContact CD-O 3.43Å; R526-G537 WeakPolarHBondContact CG-O 3.38Å; R526-Q538 CarbonylContact C-O 3.49Å; R526-Q538 WeakPolarHBondContact CA-O 3.49Å; R526-Q538 WeakPolarHBondContact CB-O 3.47Å
527	D	90.5	Very high	84.2	Confident	69 Å²	69	86.7 Å²	86.7	37%	0.369	44%	0.442	S	S	.	.			trans	-68.7	130.9	168.4	-168.9	-2.2	0	0	0	109.2	K529 G537 Q538 L540	D527-K529 WeakPolarHBondContact OD1-CB 3.4Å; D527-K529 WeakPolarHBondContact OD1-CG 3.21Å; D527-K529 PolarHBondContact OD1-N 2.82Å; D527-G537 WeakPolarHBondContact O-CA 3.38Å; D527-Q538 PolarHBondContact N-O 3.07Å; D527-L540 HydrophobicContact CB-CD2 4.05Å
528	L	85.6	Confident	84.1	Confident	122 Å²	122	91.7 Å²	91.7	64%	0.639	46%	0.464	S	S	*	.			trans	-100.1	-9.4	178.3	-58.6	179.6	0	0	0	112.2	G530 V531	L528-G530 PolarHBondContact O-N 2.9Å; L528-V531 PolarHBondContact O-N 3.06Å
529	K	80.5	Confident	84.1	Confident	185 Å²	185	83.9 Å²	83.9	80%	0.804	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	130.3	-179.9	-65.8	-174.2	-176.6	-168.7	0	110.2	D527 V531	D527-K529 WeakPolarHBondContact OD1-CB 3.4Å; D527-K529 WeakPolarHBondContact OD1-CG 3.21Å; D527-K529 PolarHBondContact OD1-N 2.82Å; K529-V531 VanDerWaalsContact C-N 3.3Å; K529-V531 PolarHBondContact O-N 3.36Å
530	G	68.6	Low	84.1	Confident	69 Å²	69	87.2 Å²	87.2	71%	0.711	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.5	-10.8	-178.7	0	0	0	0	0	116.5	L528 H532	L528-G530 PolarHBondContact O-N 2.9Å; G530-H532 PolarHBondContact O-N 3.23Å; G530-H532 PolarHBondContact O-ND1 3.35Å
531	V	67.8	Low	84	Confident	50 Å²	50	82 Å²	82	30%	0.303	43%	0.434	S	S	.	.			trans	-77.5	105.5	-175.2	-176.8	0	0	0	0	111.3	L528 K529 M535	L528-V531 PolarHBondContact O-N 3.06Å; K529-V531 VanDerWaalsContact C-N 3.3Å; K529-V531 PolarHBondContact O-N 3.36Å; V531-M535 HydrophobicContact CG1-CB 4.25Å; V531-M535 WeakPolarHBondContact CG1-O 3.48Å
532	H	64.6	Low	84	Confident	162 Å²	162	82.9 Å²	82.9	75%	0.75	44%	0.436	S	S	*	.			trans	-101.9	126.1	172.5	-67.4	73.3	0	0	0	110.5	G530	G530-H532 PolarHBondContact O-N 3.23Å; G530-H532 PolarHBondContact O-ND1 3.35Å
533	G	72.6	Confident	84.1	Confident	65 Å²	65	82.3 Å²	82.3	67%	0.67	43%	0.432	S	S	*	.	S	Bend	trans	80.3	-165.3	179.7	0	0	0	0	0	114.8	M535	G533-M535 PolarHBondContact O-N 2.91Å
534	N	69.3	Low	84.2	Confident	179 Å²	179	78.2 Å²	78.2	96%	0.957	42%	0.418	S	S	*	.	S	Bend	trans	-71	13	-170.3	-73.7	-8.3	0	0	0	115.8
535	M	71.6	Confident	84.3	Confident	140 Å²	140	78.1 Å²	78.1	69%	0.69	42%	0.417	S	S	*	.	P	Polyproline II helix	trans	-73.8	147.5	175.9	-66.5	-168.3	-70.9	0	0	110.7	V531 G533	V531-M535 HydrophobicContact CG1-CB 4.25Å; V531-M535 WeakPolarHBondContact CG1-O 3.48Å; G533-M535 PolarHBondContact O-N 2.91Å
536	K	75.6	Confident	84.4	Confident	138 Å²	138	78.3 Å²	78.3	60%	0.6	42%	0.417	S	S	*	.	P	Polyproline II helix	trans	-87.5	131.2	172.2	-69	178.8	179.5	173.2	0	109.7	D499	D499-K536 IonicContact OD1-NZ 2.75Å; D499-K536 PolarHBondContact OD1-NZ 3.45Å; D499-K536 IonicContact OD2-NZ 3.61Å; D499-K536 PolarHBondContact OD2-NZ 2.9Å
537	G	84.9	Confident	84.5	Confident	11 Å²	11	76.1 Å²	76.1	11%	0.113	41%	0.409	C	S	.	.	P	Polyproline II helix	trans	-63.8	166.8	173.7	0	0	0	0	0	114.7	R526 D527	R526-G537 VanDerWaalsContact CD-O 3.25Å; R526-G537 WeakPolarHBondContact CD-O 3.43Å; R526-G537 WeakPolarHBondContact CG-O 3.38Å; D527-G537 WeakPolarHBondContact O-CA 3.38Å
538	Q	88.4	Confident	84.7	Confident	137 Å²	137	77.4 Å²	77.4	64%	0.64	41%	0.413	S	S	*	.	P	Polyproline II helix	trans	-68.6	135.5	-179.4	-67	-161.8	22.8	0	0	111.6	R526 D527 L540	R526-Q538 CarbonylContact C-O 3.49Å; R526-Q538 WeakPolarHBondContact CA-O 3.49Å; R526-Q538 WeakPolarHBondContact CB-O 3.47Å; D527-Q538 PolarHBondContact N-O 3.07Å; Q538-L540 PolarHBondContact O-N 3.09Å
539	S	92.2	Very high	85.1	Confident	8 Å²	8	76 Å²	76	6%	0.056	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.1	131.3	175.5	177.4	0	0	0	0	112	K496 V524 G541	K496-S539 WeakPolarHBondContact CE-O 3.49Å; K496-S539 WeakPolarHBondContact O-CB 3.34Å; V524-S539 WeakPolarHBondContact CG1-OG 3.07Å; S539-G541 PolarHBondContact O-N 3.46Å; S539-G541 PolarHBondContact OG-N 2.88Å
540	L	92.6	Very high	85.7	Confident	87 Å²	87	69.4 Å²	69.4	46%	0.455	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	0.8	174.7	-63.9	171.9	0	0	0	112.5	M525 D527 Q538 Y542	M525-L540 HydrophobicContact CB-CD1 4.25Å; M525-L540 PolarHBondContact O-N 2.87Å; D527-L540 HydrophobicContact CB-CD2 4.05Å; Q538-L540 PolarHBondContact O-N 3.09Å; L540-Y542 VanDerWaalsContact C-N 3.32Å; L540-Y542 HydrophobicContact CB-CD1 3.72Å; L540-Y542 HydrophobicContact CB-CE1 3.53Å; L540-Y542 HydrophobicContact CD1-CE1 3.82Å; L540-Y542 HydrophobicContact CG-CE1 4.32Å; L540-Y542 PolarHBondContact O-N 3.28Å
541	G	91.7	Very high	86.9	Confident	14 Å²	14	73.2 Å²	73.2	14%	0.144	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	75.6	15.3	178	0	0	0	0	0	115.1	N493 L494 S539	N493-G541 PolarHBondContact N-O 2.84Å; L494-G541 PolarHBondContact N-O 3.07Å; L494-G541 WeakPolarHBondContact O-CA 3.27Å; S539-G541 PolarHBondContact O-N 3.46Å; S539-G541 PolarHBondContact OG-N 2.88Å
542	Y	94.8	Very high	88.2	Confident	71 Å²	71	71 Å²	71	28%	0.278	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	159.6	171.2	75.4	-77.3	0	0	0	112.9	L491 H492 M525 L540 F544	L491-Y542 CarbonylContact O-C 3.51Å; L491-Y542 WeakPolarHBondContact O-CA 3Å; L491-Y542 WeakPolarHBondContact O-CB 3.48Å; H492-Y542 WeakPolarHBondContact ND1-CB 3.29Å; M525-Y542 HydrophobicContact CB-CD1 4.23Å; M525-Y542 HydrophobicContact CB-CD2 4.22Å; M525-Y542 HydrophobicContact CB-CE1 3.83Å; M525-Y542 HydrophobicContact CB-CE2 3.84Å; M525-Y542 HydrophobicContact CB-CG 4.4Å; M525-Y542 HydrophobicContact CG-CD2 4Å; M525-Y542 HydrophobicContact CG-CE1 4.45Å; M525-Y542 HydrophobicContact CG-CE2 3.53Å; M525-Y542 PolarHBondContact N-O 3.08Å; L540-Y542 VanDerWaalsContact C-N 3.32Å; L540-Y542 HydrophobicContact CB-CD1 3.72Å; L540-Y542 HydrophobicContact CB-CE1 3.53Å; L540-Y542 HydrophobicContact CD1-CE1 3.82Å; L540-Y542 HydrophobicContact CG-CE1 4.32Å; L540-Y542 PolarHBondContact O-N 3.28Å; Y542-F544 HydrophobicContact CD2-CE2 4.26Å; Y542-F544 HydrophobicContact CD2-CZ 4.46Å; Y542-F544 AromaticContact CE2-CE2 3.83Å; Y542-F544 HydrophobicContact CE2-CE2 3.83Å; Y542-F544 HydrophobicContact CE2-CZ 4.16Å
543	A	96.5	Very high	89.7	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	163.4	-176.4	0	0	0	0	0	112.3	L491 L494 L503 R523 V524	L491-A543 HydrophobicContact CB-CB 4.23Å; L491-A543 HydrophobicContact CD1-CB 4.43Å; L491-A543 PolarHBondContact N-O 2.77Å; L491-A543 PolarHBondContact O-N 3.34Å; L494-A543 HydrophobicContact CD1-CB 3.57Å; L503-A543 HydrophobicContact CD2-CB 3.35Å; R523-A543 VanDerWaalsContact O-CA 3.27Å; R523-A543 WeakPolarHBondContact O-CA 3.36Å; R523-A543 VanDerWaalsContact O-CB 3.28Å; R523-A543 WeakPolarHBondContact O-CB 3.37Å; V524-A543 HydrophobicContact CB-CB 4.36Å; V524-A543 HydrophobicContact CG2-CB 4.08Å
544	F	97	Very high	90.7	Very high	45 Å²	45	61.7 Å²	61.7	20%	0.197	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	143.4	169.7	-63.6	-77.9	0	0	0	110.4	L489 C490 C522 R523 M525 Y542	L489-F544 WeakPolarHBondContact O-CA 3.35Å; C490-F544 HydrophobicContact CB-CD1 4.05Å; C490-F544 HydrophobicContact CB-CE1 3.92Å; C490-F544 WeakPolarHBondContact SG-CE1 3.5Å; C522-F544 WeakPolarHBondContact CA-O 3.46Å; R523-F544 PolarHBondContact N-O 3.34Å; R523-F544 PolarHBondContact O-N 3.45Å; M525-F544 HydrophobicContact CG-CD2 4.11Å; M525-F544 HydrophobicContact CG-CE2 4.1Å; M525-F544 HydrophobicContact SD-CD2 4.31Å; M525-F544 HydrophobicContact SD-CE2 4.44Å; Y542-F544 HydrophobicContact CD2-CE2 4.26Å; Y542-F544 HydrophobicContact CD2-CZ 4.46Å; Y542-F544 AromaticContact CE2-CE2 3.83Å; Y542-F544 HydrophobicContact CE2-CE2 3.83Å; Y542-F544 HydrophobicContact CE2-CZ 4.16Å
545	A	96.8	Very high	91.8	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	129.2	172.6	0	0	0	0	0	110.8	R488 L489 L491 L507 E521 C522	R488-A545 CarbonylContact C-O 3.46Å; R488-A545 WeakPolarHBondContact CA-O 3.42Å; L489-A545 PolarHBondContact N-O 3.19Å; L489-A545 PolarHBondContact O-N 3.42Å; L491-A545 HydrophobicContact CD1-CB 4.07Å; L507-A545 HydrophobicContact CD1-CB 3.55Å; E521-A545 CarbonylContact O-C 3.21Å; E521-A545 VanDerWaalsContact O-CA 3.25Å; E521-A545 WeakPolarHBondContact O-CA 3.29Å; C522-A545 HydrophobicContact CB-CB 4.48Å
546	E	96.7	Very high	92.9	Very high	46 Å²	46	48.9 Å²	48.9	22%	0.215	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	121	175.8	-161.8	-162.6	153.8	0	0	110.7	T487 R488 I519 K520 E521	T487-E546 PolarHBondContact OG1-OE1 3.05Å; R488-E546 HydrophobicContact CB-CB 4.32Å; R488-E546 HydrophobicContact CB-CG 4.04Å; R488-E546 HydrophobicContact CG-CB 3.99Å; R488-E546 HydrophobicContact CG-CG 4.22Å; I519-E546 CarbonylContact C-O 3.46Å; I519-E546 WeakPolarHBondContact CA-O 3.47Å; K520-E546 HydrophobicContact CB-CB 4.35Å; K520-E546 VanDerWaalsContact CD-CD 3.43Å; K520-E546 HydrophobicContact CD-CG 4.09Å; K520-E546 WeakPolarHBondContact CD-OE1 3.43Å; K520-E546 PolarHBondContact N-O 3.47Å; K520-E546 IonicContact NZ-OE1 3.65Å; K520-E546 PolarHBondContact NZ-OE1 3.4Å; E521-E546 HydrophobicContact CB-CB 4.02Å; E521-E546 PolarHBondContact N-O 2.8Å; E521-E546 PolarHBondContact O-N 3.45Å
547	F	96.4	Very high	93.9	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	162.8	171.2	-68.8	-93.2	0	0	0	111.4	T487 L489 L507 T511 V517 I519 E549 H552 A553 A556	T487-F547 VanDerWaalsContact CB-O 3.28Å; T487-F547 WeakPolarHBondContact CB-O 3.36Å; T487-F547 PolarHBondContact O-N 3.01Å; L489-F547 HydrophobicContact CD1-CE2 3.88Å; L489-F547 HydrophobicContact CG-CE2 4.34Å; L507-F547 HydrophobicContact CB-CZ 4.22Å; L507-F547 HydrophobicContact CD2-CE2 4.2Å; L507-F547 HydrophobicContact CD2-CZ 3.9Å; T511-F547 HydrophobicContact CG2-CE1 3.84Å; T511-F547 HydrophobicContact CG2-CZ 4.38Å; V517-F547 HydrophobicContact CG1-CD1 4.28Å; V517-F547 HydrophobicContact CG1-CE1 4.3Å; I519-F547 HydrophobicContact CD1-CE1 3.9Å; I519-F547 HydrophobicContact CD1-CZ 4.3Å; I519-F547 HydrophobicContact CG1-CD1 3.8Å; I519-F547 HydrophobicContact CG1-CE1 3.67Å; I519-F547 HydrophobicContact CG1-CZ 4.36Å; F547-E549 VanDerWaalsContact C-N 3.31Å; F547-H552 HydrophobicContact CB-CB 4.35Å; F547-H552 HydrophobicContact CD1-CB 3.71Å; F547-H552 HydrophobicContact CE1-CB 4.32Å; F547-H552 HydrophobicContact CG-CB 4.2Å; F547-A553 HydrophobicContact CB-CB 4.18Å; F547-A553 HydrophobicContact CD2-CB 3.63Å; F547-A553 HydrophobicContact CE2-CB 4.34Å; F547-A553 HydrophobicContact CG-CB 4.09Å; F547-A556 HydrophobicContact CE1-CB 4.39Å; F547-A556 HydrophobicContact CE2-CB 3.94Å; F547-A556 HydrophobicContact CZ-CB 3.55Å
548	Q	94.7	Very high	94.3	Very high	97 Å²	97	49 Å²	49	45%	0.453	23%	0.226	S	C	.	.	S	Bend	trans	-68.6	-32.9	168.7	-175.6	166.9	-27.1	0	0	112	R518	R518-Q548 HydrophobicContact CB-CB 4.17Å; R518-Q548 PolarHBondContact O-N 2.87Å
549	E	94.6	Very high	94.5	Very high	91 Å²	91	46.7 Å²	46.7	43%	0.425	22%	0.218	S	C	.	.	S	Bend	trans	-132.5	155	-169.2	-63.9	171	-175.1	0	0	112.4	F547 H552 A553	F547-E549 VanDerWaalsContact C-N 3.31Å; E549-H552 IonicContact OE2-CE1 3.18Å; E549-H552 PolarHBondContact OE2-CE1 2.67Å; E549-H552 IonicContact OE2-ND1 2.74Å; E549-H552 PolarHBondContact OE2-ND1 3.46Å; E549-A553 PolarHBondContact O-N 2.88Å
550	H	93.6	Very high	94.6	Very high	47 Å²	47	47 Å²	47	22%	0.218	22%	0.219	C	C	.	.	H	α-helix	trans	-68.8	-36.7	-176.4	-179.5	41.9	0	0	0	112.9	R486 A553 L554 F577	R486-H550 HydrophobicContact CB-CB 4.37Å; R486-H550 PolarHBondContact O-ND1 3Å; H550-A553 PolarHBondContact O-N 3.25Å; H550-L554 WeakPolarHBondContact O-CB 3.14Å; H550-L554 PolarHBondContact O-N 2.86Å; H550-F577 AromaticContact CE1-CE1 3.98Å; H550-F577 AromaticContact CE1-CZ 3.74Å; H550-F577 AromaticContact ND1-CE1 3.97Å
551	E	93.2	Very high	94.6	Very high	149 Å²	149	43.8 Å²	43.8	70%	0.696	20%	0.202	S	C	*	.	H	α-helix	trans	-69.6	-44.4	-172.9	-56.1	-170	179.2	0	0	111.1	A553 L554 K555	E551-A553 VanDerWaalsContact C-N 3.34Å; E551-A553 PolarHBondContact O-N 2.9Å; E551-L554 PolarHBondContact O-N 2.77Å; E551-K555 WeakPolarHBondContact O-CB 3.28Å; E551-K555 PolarHBondContact O-N 2.96Å
552	H	94.7	Very high	94.6	Very high	5 Å²	5	44 Å²	44	2%	0.023	20%	0.2	C	C	.	.	H	α-helix	trans	-55.1	-45.1	169.8	-61.3	134.6	0	0	0	112.6	T511 E514 V517 F547 E549 A556	T511-H552 HydrophobicContact CG2-CB 4.22Å; T511-H552 WeakPolarHBondContact CG2-O 3.13Å; E514-H552 WeakPolarHBondContact CB-NE2 3.34Å; E514-H552 IonicContact OE2-CD2 2.64Å; E514-H552 PolarHBondContact OE2-CD2 2.81Å; V517-H552 HydrophobicContact CG1-CB 4.38Å; F547-H552 HydrophobicContact CB-CB 4.35Å; F547-H552 HydrophobicContact CD1-CB 3.71Å; F547-H552 HydrophobicContact CE1-CB 4.32Å; F547-H552 HydrophobicContact CG-CB 4.2Å; E549-H552 IonicContact OE2-CE1 3.18Å; E549-H552 PolarHBondContact OE2-CE1 2.67Å; E549-H552 IonicContact OE2-ND1 2.74Å; E549-H552 PolarHBondContact OE2-ND1 3.46Å; H552-A556 VanDerWaalsContact O-CB 3.32Å; H552-A556 WeakPolarHBondContact O-CB 3.37Å; H552-A556 PolarHBondContact O-N 2.71Å
553	A	95.3	Very high	94.4	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-65.6	-41.1	177	0	0	0	0	0	112.5	L489 F547 E549 H550 E551 L557 F577	L489-A553 HydrophobicContact CD2-CB 4.24Å; L489-A553 HydrophobicContact CG-CB 4.35Å; F547-A553 HydrophobicContact CB-CB 4.18Å; F547-A553 HydrophobicContact CD2-CB 3.63Å; F547-A553 HydrophobicContact CE2-CB 4.34Å; F547-A553 HydrophobicContact CG-CB 4.09Å; E549-A553 PolarHBondContact O-N 2.88Å; H550-A553 PolarHBondContact O-N 3.25Å; E551-A553 VanDerWaalsContact C-N 3.34Å; E551-A553 PolarHBondContact O-N 2.9Å; A553-L557 WeakPolarHBondContact O-CB 3.26Å; A553-L557 PolarHBondContact O-N 3.07Å; A553-F577 HydrophobicContact CB-CE1 4.07Å
554	L	94	Very high	94	Very high	31 Å²	31	44.9 Å²	44.9	16%	0.162	21%	0.212	C	C	.	.	H	α-helix	trans	-66.2	-40.7	179	-172.8	67.5	0	0	0	111.9	E445 H550 E551 R558 F577	E445-L554 HydrophobicContact CG-CD1 4.15Å; H550-L554 WeakPolarHBondContact O-CB 3.14Å; H550-L554 PolarHBondContact O-N 2.86Å; E551-L554 PolarHBondContact O-N 2.77Å; L554-R558 WeakPolarHBondContact O-CB 3.32Å; L554-R558 VanDerWaalsContact O-CG 3.27Å; L554-R558 WeakPolarHBondContact O-CG 3.45Å; L554-R558 PolarHBondContact O-N 3.02Å; L554-F577 HydrophobicContact CB-CZ 4.26Å; L554-F577 HydrophobicContact CD1-CE2 3.89Å; L554-F577 HydrophobicContact CD1-CZ 3.82Å
555	K	93.8	Very high	93.5	Very high	50 Å²	50	50.9 Å²	50.9	22%	0.217	24%	0.241	C	C	.	.	H	α-helix	trans	-67.6	-46.2	175.5	-176.1	-175.8	176.8	-176.1	0	111.9	T511 S512 E514 E551 L557 R558 L559	T511-K555 PolarHBondContact O-NZ 2.77Å; T511-K555 VanDerWaalsContact O-NZ 3.16Å; S512-K555 PolarHBondContact O-NZ 2.83Å; E514-K555 WeakPolarHBondContact OE1-CD 3.32Å; E514-K555 WeakPolarHBondContact OE1-CE 3.2Å; E514-K555 IonicContact OE1-NZ 2.67Å; E514-K555 PolarHBondContact OE1-NZ 3.11Å; E514-K555 WeakPolarHBondContact OE2-CD 3.01Å; E514-K555 WeakPolarHBondContact OE2-CE 3.44Å; E514-K555 IonicContact OE2-NZ 2.81Å; E514-K555 PolarHBondContact OE2-NZ 2.7Å; E551-K555 WeakPolarHBondContact O-CB 3.28Å; E551-K555 PolarHBondContact O-N 2.96Å; K555-L557 VanDerWaalsContact C-N 3.33Å; K555-L557 PolarHBondContact O-N 2.98Å; K555-R558 PolarHBondContact O-N 3.09Å; K555-R558 VanDerWaalsContact O-N 3.15Å; K555-L559 HydrophobicContact CG-CD1 3.87Å; K555-L559 PolarHBondContact O-N 3.47Å
556	A	94.6	Very high	93	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-57.7	-44.8	175.1	0	0	0	0	0	111.7	L489 L507 T511 F547 H552 R558 I560	L489-A556 HydrophobicContact CD1-CB 4.16Å; L507-A556 HydrophobicContact CD2-CB 4.33Å; T511-A556 HydrophobicContact CG2-CB 4.14Å; F547-A556 HydrophobicContact CE1-CB 4.39Å; F547-A556 HydrophobicContact CE2-CB 3.94Å; F547-A556 HydrophobicContact CZ-CB 3.55Å; H552-A556 VanDerWaalsContact O-CB 3.32Å; H552-A556 WeakPolarHBondContact O-CB 3.37Å; H552-A556 PolarHBondContact O-N 2.71Å; A556-R558 PolarHBondContact O-N 2.97Å; A556-I560 VanDerWaalsContact O-CB 3.29Å; A556-I560 WeakPolarHBondContact O-CB 3.4Å; A556-I560 VanDerWaalsContact O-CG1 3.26Å; A556-I560 WeakPolarHBondContact O-CG1 3.29Å; A556-I560 PolarHBondContact O-N 2.98Å
557	L	94.7	Very high	92.6	Very high	2 Å²	2	52.9 Å²	52.9	1%	0.01	25%	0.251	C	S	.	.	H	α-helix	trans	-58.7	-46.7	174.4	179.7	151.5	0	0	0	111.6	E445 L489 A553 K555 L559 N561 V575 F577	E445-L557 HydrophobicContact CB-CD2 4.37Å; L489-L557 HydrophobicContact CD1-CB 4.22Å; L489-L557 HydrophobicContact CD2-CB 4.25Å; L489-L557 HydrophobicContact CD2-CD1 4.09Å; A553-L557 WeakPolarHBondContact O-CB 3.26Å; A553-L557 PolarHBondContact O-N 3.07Å; K555-L557 VanDerWaalsContact C-N 3.33Å; K555-L557 PolarHBondContact O-N 2.98Å; L557-L559 PolarHBondContact O-N 3.4Å; L557-N561 WeakPolarHBondContact O-CB 3.48Å; L557-N561 PolarHBondContact O-N 2.95Å; L557-V575 HydrophobicContact CB-CG1 4.09Å; L557-V575 HydrophobicContact CD1-CG1 4.31Å; L557-V575 HydrophobicContact CG-CB 4.36Å; L557-V575 HydrophobicContact CG-CG1 4.01Å; L557-F577 HydrophobicContact CD1-CD2 3.81Å; L557-F577 HydrophobicContact CD1-CE2 3.79Å; L557-F577 HydrophobicContact CD1-CG 4.46Å; L557-F577 HydrophobicContact CD1-CZ 4.42Å
558	R	93.7	Very high	92	Very high	148 Å²	148	54.2 Å²	54.2	56%	0.558	26%	0.264	S	S	*	.	H	α-helix	trans	-68.7	-30.2	-175.5	-75.2	171	178.7	-178.9	-1.4	114.5	E445 L554 K555 A556	E445-R558 IonicContact OE1-NH2 3.49Å; E445-R558 IonicContact OE2-CZ 3.63Å; E445-R558 IonicContact OE2-NE 2.65Å; E445-R558 PolarHBondContact OE2-NE 3.3Å; E445-R558 IonicContact OE2-NH2 2.72Å; E445-R558 PolarHBondContact OE2-NH2 3.2Å; L554-R558 WeakPolarHBondContact O-CB 3.32Å; L554-R558 VanDerWaalsContact O-CG 3.27Å; L554-R558 WeakPolarHBondContact O-CG 3.45Å; L554-R558 PolarHBondContact O-N 3.02Å; K555-R558 PolarHBondContact O-N 3.09Å; K555-R558 VanDerWaalsContact O-N 3.15Å; A556-R558 PolarHBondContact O-N 2.97Å
559	L	92.6	Very high	91.3	Very high	90 Å²	90	53.7 Å²	53.7	47%	0.471	27%	0.269	S	S	.	.	H	α-helix	trans	-91.6	-28	-179.5	-69.9	167.8	0	0	0	113.6	A510 K555 L557 N563	A510-L559 HydrophobicContact CB-CB 4.25Å; A510-L559 WeakPolarHBondContact O-CD1 3.47Å; K555-L559 HydrophobicContact CG-CD1 3.87Å; K555-L559 PolarHBondContact O-N 3.47Å; L557-L559 PolarHBondContact O-N 3.4Å; L559-N563 PolarHBondContact O-ND2 3.25Å
560	I	93.8	Very high	90.7	Very high	13 Å²	13	55.9 Å²	55.9	7%	0.067	28%	0.283	C	S	.	.	H	α-helix	trans	-88.3	-44	-180	-61.7	172.6	0	0	0	111	L507 A510 A556 N562 N563 I566 P573 V575	L507-I560 HydrophobicContact CD2-CD1 3.67Å; L507-I560 HydrophobicContact CG-CD1 4.35Å; A510-I560 HydrophobicContact CB-CD1 3.88Å; A510-I560 HydrophobicContact CB-CG1 3.81Å; A556-I560 VanDerWaalsContact O-CB 3.29Å; A556-I560 WeakPolarHBondContact O-CB 3.4Å; A556-I560 VanDerWaalsContact O-CG1 3.26Å; A556-I560 WeakPolarHBondContact O-CG1 3.29Å; A556-I560 PolarHBondContact O-N 2.98Å; I560-N562 PolarHBondContact O-N 3.07Å; I560-N563 WeakPolarHBondContact O-CB 3.08Å; I560-N563 PolarHBondContact O-N 3.35Å; I560-I566 HydrophobicContact CB-CD1 4.1Å; I560-I566 HydrophobicContact CG1-CD1 4.15Å; I560-I566 HydrophobicContact CG2-CD1 3.82Å; I560-P573 HydrophobicContact CG2-CB 4.16Å; I560-P573 HydrophobicContact CG2-CG 3.83Å; I560-P573 WeakPolarHBondContact O-CG 3.44Å; I560-V575 HydrophobicContact CB-CG2 4.13Å; I560-V575 HydrophobicContact CG2-CG2 3.66Å
561	N	94	Very high	90.3	Very high	20 Å²	20	58.7 Å²	58.7	11%	0.107	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	131.3	-172.4	-170.7	40.3	0	0	0	112.6	G446 L557 N563 V575	G446-N561 VanDerWaalsContact CA-ND2 3.34Å; G446-N561 WeakPolarHBondContact CA-ND2 3.35Å; G446-N561 PolarHBondContact O-ND2 3.32Å; L557-N561 WeakPolarHBondContact O-CB 3.48Å; L557-N561 PolarHBondContact O-N 2.95Å; N561-N563 PolarHBondContact O-N 2.99Å; N561-V575 HydrophobicContact CB-CB 3.98Å; N561-V575 HydrophobicContact CB-CG2 4.18Å; N561-V575 PolarHBondContact OD1-N 2.68Å
562	N	90.9	Very high	90.2	Very high	20 Å²	20	52.8 Å²	52.8	11%	0.107	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	61.6	6.1	178.8	-170.2	46	0	0	0	115.6	I448 A454 V458 I560 P564 R572 P573	I448-N562 HydrophobicContact CD1-CB 4.32Å; I448-N562 HydrophobicContact CG1-CB 4.27Å; A454-N562 PolarHBondContact O-ND2 2.87Å; V458-N562 WeakPolarHBondContact CG2-OD1 3.38Å; I560-N562 PolarHBondContact O-N 3.07Å; N562-P564 WeakPolarHBondContact O-CD 3.37Å; N562-R572 PolarHBondContact O-NH1 2.97Å; N562-R572 WeakPolarHBondContact OD1-CD 3.34Å; N562-R572 PolarHBondContact OD1-NH1 3.18Å; N562-R572 VanDerWaalsContact OD1-NH1 3.11Å; N562-P573 PolarHBondContact N-O 2.9Å
563	N	90.7	Very high	90.1	Very high	39 Å²	39	52.6 Å²	52.6	21%	0.209	27%	0.265	C	S	.	.			trans	-73.6	119.2	178.5	-174.7	-19.7	0	0	0	110.9	L559 I560 N561 E565 I566 P573	L559-N563 PolarHBondContact O-ND2 3.25Å; I560-N563 WeakPolarHBondContact O-CB 3.08Å; I560-N563 PolarHBondContact O-N 3.35Å; N561-N563 PolarHBondContact O-N 2.99Å; N563-E565 VanDerWaalsContact OD1-CB 3.32Å; N563-E565 WeakPolarHBondContact OD1-CB 3.5Å; N563-E565 WeakPolarHBondContact OD1-CG 3.38Å; N563-E565 PolarHBondContact OD1-N 3.45Å; N563-I566 HydrophobicContact CB-CD1 3.88Å; N563-I566 HydrophobicContact CB-CG1 4.15Å; N563-P573 VanDerWaalsContact O-CD 3.32Å; N563-P573 WeakPolarHBondContact O-CD 3.43Å
564	P	87.3	Confident	90	Very high	49 Å²	49	52.8 Å²	52.8	32%	0.318	27%	0.266	S	S	.	.	S	Bend	trans	-75.8	-18.7	-179.9	32.6	-36.3	0	0	0	114.1	N562 I566 G568 R572	N562-P564 WeakPolarHBondContact O-CD 3.37Å; P564-I566 VanDerWaalsContact C-N 3.28Å; P564-I566 PolarHBondContact O-N 3.05Å; P564-G568 CarbonylContact O-C 3.58Å; P564-G568 WeakPolarHBondContact O-CA 3.43Å; P564-G568 PolarHBondContact O-N 3.06Å; P564-R572 HydrophobicContact CB-CG 4.39Å
565	E	87.2	Confident	90.1	Very high	172 Å²	172	51.3 Å²	51.3	80%	0.804	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.2	-26.4	-175.7	-59	175.8	154.4	0	0	112.4	N563	N563-E565 VanDerWaalsContact OD1-CB 3.32Å; N563-E565 WeakPolarHBondContact OD1-CB 3.5Å; N563-E565 WeakPolarHBondContact OD1-CG 3.38Å; N563-E565 PolarHBondContact OD1-N 3.45Å
566	I	87.1	Confident	90.2	Very high	42 Å²	42	50 Å²	50	22%	0.215	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-39	-171	-58.2	-179.3	0	0	0	112.3	L506 I560 N563 P564 P573	L506-I566 HydrophobicContact CD1-CG2 3.98Å; L506-I566 HydrophobicContact CD2-CG2 4.19Å; I560-I566 HydrophobicContact CB-CD1 4.1Å; I560-I566 HydrophobicContact CG1-CD1 4.15Å; I560-I566 HydrophobicContact CG2-CD1 3.82Å; N563-I566 HydrophobicContact CB-CD1 3.88Å; N563-I566 HydrophobicContact CB-CG1 4.15Å; P564-I566 VanDerWaalsContact C-N 3.28Å; P564-I566 PolarHBondContact O-N 3.05Å; I566-P573 HydrophobicContact CD1-CG 4.47Å
567	F	87	Confident	90.3	Very high	46 Å²	46	50.1 Å²	50.1	20%	0.202	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-138.1	10.6	-176.6	-59.8	-48.6	0	0	0	114	L494 P495 V498 L506 K571 P573	L494-F567 HydrophobicContact CD2-CE2 3.53Å; L494-F567 HydrophobicContact CD2-CZ 3.96Å; P495-F567 HydrophobicContact CG-CB 3.93Å; P495-F567 HydrophobicContact CG-CD1 3.73Å; P495-F567 HydrophobicContact CG-CD2 4.39Å; P495-F567 HydrophobicContact CG-CE1 4.37Å; P495-F567 HydrophobicContact CG-CG 3.76Å; V498-F567 HydrophobicContact CG2-CD1 4.27Å; V498-F567 HydrophobicContact CG2-CE1 3.55Å; V498-F567 HydrophobicContact CG2-CZ 4.03Å; L506-F567 HydrophobicContact CD1-CE1 3.97Å; L506-F567 HydrophobicContact CD1-CZ 3.89Å; F567-K571 HydrophobicContact CB-CB 4.43Å; F567-K571 WeakPolarHBondContact CB-O 3.37Å; F567-P573 HydrophobicContact CD2-CB 4.17Å; F567-P573 HydrophobicContact CD2-CG 4.31Å; F567-P573 HydrophobicContact CE2-CB 4.06Å; F567-P573 HydrophobicContact CE2-CG 4.43Å
568	G	84.1	Confident	90.3	Very high	27 Å²	27	50.2 Å²	50.2	28%	0.278	25%	0.254	S	S	.	.			trans	83.9	163.2	-174.1	0	0	0	0	0	113.9	P564 L570 K571	P564-G568 CarbonylContact O-C 3.58Å; P564-G568 WeakPolarHBondContact O-CA 3.43Å; P564-G568 PolarHBondContact O-N 3.06Å; G568-L570 PolarHBondContact O-N 3.48Å; G568-L570 VanDerWaalsContact O-N 3.11Å; G568-K571 PolarHBondContact O-N 3.15Å
569	P	80.5	Confident	90.4	Very high	87 Å²	87	45.6 Å²	45.6	57%	0.565	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-21.4	-170.1	25.5	-35.4	0	0	0	114.5
570	L	81.4	Confident	90.5	Very high	136 Å²	136	42.8 Å²	42.8	71%	0.712	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84	-18	-177.4	-63.1	176.6	0	0	0	114.4	G568	G568-L570 PolarHBondContact O-N 3.48Å; G568-L570 VanDerWaalsContact O-N 3.11Å
571	K	84.9	Confident	90.5	Very high	106 Å²	106	43.3 Å²	43.3	46%	0.461	23%	0.228	S	C	.	.	S	Bend	trans	-136.2	49.7	-174.7	-68	-172.2	179.6	176.8	0	111.6	P495 F567 G568	P495-K571 HydrophobicContact CG-CD 4.43Å; F567-K571 HydrophobicContact CB-CB 4.43Å; F567-K571 WeakPolarHBondContact CB-O 3.37Å; G568-K571 PolarHBondContact O-N 3.15Å
572	R	90.9	Very high	90.4	Very high	25 Å²	25	47.9 Å²	47.9	9%	0.094	24%	0.243	C	C	.	.			trans	-56.2	129.5	176	-58.1	-175.9	179.7	-149.7	4.5	109.3	E456 G457 N493 N562 P564	E456-R572 PolarHBondContact O-NH2 2.82Å; G457-R572 PolarHBondContact O-NH2 2.92Å; N493-R572 PolarHBondContact ND2-O 3.41Å; N562-R572 PolarHBondContact O-NH1 2.97Å; N562-R572 WeakPolarHBondContact OD1-CD 3.34Å; N562-R572 PolarHBondContact OD1-NH1 3.18Å; N562-R572 VanDerWaalsContact OD1-NH1 3.11Å; P564-R572 HydrophobicContact CB-CG 4.39Å
573	P	93.3	Very high	90.5	Very high	1 Å²	1	53.2 Å²	53.2	1%	0.006	26%	0.262	C	S	.	.			trans	-65.9	144.3	179.1	29.2	-35.3	0	0	0	110.6	I560 N562 N563 I566 F567 V575	I560-P573 HydrophobicContact CG2-CB 4.16Å; I560-P573 HydrophobicContact CG2-CG 3.83Å; I560-P573 WeakPolarHBondContact O-CG 3.44Å; N562-P573 PolarHBondContact N-O 2.9Å; N563-P573 VanDerWaalsContact O-CD 3.32Å; N563-P573 WeakPolarHBondContact O-CD 3.43Å; I566-P573 HydrophobicContact CD1-CG 4.47Å; F567-P573 HydrophobicContact CD2-CB 4.17Å; F567-P573 HydrophobicContact CD2-CG 4.31Å; F567-P573 HydrophobicContact CE2-CB 4.06Å; F567-P573 HydrophobicContact CE2-CG 4.43Å; P573-V575 HydrophobicContact CB-CG2 4.36Å
574	I	94.3	Very high	90.6	Very high	4 Å²	4	59 Å²	59	2%	0.021	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	114.7	174.6	-61.2	168.1	0	0	0	106.2	K465 R466 F469 H492 N493	K465-I574 HydrophobicContact CB-CD1 4.12Å; R466-I574 HydrophobicContact CG-CD1 3.64Å; R466-I574 HydrophobicContact CG-CG1 3.95Å; R466-I574 HydrophobicContact CG-CG2 4.31Å; F469-I574 HydrophobicContact CD2-CD1 4.09Å; F469-I574 HydrophobicContact CD2-CG2 4.37Å; F469-I574 HydrophobicContact CE2-CD1 3.98Å; H492-I574 HydrophobicContact CB-CB 4.17Å; H492-I574 PolarHBondContact N-O 3.07Å; H492-I574 PolarHBondContact O-N 3.42Å; H492-I574 VanDerWaalsContact O-N 3.09Å; N493-I574 HydrophobicContact CB-CD1 4.24Å; N493-I574 HydrophobicContact CB-CG1 4.35Å
575	V	95.2	Very high	90.7	Very high	0 Å²	0	59.9 Å²	59.9	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	123.8	-173.5	-171.3	0	0	0	0	110.7	L489 L491 L557 I560 N561 P573	L489-V575 HydrophobicContact CB-CG1 4.36Å; L489-V575 HydrophobicContact CD1-CG1 3.95Å; L491-V575 HydrophobicContact CD2-CB 4.09Å; L491-V575 HydrophobicContact CD2-CG1 3.55Å; L491-V575 HydrophobicContact CD2-CG2 3.58Å; L557-V575 HydrophobicContact CB-CG1 4.09Å; L557-V575 HydrophobicContact CD1-CG1 4.31Å; L557-V575 HydrophobicContact CG-CB 4.36Å; L557-V575 HydrophobicContact CG-CG1 4.01Å; I560-V575 HydrophobicContact CB-CG2 4.13Å; I560-V575 HydrophobicContact CG2-CG2 3.66Å; N561-V575 HydrophobicContact CB-CB 3.98Å; N561-V575 HydrophobicContact CB-CG2 4.18Å; N561-V575 PolarHBondContact OD1-N 2.68Å; P573-V575 HydrophobicContact CB-CG2 4.36Å
576	E	95.4	Very high	90.9	Very high	23 Å²	23	58.3 Å²	58.3	11%	0.107	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	161	179.3	-54.6	-155	132.9	0	0	111.5	K473 L489 C490	K473-E576 VanDerWaalsContact CD-OE2 3.32Å; K473-E576 WeakPolarHBondContact CD-OE2 3.37Å; K473-E576 WeakPolarHBondContact CE-OE2 3.4Å; K473-E576 IonicContact NZ-OE1 3.48Å; K473-E576 PolarHBondContact NZ-OE1 3.04Å; K473-E576 IonicContact NZ-OE2 3.02Å; K473-E576 PolarHBondContact NZ-OE2 3.02Å; L489-E576 CarbonylContact C-O 3.52Å; L489-E576 VanDerWaalsContact CA-O 3.31Å; L489-E576 WeakPolarHBondContact CA-O 3.43Å; C490-E576 PolarHBondContact N-O 3.26Å; C490-E576 PolarHBondContact O-N 3.1Å
577	F	96.7	Very high	91.1	Very high	3 Å²	3	62.5 Å²	62.5	1%	0.013	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	135.6	164.1	-71.5	-78.6	0	0	0	110.7	L442 E445 V484 S485 R486 L489 H550 A553 L554 L557	L442-F577 HydrophobicContact CB-CB 4.5Å; L442-F577 HydrophobicContact CB-CD2 3.84Å; L442-F577 HydrophobicContact CB-CE2 4.33Å; L442-F577 HydrophobicContact CB-CG 4.21Å; L442-F577 HydrophobicContact CD1-CD1 4.35Å; L442-F577 HydrophobicContact CD1-CD2 4.4Å; L442-F577 HydrophobicContact CD1-CE1 4.44Å; L442-F577 HydrophobicContact CD1-CE2 4.48Å; L442-F577 HydrophobicContact CD1-CG 4.34Å; L442-F577 HydrophobicContact CD2-CD2 4.22Å; L442-F577 HydrophobicContact CD2-CE2 3.82Å; L442-F577 HydrophobicContact CD2-CZ 4.22Å; L442-F577 HydrophobicContact CG-CD2 4.37Å; L442-F577 HydrophobicContact CG-CE2 4.43Å; E445-F577 HydrophobicContact CB-CD2 4.21Å; E445-F577 HydrophobicContact CB-CE2 3.96Å; E445-F577 HydrophobicContact CG-CE2 4.23Å; V484-F577 HydrophobicContact CG1-CB 3.38Å; V484-F577 HydrophobicContact CG1-CG 4.32Å; S485-F577 VanDerWaalsContact O-CD1 3.31Å; S485-F577 WeakPolarHBondContact O-CD1 3.28Å; R486-F577 WeakPolarHBondContact O-CE1 3.28Å; L489-F577 HydrophobicContact CD2-CD1 3.62Å; L489-F577 HydrophobicContact CD2-CE1 3.71Å; L489-F577 HydrophobicContact CD2-CG 4.17Å; L489-F577 HydrophobicContact CD2-CZ 4.33Å; H550-F577 AromaticContact CE1-CE1 3.98Å; H550-F577 AromaticContact CE1-CZ 3.74Å; H550-F577 AromaticContact ND1-CE1 3.97Å; A553-F577 HydrophobicContact CB-CE1 4.07Å; L554-F577 HydrophobicContact CB-CZ 4.26Å; L554-F577 HydrophobicContact CD1-CE2 3.89Å; L554-F577 HydrophobicContact CD1-CZ 3.82Å; L557-F577 HydrophobicContact CD1-CD2 3.81Å; L557-F577 HydrophobicContact CD1-CE2 3.79Å; L557-F577 HydrophobicContact CD1-CG 4.46Å; L557-F577 HydrophobicContact CD1-CZ 4.42Å
578	S	95.9	Very high	91.3	Very high	3 Å²	3	66.4 Å²	66.4	2%	0.021	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.5	143	-176.5	-60.6	0	0	0	0	112.1	S485 R488 L489 C490	S485-S578 WeakPolarHBondContact CB-O 3.41Å; S485-S578 PolarHBondContact N-O 3.08Å; R488-S578 WeakPolarHBondContact O-CB 3.27Å; R488-S578 PolarHBondContact O-N 3.09Å; R488-S578 PolarHBondContact O-OG 3.27Å; R488-S578 VanDerWaalsContact O-OG 3.05Å; L489-S578 VanDerWaalsContact C-OG 3.27Å; L489-S578 PolarHBondContact O-OG 2.88Å; C490-S578 PolarHBondContact N-OG 2.96Å
579	L	95.4	Very high	91.6	Very high	52 Å²	52	71.3 Å²	71.3	27%	0.272	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	130.6	166.3	-62.3	-171.9	0	0	0	110.1	K473 K476 L477 I482 F483 V484	K473-L579 HydrophobicContact CB-CD1 4.47Å; K473-L579 HydrophobicContact CG-CD1 4.03Å; K476-L579 HydrophobicContact CB-CD1 3.75Å; K476-L579 HydrophobicContact CD-CD1 4.41Å; L477-L579 HydrophobicContact CD1-CD2 4.32Å; L477-L579 HydrophobicContact CD2-CD2 3.76Å; L477-L579 HydrophobicContact CG-CD1 4.24Å; L477-L579 HydrophobicContact CG-CD2 4.05Å; I482-L579 HydrophobicContact CG2-CB 4Å; I482-L579 HydrophobicContact CG2-CD1 4.38Å; F483-L579 WeakPolarHBondContact O-CA 3.08Å; V484-L579 HydrophobicContact CG2-CD2 4Å
580	E	94.7	Very high	92.2	Very high	31 Å²	31	71.2 Å²	71.2	15%	0.145	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	139.3	-177.4	-69.6	169.5	-167.8	0	0	109.8	I482 F483 S485 L585	I482-E580 CarbonylContact C-O 3.47Å; I482-E580 VanDerWaalsContact CA-O 3.31Å; I482-E580 WeakPolarHBondContact CA-O 3.25Å; F483-E580 HydrophobicContact CD1-CB 4.23Å; F483-E580 WeakPolarHBondContact CD1-O 3.38Å; F483-E580 HydrophobicContact CE1-CB 3.64Å; F483-E580 WeakPolarHBondContact CE1-O 3.18Å; F483-E580 HydrophobicContact CE2-CB 4.4Å; F483-E580 HydrophobicContact CZ-CB 3.73Å; F483-E580 WeakPolarHBondContact CZ-OE2 3.31Å; F483-E580 PolarHBondContact N-O 2.91Å; F483-E580 PolarHBondContact O-N 3.27Å; S485-E580 WeakPolarHBondContact CB-OE1 3.45Å; S485-E580 PolarHBondContact OG-OE1 2.93Å; E580-L585 HydrophobicContact CB-CD1 4.23Å
581	D	94.5	Very high	92.6	Very high	24 Å²	24	74.2 Å²	74.2	13%	0.128	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	123.4	173.8	-173	-27.2	0	0	0	109.8	N481 I482 R583 K584 L585	N481-D581 WeakPolarHBondContact CB-OD1 3.44Å; I482-D581 HydrophobicContact CG1-CB 4.1Å; D581-R583 PolarHBondContact O-N 3.44Å; D581-R583 VanDerWaalsContact O-N 3.16Å; D581-R583 VanDerWaalsContact OD1-CB 3.29Å; D581-R583 WeakPolarHBondContact OD1-CB 3.48Å; D581-R583 WeakPolarHBondContact OD1-CG 3.34Å; D581-R583 PolarHBondContact OD1-N 3.45Å; D581-R583 IonicContact OD1-NE 4Å; D581-R583 PolarHBondContact OD1-NE 2.91Å; D581-R583 IonicContact OD2-CZ 2.82Å; D581-R583 VanDerWaalsContact OD2-CZ 3.27Å; D581-R583 IonicContact OD2-NE 3.94Å; D581-R583 PolarHBondContact OD2-NE 3Å; D581-R583 IonicContact OD2-NH2 3.05Å; D581-R583 PolarHBondContact OD2-NH2 2.7Å; D581-K584 HydrophobicContact CB-CB 4.37Å; D581-K584 HydrophobicContact CB-CG 4.36Å; D581-K584 PolarHBondContact O-N 3.39Å; D581-K584 VanDerWaalsContact O-N 3.14Å; D581-L585 PolarHBondContact O-N 3.01Å
582	R	91.6	Very high	92.9	Very high	115 Å²	115	73.4 Å²	73.4	43%	0.434	33%	0.326	S	S	.	.	H	α-helix	trans	-54	-32.3	177	-72.2	178.2	169	-88.2	-3	113.2	T437 N481 F483 K586	T437-R582 PolarHBondContact O-NH2 3.23Å; N481-R582 PolarHBondContact O-N 2.75Å; F483-R582 HydrophobicContact CD1-CG 3.63Å; F483-R582 HydrophobicContact CE1-CG 3.71Å; R582-K586 PolarHBondContact O-N 3.49Å; R582-K586 VanDerWaalsContact O-N 3.09Å
583	R	92.3	Very high	92.9	Very high	132 Å²	132	77.2 Å²	77.2	50%	0.498	35%	0.345	S	S	.	.	H	α-helix	trans	-67.3	-51.7	176.8	-60.1	174.5	-68.6	-178.9	0.4	111	N481 D581 L585 K586 M587	N481-R583 HydrophobicContact CB-CG 4.47Å; N481-R583 PolarHBondContact ND2-NE 2.81Å; D581-R583 PolarHBondContact O-N 3.44Å; D581-R583 VanDerWaalsContact O-N 3.16Å; D581-R583 VanDerWaalsContact OD1-CB 3.29Å; D581-R583 WeakPolarHBondContact OD1-CB 3.48Å; D581-R583 WeakPolarHBondContact OD1-CG 3.34Å; D581-R583 PolarHBondContact OD1-N 3.45Å; D581-R583 IonicContact OD1-NE 4Å; D581-R583 PolarHBondContact OD1-NE 2.91Å; D581-R583 IonicContact OD2-CZ 2.82Å; D581-R583 VanDerWaalsContact OD2-CZ 3.27Å; D581-R583 IonicContact OD2-NE 3.94Å; D581-R583 PolarHBondContact OD2-NE 3Å; D581-R583 IonicContact OD2-NH2 3.05Å; D581-R583 PolarHBondContact OD2-NH2 2.7Å; R583-L585 VanDerWaalsContact C-N 3.28Å; R583-L585 PolarHBondContact O-N 2.94Å; R583-K586 PolarHBondContact O-N 2.83Å; R583-M587 WeakPolarHBondContact O-CG 2.95Å; R583-M587 PolarHBondContact O-N 3.12Å
584	K	92	Very high	92.8	Very high	161 Å²	161	85.8 Å²	85.8	70%	0.7	38%	0.378	S	S	*	.	H	α-helix	trans	-65.6	-31.1	180	-64.8	-159.6	176	-162.8	0	111.9	D581 K588	D581-K584 HydrophobicContact CB-CB 4.37Å; D581-K584 HydrophobicContact CB-CG 4.36Å; D581-K584 PolarHBondContact O-N 3.39Å; D581-K584 VanDerWaalsContact O-N 3.14Å; K584-K588 WeakPolarHBondContact O-CB 3.43Å; K584-K588 PolarHBondContact O-N 2.9Å; K584-K588 VanDerWaalsContact O-N 3.08Å
585	L	90.5	Very high	92.5	Very high	67 Å²	67	89.1 Å²	89.1	35%	0.351	40%	0.401	S	S	.	.	H	α-helix	trans	-66.2	-50	170.9	-69.9	-177.4	0	0	0	112.7	F483 E580 D581 R583 M587 K588 E589	F483-L585 HydrophobicContact CE1-CD1 3.71Å; F483-L585 HydrophobicContact CZ-CD1 3.54Å; E580-L585 HydrophobicContact CB-CD1 4.23Å; D581-L585 PolarHBondContact O-N 3.01Å; R583-L585 VanDerWaalsContact C-N 3.28Å; R583-L585 PolarHBondContact O-N 2.94Å; L585-M587 VanDerWaalsContact C-N 3.3Å; L585-M587 PolarHBondContact O-N 3.26Å; L585-K588 WeakPolarHBondContact O-CB 3.25Å; L585-K588 PolarHBondContact O-N 3.16Å; L585-K588 VanDerWaalsContact O-N 3.07Å; L585-E589 WeakPolarHBondContact O-CB 3.42Å; L585-E589 PolarHBondContact O-N 3.45Å
586	K	91.8	Very high	92.4	Very high	139 Å²	139	94.3 Å²	94.3	60%	0.604	43%	0.428	S	S	*	.	H	α-helix	trans	-55.9	-43.1	175.4	-80.1	-168.9	168.2	-157.9	0	112.5	R582 R583 K588 E589 L590	R582-K586 PolarHBondContact O-N 3.49Å; R582-K586 VanDerWaalsContact O-N 3.09Å; R583-K586 PolarHBondContact O-N 2.83Å; K586-K588 VanDerWaalsContact C-N 3.33Å; K586-K588 PolarHBondContact O-N 2.78Å; K586-E589 PolarHBondContact O-N 2.9Å; K586-L590 WeakPolarHBondContact O-CB 3.46Å; K586-L590 WeakPolarHBondContact O-CG 3.36Å; K586-L590 PolarHBondContact O-N 3.06Å
587	M	90.9	Very high	92	Very high	130 Å²	130	97.8 Å²	97.8	64%	0.64	44%	0.444	S	S	*	.	H	α-helix	trans	-66.1	-34.3	177.3	-64.6	-56.3	-70.8	0	0	112.7	R583 L585 L590 R591	R583-M587 WeakPolarHBondContact O-CG 2.95Å; R583-M587 PolarHBondContact O-N 3.12Å; L585-M587 VanDerWaalsContact C-N 3.3Å; L585-M587 PolarHBondContact O-N 3.26Å; M587-L590 HydrophobicContact SD-CD1 4.39Å; M587-R591 VanDerWaalsContact O-CB 3.29Å; M587-R591 WeakPolarHBondContact O-CB 3.48Å; M587-R591 PolarHBondContact O-N 3.11Å
588	K	90.7	Very high	91.7	Very high	128 Å²	128	104.8 Å²	104.8	56%	0.557	48%	0.475	S	S	*	.	H	α-helix	trans	-67.1	-43.1	172.7	-175.3	-173.1	176.5	-170.3	0	111.4	K584 L585 K586 R591 I592	K584-K588 WeakPolarHBondContact O-CB 3.43Å; K584-K588 PolarHBondContact O-N 2.9Å; K584-K588 VanDerWaalsContact O-N 3.08Å; L585-K588 WeakPolarHBondContact O-CB 3.25Å; L585-K588 PolarHBondContact O-N 3.16Å; L585-K588 VanDerWaalsContact O-N 3.07Å; K586-K588 VanDerWaalsContact C-N 3.33Å; K586-K588 PolarHBondContact O-N 2.78Å; K588-R591 PolarHBondContact O-N 3.5Å; K588-I592 HydrophobicContact CG-CD1 4.07Å; K588-I592 VanDerWaalsContact O-CG1 3.29Å; K588-I592 WeakPolarHBondContact O-CG1 3.07Å; K588-I592 PolarHBondContact O-N 3.39Å
589	E	90.8	Very high	91	Very high	130 Å²	130	110.1 Å²	110.1	61%	0.607	50%	0.501	S	S	*	.	H	α-helix	trans	-62.3	-50.6	178.5	-173	166.1	-134.8	0	0	111.3	L585 K586 R591 I592 Q593	L585-E589 WeakPolarHBondContact O-CB 3.42Å; L585-E589 PolarHBondContact O-N 3.45Å; K586-E589 PolarHBondContact O-N 2.9Å; E589-R591 VanDerWaalsContact C-N 3.32Å; E589-R591 PolarHBondContact O-N 3.06Å; E589-I592 WeakPolarHBondContact O-CB 3.32Å; E589-I592 PolarHBondContact O-N 3.38Å; E589-I592 VanDerWaalsContact O-N 3.09Å; E589-Q593 PolarHBondContact O-N 3.32Å
590	L	92.4	Very high	90.4	Very high	85 Å²	85	114.1 Å²	114.1	45%	0.445	51%	0.512	S	S	.	.	H	α-helix	trans	-59.3	-38.6	173.4	-70.9	168.1	0	0	0	112.7	K586 M587 Q593 R594	K586-L590 WeakPolarHBondContact O-CB 3.46Å; K586-L590 WeakPolarHBondContact O-CG 3.36Å; K586-L590 PolarHBondContact O-N 3.06Å; M587-L590 HydrophobicContact SD-CD1 4.39Å; L590-Q593 PolarHBondContact O-N 3.1Å; L590-R594 WeakPolarHBondContact O-CB 3.24Å; L590-R594 WeakPolarHBondContact O-CG 3.2Å; L590-R594 PolarHBondContact O-N 2.83Å
591	R	91	Very high	89.6	Confident	200 Å²	200	116.9 Å²	116.9	76%	0.755	54%	0.535	S	S	*	.	H	α-helix	trans	-66.1	-36.8	175	-175.6	179.2	-73.5	-171	-3.5	111.9	M587 K588 E589 S595	M587-R591 VanDerWaalsContact O-CB 3.29Å; M587-R591 WeakPolarHBondContact O-CB 3.48Å; M587-R591 PolarHBondContact O-N 3.11Å; K588-R591 PolarHBondContact O-N 3.5Å; E589-R591 VanDerWaalsContact C-N 3.32Å; E589-R591 PolarHBondContact O-N 3.06Å; R591-S595 WeakPolarHBondContact O-CB 3.38Å; R591-S595 PolarHBondContact O-N 3.16Å; R591-S595 VanDerWaalsContact O-N 3.08Å
592	I	90.5	Very high	88.4	Confident	89 Å²	89	122 Å²	122	46%	0.456	56%	0.556	S	S	.	*	H	α-helix	trans	-68.5	-47.1	174.6	-69.3	164.6	0	0	0	110	K588 E589 S595 L596	K588-I592 HydrophobicContact CG-CD1 4.07Å; K588-I592 VanDerWaalsContact O-CG1 3.29Å; K588-I592 WeakPolarHBondContact O-CG1 3.07Å; K588-I592 PolarHBondContact O-N 3.39Å; E589-I592 WeakPolarHBondContact O-CB 3.32Å; E589-I592 PolarHBondContact O-N 3.38Å; E589-I592 VanDerWaalsContact O-N 3.09Å; I592-S595 CarbonylContact O-C 3.54Å; I592-S595 WeakPolarHBondContact O-CA 3.24Å; I592-S595 PolarHBondContact O-N 3.26Å; I592-S595 VanDerWaalsContact O-N 3.09Å; I592-L596 HydrophobicContact CG2-CD1 3.96Å; I592-L596 HydrophobicContact CG2-CG 4.43Å; I592-L596 WeakPolarHBondContact O-CG 3.48Å; I592-L596 PolarHBondContact O-N 2.89Å
593	Q	90.2	Very high	86.7	Confident	104 Å²	104	121.2 Å²	121.2	49%	0.486	57%	0.566	S	S	.	*	H	α-helix	trans	-59.3	-50.1	178.3	-173.1	177.4	1.9	0	0	111.8	E589 L590 S595 L596 Q597	E589-Q593 PolarHBondContact O-N 3.32Å; L590-Q593 PolarHBondContact O-N 3.1Å; Q593-S595 PolarHBondContact O-N 3.32Å; Q593-L596 PolarHBondContact O-N 3.43Å; Q593-Q597 PolarHBondContact O-N 3.25Å
594	R	91.7	Very high	84.9	Confident	182 Å²	182	119.6 Å²	119.6	69%	0.687	58%	0.58	S	S	*	*	H	α-helix	trans	-58.7	-33.6	173.6	-73.7	179.3	173	-169	-3.8	112.6	L590 K598	L590-R594 WeakPolarHBondContact O-CB 3.24Å; L590-R594 WeakPolarHBondContact O-CG 3.2Å; L590-R594 PolarHBondContact O-N 2.83Å; R594-K598 WeakPolarHBondContact O-CB 3.41Å; R594-K598 WeakPolarHBondContact O-CG 3.38Å; R594-K598 PolarHBondContact O-N 3.27Å
595	S	89.2	Confident	82.6	Confident	73 Å²	73	118.1 Å²	118.1	51%	0.51	59%	0.585	S	S	.	*	H	α-helix	trans	-75.2	-27	174.7	-167.3	0	0	0	0	113.5	R591 I592 Q593 M599	R591-S595 WeakPolarHBondContact O-CB 3.38Å; R591-S595 PolarHBondContact O-N 3.16Å; R591-S595 VanDerWaalsContact O-N 3.08Å; I592-S595 CarbonylContact O-C 3.54Å; I592-S595 WeakPolarHBondContact O-CA 3.24Å; I592-S595 PolarHBondContact O-N 3.26Å; I592-S595 VanDerWaalsContact O-N 3.09Å; Q593-S595 PolarHBondContact O-N 3.32Å; S595-M599 VanDerWaalsContact O-CG 3.24Å; S595-M599 WeakPolarHBondContact O-CG 3.5Å; S595-M599 PolarHBondContact O-N 2.81Å
596	L	91.7	Very high	80.4	Confident	109 Å²	109	118 Å²	118	57%	0.571	60%	0.6	S	S	*	*	H	α-helix	trans	-75.5	-44.6	174.7	-71.9	167	0	0	0	110.3	I592 Q593 K598 M599 R600	I592-L596 HydrophobicContact CG2-CD1 3.96Å; I592-L596 HydrophobicContact CG2-CG 4.43Å; I592-L596 WeakPolarHBondContact O-CG 3.48Å; I592-L596 PolarHBondContact O-N 2.89Å; Q593-L596 PolarHBondContact O-N 3.43Å; L596-K598 PolarHBondContact O-N 3.26Å; L596-M599 CarbonylContact O-C 3.49Å; L596-M599 WeakPolarHBondContact O-CA 3.16Å; L596-M599 PolarHBondContact O-N 3.02Å; L596-R600 PolarHBondContact O-N 3.36Å
597	Q	88.3	Confident	78	Confident	96 Å²	96	119.2 Å²	119.2	45%	0.449	61%	0.608	S	S	.	*	H	α-helix	trans	-55.7	-49.7	171.1	-71.8	171.6	-54.2	0	0	111	Q593 M599 R600 S601	Q593-Q597 PolarHBondContact O-N 3.25Å; Q597-M599 PolarHBondContact O-N 2.98Å; Q597-R600 PolarHBondContact O-N 3.35Å; Q597-R600 VanDerWaalsContact O-N 3.09Å; Q597-S601 WeakPolarHBondContact O-CB 3.42Å; Q597-S601 PolarHBondContact O-N 2.65Å; Q597-S601 PolarHBondContact O-OG 2.71Å
598	K	89.2	Confident	75.7	Confident	150 Å²	150	119 Å²	119	65%	0.652	62%	0.616	S	S	*	*	H	α-helix	trans	-66.6	-1.2	174.5	-71.8	-172	177.5	-165.9	0	115.6	R594 L596 K602	R594-K598 WeakPolarHBondContact O-CB 3.41Å; R594-K598 WeakPolarHBondContact O-CG 3.38Å; R594-K598 PolarHBondContact O-N 3.27Å; L596-K598 PolarHBondContact O-N 3.26Å; K598-K602 WeakPolarHBondContact O-CE 3.3Å; K598-K602 WeakPolarHBondContact O-CG 3.41Å
599	M	81.3	Confident	73.2	Confident	115 Å²	115	121 Å²	121	57%	0.567	63%	0.627	S	S	*	*	H	α-helix	trans	-107.1	-29.8	169.8	-71.8	-67.6	-62.9	0	0	112.2	S595 L596 Q597 K602	S595-M599 VanDerWaalsContact O-CG 3.24Å; S595-M599 WeakPolarHBondContact O-CG 3.5Å; S595-M599 PolarHBondContact O-N 2.81Å; L596-M599 CarbonylContact O-C 3.49Å; L596-M599 WeakPolarHBondContact O-CA 3.16Å; L596-M599 PolarHBondContact O-N 3.02Å; Q597-M599 PolarHBondContact O-N 2.98Å; M599-K602 HydrophobicContact SD-CD 4.08Å; M599-K602 PolarHBondContact SD-NZ 2.91Å
600	R	84	Confident	70.7	Confident	136 Å²	136	124.9 Å²	124.9	51%	0.513	64%	0.642	S	S	.	*	H	α-helix	trans	-67.4	-48.6	166.3	-73.6	-170.9	167.7	-157.3	-12.8	111.7	E229 E231 L596 Q597 K602	E229-R600 IonicContact OE1-CZ 3.81Å; E229-R600 IonicContact OE1-NH1 2.73Å; E229-R600 PolarHBondContact OE1-NH1 3.47Å; E229-R600 IonicContact OE1-NH2 3.07Å; E229-R600 PolarHBondContact OE1-NH2 2.89Å; E229-R600 IonicContact OE2-NH2 2.74Å; E231-R600 VanDerWaalsContact OE1-CD 3.24Å; E231-R600 WeakPolarHBondContact OE1-CD 3.35Å; E231-R600 IonicContact OE1-CZ 3.47Å; E231-R600 IonicContact OE1-NE 3.77Å; E231-R600 IonicContact OE1-NH1 2.72Å; E231-R600 PolarHBondContact OE1-NH1 3.09Å; L596-R600 PolarHBondContact O-N 3.36Å; Q597-R600 PolarHBondContact O-N 3.35Å; Q597-R600 VanDerWaalsContact O-N 3.09Å; R600-K602 PolarHBondContact O-N 3.45Å
601	S	77.9	Confident	68	Low	89 Å²	89	124.2 Å²	124.2	62%	0.622	66%	0.656	S	S	*	*	S	Bend	trans	-75.7	11.9	-175.9	82.6	0	0	0	0	114.5	Q597 P603	Q597-S601 WeakPolarHBondContact O-CB 3.42Å; Q597-S601 PolarHBondContact O-N 2.65Å; Q597-S601 PolarHBondContact O-OG 2.71Å; S601-P603 WeakPolarHBondContact O-CD 3.43Å
602	K	69.2	Low	65.4	Low	133 Å²	133	124.2 Å²	124.2	58%	0.578	67%	0.665	S	S	*	*	S	Bend	trans	-86.5	112	171.4	-84.4	175.9	-179.5	173.9	0	107.9	K598 M599 R600	K598-K602 WeakPolarHBondContact O-CE 3.3Å; K598-K602 WeakPolarHBondContact O-CG 3.41Å; M599-K602 HydrophobicContact SD-CD 4.08Å; M599-K602 PolarHBondContact SD-NZ 2.91Å; R600-K602 PolarHBondContact O-N 3.45Å
603	P	56.2	Low	63	Low	98 Å²	98	125.7 Å²	125.7	64%	0.636	68%	0.68	S	S	*	*			trans	-61.6	147.4	177.1	28	-35.2	0	0	0	110	S601 T605	S601-P603 WeakPolarHBondContact O-CD 3.43Å; P603-T605 HydrophobicContact CB-CG2 4.29Å; P603-T605 HydrophobicContact CG-CG2 4.24Å; P603-T605 PolarHBondContact O-N 2.88Å
604	A	54.2	Low	60.8	Low	97 Å²	97	129.7 Å²	129.7	80%	0.802	70%	0.699	S	S	*	*			trans	-75	47.9	177.5	0	0	0	0	0	112.3	G606	A604-G606 PolarHBondContact O-N 3.44Å
605	T	43.7	Very low	58.3	Low	130 Å²	130	127 Å²	127	80%	0.798	71%	0.705	S	S	*	*			trans	-70.2	77.3	173.6	48.2	0	0	0	0	109.9	P603	P603-T605 HydrophobicContact CB-CG2 4.29Å; P603-T605 HydrophobicContact CG-CG2 4.24Å; P603-T605 PolarHBondContact O-N 2.88Å
606	G	44.2	Very low	56.1	Low	64 Å²	64	128.3 Å²	128.3	66%	0.66	72%	0.721	S	S	*	*			trans	-175.2	22.5	-172.9	0	0	0	0	0	114.8	A604 P608	A604-G606 PolarHBondContact O-N 3.44Å; G606-P608 VanDerWaalsContact O-CD 3.32Å; G606-P608 WeakPolarHBondContact O-CD 3.36Å
607	E	39.9	Very low	53.7	Low	166 Å²	166	132.6 Å²	132.6	78%	0.776	73%	0.734	S	S	*	*			trans	-67	120.4	171.2	-71.7	-163.8	138.1	0	0	111.1	Q609	E607-Q609 PolarHBondContact O-N 2.9Å; E607-Q609 VanDerWaalsContact O-N 3.14Å
608	P	43.9	Very low	51.4	Low	124 Å²	124	134.1 Å²	134.1	81%	0.805	75%	0.746	S	S	*	*			trans	-83.7	89.4	176.2	33.4	-32	0	0	0	110.3	G606 K610	G606-P608 VanDerWaalsContact O-CD 3.32Å; G606-P608 WeakPolarHBondContact O-CD 3.36Å; P608-K610 PolarHBondContact O-N 2.93Å
609	Q	38.3	Very low	49.1	Very low	171 Å²	171	136.6 Å²	136.6	80%	0.799	76%	0.759	S	S	*	*			trans	-64.9	90.6	170.4	-71	-172.1	-1.5	0	0	111.7	E607	E607-Q609 PolarHBondContact O-N 2.9Å; E607-Q609 VanDerWaalsContact O-N 3.14Å
610	K	37.4	Very low	47.3	Very low	211 Å²	211	138.3 Å²	138.3	92%	0.917	77%	0.766	S	S	*	*			trans	175	140.6	144.6	-99.1	152.8	-173.1	175.3	0	113.3	P608	P608-K610 PolarHBondContact O-N 2.93Å
611	G	37.1	Very low	45.3	Very low	72 Å²	72	139.5 Å²	139.5	74%	0.742	78%	0.778	S	S	*	*			trans	111.3	88.2	155.2	0	0	0	0	0	115.7
612	Q	35.6	Very low	43.4	Very low	199 Å²	199	145.1 Å²	145.1	93%	0.93	79%	0.791	S	S	*	*			trans	-77.8	132	154.1	-68.1	171.9	-64.1	0	0	109
613	P	40.2	Very low	42	Very low	121 Å²	121	142.8 Å²	142.8	79%	0.786	80%	0.796	S	S	*	*			trans	-104.7	130.4	160.4	34.1	-25.3	0	0	0	110.6
614	E	42.9	Very low	41.1	Very low	187 Å²	187	142.3 Å²	142.3	87%	0.874	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-75.3	153.2	171.1	-72.2	-156.5	141.3	0	0	112.2	A616	E614-A616 PolarHBondContact O-N 2.74Å
615	P	39.9	Very low	40.6	Very low	125 Å²	125	146.4 Å²	146.4	81%	0.812	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-78.2	121.4	-174.5	30.3	-34.6	0	0	0	113
616	A	42.7	Very low	40.5	Very low	102 Å²	102	147.3 Å²	147.3	84%	0.843	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-75.8	149.5	169.5	0	0	0	0	0	111.9	E614	E614-A616 PolarHBondContact O-N 2.74Å
617	K	41	Very low	40.3	Very low	198 Å²	198	151.5 Å²	151.5	86%	0.861	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-90.3	165.1	-177	-68	-178.6	178.4	177.4	0	113.5
618	D	39.6	Very low	40	Very low	129 Å²	129	148.4 Å²	148.4	69%	0.69	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-55.7	151.3	-178.3	-52.5	-102.5	0	0	0	116.1
619	Q	41.4	Very low	39.8	Very low	201 Å²	201	150.4 Å²	150.4	94%	0.939	79%	0.791	S	S	*	*				-152.5	162.4	122.2	-117.9	158.8	87.3	0	0	112.7
620	Q	44.7	Very low	39.6	Very low	151 Å²	151	150.1 Å²	150.1	71%	0.706	79%	0.79	S	S	*	*			trans	-114.2	147.5	-152.3	-66.3	176.3	-15.6	0	0	115
621	Q	40.7	Very low	39.7	Very low	162 Å²	162	148 Å²	148	76%	0.757	78%	0.783	S	S	*	*			trans	30.3	120.9	137.3	-55.4	177.1	6.9	0	0	120.2
622	K	39.6	Very low	39.7	Very low	207 Å²	207	149.4 Å²	149.4	90%	0.9	78%	0.782	S	S	*	*				168	160.7	125.3	-90.4	152.8	-173	175	0	109.8
623	A	38.6	Very low	39.9	Very low	84 Å²	84	148.8 Å²	148.8	69%	0.694	78%	0.776	S	S	*	*			cis	-172.4	142.9	-36	0	0	0	0	0	108.4
624	A	38.3	Very low	39.9	Very low	87 Å²	87	149.7 Å²	149.7	72%	0.719	78%	0.779	S	S	*	*			trans	67	135	151.1	0	0	0	0	0	122.4
625	Q	43.6	Very low	40	Very low	183 Å²	183	146.2 Å²	146.2	86%	0.855	77%	0.773	S	S	*	*			trans	99.4	135.2	133.9	-83.3	168.4	11.7	0	0	123.9
626	H	41.4	Very low	39.9	Very low	150 Å²	150	146.3 Å²	146.3	69%	0.694	77%	0.773	S	S	*	*			trans	86.5	94.3	152.8	-92.4	-98.6	0	0	0	123.3
627	H	39	Very low	39.6	Very low	151 Å²	151	149 Å²	149	70%	0.699	77%	0.768	S	S	*	*				77.7	148.9	121.5	-88.8	-105.3	0	0	0	123.8
628	T	33.3	Very low	39.4	Very low	102 Å²	102	145.3 Å²	145.3	63%	0.626	75%	0.754	S	S	*	*			trans	-34.5	166.9	167.5	22.8	0	0	0	0	117.9
629	E	39.4	Very low	39.3	Very low	165 Å²	165	146.1 Å²	146.1	77%	0.771	75%	0.752	S	S	*	*			cis	-149.3	-165.2	26.1	-148.8	126.2	-112.3	0	0	114.7
630	E	34	Very low	39	Very low	165 Å²	165	146.5 Å²	146.5	77%	0.771	74%	0.744	S	S	*	*			trans	-49.3	155.9	-177.4	-52	179.2	138.2	0	0	115.2
631	Q	39.9	Very low	38.7	Very low	167 Å²	167	148.3 Å²	148.3	78%	0.78	75%	0.75	S	S	*	*				-171.9	136.6	66.5	-75.8	-178	5.3	0	0	115.1
632	S	38.6	Very low	38.4	Very low	101 Å²	101	145.4 Å²	145.4	71%	0.706	75%	0.753	S	S	*	*			trans	53	136.6	139.7	85.5	0	0	0	0	125.7
633	K	38.5	Very low	38.5	Very low	187 Å²	187	139.1 Å²	139.1	81%	0.813	75%	0.747	S	S	*	*			trans	84.6	99	136	-86	-177.5	175.5	176.9	0	123.5
634	V	41.4	Very low	38.6	Very low	139 Å²	139	140.5 Å²	140.5	84%	0.842	75%	0.752	S	S	*	*			trans	63.7	156.2	136.2	-76.6	0	0	0	0	121.3
635	P	43.3	Very low	38.9	Very low	115 Å²	115	143 Å²	143	75%	0.747	76%	0.758	S	S	*	*			trans	-122.5	179	-150.5	44.6	-33.3	0	0	0	115.5
636	P	39.5	Very low	38.9	Very low	127 Å²	127	139.6 Å²	139.6	83%	0.825	76%	0.755	S	S	*	*			trans	-113.1	161.8	159.1	36.6	-26.1	0	0	0	114.4
637	E	35.1	Very low	38.9	Very low	157 Å²	157	144.1 Å²	144.1	73%	0.734	77%	0.766	S	S	*	*			trans	-85.7	163.9	177.6	-83.8	-163.3	94.2	0	0	114.6
638	Q	37.2	Very low	39	Very low	122 Å²	122	143.3 Å²	143.3	57%	0.57	77%	0.772	S	S	*	*			trans	38	125.3	144.5	-60.2	177.4	36.3	0	0	118.7
639	K	36.9	Very low	39.7	Very low	146 Å²	146	141 Å²	141	64%	0.635	77%	0.768	S	S	*	*				177.2	152.2	72.3	-113.2	124	178.9	148.5	0	111.8
640	R	35.2	Very low	39.9	Very low	208 Å²	208	142.9 Å²	142.9	79%	0.785	77%	0.774	S	S	*	*			trans	65.6	150	147.8	-65.2	164.9	-179.1	-172.6	-0.9	114.5
641	K	38.8	Very low	40.3	Very low	190 Å²	190	143.4 Å²	143.4	83%	0.826	78%	0.777	S	S	*	*			cis	170	165.5	3.4	-106.3	-178.4	175.2	-166.3	0	103
642	A	35.3	Very low	40.8	Very low	100 Å²	100	141 Å²	141	83%	0.826	77%	0.774	S	S	*	*			cis	-157.3	175.5	-5.1	0	0	0	0	0	108.3
643	G	40.1	Very low	41.6	Very low	75 Å²	75	145.6 Å²	145.6	77%	0.773	78%	0.781	S	S	*	*			trans	134	130.2	173.4	0	0	0	0	0	113.2
644	S	41.1	Very low	42.3	Very low	114 Å²	114	140.6 Å²	140.6	80%	0.797	78%	0.775	S	S	*	*			cis	161.3	84.6	-47.2	176.7	0	0	0	0	109.3
645	T	44.3	Very low	43.1	Very low	138 Å²	138	143.2 Å²	143.2	85%	0.847	78%	0.778	S	S	*	*			trans	-152.4	104.2	163	22.5	0	0	0	0	107
646	S	44.8	Very low	43.8	Very low	113 Å²	113	140.8 Å²	140.8	79%	0.79	76%	0.761	S	S	*	*				74.9	102	88.2	-164.2	0	0	0	0	112.9
647	W	40.2	Very low	45	Very low	244 Å²	244	140.7 Å²	140.7	92%	0.924	75%	0.749	S	S	*	*			trans	-127.6	124	172.5	-179.3	43.1	0	0	0	108.8
648	T	41.2	Very low	46.6	Very low	134 Å²	134	139 Å²	139	82%	0.822	74%	0.741	S	S	*	*			trans	-105.1	107.3	179.8	49.1	0	0	0	0	110.1
649	G	49.1	Very low	48.3	Very low	53 Å²	53	136.7 Å²	136.7	55%	0.546	74%	0.736	S	S	.	*			trans	-148.6	150.2	177.9	0	0	0	0	0	110.6	Q651	G649-Q651 PolarHBondContact O-N 3.07Å
650	F	42.4	Very low	50.1	Low	206 Å²	206	135.8 Å²	135.8	90%	0.904	73%	0.734	S	S	*	*			trans	-60.9	118	-168.9	-151	-98.8	0	0	0	112	T652	F650-T652 HydrophobicContact CD1-CG2 4.19Å; F650-T652 HydrophobicContact CE1-CG2 4.1Å
651	Q	43.4	Very low	51.7	Low	175 Å²	175	129.5 Å²	129.5	82%	0.818	72%	0.715	S	S	*	*			trans	-118.1	97.7	-177	-166.9	177.7	32.7	0	0	110.9	G649 K653	G649-Q651 PolarHBondContact O-N 3.07Å; Q651-K653 PolarHBondContact O-N 3.49Å
652	T	49.9	Very low	53.4	Low	117 Å²	117	126.9 Å²	126.9	72%	0.718	72%	0.717	S	S	*	*			trans	-69.2	117.8	175.6	42.1	0	0	0	0	110.8	F650 A654	F650-T652 HydrophobicContact CD1-CG2 4.19Å; F650-T652 HydrophobicContact CE1-CG2 4.1Å; T652-A654 PolarHBondContact O-N 2.92Å
653	K	56.1	Low	55.5	Low	197 Å²	197	127.6 Å²	127.6	86%	0.857	71%	0.707	S	S	*	*			trans	-78.4	103.9	170.3	-67.7	179.3	-178.1	175.2	0	108.6	Q651 E655	Q651-K653 PolarHBondContact O-N 3.49Å; K653-E655 PolarHBondContact O-N 2.67Å
654	A	53.4	Low	57.1	Low	83 Å²	83	127.1 Å²	127.1	69%	0.686	70%	0.703	S	S	*	*			trans	-70.9	114.1	167	0	0	0	0	0	109.1	T652	T652-A654 PolarHBondContact O-N 2.92Å
655	E	56.8	Low	58.8	Low	194 Å²	194	128 Å²	128	91%	0.907	69%	0.692	S	S	*	*			trans	-64.6	136.9	166.5	-68	-169.4	124.4	0	0	109.5	K653	K653-E655 PolarHBondContact O-N 2.67Å
656	V	58.1	Low	60.2	Low	64 Å²	64	127.2 Å²	127.2	39%	0.388	68%	0.677	S	S	.	*			trans	-124.9	90.9	-176.7	179.3	0	0	0	0	108.6	Q658 R668	V656-Q658 PolarHBondContact O-N 3Å; V656-R668 HydrophobicContact CG1-CB 4.21Å; V656-R668 HydrophobicContact CG1-CG 3.62Å
657	E	66	Low	61.3	Low	125 Å²	125	130.6 Å²	130.6	58%	0.584	67%	0.672	S	S	*	*	P	Polyproline II helix	trans	-54.9	122.1	165.7	-102.3	-175.1	114	0	0	109.7	K669	E657-K669 HydrophobicContact CB-CB 4.15Å; E657-K669 HydrophobicContact CB-CD 3.9Å; E657-K669 HydrophobicContact CG-CD 4.46Å; E657-K669 PolarHBondContact O-N 2.97Å; E657-K669 IonicContact OE1-NZ 3.01Å; E657-K669 PolarHBondContact OE1-NZ 3.06Å; E657-K669 WeakPolarHBondContact OE2-CD 3.49Å; E657-K669 WeakPolarHBondContact OE2-CE 3.47Å; E657-K669 IonicContact OE2-NZ 3.24Å; E657-K669 PolarHBondContact OE2-NZ 3.11Å
658	Q	68.6	Low	62.7	Low	120 Å²	120	127.4 Å²	127.4	56%	0.561	66%	0.66	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-103.1	127.1	169.5	-61.9	-173.5	16.5	0	0	108.1	V656 K666 R667	V656-Q658 PolarHBondContact O-N 3Å; Q658-K666 HydrophobicContact CB-CB 4.5Å; Q658-R667 WeakPolarHBondContact CA-O 3.49Å
659	V	72.4	Confident	64	Low	75 Å²	75	126.4 Å²	126.4	46%	0.455	64%	0.644	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-99.3	132	171.8	-177.7	0	0	0	0	107.9	R667 K669	V659-R667 PolarHBondContact N-O 2.94Å; V659-R667 PolarHBondContact O-N 2.81Å; V659-R667 VanDerWaalsContact O-N 3.13Å; V659-K669 HydrophobicContact CG2-CB 4.37Å; V659-K669 HydrophobicContact CG2-CD 4.37Å; V659-K669 HydrophobicContact CG2-CG 4.41Å
660	E	74.7	Confident	64.6	Low	127 Å²	127	130 Å²	130	59%	0.593	66%	0.656	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-85.6	126.6	174.5	-58.7	-168.1	163.6	0	0	109.5	K666	E660-K666 HydrophobicContact CG-CD 4.18Å; E660-K666 HydrophobicContact CG-CG 4.2Å; E660-K666 WeakPolarHBondContact OE1-CE 3.48Å; E660-K666 IonicContact OE1-NZ 2.6Å; E660-K666 PolarHBondContact OE1-NZ 3.46Å
661	L	69.7	Low	65.3	Low	76 Å²	76	127.4 Å²	127.4	40%	0.398	65%	0.65	S	S	.	*	P	Polyproline II helix	trans	-85.2	154	171.4	-69.8	160.4	0	0	0	109.6	D663 G664 K665 R667	L661-D663 PolarHBondContact O-N 2.92Å; L661-G664 PolarHBondContact O-N 2.99Å; L661-K665 WeakPolarHBondContact CB-O 3.24Å; L661-K665 PolarHBondContact N-O 3.29Å; L661-R667 HydrophobicContact CD1-CG 4.07Å
662	P	73	Confident	66	Low	134 Å²	134	123.8 Å²	123.8	87%	0.87	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.3	-21.6	175.7	22.5	-33.5	0	0	0	113.7	G664	P662-G664 PolarHBondContact O-N 3.47Å
663	D	79.4	Confident	66.3	Low	116 Å²	116	126 Å²	126	62%	0.62	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.6	5.8	170.2	-77.4	17.8	0	0	0	114.9	L661 K665	L661-D663 PolarHBondContact O-N 2.92Å; D663-K665 HydrophobicContact CB-CD 4.17Å; D663-K665 PolarHBondContact O-N 3.13Å; D663-K665 VanDerWaalsContact O-N 3.14Å; D663-K665 IonicContact OD2-NZ 3.59Å
664	G	75.6	Confident	66.4	Low	65 Å²	65	122.3 Å²	122.3	67%	0.67	65%	0.653	S	S	*	*	S	Bend	trans	69.5	5.1	-176.5	0	0	0	0	0	115.2	L661 P662	L661-G664 PolarHBondContact O-N 2.99Å; P662-G664 PolarHBondContact O-N 3.47Å
665	K	75.8	Confident	66.7	Low	133 Å²	133	123.6 Å²	123.6	58%	0.578	66%	0.657	S	S	*	*			trans	-96.6	122.1	-176.7	-67.3	161.3	-165.6	153.9	0	110.4	L661 D663	L661-K665 WeakPolarHBondContact CB-O 3.24Å; L661-K665 PolarHBondContact N-O 3.29Å; D663-K665 HydrophobicContact CB-CD 4.17Å; D663-K665 PolarHBondContact O-N 3.13Å; D663-K665 VanDerWaalsContact O-N 3.14Å; D663-K665 IonicContact OD2-NZ 3.59Å
666	K	73.6	Confident	66.3	Low	121 Å²	121	123.2 Å²	123.2	53%	0.526	66%	0.655	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-82	133.9	177	-43.3	-157.9	-173.1	-155.8	0	110.5	Q658 E660	Q658-K666 HydrophobicContact CB-CB 4.5Å; E660-K666 HydrophobicContact CG-CD 4.18Å; E660-K666 HydrophobicContact CG-CG 4.2Å; E660-K666 WeakPolarHBondContact OE1-CE 3.48Å; E660-K666 IonicContact OE1-NZ 2.6Å; E660-K666 PolarHBondContact OE1-NZ 3.46Å
667	R	68.2	Low	65.9	Low	184 Å²	184	131.4 Å²	131.4	69%	0.694	68%	0.679	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-124.8	147.6	170	-67.5	179.7	87.2	164.8	2.4	110.1	Q658 V659 L661	Q658-R667 WeakPolarHBondContact CA-O 3.49Å; V659-R667 PolarHBondContact N-O 2.94Å; V659-R667 PolarHBondContact O-N 2.81Å; V659-R667 VanDerWaalsContact O-N 3.13Å; L661-R667 HydrophobicContact CD1-CG 4.07Å
668	R	69.5	Low	65.2	Low	176 Å²	176	128.2 Å²	128.2	66%	0.664	68%	0.679	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-63.8	134	169.8	-65.7	-176.5	61.1	-174.2	-1.8	109.1	V656 V670	V656-R668 HydrophobicContact CG1-CB 4.21Å; V656-R668 HydrophobicContact CG1-CG 3.62Å; R668-V670 PolarHBondContact O-N 2.78Å; R668-V670 VanDerWaalsContact O-N 3.13Å
669	K	68.4	Low	64	Low	113 Å²	113	128.7 Å²	128.7	49%	0.491	69%	0.693	S	S	.	*			trans	-67.1	104.6	170.7	-164.9	177	-176.7	-179.7	0	108.8	E657 V659	E657-K669 HydrophobicContact CB-CB 4.15Å; E657-K669 HydrophobicContact CB-CD 3.9Å; E657-K669 HydrophobicContact CG-CD 4.46Å; E657-K669 PolarHBondContact O-N 2.97Å; E657-K669 IonicContact OE1-NZ 3.01Å; E657-K669 PolarHBondContact OE1-NZ 3.06Å; E657-K669 WeakPolarHBondContact OE2-CD 3.49Å; E657-K669 WeakPolarHBondContact OE2-CE 3.47Å; E657-K669 IonicContact OE2-NZ 3.24Å; E657-K669 PolarHBondContact OE2-NZ 3.11Å; V659-K669 HydrophobicContact CG2-CB 4.37Å; V659-K669 HydrophobicContact CG2-CD 4.37Å; V659-K669 HydrophobicContact CG2-CG 4.41Å
670	V	61.3	Low	62.7	Low	130 Å²	130	134.7 Å²	134.7	79%	0.788	71%	0.713	S	S	*	*	P	Polyproline II helix	trans	-90.5	119.5	175	179.1	0	0	0	0	107.8	R668	R668-V670 PolarHBondContact O-N 2.78Å; R668-V670 VanDerWaalsContact O-N 3.13Å
671	L	57.3	Low	61.4	Low	151 Å²	151	135.6 Å²	135.6	79%	0.791	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-65.1	133.1	172.4	-68.4	170.6	0	0	0	109.4	L673	L671-L673 PolarHBondContact O-N 3.07Å
672	A	57.6	Low	60.2	Low	99 Å²	99	143.7 Å²	143.7	82%	0.818	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-71.2	121.1	177.3	0	0	0	0	0	110
673	L	55.8	Low	59	Low	162 Å²	162	145.5 Å²	145.5	85%	0.848	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-63.7	135.7	171.6	-72.9	168	0	0	0	109.8	L671 S675	L671-L673 PolarHBondContact O-N 3.07Å; L673-S675 PolarHBondContact O-N 3.41Å
674	P	60.2	Low	57.4	Low	120 Å²	120	150.7 Å²	150.7	78%	0.779	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-59.2	123.9	-178.9	-26.5	34.9	0	0	0	112.8	H676	P674-H676 PolarHBondContact O-N 2.95Å
675	S	59.2	Low	56.1	Low	111 Å²	111	155.3 Å²	155.3	78%	0.776	77%	0.767	S	S	*	*			trans	-74.9	98.8	177.7	58.2	0	0	0	0	110.5	L673 R677	L673-S675 PolarHBondContact O-N 3.41Å; S675-R677 PolarHBondContact O-N 3.26Å
676	H	48.5	Very low	54.6	Low	186 Å²	186	158 Å²	158	86%	0.861	78%	0.779	S	S	*	*			trans	-75.1	61.3	-173.2	-156.6	-91.3	0	0	0	113.8	P674 G678	P674-H676 PolarHBondContact O-N 2.95Å; H676-G678 PolarHBondContact O-N 3.47Å
677	R	48.8	Very low	53.2	Low	236 Å²	236	156 Å²	156	89%	0.891	79%	0.792	S	S	*	*			trans	-85.8	50.2	-173.2	-150	177.8	-159.1	-117.8	6.3	113	S675	S675-R677 PolarHBondContact O-N 3.26Å
678	G	51.9	Low	52.1	Low	57 Å²	57	156.8 Å²	156.8	59%	0.588	80%	0.8	S	S	*	*			trans	-73.6	137.6	178	0	0	0	0	0	113.3	H676	H676-G678 PolarHBondContact O-N 3.47Å
679	P	43.1	Very low	51	Low	130 Å²	130	155.1 Å²	155.1	84%	0.844	81%	0.81	S	S	*	*			trans	-86	121.2	-177.5	32.2	-33.2	0	0	0	112.8
680	K	45.4	Very low	49.9	Very low	202 Å²	202	158.9 Å²	158.9	88%	0.878	83%	0.826	S	S	*	*			trans	-128.7	92.5	169.6	-106.8	171.9	179.5	171.5	0	113.1
681	I	48.1	Very low	49.1	Very low	145 Å²	145	158 Å²	158	74%	0.744	82%	0.822	S	S	*	*			trans	39.4	105	145.8	-50	174.1	0	0	0	117.1	L683	I681-L683 HydrophobicContact CG2-CD1 3.87Å
682	R	43.1	Very low	48.4	Very low	246 Å²	246	156.2 Å²	156.2	93%	0.928	82%	0.818	S	S	*	*			trans	-88.8	109.1	155.4	-72.3	177.6	172.9	169.9	-3.1	109.3
683	L	48.6	Very low	47.8	Very low	172 Å²	172	160.1 Å²	160.1	90%	0.901	82%	0.819	S	S	*	*			trans	-80.9	121.8	158.7	-120.2	75.6	0	0	0	108.7	I681	I681-L683 HydrophobicContact CG2-CD1 3.87Å
684	R	44.7	Very low	47.2	Very low	225 Å²	225	157.2 Å²	157.2	85%	0.849	81%	0.81	S	S	*	*			trans	-138.3	117.1	179.2	179.2	-161.2	-150	-176.5	8.9	106.7
685	D	49.1	Very low	46.3	Very low	162 Å²	162	160.8 Å²	160.8	87%	0.866	81%	0.813	S	S	*	*			trans	-147.1	146.2	163.1	-126.7	-34.4	0	0	0	113.9
686	K	45.1	Very low	45.6	Very low	191 Å²	191	165.6 Å²	165.6	83%	0.83	82%	0.82	S	S	*	*			trans	-117	107.7	174.9	-73.5	-175.3	174.8	-174.8	0	106.7
687	G	43.5	Very low	45.2	Very low	77 Å²	77	162.1 Å²	162.1	79%	0.794	81%	0.814	S	S	*	*			trans	-64.7	148.6	-167	0	0	0	0	0	115.1
688	K	45.9	Very low	44.6	Very low	201 Å²	201	159.4 Å²	159.4	87%	0.874	81%	0.808	S	S	*	*			trans	-162	142.1	155.9	-114.5	173.9	-175.3	-176.7	0	111.2
689	V	45.2	Very low	44.1	Very low	142 Å²	142	162.8 Å²	162.8	86%	0.861	82%	0.82	S	S	*	*			trans	72.5	154.5	170.1	-149.5	0	0	0	0	117.4
690	K	45.6	Very low	44	Very low	191 Å²	191	162.9 Å²	162.9	83%	0.83	81%	0.809	S	S	*	*			trans	-111.7	-167.2	180	-49	176.9	-179.4	174.3	0	108.3
691	P	43.5	Very low	43.8	Very low	111 Å²	111	161.3 Å²	161.3	72%	0.721	81%	0.809	S	S	*	*			cis	-136.9	166.9	-7.2	38.2	-18.2	0	0	0	117.4
692	V	42.8	Very low	43.5	Very low	114 Å²	114	160.3 Å²	160.3	69%	0.691	81%	0.805	S	S	*	*			trans	33.3	124	140	-177.3	0	0	0	0	120.6
693	H	46.5	Very low	43.4	Very low	181 Å²	181	156.6 Å²	156.6	84%	0.838	80%	0.798	S	S	*	*				-172.7	161.3	117.4	-93.3	-66.9	0	0	0	111.4
694	P	43.2	Very low	42.6	Very low	101 Å²	101	160.1 Å²	160.1	66%	0.656	80%	0.8	S	S	*	*			trans	-134.7	170.2	-155.1	44.4	-29.2	0	0	0	119.3
695	K	40.9	Very low	42.2	Very low	196 Å²	196	156.6 Å²	156.6	85%	0.852	79%	0.79	S	S	*	*			trans	75.1	120.9	161.7	-57.4	179.8	-177.4	177.1	0	120.3
696	K	44.2	Very low	41.4	Very low	212 Å²	212	158.5 Å²	158.5	92%	0.922	79%	0.794	S	S	*	*				-169.3	155.6	122	-102.1	165	-175.8	179.8	0	111
697	P	39.4	Very low	40.8	Very low	113 Å²	113	157.6 Å²	157.6	73%	0.734	79%	0.793	S	S	*	*			trans	-126.9	166.8	-171.8	41.8	-29	0	0	0	116.7
698	K	37.6	Very low	40.3	Very low	178 Å²	178	164.1 Å²	164.1	77%	0.774	80%	0.799	S	S	*	*			trans	68.9	163.1	162.4	-85.1	-171.7	178.2	-163.5	0	115.5
699	P	40.5	Very low	39.7	Very low	129 Å²	129	163.1 Å²	163.1	84%	0.838	80%	0.798	S	S	*	*			cis	-124.4	-165.4	26.6	44	-28.9	0	0	0	116.8
700	Q	40.3	Very low	39.2	Very low	132 Å²	132	165 Å²	165	62%	0.617	80%	0.797	S	S	*	*			trans	-93.3	160.3	-177.1	-65.2	153	-106.4	0	0	112.3
701	I	42.2	Very low	38.9	Very low	169 Å²	169	164.5 Å²	164.5	87%	0.867	80%	0.802	S	S	*	*			trans	-125	133.2	152.8	-67.5	178.7	0	0	0	107.2
702	N	42.1	Very low	38.5	Very low	123 Å²	123	164.8 Å²	164.8	66%	0.658	81%	0.807	S	S	*	*			trans	-125.4	172.1	175.6	-80.8	5.8	0	0	0	108.9
703	Q	39.9	Very low	38	Very low	168 Å²	168	164.8 Å²	164.8	79%	0.785	81%	0.812	S	S	*	*			trans	86.6	85.4	162.3	-51	-173.1	7.8	0	0	119
704	W	32.8	Very low	37.6	Very low	247 Å²	247	164.4 Å²	164.4	94%	0.936	81%	0.811	S	S	*	*				-127	106.1	117.2	-96.1	-73.7	0	0	0	105.3
705	K	36.1	Very low	37.5	Very low	151 Å²	151	167 Å²	167	66%	0.657	81%	0.814	S	S	*	*				52.1	108.4	93.9	-67.2	-171.4	172.9	-168.8	0	111.4
706	Q	31.1	Very low	37.2	Very low	202 Å²	202	163.4 Å²	163.4	94%	0.944	81%	0.808	S	S	*	*			cis	51	68	49.4	-71.9	-166.3	-21.6	0	0	113.9
707	E	33.3	Very low	36.9	Very low	171 Å²	171	159.1 Å²	159.1	80%	0.799	81%	0.805	S	S	*	*			trans	-155.5	61.2	168	-159.7	147.6	-153.1	0	0	112
708	K	32.6	Very low	36.5	Very low	214 Å²	214	164.5 Å²	164.5	93%	0.93	81%	0.811	S	S	*	*			trans	-152.9	48.8	172.5	-132.6	179.5	-174.9	-173.1	0	113.3
709	Q	34.5	Very low	36.4	Very low	180 Å²	180	166.1 Å²	166.1	84%	0.841	82%	0.818	S	S	*	*	S	Bend	trans	-138.1	139.8	164.5	-73.6	-171.8	-9.5	0	0	108.5
710	Q	35	Very low	36	Very low	183 Å²	183	170.1 Å²	170.1	86%	0.855	82%	0.822	S	S	*	*			trans	73.8	155.9	-169.6	-48.2	171.3	32.4	0	0	113.1
711	L	37.4	Very low	36	Very low	179 Å²	179	168.6 Å²	168.6	94%	0.937	83%	0.832	S	S	*	*			trans	67.1	128.1	-149.2	-51.4	168.6	0	0	0	111.6
712	S	35.6	Very low	36	Very low	117 Å²	117	170.2 Å²	170.2	82%	0.818	83%	0.833	S	S	*	*			cis	-142.5	141.3	-3.4	53.9	0	0	0	0	111.1
713	S	33.6	Very low	36.2	Very low	114 Å²	114	167.6 Å²	167.6	80%	0.797	84%	0.835	S	S	*	*			trans	-102.2	110.3	178.8	54.5	0	0	0	0	111.9
714	E	38.1	Very low	37.1	Very low	173 Å²	173	164.5 Å²	164.5	81%	0.808	82%	0.823	S	S	*	*			trans	-156.6	124.5	151.3	-125.8	163.9	177.6	0	0	116.9
715	Q	39.4	Very low	38.8	Very low	157 Å²	157	161.5 Å²	161.5	73%	0.734	82%	0.817	S	S	*	*			trans	38	113	145.4	-63.3	-176.7	45.9	0	0	123.6
716	V	35	Very low	40.5	Very low	120 Å²	120	159.2 Å²	159.2	73%	0.727	82%	0.816	S	S	*	*				66.8	109.8	124.3	-175.6	0	0	0	0	119.5
717	S	37.6	Very low	42.5	Very low	121 Å²	121	155.1 Å²	155.1	85%	0.846	80%	0.797	S	S	*	*				-138.3	154.7	114.7	78.7	0	0	0	0	110.6
718	R	31.2	Very low	44.6	Very low	227 Å²	227	151.1 Å²	151.1	86%	0.857	78%	0.784	S	S	*	*			trans	-112.2	124.9	-172.1	-70.7	171.4	169.1	165.4	-4.6	111.5
719	K	36.6	Very low	47	Very low	212 Å²	212	150.3 Å²	150.3	92%	0.922	78%	0.775	S	S	*	*			trans	-129.6	143.6	149.9	-74.9	-173	178	175.4	0	109.9
720	K	31.7	Very low	49.3	Very low	213 Å²	213	148 Å²	148	93%	0.926	76%	0.762	S	S	*	*			trans	-101.4	123.4	-174.5	-64.4	174.5	179.7	174.8	0	109.6
721	A	40	Very low	51.7	Low	100 Å²	100	143.7 Å²	143.7	83%	0.826	75%	0.745	S	S	*	*			trans	-115.8	159.2	163.6	0	0	0	0	0	110.2	G723	A721-G723 PolarHBondContact O-N 2.92Å; A721-G723 VanDerWaalsContact O-N 3.15Å
722	K	41.8	Very low	54.1	Low	203 Å²	203	141.1 Å²	141.1	88%	0.883	73%	0.728	S	S	*	*			trans	-82.4	91	-170.3	-67	170.2	-177.1	165.8	0	111.5	N724	K722-N724 PolarHBondContact O-N 3.09Å
723	G	46.4	Very low	56.6	Low	68 Å²	68	140.4 Å²	140.4	70%	0.701	72%	0.715	S	S	*	*			trans	-56.9	132	168.7	0	0	0	0	0	111.6	A721	A721-G723 PolarHBondContact O-N 2.92Å; A721-G723 VanDerWaalsContact O-N 3.15Å
724	N	59.6	Low	59	Low	102 Å²	102	137.4 Å²	137.4	55%	0.545	69%	0.692	S	S	.	*			trans	-73	135.5	-170.8	-84.2	-51.3	0	0	0	112.4	K722 T726 E727 T728	K722-N724 PolarHBondContact O-N 3.09Å; N724-T726 PolarHBondContact O-N 3.27Å; N724-T726 VanDerWaalsContact O-N 3.12Å; N724-E727 PolarHBondContact O-N 3.04Å; N724-T728 PolarHBondContact O-OG1 3.19Å
725	K	67.6	Low	61.2	Low	185 Å²	185	134.9 Å²	134.9	80%	0.804	68%	0.68	S	S	*	*	H	α-helix	trans	-61.7	-18.4	175.8	-69.8	-176.4	178.2	179.3	0	113.2	R729	K725-R729 VanDerWaalsContact O-CB 3.3Å; K725-R729 WeakPolarHBondContact O-CB 3.3Å; K725-R729 PolarHBondContact O-N 3.36Å
726	T	72.6	Confident	63.3	Low	103 Å²	103	133.1 Å²	133.1	63%	0.632	67%	0.672	S	S	*	*	H	α-helix	trans	-72.6	-45.2	176.8	45	0	0	0	0	112.1	N724 R729 F730	N724-T726 PolarHBondContact O-N 3.27Å; N724-T726 VanDerWaalsContact O-N 3.12Å; T726-R729 PolarHBondContact O-N 2.7Å; T726-F730 WeakPolarHBondContact O-CB 3.29Å; T726-F730 PolarHBondContact O-N 3.41Å
727	E	73.4	Confident	65.5	Low	116 Å²	116	134.1 Å²	134.1	54%	0.542	66%	0.663	S	S	.	*	H	α-helix	trans	-68.7	-42.3	-179.4	-66.1	177.9	105.7	0	0	112.2	N724 R729 F730 N731	N724-E727 PolarHBondContact O-N 3.04Å; E727-R729 VanDerWaalsContact C-N 3.32Å; E727-R729 PolarHBondContact O-N 3.35Å; E727-F730 PolarHBondContact O-N 3.2Å; E727-N731 WeakPolarHBondContact O-CB 3.38Å; E727-N731 PolarHBondContact O-N 3.05Å; E727-N731 PolarHBondContact O-ND2 2.85Å
728	T	77	Confident	67.7	Low	86 Å²	86	134.2 Å²	134.2	53%	0.528	65%	0.649	S	S	.	*	H	α-helix	trans	-61.8	-40.2	174.8	25.9	0	0	0	0	111.7	N724 Q732	N724-T728 PolarHBondContact O-OG1 3.19Å; T728-Q732 VanDerWaalsContact O-CG 3.32Å; T728-Q732 WeakPolarHBondContact O-CG 3.18Å; T728-Q732 PolarHBondContact O-N 3.02Å
729	R	83.1	Confident	69.9	Low	198 Å²	198	129.4 Å²	129.4	75%	0.747	64%	0.636	S	S	*	*	H	α-helix	trans	-68.4	-38	173.8	-174.1	179.9	179.3	-162.5	-0.8	112.6	K725 T726 E727 L733	K725-R729 VanDerWaalsContact O-CB 3.3Å; K725-R729 WeakPolarHBondContact O-CB 3.3Å; K725-R729 PolarHBondContact O-N 3.36Å; T726-R729 PolarHBondContact O-N 2.7Å; E727-R729 VanDerWaalsContact C-N 3.32Å; E727-R729 PolarHBondContact O-N 3.35Å; R729-L733 PolarHBondContact O-N 2.81Å; R729-L733 VanDerWaalsContact O-N 3.12Å
730	F	83.2	Confident	72	Confident	130 Å²	130	127.6 Å²	127.6	57%	0.57	63%	0.628	S	S	*	*	H	α-helix	trans	-65.4	-48.3	177.4	179.7	-102	0	0	0	111.4	T726 E727 Q732 L733 V734	T726-F730 WeakPolarHBondContact O-CB 3.29Å; T726-F730 PolarHBondContact O-N 3.41Å; E727-F730 PolarHBondContact O-N 3.2Å; F730-Q732 PolarHBondContact O-N 3.45Å; F730-L733 WeakPolarHBondContact O-CB 3.42Å; F730-L733 PolarHBondContact O-N 2.64Å; F730-V734 HydrophobicContact CD1-CG2 4.2Å; F730-V734 HydrophobicContact CE1-CG2 3.82Å; F730-V734 HydrophobicContact CE2-CG2 4.27Å; F730-V734 HydrophobicContact CZ-CG2 3.86Å; F730-V734 WeakPolarHBondContact O-CG2 3.25Å; F730-V734 PolarHBondContact O-N 2.82Å
731	N	85.5	Confident	73.9	Confident	94 Å²	94	123.5 Å²	123.5	50%	0.503	62%	0.616	S	S	.	*	H	α-helix	trans	-61.5	-42.2	178.9	-70.8	-24.4	0	0	0	111.9	E727 L733 V734 E735	E727-N731 WeakPolarHBondContact O-CB 3.38Å; E727-N731 PolarHBondContact O-N 3.05Å; E727-N731 PolarHBondContact O-ND2 2.85Å; N731-L733 VanDerWaalsContact C-N 3.32Å; N731-L733 PolarHBondContact O-N 3.13Å; N731-V734 PolarHBondContact O-N 3.03Å; N731-E735 PolarHBondContact O-N 2.96Å
732	Q	86.9	Confident	75.3	Confident	124 Å²	124	125.4 Å²	125.4	58%	0.579	61%	0.611	S	S	*	*	H	α-helix	trans	-60.3	-38.5	172.7	-74.9	175.9	-3.6	0	0	112.9	T728 F730 E735 Q736	T728-Q732 VanDerWaalsContact O-CG 3.32Å; T728-Q732 WeakPolarHBondContact O-CG 3.18Å; T728-Q732 PolarHBondContact O-N 3.02Å; F730-Q732 PolarHBondContact O-N 3.45Å; Q732-E735 PolarHBondContact O-N 3.04Å; Q732-Q736 WeakPolarHBondContact O-CG 3.49Å; Q732-Q736 PolarHBondContact O-N 3.25Å
733	L	87.8	Confident	76.2	Confident	103 Å²	103	117.2 Å²	117.2	54%	0.539	59%	0.585	S	S	.	*	H	α-helix	trans	-68.3	-40.8	177.2	-168.3	69.1	0	0	0	111.6	R729 F730 N731 Q736 Y737	R729-L733 PolarHBondContact O-N 2.81Å; R729-L733 VanDerWaalsContact O-N 3.12Å; F730-L733 WeakPolarHBondContact O-CB 3.42Å; F730-L733 PolarHBondContact O-N 2.64Å; N731-L733 VanDerWaalsContact C-N 3.32Å; N731-L733 PolarHBondContact O-N 3.13Å; L733-Q736 PolarHBondContact O-N 3.13Å; L733-Y737 PolarHBondContact O-N 3.06Å
734	V	85.2	Confident	76.5	Confident	50 Å²	50	119.9 Å²	119.9	30%	0.303	59%	0.589	S	S	.	*	H	α-helix	trans	-64.1	-39.8	174.7	172	0	0	0	0	111.3	F730 N731 Y737 K738	F730-V734 HydrophobicContact CD1-CG2 4.2Å; F730-V734 HydrophobicContact CE1-CG2 3.82Å; F730-V734 HydrophobicContact CE2-CG2 4.27Å; F730-V734 HydrophobicContact CZ-CG2 3.86Å; F730-V734 WeakPolarHBondContact O-CG2 3.25Å; F730-V734 PolarHBondContact O-N 2.82Å; N731-V734 PolarHBondContact O-N 3.03Å; V734-Y737 PolarHBondContact O-N 2.93Å; V734-K738 HydrophobicContact CG1-CD 4.36Å; V734-K738 WeakPolarHBondContact O-CB 3.37Å; V734-K738 WeakPolarHBondContact O-CG 3.45Å; V734-K738 PolarHBondContact O-N 2.68Å
735	E	83.3	Confident	75.8	Confident	120 Å²	120	120.7 Å²	120.7	56%	0.561	60%	0.603	S	S	*	*	H	α-helix	trans	-64.5	-43.4	173.5	-74.6	-167.6	123.8	0	0	112.4	N731 Q732 Y737 K738 Q739	N731-E735 PolarHBondContact O-N 2.96Å; Q732-E735 PolarHBondContact O-N 3.04Å; E735-Y737 VanDerWaalsContact C-N 3.31Å; E735-Y737 PolarHBondContact O-N 3.21Å; E735-K738 PolarHBondContact O-N 3.07Å; E735-Q739 WeakPolarHBondContact O-CB 3.44Å; E735-Q739 WeakPolarHBondContact O-CG 3.19Å; E735-Q739 PolarHBondContact O-N 3.29Å
736	Q	84.9	Confident	74.8	Confident	120 Å²	120	121.8 Å²	121.8	56%	0.561	61%	0.608	S	S	*	*	H	α-helix	trans	-61	-39	173.7	-74.8	-173.9	1.5	0	0	112.2	Q732 L733 Q739 K740	Q732-Q736 WeakPolarHBondContact O-CG 3.49Å; Q732-Q736 PolarHBondContact O-N 3.25Å; L733-Q736 PolarHBondContact O-N 3.13Å; Q736-Q739 PolarHBondContact O-N 3.27Å; Q736-K740 WeakPolarHBondContact O-CG 3.5Å; Q736-K740 PolarHBondContact O-N 3.32Å
737	Y	79.9	Confident	73.2	Confident	141 Å²	141	120.1 Å²	120.1	55%	0.553	61%	0.611	S	S	*	*	H	α-helix	trans	-69.8	-40.9	177.8	-133.2	-91.9	0	0	0	111.9	L733 V734 E735 K740 L741	L733-Y737 PolarHBondContact O-N 3.06Å; V734-Y737 PolarHBondContact O-N 2.93Å; E735-Y737 VanDerWaalsContact C-N 3.31Å; E735-Y737 PolarHBondContact O-N 3.21Å; Y737-K740 PolarHBondContact O-N 3.23Å; Y737-L741 HydrophobicContact CD1-CD1 3.78Å; Y737-L741 HydrophobicContact CD1-CG 4.31Å; Y737-L741 HydrophobicContact CE1-CD1 4.23Å; Y737-L741 WeakPolarHBondContact O-CB 3.47Å; Y737-L741 PolarHBondContact O-N 3.19Å
738	K	84	Confident	71.4	Confident	124 Å²	124	119.5 Å²	119.5	54%	0.539	63%	0.626	S	S	.	*	H	α-helix	trans	-59.8	-44.8	171.3	-78.9	179.4	177.1	177.5	0	112.1	V734 E735 K740 L741 L742	V734-K738 HydrophobicContact CG1-CD 4.36Å; V734-K738 WeakPolarHBondContact O-CB 3.37Å; V734-K738 WeakPolarHBondContact O-CG 3.45Å; V734-K738 PolarHBondContact O-N 2.68Å; E735-K738 PolarHBondContact O-N 3.07Å; K738-K740 VanDerWaalsContact C-N 3.29Å; K738-K740 PolarHBondContact O-N 2.79Å; K738-L741 PolarHBondContact O-N 2.88Å; K738-L742 HydrophobicContact CB-CD1 4.37Å; K738-L742 WeakPolarHBondContact O-CB 3.06Å; K738-L742 PolarHBondContact O-N 2.6Å
739	Q	77.9	Confident	69.6	Low	125 Å²	125	120.7 Å²	120.7	58%	0.584	64%	0.635	S	S	*	*	H	α-helix	trans	-63.3	-33.2	176.9	-72.5	178.3	24.4	0	0	112.6	E735 Q736 G743	E735-Q739 WeakPolarHBondContact O-CB 3.44Å; E735-Q739 WeakPolarHBondContact O-CG 3.19Å; E735-Q739 PolarHBondContact O-N 3.29Å; Q736-Q739 PolarHBondContact O-N 3.27Å; Q739-G743 WeakPolarHBondContact O-CA 3.32Å; Q739-G743 PolarHBondContact O-N 3.14Å; Q739-G743 VanDerWaalsContact O-N 3.14Å
740	K	79.3	Confident	67.2	Low	175 Å²	175	119.4 Å²	119.4	76%	0.761	64%	0.642	S	S	*	*	H	α-helix	trans	-73.7	-36.3	173.2	-76.6	-177.5	175.6	-178.6	0	113.7	Q736 Y737 K738	Q736-K740 WeakPolarHBondContact O-CG 3.5Å; Q736-K740 PolarHBondContact O-N 3.32Å; Y737-K740 PolarHBondContact O-N 3.23Å; K738-K740 VanDerWaalsContact C-N 3.29Å; K738-K740 PolarHBondContact O-N 2.79Å
741	L	71.8	Confident	65.3	Low	127 Å²	127	117.8 Å²	117.8	67%	0.665	65%	0.653	S	S	*	*	H	α-helix	trans	-78.3	-38.8	-179.4	-82.4	166.6	0	0	0	113.7	Y737 K738	Y737-L741 HydrophobicContact CD1-CD1 3.78Å; Y737-L741 HydrophobicContact CD1-CG 4.31Å; Y737-L741 HydrophobicContact CE1-CD1 4.23Å; Y737-L741 WeakPolarHBondContact O-CB 3.47Å; Y737-L741 PolarHBondContact O-N 3.19Å; K738-L741 PolarHBondContact O-N 2.88Å
742	L	70.7	Confident	63.4	Low	139 Å²	139	123.1 Å²	123.1	73%	0.728	67%	0.672	S	S	*	*	H	α-helix	trans	-97.6	-13.2	-174.6	-66.6	159.4	0	0	0	113.1	K738	K738-L742 HydrophobicContact CB-CD1 4.37Å; K738-L742 WeakPolarHBondContact O-CB 3.06Å; K738-L742 PolarHBondContact O-N 2.6Å
743	G	60.3	Low	61.1	Low	32 Å²	32	129.2 Å²	129.2	33%	0.33	69%	0.689	S	S	.	*			trans	74.9	157.7	-176.1	0	0	0	0	0	113.7	Q739 S745	Q739-G743 WeakPolarHBondContact O-CA 3.32Å; Q739-G743 PolarHBondContact O-N 3.14Å; Q739-G743 VanDerWaalsContact O-N 3.14Å; G743-S745 VanDerWaalsContact C-N 3.31Å; G743-S745 PolarHBondContact O-N 3.14Å
744	P	52.9	Low	59.1	Low	124 Å²	124	129.4 Å²	129.4	81%	0.805	70%	0.699	S	S	*	*			trans	-80.8	72.1	179.8	33.7	-35.9	0	0	0	111.6	K746	P744-K746 PolarHBondContact O-N 2.86Å
745	S	43.7	Very low	57.2	Low	118 Å²	118	136.5 Å²	136.5	83%	0.825	73%	0.726	S	S	*	*			trans	-74	52.2	-179.9	56.3	0	0	0	0	114.5	G743 G747	G743-S745 VanDerWaalsContact C-N 3.31Å; G743-S745 PolarHBondContact O-N 3.14Å; S745-G747 PolarHBondContact O-N 3.47Å
746	K	46.3	Very low	55.5	Low	208 Å²	208	143.3 Å²	143.3	90%	0.904	75%	0.747	S	S	*	*			trans	-84.7	93.6	166.5	-74	-174	176	-178	0	110	P744	P744-K746 PolarHBondContact O-N 2.86Å
747	G	39.7	Very low	53.3	Low	69 Å²	69	146.8 Å²	146.8	71%	0.711	76%	0.761	S	S	*	*			trans	174.5	84.5	174.6	0	0	0	0	0	118.4	S745	S745-G747 PolarHBondContact O-N 3.47Å
748	A	36.1	Very low	51.5	Low	103 Å²	103	147.3 Å²	147.3	85%	0.851	77%	0.773	S	S	*	*			trans	65.6	160.7	154.5	0	0	0	0	0	118.6
749	P	39.2	Very low	49.8	Very low	110 Å²	110	151 Å²	151	71%	0.714	81%	0.814	S	S	*	*			trans	-137.2	-173.5	-147.6	45.4	-28.4	0	0	0	117.1
750	L	33.3	Very low	48.4	Very low	171 Å²	171	152.3 Å²	152.3	90%	0.895	83%	0.825	S	S	*	*			trans	66.6	98.7	157.1	-67.8	167.3	0	0	0	119.7
751	A	42.3	Very low	46.8	Very low	97 Å²	97	151.1 Å²	151.1	80%	0.802	83%	0.829	S	S	*	*			trans	-154.5	117.5	141.2	0	0	0	0	0	113.7
752	K	45.9	Very low	45.4	Very low	206 Å²	206	152.4 Å²	152.4	90%	0.896	84%	0.838	S	S	*	*			trans	50.8	85.5	152.4	-60.6	179.7	-178.5	176.6	0	119
753	R	39.3	Very low	43.9	Very low	252 Å²	252	153.2 Å²	153.2	95%	0.951	84%	0.844	S	S	*	*			trans	-68.5	136.2	150.3	-71.4	161.9	59.3	177.3	-1	110.2
754	S	44.2	Very low	42.9	Very low	107 Å²	107	160.8 Å²	160.8	75%	0.748	88%	0.877	S	S	*	*			trans	-161.4	123.1	154.8	59.2	0	0	0	0	114.5
755	K	45.4	Very low	42.2	Very low	198 Å²	198	163.2 Å²	163.2	86%	0.861	88%	0.881	S	S	*	*			trans	51.8	96.1	151.4	-60.8	-177.7	177.2	-175.4	0	118.9
756	W	47.8	Very low	42.1	Very low	263 Å²	263	166.4 Å²	166.4	100%	0.996	89%	0.885	S	S	*	*			trans	-148.2	40.8	141.9	-135.7	-48.4	0	0	0	113.2
757	F	38.7	Very low	41.8	Very low	194 Å²	194	163.2 Å²	163.2	85%	0.851	88%	0.884	S	S	*	*			trans	-99.3	164.7	156.2	-119	-105.9	0	0	0	107.9
758	D	42.2	Very low	42	Very low	151 Å²	151	171.1 Å²	171.1	81%	0.807	90%	0.898	S	S	*	*			trans	72.3	71.5	-177.3	-55	-37.5	0	0	0	117.2
759	S	49.7	Very low	42.5	Very low	201 Å²	201	177.3 Å²	177.3	100%	1.406	90%	0.902	S	S	*	*			trans	-170.1	0	139.8	-77.4	0	0	0	0	111.7

Retrieved 759 of 759 residues in 2366.9 ms (Link to these results)

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