A0A077ZEQ5_TRITR Loading...

Parafibromin

AlphaFold DB , UniProt , Accession A0A077ZEQ5, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 552 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	51.7	Low	84.2	Confident	175 Å²	175	44 Å²	44	86%	0.862	21%	0.214	S	C	*	.				0	105.5	0	-79.3	-60	-148.4	0	0	106.4	Y3 F110	M1-Y3 HydrophobicContact CB-CE2 4.31Å; M1-Y3 PolarHBondContact O-N 3.26Å; M1-Y3 VanDerWaalsContact O-N 3.17Å; M1-F110 HydrophobicContact SD-CD2 4.31Å; M1-F110 HydrophobicContact SD-CE2 4.06Å
2	D	72.6	Confident	84.6	Confident	59 Å²	59	43.1 Å²	43.1	32%	0.316	21%	0.213	S	C	.	.			trans	-84.6	93.3	-172.5	-67.2	1.3	0	0	0	108.6	R7 K30	D2-R7 HydrophobicContact CB-CG 4.44Å; D2-R7 IonicContact OD2-CZ 3.7Å; D2-R7 IonicContact OD2-NE 3.57Å; D2-R7 PolarHBondContact OD2-NE 3.5Å; D2-R7 IonicContact OD2-NH2 2.75Å; D2-R7 PolarHBondContact OD2-NH2 3.43Å; D2-K30 IonicContact OD2-NZ 3.24Å; D2-K30 PolarHBondContact OD2-NZ 3.31Å
3	Y	84.3	Confident	85	Confident	36 Å²	36	43.6 Å²	43.6	14%	0.141	22%	0.216	C	C	.	.			trans	-70.7	144.7	172	-72	-74.6	0	0	0	110.1	M1 L5 S6 R7 N39 C106	M1-Y3 HydrophobicContact CB-CE2 4.31Å; M1-Y3 PolarHBondContact O-N 3.26Å; M1-Y3 VanDerWaalsContact O-N 3.17Å; Y3-L5 PolarHBondContact O-N 3.49Å; Y3-S6 WeakPolarHBondContact O-CB 3.48Å; Y3-S6 PolarHBondContact O-N 3.12Å; Y3-S6 VanDerWaalsContact O-N 3.11Å; Y3-R7 PolarHBondContact O-N 3.17Å; Y3-R7 VanDerWaalsContact O-N 3.11Å; Y3-N39 HydrophobicContact CD1-CB 4.1Å; Y3-N39 HydrophobicContact CE1-CB 4.44Å; Y3-N39 HydrophobicContact CG-CB 4.33Å; Y3-C106 PolarHBondContact OH-O 3.1Å
4	P	89.2	Confident	85.3	Confident	2 Å²	2	47.9 Å²	47.9	1%	0.013	24%	0.24	C	C	.	.	H	α-helix	trans	-61	-32.8	-178.8	25.3	-35.7	0	0	0	112.3	R7 M8 F32 L51	P4-R7 PolarHBondContact O-N 3.46Å; P4-M8 WeakPolarHBondContact O-CB 3.37Å; P4-M8 PolarHBondContact O-N 3.01Å; P4-F32 HydrophobicContact CB-CD1 3.93Å; P4-F32 HydrophobicContact CB-CD2 4.29Å; P4-F32 HydrophobicContact CB-CE1 4.06Å; P4-F32 HydrophobicContact CB-CE2 4.45Å; P4-F32 HydrophobicContact CB-CG 4.03Å; P4-F32 HydrophobicContact CB-CZ 4.33Å; P4-L51 HydrophobicContact CB-CD1 3.93Å; P4-L51 HydrophobicContact CB-CD2 4.02Å
5	L	90.3	Very high	85.3	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-67.7	-39.7	176.3	-168.4	70.1	0	0	0	112.6	Y3 M8 R9 T38 N39 F40 V54 L88 Y91 L92 I104	Y3-L5 PolarHBondContact O-N 3.49Å; L5-M8 HydrophobicContact CD1-CE 3.69Å; L5-M8 PolarHBondContact O-N 3.21Å; L5-R9 PolarHBondContact O-N 3.49Å; L5-T38 HydrophobicContact CB-CG2 4.46Å; L5-T38 HydrophobicContact CD1-CG2 4.44Å; L5-N39 WeakPolarHBondContact CB-OD1 3.44Å; L5-N39 WeakPolarHBondContact CD2-OD1 3.49Å; L5-F40 HydrophobicContact CD2-CB 3.86Å; L5-F40 HydrophobicContact CD2-CD2 4.27Å; L5-V54 HydrophobicContact CD1-CG1 3.87Å; L5-L88 HydrophobicContact CD1-CD1 4.34Å; L5-Y91 HydrophobicContact CD2-CD1 4.17Å; L5-Y91 HydrophobicContact CD2-CE1 3.84Å; L5-Y91 HydrophobicContact CG-CD1 4.37Å; L5-Y91 HydrophobicContact CG-CE1 3.92Å; L5-L92 HydrophobicContact CD1-CD2 4.09Å; L5-I104 HydrophobicContact CD2-CD1 4.44Å
6	S	88.3	Confident	85.6	Confident	32 Å²	32	55.4 Å²	55.4	22%	0.224	29%	0.289	C	S	.	.	H	α-helix	trans	-64.3	-43.3	175.7	-58.8	0	0	0	0	111	Y3 M8 R9 D10	Y3-S6 WeakPolarHBondContact O-CB 3.48Å; Y3-S6 PolarHBondContact O-N 3.12Å; Y3-S6 VanDerWaalsContact O-N 3.11Å; S6-M8 PolarHBondContact O-N 2.74Å; S6-R9 WeakPolarHBondContact O-CB 3.47Å; S6-R9 PolarHBondContact O-N 2.86Å; S6-D10 VanDerWaalsContact O-CG 3.22Å; S6-D10 PolarHBondContact O-N 3.03Å
7	R	88.9	Confident	85.7	Confident	50 Å²	50	61.9 Å²	61.9	19%	0.189	32%	0.318	C	S	.	.	H	α-helix	trans	-63	-41.5	174.6	-75.5	-66	-170.2	132.3	-6.1	112.4	D2 Y3 P4 R9 D10 Y11 F27 D29	D2-R7 HydrophobicContact CB-CG 4.44Å; D2-R7 IonicContact OD2-CZ 3.7Å; D2-R7 IonicContact OD2-NE 3.57Å; D2-R7 PolarHBondContact OD2-NE 3.5Å; D2-R7 IonicContact OD2-NH2 2.75Å; D2-R7 PolarHBondContact OD2-NH2 3.43Å; Y3-R7 PolarHBondContact O-N 3.17Å; Y3-R7 VanDerWaalsContact O-N 3.11Å; P4-R7 PolarHBondContact O-N 3.46Å; R7-R9 VanDerWaalsContact C-N 3.34Å; R7-R9 PolarHBondContact O-N 3.34Å; R7-D10 PolarHBondContact O-N 3.04Å; R7-Y11 VanDerWaalsContact O-CD2 3.24Å; R7-Y11 WeakPolarHBondContact O-CD2 3.27Å; R7-Y11 PolarHBondContact O-N 3.19Å; R7-F27 HydrophobicContact CB-CD1 4.42Å; R7-F27 HydrophobicContact CB-CG 4.43Å; R7-D29 IonicContact NH1-OD1 3.88Å
8	M	90.9	Very high	86	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-63.4	-40	176.2	-174.7	165.1	57.6	0	0	112.3	P4 L5 S6 Y11 T12 I18 F27 L51 V54 Y55 L58 L92	P4-M8 WeakPolarHBondContact O-CB 3.37Å; P4-M8 PolarHBondContact O-N 3.01Å; L5-M8 HydrophobicContact CD1-CE 3.69Å; L5-M8 PolarHBondContact O-N 3.21Å; S6-M8 PolarHBondContact O-N 2.74Å; M8-Y11 PolarHBondContact O-N 3.26Å; M8-T12 WeakPolarHBondContact O-CB 3.33Å; M8-T12 PolarHBondContact O-N 3.14Å; M8-T12 PolarHBondContact O-OG1 3.08Å; M8-I18 HydrophobicContact CG-CD1 3.84Å; M8-F27 HydrophobicContact CB-CE1 3.77Å; M8-F27 HydrophobicContact CB-CZ 4.2Å; M8-F27 HydrophobicContact CG-CE1 4.17Å; M8-L51 HydrophobicContact CE-CD1 4.18Å; M8-L51 HydrophobicContact SD-CD1 4.38Å; M8-V54 HydrophobicContact CE-CB 3.76Å; M8-V54 HydrophobicContact CE-CG1 3.23Å; M8-Y55 HydrophobicContact SD-CD2 4.24Å; M8-L58 HydrophobicContact CG-CD2 4.32Å; M8-L58 HydrophobicContact SD-CD2 4.46Å; M8-L92 HydrophobicContact CE-CD1 4.46Å; M8-L92 HydrophobicContact CE-CD2 4.05Å; M8-L92 HydrophobicContact CG-CD2 4.42Å
9	R	89.8	Confident	86.3	Confident	40 Å²	40	60.2 Å²	60.2	15%	0.151	31%	0.309	C	S	.	.	H	α-helix	trans	-58.1	-50.5	171.1	176.2	-178.7	-175.4	-133.8	-3.6	110.9	L5 S6 R7 Y11 T12 I13 Y91 L92 N94 E95	L5-R9 PolarHBondContact O-N 3.49Å; S6-R9 WeakPolarHBondContact O-CB 3.47Å; S6-R9 PolarHBondContact O-N 2.86Å; R7-R9 VanDerWaalsContact C-N 3.34Å; R7-R9 PolarHBondContact O-N 3.34Å; R9-Y11 VanDerWaalsContact C-N 3.3Å; R9-Y11 PolarHBondContact O-N 3.14Å; R9-T12 PolarHBondContact O-N 3.4Å; R9-T12 VanDerWaalsContact O-N 3.14Å; R9-I13 HydrophobicContact CG-CD1 3.49Å; R9-I13 VanDerWaalsContact CG-CD1 3.49Å; R9-I13 HydrophobicContact CG-CG1 4.28Å; R9-I13 WeakPolarHBondContact O-CG1 3.4Å; R9-I13 PolarHBondContact O-N 3.04Å; R9-Y91 HydrophobicContact CB-CE1 4.42Å; R9-Y91 WeakPolarHBondContact CD-O 3.41Å; R9-Y91 WeakPolarHBondContact CG-O 3.37Å; R9-Y91 PolarHBondContact NE-O 3.14Å; R9-L92 HydrophobicContact CB-CD2 4.15Å; R9-N94 PolarHBondContact NH2-O 3.36Å; R9-E95 PolarHBondContact NH2-O 2.93Å
10	D	89.3	Confident	86.5	Confident	71 Å²	71	61.7 Å²	61.7	38%	0.38	31%	0.314	S	S	.	.	H	α-helix	trans	-59.3	-40.8	-179.7	-63.6	-19.3	0	0	0	111.9	S6 R7 N14	S6-D10 VanDerWaalsContact O-CG 3.22Å; S6-D10 PolarHBondContact O-N 3.03Å; R7-D10 PolarHBondContact O-N 3.04Å; D10-N14 WeakPolarHBondContact O-CB 3.34Å; D10-N14 PolarHBondContact O-N 3.26Å; D10-N14 PolarHBondContact O-ND2 3.42Å
11	Y	90.6	Very high	86.5	Confident	19 Å²	19	60.9 Å²	60.9	8%	0.075	31%	0.309	C	S	.	.	H	α-helix	trans	-68.8	-39.4	177.1	-86.8	-113.9	0	0	0	111.9	R7 M8 R9 G15 R16 I18 F27 G28	R7-Y11 VanDerWaalsContact O-CD2 3.24Å; R7-Y11 WeakPolarHBondContact O-CD2 3.27Å; R7-Y11 PolarHBondContact O-N 3.19Å; M8-Y11 PolarHBondContact O-N 3.26Å; R9-Y11 VanDerWaalsContact C-N 3.3Å; R9-Y11 PolarHBondContact O-N 3.14Å; Y11-G15 PolarHBondContact O-N 3.36Å; Y11-G15 VanDerWaalsContact O-N 3.11Å; Y11-R16 HydrophobicContact CD1-CB 3.41Å; Y11-R16 VanDerWaalsContact CD1-CB 3.41Å; Y11-R16 HydrophobicContact CD1-CG 4.45Å; Y11-R16 HydrophobicContact CE1-CB 3.84Å; Y11-R16 HydrophobicContact CG-CB 4.02Å; Y11-R16 PolarHBondContact O-N 3.34Å; Y11-I18 HydrophobicContact CD1-CG1 4.17Å; Y11-I18 HydrophobicContact CG-CG1 4.33Å; Y11-F27 HydrophobicContact CD1-CD1 4.42Å; Y11-F27 HydrophobicContact CD2-CB 4.25Å; Y11-F27 HydrophobicContact CD2-CD1 4.12Å; Y11-F27 HydrophobicContact CE1-CB 4.32Å; Y11-F27 HydrophobicContact CE2-CB 3.85Å; Y11-F27 HydrophobicContact CG-CD1 4.06Å; Y11-F27 PolarHBondContact OH-O 3.17Å; Y11-G28 WeakPolarHBondContact OH-CA 3.47Å; Y11-G28 PolarHBondContact OH-N 2.75Å
12	T	89.8	Confident	88.1	Confident	33 Å²	33	55.1 Å²	55.1	20%	0.202	30%	0.295	C	S	.	.	H	α-helix	trans	-66	-43.9	178.3	-54	0	0	0	0	111.6	M8 R9 G15 L58	M8-T12 WeakPolarHBondContact O-CB 3.33Å; M8-T12 PolarHBondContact O-N 3.14Å; M8-T12 PolarHBondContact O-OG1 3.08Å; R9-T12 PolarHBondContact O-N 3.4Å; R9-T12 VanDerWaalsContact O-N 3.14Å; T12-G15 PolarHBondContact O-N 3.38Å; T12-L58 HydrophobicContact CG2-CD1 4.07Å; T12-L58 HydrophobicContact CG2-CD2 4.2Å; T12-L58 WeakPolarHBondContact OG1-CD2 3.35Å
13	I	89	Confident	89	Confident	50 Å²	50	57.3 Å²	57.3	26%	0.256	31%	0.306	S	S	.	.	H	α-helix	trans	-68.4	-42.9	178.8	-67.3	168.5	0	0	0	110.8	R9 G15 E95	R9-I13 HydrophobicContact CG-CD1 3.49Å; R9-I13 VanDerWaalsContact CG-CD1 3.49Å; R9-I13 HydrophobicContact CG-CG1 4.28Å; R9-I13 WeakPolarHBondContact O-CG1 3.4Å; R9-I13 PolarHBondContact O-N 3.04Å; I13-G15 PolarHBondContact O-N 3.45Å; I13-E95 HydrophobicContact CG2-CB 4.25Å; I13-E95 HydrophobicContact CG2-CG 4.04Å
14	N	89.1	Confident	89.3	Confident	103 Å²	103	58.9 Å²	58.9	55%	0.551	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.3	-1.2	179.7	-68.6	-46.5	0	0	0	113.7	D10 R16	D10-N14 WeakPolarHBondContact O-CB 3.34Å; D10-N14 PolarHBondContact O-N 3.26Å; D10-N14 PolarHBondContact O-ND2 3.42Å; N14-R16 HydrophobicContact CB-CG 4.03Å; N14-R16 PolarHBondContact O-N 3.24Å
15	G	86.6	Confident	89.4	Confident	68 Å²	68	58.8 Å²	58.8	70%	0.701	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.9	26.3	-176.2	0	0	0	0	0	114	Y11 T12 I13	Y11-G15 PolarHBondContact O-N 3.36Å; Y11-G15 VanDerWaalsContact O-N 3.11Å; T12-G15 PolarHBondContact O-N 3.38Å; I13-G15 PolarHBondContact O-N 3.45Å
16	R	89.1	Confident	89.5	Confident	149 Å²	149	59 Å²	59	56%	0.562	31%	0.313	S	S	*	.			trans	-84.6	138.8	176.5	-64.2	-175.8	-171.5	-158.4	2	110	Y11 N14	Y11-R16 HydrophobicContact CD1-CB 3.41Å; Y11-R16 VanDerWaalsContact CD1-CB 3.41Å; Y11-R16 HydrophobicContact CD1-CG 4.45Å; Y11-R16 HydrophobicContact CE1-CB 3.84Å; Y11-R16 HydrophobicContact CG-CB 4.02Å; Y11-R16 PolarHBondContact O-N 3.34Å; N14-R16 HydrophobicContact CB-CG 4.03Å; N14-R16 PolarHBondContact O-N 3.24Å
17	E	86.8	Confident	89.6	Confident	166 Å²	166	57.4 Å²	57.4	78%	0.776	30%	0.302	S	S	*	.			trans	-72.6	137.4	176.9	-169.3	171.7	-166.7	0	0	111.3
18	I	91.4	Very high	89.5	Confident	15 Å²	15	57.1 Å²	57.1	8%	0.077	32%	0.315	C	S	.	.			trans	-101.4	114.2	174.1	-59.5	161.9	0	0	0	106.8	M8 Y11 L25 F27 Y55	M8-I18 HydrophobicContact CG-CD1 3.84Å; Y11-I18 HydrophobicContact CD1-CG1 4.17Å; Y11-I18 HydrophobicContact CG-CG1 4.33Å; I18-L25 HydrophobicContact CG2-CB 4.47Å; I18-L25 HydrophobicContact CG2-CD2 4.32Å; I18-F27 HydrophobicContact CB-CE1 4.41Å; I18-F27 HydrophobicContact CD1-CD1 4.36Å; I18-F27 HydrophobicContact CD1-CE1 3.74Å; I18-F27 HydrophobicContact CG1-CD1 3.98Å; I18-F27 HydrophobicContact CG1-CE1 3.8Å; I18-F27 HydrophobicContact CG2-CD1 4.14Å; I18-F27 HydrophobicContact CG2-CE1 3.71Å; I18-F27 HydrophobicContact CG2-CZ 3.97Å; I18-Y55 HydrophobicContact CB-CE2 3.78Å; I18-Y55 HydrophobicContact CD1-CD2 4.21Å; I18-Y55 HydrophobicContact CD1-CE2 4Å; I18-Y55 HydrophobicContact CG2-CD2 4.31Å; I18-Y55 HydrophobicContact CG2-CE2 3.73Å; I18-Y55 PolarHBondContact O-OH 3.4Å
19	I	91.3	Very high	89.3	Confident	76 Å²	76	61.1 Å²	61.1	39%	0.39	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	132.3	-175.5	-57	168.9	0	0	0	109	E21 I26	I19-E21 HydrophobicContact CG2-CG 4.01Å; I19-I26 HydrophobicContact CB-CB 4.22Å; I19-I26 PolarHBondContact N-O 2.83Å; I19-I26 PolarHBondContact O-N 3.39Å
20	E	90.4	Very high	89.3	Confident	89 Å²	89	60.4 Å²	60.4	42%	0.416	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	106.2	177.2	-173	178.1	173.1	0	0	109	L25 K34 K59	E20-L25 HydrophobicContact CB-CD2 4.02Å; E20-L25 HydrophobicContact CG-CD2 3.98Å; E20-K34 VanDerWaalsContact OE1-CE 3.29Å; E20-K34 WeakPolarHBondContact OE1-CE 3.32Å; E20-K34 IonicContact OE1-NZ 3.05Å; E20-K34 PolarHBondContact OE1-NZ 2.9Å; E20-K59 IonicContact OE2-NZ 2.63Å; E20-K59 PolarHBondContact OE2-NZ 2.81Å
21	E	86.9	Confident	89.4	Confident	45 Å²	45	57 Å²	57	21%	0.21	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	108.8	177.8	-81.1	-176.4	-168	0	0	109.3	I19 D23 Y24 I26 R120	I19-E21 HydrophobicContact CG2-CG 4.01Å; E21-D23 PolarHBondContact O-N 3.14Å; E21-Y24 PolarHBondContact N-O 3.2Å; E21-Y24 PolarHBondContact O-N 3.11Å; E21-I26 HydrophobicContact CB-CD1 3.89Å; E21-I26 HydrophobicContact CG-CD1 3.9Å; E21-I26 WeakPolarHBondContact OE2-CD1 3.28Å; E21-R120 IonicContact OE1-CZ 2.64Å; E21-R120 IonicContact OE1-NH1 2.69Å; E21-R120 PolarHBondContact OE1-NH1 3.25Å; E21-R120 IonicContact OE1-NH2 2.91Å; E21-R120 PolarHBondContact OE1-NH2 3.17Å; E21-R120 IonicContact OE2-NH2 2.79Å
22	G	86.5	Confident	89.4	Confident	55 Å²	55	56.1 Å²	56.1	57%	0.567	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.5	-119.9	178.8	0	0	0	0	0	112.4	Y24 K34	G22-Y24 VanDerWaalsContact C-N 3.33Å; G22-K34 WeakPolarHBondContact O-CE 3.31Å; G22-K34 PolarHBondContact O-NZ 3.47Å
23	D	90.1	Very high	89.5	Confident	104 Å²	104	57.7 Å²	57.7	56%	0.556	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.3	9.4	179.2	-62.9	-36.5	0	0	0	113.8	E21 H33 K34	E21-D23 PolarHBondContact O-N 3.14Å; D23-H33 CarbonylContact O-C 3.49Å; D23-H33 WeakPolarHBondContact O-CA 3.41Å; D23-K34 WeakPolarHBondContact O-CB 3.15Å; D23-K34 WeakPolarHBondContact O-CG 3.46Å; D23-K34 PolarHBondContact O-N 2.96Å
24	Y	91.6	Very high	89.6	Confident	69 Å²	69	56.4 Å²	56.4	27%	0.271	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	147	-175.2	-65.4	-93.3	0	0	0	112.9	E21 G22 A31 F32 H33 V114 L119	E21-Y24 PolarHBondContact N-O 3.2Å; E21-Y24 PolarHBondContact O-N 3.11Å; G22-Y24 VanDerWaalsContact C-N 3.33Å; Y24-A31 HydrophobicContact CD1-CB 4.36Å; Y24-F32 CarbonylContact C-O 3.57Å; Y24-F32 WeakPolarHBondContact CA-O 3.32Å; Y24-H33 HydrophobicContact CD1-CB 4.21Å; Y24-H33 HydrophobicContact CE1-CB 4.01Å; Y24-H33 AromaticContact CZ-CD2 3.88Å; Y24-V114 HydrophobicContact CE1-CG2 4.24Å; Y24-L119 HydrophobicContact CD1-CD1 3.74Å; Y24-L119 HydrophobicContact CD2-CD1 4.24Å; Y24-L119 HydrophobicContact CD2-CD2 3.65Å; Y24-L119 HydrophobicContact CD2-CG 4.47Å; Y24-L119 HydrophobicContact CE1-CD1 4.11Å; Y24-L119 HydrophobicContact CE2-CD2 3.96Å; Y24-L119 HydrophobicContact CG-CD1 3.8Å; Y24-L119 HydrophobicContact CG-CD2 4.01Å; Y24-L119 HydrophobicContact CG-CG 4.5Å
25	L	91.7	Very high	89.7	Confident	1 Å²	1	54.9 Å²	54.9	1%	0.005	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	120	168.8	-70.2	169.8	0	0	0	108.8	I18 E20 F27 A31 F32 K34 L51 Y55	I18-L25 HydrophobicContact CG2-CB 4.47Å; I18-L25 HydrophobicContact CG2-CD2 4.32Å; E20-L25 HydrophobicContact CB-CD2 4.02Å; E20-L25 HydrophobicContact CG-CD2 3.98Å; L25-F27 HydrophobicContact CB-CE2 3.82Å; L25-F27 HydrophobicContact CB-CZ 4.18Å; L25-F27 WeakPolarHBondContact O-CD2 3.21Å; L25-F27 WeakPolarHBondContact O-CE2 3.21Å; L25-A31 WeakPolarHBondContact O-CA 3.47Å; L25-F32 PolarHBondContact N-O 3.05Å; L25-F32 PolarHBondContact O-N 2.88Å; L25-K34 HydrophobicContact CD1-CG 4.36Å; L25-K34 HydrophobicContact CG-CG 4.08Å; L25-L51 HydrophobicContact CB-CD2 4.32Å; L25-L51 HydrophobicContact CD1-CD2 3.96Å; L25-L51 HydrophobicContact CD1-CG 3.77Å; L25-Y55 HydrophobicContact CD1-CD1 4.16Å; L25-Y55 HydrophobicContact CD1-CG 4.05Å; L25-Y55 HydrophobicContact CD2-CD1 3.71Å; L25-Y55 HydrophobicContact CD2-CE1 3.6Å; L25-Y55 HydrophobicContact CD2-CE2 4.48Å; L25-Y55 HydrophobicContact CD2-CG 4.17Å
26	I	91.8	Very high	89.9	Confident	3 Å²	3	52.1 Å²	52.1	2%	0.015	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	124.4	-174.1	-63	169.1	0	0	0	109.7	I19 E21 A31 V116	I19-I26 HydrophobicContact CB-CB 4.22Å; I19-I26 PolarHBondContact N-O 2.83Å; I19-I26 PolarHBondContact O-N 3.39Å; E21-I26 HydrophobicContact CB-CD1 3.89Å; E21-I26 HydrophobicContact CG-CD1 3.9Å; E21-I26 WeakPolarHBondContact OE2-CD1 3.28Å; I26-A31 HydrophobicContact CG1-CB 3.97Å; I26-V116 HydrophobicContact CB-CG2 4.37Å; I26-V116 HydrophobicContact CD1-CG2 4.47Å; I26-V116 HydrophobicContact CG1-CG2 4.21Å; I26-V116 HydrophobicContact CG2-CG2 3.39Å
27	F	90.9	Very high	90	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	74.1	175.6	-56.4	-91.7	0	0	0	108.8	R7 M8 Y11 I18 L25 D29 K30 F32 L51	R7-F27 HydrophobicContact CB-CD1 4.42Å; R7-F27 HydrophobicContact CB-CG 4.43Å; M8-F27 HydrophobicContact CB-CE1 3.77Å; M8-F27 HydrophobicContact CB-CZ 4.2Å; M8-F27 HydrophobicContact CG-CE1 4.17Å; Y11-F27 HydrophobicContact CD1-CD1 4.42Å; Y11-F27 HydrophobicContact CD2-CB 4.25Å; Y11-F27 HydrophobicContact CD2-CD1 4.12Å; Y11-F27 HydrophobicContact CE1-CB 4.32Å; Y11-F27 HydrophobicContact CE2-CB 3.85Å; Y11-F27 HydrophobicContact CG-CD1 4.06Å; Y11-F27 PolarHBondContact OH-O 3.17Å; I18-F27 HydrophobicContact CB-CE1 4.41Å; I18-F27 HydrophobicContact CD1-CD1 4.36Å; I18-F27 HydrophobicContact CD1-CE1 3.74Å; I18-F27 HydrophobicContact CG1-CD1 3.98Å; I18-F27 HydrophobicContact CG1-CE1 3.8Å; I18-F27 HydrophobicContact CG2-CD1 4.14Å; I18-F27 HydrophobicContact CG2-CE1 3.71Å; I18-F27 HydrophobicContact CG2-CZ 3.97Å; L25-F27 HydrophobicContact CB-CE2 3.82Å; L25-F27 HydrophobicContact CB-CZ 4.18Å; L25-F27 WeakPolarHBondContact O-CD2 3.21Å; L25-F27 WeakPolarHBondContact O-CE2 3.21Å; F27-D29 PolarHBondContact O-N 2.97Å; F27-D29 VanDerWaalsContact O-N 3.13Å; F27-K30 PolarHBondContact N-O 2.9Å; F27-K30 PolarHBondContact O-N 3.29Å; F27-F32 AromaticContact CD2-CD2 3.54Å; F27-F32 HydrophobicContact CD2-CD2 3.54Å; F27-F32 AromaticContact CD2-CE2 3.98Å; F27-F32 HydrophobicContact CD2-CE2 3.98Å; F27-F32 AromaticContact CE2-CD2 3.72Å; F27-F32 HydrophobicContact CE2-CD2 3.72Å; F27-F32 HydrophobicContact CE2-CE2 4.43Å; F27-L51 HydrophobicContact CE2-CD2 4.14Å; F27-L51 HydrophobicContact CZ-CD1 4.45Å; F27-L51 HydrophobicContact CZ-CD2 4.4Å
28	G	86.9	Confident	90.2	Very high	44 Å²	44	41.2 Å²	41.2	45%	0.454	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	73	-100.4	-180	0	0	0	0	0	111.7	Y11 V116	Y11-G28 WeakPolarHBondContact OH-CA 3.47Å; Y11-G28 PolarHBondContact OH-N 2.75Å; G28-V116 WeakPolarHBondContact O-CG2 3.1Å
29	D	86.8	Confident	90.2	Very high	83 Å²	83	40.7 Å²	40.7	44%	0.444	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.4	-18.7	-179	61.6	-38.5	0	0	0	113.6	R7 F27 L115 V116	R7-D29 IonicContact NH1-OD1 3.88Å; F27-D29 PolarHBondContact O-N 2.97Å; F27-D29 VanDerWaalsContact O-N 3.13Å; D29-L115 WeakPolarHBondContact O-CA 3.34Å; D29-V116 PolarHBondContact O-N 2.64Å
30	K	89.2	Confident	90.2	Very high	26 Å²	26	37.1 Å²	37.1	11%	0.113	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	136.4	-174.6	-60.6	-178	-174.7	-171.4	0	111.4	D2 F27 F32 F113	D2-K30 IonicContact OD2-NZ 3.24Å; D2-K30 PolarHBondContact OD2-NZ 3.31Å; F27-K30 PolarHBondContact N-O 2.9Å; F27-K30 PolarHBondContact O-N 3.29Å; K30-F32 HydrophobicContact CB-CE2 4.22Å; K30-F113 HydrophobicContact CB-CB 4.27Å; K30-F113 HydrophobicContact CB-CD2 4.03Å; K30-F113 HydrophobicContact CB-CG 4.31Å; K30-F113 HydrophobicContact CD-CD1 4.35Å; K30-F113 HydrophobicContact CD-CD2 3.84Å; K30-F113 HydrophobicContact CD-CE1 4.47Å; K30-F113 HydrophobicContact CD-CE2 3.96Å; K30-F113 HydrophobicContact CD-CG 4.06Å; K30-F113 HydrophobicContact CD-CZ 4.28Å; K30-F113 HydrophobicContact CG-CD2 3.67Å; K30-F113 HydrophobicContact CG-CE2 3.98Å; K30-F113 HydrophobicContact CG-CG 4.23Å
31	A	90.6	Very high	90.2	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	132.9	174.6	0	0	0	0	0	110.7	Y24 L25 I26 F113 V114 V116 L119	Y24-A31 HydrophobicContact CD1-CB 4.36Å; L25-A31 WeakPolarHBondContact O-CA 3.47Å; I26-A31 HydrophobicContact CG1-CB 3.97Å; A31-F113 CarbonylContact O-C 3.56Å; A31-F113 VanDerWaalsContact O-CA 3.31Å; A31-F113 WeakPolarHBondContact O-CA 3.36Å; A31-V114 PolarHBondContact N-O 3.16Å; A31-V114 PolarHBondContact O-N 2.93Å; A31-V116 HydrophobicContact CB-CG2 4.38Å; A31-L119 HydrophobicContact CB-CD1 3.14Å
32	F	91.6	Very high	90.3	Very high	0 Å²	0	34 Å²	34	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	139.2	175.5	-63.7	-91.2	0	0	0	109.6	P4 Y24 L25 F27 K30 L51 F113	P4-F32 HydrophobicContact CB-CD1 3.93Å; P4-F32 HydrophobicContact CB-CD2 4.29Å; P4-F32 HydrophobicContact CB-CE1 4.06Å; P4-F32 HydrophobicContact CB-CE2 4.45Å; P4-F32 HydrophobicContact CB-CG 4.03Å; P4-F32 HydrophobicContact CB-CZ 4.33Å; Y24-F32 CarbonylContact C-O 3.57Å; Y24-F32 WeakPolarHBondContact CA-O 3.32Å; L25-F32 PolarHBondContact N-O 3.05Å; L25-F32 PolarHBondContact O-N 2.88Å; F27-F32 AromaticContact CD2-CD2 3.54Å; F27-F32 HydrophobicContact CD2-CD2 3.54Å; F27-F32 AromaticContact CD2-CE2 3.98Å; F27-F32 HydrophobicContact CD2-CE2 3.98Å; F27-F32 AromaticContact CE2-CD2 3.72Å; F27-F32 HydrophobicContact CE2-CD2 3.72Å; F27-F32 HydrophobicContact CE2-CE2 4.43Å; K30-F32 HydrophobicContact CB-CE2 4.22Å; F32-L51 HydrophobicContact CB-CD2 3.54Å; F32-L51 HydrophobicContact CG-CD2 4.35Å; F32-F113 HydrophobicContact CD1-CB 3.91Å; F32-F113 HydrophobicContact CE1-CB 3.62Å; F32-F113 HydrophobicContact CE1-CD1 4.5Å; F32-F113 HydrophobicContact CE1-CG 4.5Å; F32-F113 HydrophobicContact CE2-CB 4.33Å; F32-F113 HydrophobicContact CG-CB 4.41Å; F32-F113 HydrophobicContact CZ-CB 3.85Å
33	H	91.7	Very high	90.3	Very high	65 Å²	65	39.2 Å²	39.2	30%	0.301	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	140	175.6	-168.6	-90.7	0	0	0	110.6	D23 Y24 S35 C36	D23-H33 CarbonylContact O-C 3.49Å; D23-H33 WeakPolarHBondContact O-CA 3.41Å; Y24-H33 HydrophobicContact CD1-CB 4.21Å; Y24-H33 HydrophobicContact CE1-CB 4.01Å; Y24-H33 AromaticContact CZ-CD2 3.88Å; H33-S35 VanDerWaalsContact C-N 3.28Å; H33-S35 PolarHBondContact CE1-OG 3.26Å; H33-S35 PolarHBondContact ND1-N 2.95Å; H33-S35 PolarHBondContact ND1-OG 3.38Å; H33-S35 PolarHBondContact O-N 3.34Å; H33-C36 WeakPolarHBondContact O-CB 3.49Å; H33-C36 PolarHBondContact O-N 3.22Å
34	K	91.1	Very high	90	Very high	23 Å²	23	39.1 Å²	39.1	10%	0.1	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-37.6	-176.9	-80.5	178.2	179.1	-178.9	0	113.9	E20 G22 D23 L25 C36 E52	E20-K34 VanDerWaalsContact OE1-CE 3.29Å; E20-K34 WeakPolarHBondContact OE1-CE 3.32Å; E20-K34 IonicContact OE1-NZ 3.05Å; E20-K34 PolarHBondContact OE1-NZ 2.9Å; G22-K34 WeakPolarHBondContact O-CE 3.31Å; G22-K34 PolarHBondContact O-NZ 3.47Å; D23-K34 WeakPolarHBondContact O-CB 3.15Å; D23-K34 WeakPolarHBondContact O-CG 3.46Å; D23-K34 PolarHBondContact O-N 2.96Å; L25-K34 HydrophobicContact CD1-CG 4.36Å; L25-K34 HydrophobicContact CG-CG 4.08Å; K34-C36 PolarHBondContact O-N 2.75Å; K34-E52 HydrophobicContact CB-CB 3.95Å; K34-E52 HydrophobicContact CB-CG 4.32Å; K34-E52 HydrophobicContact CD-CG 4.45Å; K34-E52 HydrophobicContact CG-CB 4.4Å; K34-E52 HydrophobicContact CG-CG 4.49Å; K34-E52 WeakPolarHBondContact O-CB 3.21Å; K34-E52 PolarHBondContact O-N 3.19Å; K34-E52 VanDerWaalsContact O-N 3.1Å
35	S	90.4	Very high	89.6	Confident	72 Å²	72	40.8 Å²	40.8	50%	0.503	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-3.6	178.8	74.5	0	0	0	0	115	H33 K37	H33-S35 VanDerWaalsContact C-N 3.28Å; H33-S35 PolarHBondContact CE1-OG 3.26Å; H33-S35 PolarHBondContact ND1-N 2.95Å; H33-S35 PolarHBondContact ND1-OG 3.38Å; H33-S35 PolarHBondContact O-N 3.34Å; S35-K37 PolarHBondContact O-N 3.23Å
36	C	90.5	Very high	89.1	Confident	9 Å²	9	48.5 Å²	48.5	6%	0.061	24%	0.243	C	C	.	.			trans	-57.5	129.5	178.6	175.7	0	0	0	0	111.8	H33 K34 T50 L51 C111	H33-C36 WeakPolarHBondContact O-CB 3.49Å; H33-C36 PolarHBondContact O-N 3.22Å; K34-C36 PolarHBondContact O-N 2.75Å; C36-T50 CarbonylContact O-C 3.57Å; C36-T50 WeakPolarHBondContact O-CA 3.37Å; C36-L51 HydrophobicContact CB-CB 4.32Å; C36-L51 PolarHBondContact O-N 3.44Å; C36-C111 HydrophobicContact CB-CB 4.31Å; C36-C111 WeakPolarHBondContact CB-SG 3.44Å; C36-C111 WeakPolarHBondContact SG-CB 3.18Å; C36-C111 CovalentContact SG-SG 2Å; C36-C111 PolarHBondContact SG-SG 3Å
37	K	91.8	Very high	89	Confident	86 Å²	86	50.8 Å²	50.8	37%	0.374	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	132.9	174.4	-68.8	-170.5	177.4	-168.3	0	110.3	S35 D47	S35-K37 PolarHBondContact O-N 3.23Å; K37-D47 WeakPolarHBondContact CE-OD1 3.43Å; K37-D47 IonicContact NZ-OD1 2.86Å; K37-D47 PolarHBondContact NZ-OD1 2.6Å; K37-D47 IonicContact NZ-OD2 2.77Å; K37-D47 PolarHBondContact NZ-OD2 2.88Å
38	T	91.1	Very high	89	Confident	1 Å²	1	52.3 Å²	52.3	1%	0.006	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	-179	174.1	66.8	0	0	0	0	110.9	L5 F40 Y48 Y49 L51 V54	L5-T38 HydrophobicContact CB-CG2 4.46Å; L5-T38 HydrophobicContact CD1-CG2 4.44Å; T38-F40 PolarHBondContact OG1-N 3.08Å; T38-Y48 WeakPolarHBondContact O-CB 3.41Å; T38-Y48 WeakPolarHBondContact O-CD1 3.36Å; T38-Y49 WeakPolarHBondContact CB-O 3.34Å; T38-Y49 WeakPolarHBondContact CG2-O 3.44Å; T38-Y49 PolarHBondContact N-O 2.9Å; T38-Y49 PolarHBondContact OG1-O 2.88Å; T38-L51 HydrophobicContact CG2-CB 4.25Å; T38-L51 HydrophobicContact CG2-CD1 4.15Å; T38-V54 HydrophobicContact CG2-CG2 4.32Å
39	N	90.9	Very high	89.3	Confident	4 Å²	4	50.2 Å²	50.2	2%	0.021	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	12	174.3	61.3	-17.9	0	0	0	113.5	Y3 L5 I104 D105 A108	Y3-N39 HydrophobicContact CD1-CB 4.1Å; Y3-N39 HydrophobicContact CE1-CB 4.44Å; Y3-N39 HydrophobicContact CG-CB 4.33Å; L5-N39 WeakPolarHBondContact CB-OD1 3.44Å; L5-N39 WeakPolarHBondContact CD2-OD1 3.49Å; N39-I104 WeakPolarHBondContact ND2-CG2 3.46Å; N39-I104 WeakPolarHBondContact O-CA 3.47Å; N39-D105 PolarHBondContact O-N 2.58Å; N39-A108 HydrophobicContact CB-CB 3.65Å
40	F	90.9	Very high	89.7	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	118.5	178.6	-163.8	-78	0	0	0	111.5	L5 T38 Y48 Y49 D84 P87 L88 P101 R103 I104	L5-F40 HydrophobicContact CD2-CB 3.86Å; L5-F40 HydrophobicContact CD2-CD2 4.27Å; T38-F40 PolarHBondContact OG1-N 3.08Å; F40-Y48 WeakPolarHBondContact O-CA 3.37Å; F40-Y49 AromaticContact CD1-CD2 3.66Å; F40-Y49 HydrophobicContact CD1-CD2 3.66Å; F40-Y49 AromaticContact CD1-CE2 3.77Å; F40-Y49 HydrophobicContact CD1-CE2 3.77Å; F40-Y49 HydrophobicContact CE1-CD2 4.35Å; F40-Y49 HydrophobicContact CE1-CE2 4.02Å; F40-Y49 HydrophobicContact CG-CD2 4.49Å; F40-Y49 PolarHBondContact O-N 2.82Å; F40-D84 HydrophobicContact CE1-CB 4.12Å; F40-P87 HydrophobicContact CZ-CB 4.48Å; F40-L88 HydrophobicContact CD1-CD1 4.5Å; F40-L88 HydrophobicContact CD2-CD1 3.6Å; F40-L88 HydrophobicContact CE2-CB 4.08Å; F40-L88 HydrophobicContact CE2-CD1 3.74Å; F40-L88 HydrophobicContact CG-CD1 3.99Å; F40-L88 HydrophobicContact CZ-CB 3.97Å; F40-L88 HydrophobicContact CZ-CD1 4.24Å; F40-P101 HydrophobicContact CE2-CG 4.35Å; F40-R103 HydrophobicContact CE1-CB 4.4Å; F40-R103 HydrophobicContact CZ-CB 4.29Å; F40-I104 HydrophobicContact CD2-CG1 3.98Å
41	L	90.6	Very high	89.8	Confident	58 Å²	58	46.3 Å²	46.3	30%	0.304	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	131.4	-178.3	-165.7	75.7	0	0	0	112	Y48 R103	L41-Y48 HydrophobicContact CD1-CD1 4.32Å; L41-Y48 HydrophobicContact CD1-CE1 4.02Å; L41-R103 WeakPolarHBondContact CB-O 3.35Å; L41-R103 PolarHBondContact N-O 2.86Å
42	M	90.8	Very high	90	Very high	11 Å²	11	49.1 Å²	49.1	5%	0.054	24%	0.235	C	C	.	.	P	Polyproline II helix	trans	-66	145.8	173.9	-60	176.6	69.3	0	0	111.5	Q45 D47 Y49 Q78 I81	M42-Q45 HydrophobicContact CB-CB 4.42Å; M42-Q45 HydrophobicContact SD-CB 4.44Å; M42-D47 WeakPolarHBondContact CB-O 3.48Å; M42-D47 VanDerWaalsContact CG-O 3.3Å; M42-D47 WeakPolarHBondContact CG-O 3.46Å; M42-D47 PolarHBondContact N-O 2.95Å; M42-D47 HydrophobicContact SD-CB 4.22Å; M42-Y49 HydrophobicContact CB-CE2 4.17Å; M42-Y49 HydrophobicContact CE-CD1 4.4Å; M42-Y49 HydrophobicContact CE-CE1 3.88Å; M42-Y49 HydrophobicContact CG-CD1 3.91Å; M42-Y49 HydrophobicContact CG-CD2 3.87Å; M42-Y49 HydrophobicContact CG-CE1 3.73Å; M42-Y49 HydrophobicContact CG-CE2 3.69Å; M42-Y49 HydrophobicContact CG-CG 3.98Å; M42-Y49 HydrophobicContact SD-CD1 4.37Å; M42-Y49 HydrophobicContact SD-CE1 4.31Å; M42-Q78 HydrophobicContact CE-CG 4.23Å; M42-Q78 PolarHBondContact SD-NE2 2.89Å; M42-I81 HydrophobicContact CE-CD1 4.31Å
43	W	85.4	Confident	90.1	Very high	165 Å²	165	49.1 Å²	49.1	63%	0.625	24%	0.235	S	C	*	.	S	Bend	trans	-62.1	-45.3	178.7	178.9	-113.8	0	0	0	114.6	P83 D84 R103	W43-P83 HydrophobicContact CD2-CB 4.41Å; W43-P83 HydrophobicContact CG-CB 4.3Å; W43-P83 HydrophobicContact CG-CG 4.36Å; W43-D84 VanDerWaalsContact CB-OD1 3.31Å; W43-D84 WeakPolarHBondContact CB-OD1 3.36Å; W43-D84 PolarHBondContact N-OD2 3.44Å; W43-R103 VanDerWaalsContact CA-NH1 3.27Å; W43-R103 VanDerWaalsContact CB-NH1 3.32Å
44	N	84.4	Confident	90.2	Very high	101 Å²	101	46 Å²	46	54%	0.54	22%	0.221	S	C	.	.	S	Bend	trans	-91.5	-22.8	-169.9	65.7	-15.3	0	0	0	113	I81	N44-I81 HydrophobicContact CB-CD1 4.07Å; N44-I81 WeakPolarHBondContact ND2-CD1 3.18Å; N44-I81 WeakPolarHBondContact OD1-CD1 3.29Å
45	Q	82.1	Confident	90.3	Very high	104 Å²	104	46 Å²	46	49%	0.486	22%	0.22	S	C	.	.	S	Bend	trans	-127.7	144.5	-172.1	-71.6	179.9	-11.5	0	0	109.4	M42 D47	M42-Q45 HydrophobicContact CB-CB 4.42Å; M42-Q45 HydrophobicContact SD-CB 4.44Å; Q45-D47 HydrophobicContact CB-CB 4.48Å; Q45-D47 PolarHBondContact O-N 2.96Å
46	K	82	Confident	90.5	Very high	163 Å²	163	43 Å²	43	71%	0.709	20%	0.198	S	C	*	.	S	Bend	trans	-79.6	44.5	171.6	-67.7	-171	172	-163.3	0	111.1
47	D	89.2	Confident	90.7	Very high	52 Å²	52	42.6 Å²	42.6	28%	0.278	20%	0.195	S	C	.	.	S	Bend	trans	-123	167.5	175.8	-151.5	-8.6	0	0	0	109.1	K37 M42 Q45	K37-D47 WeakPolarHBondContact CE-OD1 3.43Å; K37-D47 IonicContact NZ-OD1 2.86Å; K37-D47 PolarHBondContact NZ-OD1 2.6Å; K37-D47 IonicContact NZ-OD2 2.77Å; K37-D47 PolarHBondContact NZ-OD2 2.88Å; M42-D47 WeakPolarHBondContact CB-O 3.48Å; M42-D47 VanDerWaalsContact CG-O 3.3Å; M42-D47 WeakPolarHBondContact CG-O 3.46Å; M42-D47 PolarHBondContact N-O 2.95Å; M42-D47 HydrophobicContact SD-CB 4.22Å; Q45-D47 HydrophobicContact CB-CB 4.48Å; Q45-D47 PolarHBondContact O-N 2.96Å
48	Y	92.1	Very high	90.7	Very high	31 Å²	31	39.5 Å²	39.5	12%	0.122	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	148.4	-178	-54.2	-86.1	0	0	0	110.7	T38 F40 L41 D105 A108 P109	T38-Y48 WeakPolarHBondContact O-CB 3.41Å; T38-Y48 WeakPolarHBondContact O-CD1 3.36Å; F40-Y48 WeakPolarHBondContact O-CA 3.37Å; L41-Y48 HydrophobicContact CD1-CD1 4.32Å; L41-Y48 HydrophobicContact CD1-CE1 4.02Å; Y48-D105 HydrophobicContact CE1-CB 3.92Å; Y48-D105 PolarHBondContact OH-OD2 3.11Å; Y48-A108 HydrophobicContact CD1-CB 4.17Å; Y48-A108 HydrophobicContact CE1-CB 3.66Å; Y48-A108 HydrophobicContact CE2-CB 4.36Å; Y48-P109 HydrophobicContact CE2-CG 4.39Å
49	Y	93.2	Very high	90.7	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67	142.5	174.6	-69.1	-75.1	0	0	0	111.3	T38 F40 M42 Q78 V80 I81 D84	T38-Y49 WeakPolarHBondContact CB-O 3.34Å; T38-Y49 WeakPolarHBondContact CG2-O 3.44Å; T38-Y49 PolarHBondContact N-O 2.9Å; T38-Y49 PolarHBondContact OG1-O 2.88Å; F40-Y49 AromaticContact CD1-CD2 3.66Å; F40-Y49 HydrophobicContact CD1-CD2 3.66Å; F40-Y49 AromaticContact CD1-CE2 3.77Å; F40-Y49 HydrophobicContact CD1-CE2 3.77Å; F40-Y49 HydrophobicContact CE1-CD2 4.35Å; F40-Y49 HydrophobicContact CE1-CE2 4.02Å; F40-Y49 HydrophobicContact CG-CD2 4.49Å; F40-Y49 PolarHBondContact O-N 2.82Å; M42-Y49 HydrophobicContact CB-CE2 4.17Å; M42-Y49 HydrophobicContact CE-CD1 4.4Å; M42-Y49 HydrophobicContact CE-CE1 3.88Å; M42-Y49 HydrophobicContact CG-CD1 3.91Å; M42-Y49 HydrophobicContact CG-CD2 3.87Å; M42-Y49 HydrophobicContact CG-CE1 3.73Å; M42-Y49 HydrophobicContact CG-CE2 3.69Å; M42-Y49 HydrophobicContact CG-CG 3.98Å; M42-Y49 HydrophobicContact SD-CD1 4.37Å; M42-Y49 HydrophobicContact SD-CE1 4.31Å; Y49-Q78 VanDerWaalsContact CA-OE1 3.3Å; Y49-Q78 HydrophobicContact CD1-CG 4.34Å; Y49-V80 HydrophobicContact CD1-CG2 4.21Å; Y49-V80 HydrophobicContact CE1-CB 4.37Å; Y49-V80 HydrophobicContact CE1-CG2 4.18Å; Y49-I81 WeakPolarHBondContact OH-CG1 3.42Å; Y49-I81 PolarHBondContact OH-N 3.14Å; Y49-D84 HydrophobicContact CE2-CB 4.35Å; Y49-D84 WeakPolarHBondContact CE2-OD2 3.48Å; Y49-D84 PolarHBondContact OH-OD2 3.4Å
50	T	93.6	Very high	90.8	Very high	28 Å²	28	45.7 Å²	45.7	17%	0.172	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	152.4	171	63.9	0	0	0	0	111.5	C36 E52 S53 V54	C36-T50 CarbonylContact O-C 3.57Å; C36-T50 WeakPolarHBondContact O-CA 3.37Å; T50-E52 VanDerWaalsContact C-N 3.29Å; T50-E52 PolarHBondContact O-N 3.09Å; T50-S53 WeakPolarHBondContact O-CB 3.13Å; T50-S53 PolarHBondContact O-N 2.59Å; T50-S53 VanDerWaalsContact O-N 3.15Å; T50-S53 WeakPolarHBondContact OG1-CB 3.35Å; T50-S53 PolarHBondContact OG1-N 2.98Å; T50-S53 PolarHBondContact OG1-OG 2.97Å; T50-V54 PolarHBondContact O-N 3.35Å
51	L	93.1	Very high	90.7	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-59.7	-42.1	-178.9	-175.9	60.9	0	0	0	111.5	P4 M8 L25 F27 F32 C36 T38 S53 V54 Y55	P4-L51 HydrophobicContact CB-CD1 3.93Å; P4-L51 HydrophobicContact CB-CD2 4.02Å; M8-L51 HydrophobicContact CE-CD1 4.18Å; M8-L51 HydrophobicContact SD-CD1 4.38Å; L25-L51 HydrophobicContact CB-CD2 4.32Å; L25-L51 HydrophobicContact CD1-CD2 3.96Å; L25-L51 HydrophobicContact CD1-CG 3.77Å; F27-L51 HydrophobicContact CE2-CD2 4.14Å; F27-L51 HydrophobicContact CZ-CD1 4.45Å; F27-L51 HydrophobicContact CZ-CD2 4.4Å; F32-L51 HydrophobicContact CB-CD2 3.54Å; F32-L51 HydrophobicContact CG-CD2 4.35Å; C36-L51 HydrophobicContact CB-CB 4.32Å; C36-L51 PolarHBondContact O-N 3.44Å; T38-L51 HydrophobicContact CG2-CB 4.25Å; T38-L51 HydrophobicContact CG2-CD1 4.15Å; L51-S53 VanDerWaalsContact C-N 3.32Å; L51-S53 PolarHBondContact O-N 2.64Å; L51-V54 PolarHBondContact O-N 3.46Å; L51-Y55 WeakPolarHBondContact O-CB 3.35Å; L51-Y55 PolarHBondContact O-N 3.03Å
52	E	93.9	Very high	90.7	Very high	58 Å²	58	53.8 Å²	53.8	27%	0.271	25%	0.253	S	S	.	.	H	α-helix	trans	-57.3	-43.2	174.8	-173.9	173	-150.1	0	0	112.9	K34 T50 V54 Y55 F56 L77	K34-E52 HydrophobicContact CB-CB 3.95Å; K34-E52 HydrophobicContact CB-CG 4.32Å; K34-E52 HydrophobicContact CD-CG 4.45Å; K34-E52 HydrophobicContact CG-CB 4.4Å; K34-E52 HydrophobicContact CG-CG 4.49Å; K34-E52 WeakPolarHBondContact O-CB 3.21Å; K34-E52 PolarHBondContact O-N 3.19Å; K34-E52 VanDerWaalsContact O-N 3.1Å; T50-E52 VanDerWaalsContact C-N 3.29Å; T50-E52 PolarHBondContact O-N 3.09Å; E52-V54 PolarHBondContact O-N 3.49Å; E52-Y55 PolarHBondContact O-N 3.17Å; E52-F56 VanDerWaalsContact O-CB 3.28Å; E52-F56 WeakPolarHBondContact O-CB 3.34Å; E52-F56 PolarHBondContact O-N 3.29Å; E52-L77 HydrophobicContact CG-CD1 4.23Å; E52-L77 HydrophobicContact CG-CD2 3.65Å; E52-L77 WeakPolarHBondContact OE2-CD2 3.42Å
53	S	93.4	Very high	90.7	Very high	1 Å²	1	55.7 Å²	55.7	1%	0.007	26%	0.264	C	S	.	.	H	α-helix	trans	-66	-40.1	-178.7	-61.4	0	0	0	0	112.3	T50 L51 F57 Q78	T50-S53 WeakPolarHBondContact O-CB 3.13Å; T50-S53 PolarHBondContact O-N 2.59Å; T50-S53 VanDerWaalsContact O-N 3.15Å; T50-S53 WeakPolarHBondContact OG1-CB 3.35Å; T50-S53 PolarHBondContact OG1-N 2.98Å; T50-S53 PolarHBondContact OG1-OG 2.97Å; L51-S53 VanDerWaalsContact C-N 3.32Å; L51-S53 PolarHBondContact O-N 2.64Å; S53-F57 WeakPolarHBondContact O-CB 3.22Å; S53-F57 PolarHBondContact O-N 3.43Å; S53-Q78 WeakPolarHBondContact CB-O 3.38Å; S53-Q78 WeakPolarHBondContact OG-CB 3.28Å; S53-Q78 PolarHBondContact OG-N 2.95Å; S53-Q78 PolarHBondContact OG-O 3.41Å
54	V	93.8	Very high	91.1	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-72	-39.8	176.9	-175.5	0	0	0	0	110.9	L5 M8 T38 T50 L51 E52 F57 L58 L88 L92	L5-V54 HydrophobicContact CD1-CG1 3.87Å; M8-V54 HydrophobicContact CE-CB 3.76Å; M8-V54 HydrophobicContact CE-CG1 3.23Å; T38-V54 HydrophobicContact CG2-CG2 4.32Å; T50-V54 PolarHBondContact O-N 3.35Å; L51-V54 PolarHBondContact O-N 3.46Å; E52-V54 PolarHBondContact O-N 3.49Å; V54-F57 WeakPolarHBondContact O-CB 3.47Å; V54-F57 PolarHBondContact O-N 2.93Å; V54-L58 PolarHBondContact O-N 3.44Å; V54-L88 HydrophobicContact CG1-CD1 4.14Å; V54-L88 HydrophobicContact CG1-CD2 4.06Å; V54-L88 HydrophobicContact CG1-CG 4.34Å; V54-L88 HydrophobicContact CG2-CD2 4.37Å; V54-L92 HydrophobicContact CG1-CD1 3.82Å
55	Y	93.6	Very high	91.5	Very high	22 Å²	22	49.2 Å²	49.2	9%	0.086	24%	0.243	C	C	.	.	H	α-helix	trans	-63.9	-42.9	175.7	179.8	-112.9	0	0	0	112.1	M8 I18 L25 L51 E52 F57 L58 K59	M8-Y55 HydrophobicContact SD-CD2 4.24Å; I18-Y55 HydrophobicContact CB-CE2 3.78Å; I18-Y55 HydrophobicContact CD1-CD2 4.21Å; I18-Y55 HydrophobicContact CD1-CE2 4Å; I18-Y55 HydrophobicContact CG2-CD2 4.31Å; I18-Y55 HydrophobicContact CG2-CE2 3.73Å; I18-Y55 PolarHBondContact O-OH 3.4Å; L25-Y55 HydrophobicContact CD1-CD1 4.16Å; L25-Y55 HydrophobicContact CD1-CG 4.05Å; L25-Y55 HydrophobicContact CD2-CD1 3.71Å; L25-Y55 HydrophobicContact CD2-CE1 3.6Å; L25-Y55 HydrophobicContact CD2-CE2 4.48Å; L25-Y55 HydrophobicContact CD2-CG 4.17Å; L51-Y55 WeakPolarHBondContact O-CB 3.35Å; L51-Y55 PolarHBondContact O-N 3.03Å; E52-Y55 PolarHBondContact O-N 3.17Å; Y55-F57 VanDerWaalsContact C-N 3.34Å; Y55-F57 PolarHBondContact O-N 3.24Å; Y55-L58 PolarHBondContact O-N 3.23Å; Y55-K59 HydrophobicContact CD1-CD 4.48Å; Y55-K59 HydrophobicContact CE1-CD 3.96Å; Y55-K59 PolarHBondContact O-N 3.03Å; Y55-K59 WeakPolarHBondContact OH-CE 3.48Å; Y55-K59 PolarHBondContact OH-NZ 3.3Å
56	F	93.9	Very high	92.1	Very high	8 Å²	8	48.2 Å²	48.2	4%	0.035	25%	0.245	C	C	.	.	H	α-helix	trans	-62.2	-40.1	173.7	179.9	-100.1	0	0	0	111.9	E52 K59 N60 Y68 E71 A72 L77	E52-F56 VanDerWaalsContact O-CB 3.28Å; E52-F56 WeakPolarHBondContact O-CB 3.34Å; E52-F56 PolarHBondContact O-N 3.29Å; F56-K59 PolarHBondContact O-N 3.06Å; F56-N60 WeakPolarHBondContact CE2-ND2 3.46Å; F56-N60 WeakPolarHBondContact CZ-ND2 3.16Å; F56-N60 WeakPolarHBondContact O-CB 3.41Å; F56-N60 PolarHBondContact O-N 3.25Å; F56-N60 VanDerWaalsContact O-N 3.12Å; F56-Y68 HydrophobicContact CD1-CD2 4.29Å; F56-Y68 AromaticContact CD1-CE2 3.58Å; F56-Y68 HydrophobicContact CD1-CE2 3.58Å; F56-Y68 AromaticContact CE1-CD2 3.88Å; F56-Y68 HydrophobicContact CE1-CD2 3.88Å; F56-Y68 AromaticContact CE1-CE2 3.61Å; F56-Y68 HydrophobicContact CE1-CE2 3.61Å; F56-E71 HydrophobicContact CZ-CB 3.82Å; F56-A72 HydrophobicContact CD1-CB 4.19Å; F56-A72 HydrophobicContact CE1-CB 3.66Å; F56-L77 HydrophobicContact CB-CD1 3.74Å; F56-L77 HydrophobicContact CD1-CD1 4.06Å; F56-L77 HydrophobicContact CD2-CD1 3.91Å; F56-L77 HydrophobicContact CG-CD1 3.61Å
57	F	94.3	Very high	92.7	Very high	2 Å²	2	43 Å²	43	1%	0.009	23%	0.228	C	C	.	.	H	α-helix	trans	-61.1	-42.6	172.1	168.7	-106.9	0	0	0	112.5	S53 V54 Y55 N60 R61 Y68 V80 R85 L88 E89	S53-F57 WeakPolarHBondContact O-CB 3.22Å; S53-F57 PolarHBondContact O-N 3.43Å; V54-F57 WeakPolarHBondContact O-CB 3.47Å; V54-F57 PolarHBondContact O-N 2.93Å; Y55-F57 VanDerWaalsContact C-N 3.34Å; Y55-F57 PolarHBondContact O-N 3.24Å; F57-N60 CarbonylContact O-C 3.59Å; F57-N60 PolarHBondContact O-N 2.96Å; F57-R61 PolarHBondContact O-N 3.18Å; F57-Y68 HydrophobicContact CB-CE2 4.02Å; F57-Y68 HydrophobicContact CD2-CE2 4.19Å; F57-V80 HydrophobicContact CB-CB 4.47Å; F57-V80 HydrophobicContact CB-CG2 3.87Å; F57-V80 HydrophobicContact CD2-CB 4.29Å; F57-V80 HydrophobicContact CG-CB 4.31Å; F57-V80 HydrophobicContact CG-CG2 4.08Å; F57-R85 HydrophobicContact CE2-CB 3.99Å; F57-R85 HydrophobicContact CE2-CG 3.8Å; F57-R85 HydrophobicContact CZ-CB 3.96Å; F57-R85 HydrophobicContact CZ-CG 4.24Å; F57-R85 WeakPolarHBondContact CZ-O 3.35Å; F57-L88 HydrophobicContact CD1-CD2 3.83Å; F57-L88 HydrophobicContact CD1-CG 4.29Å; F57-L88 HydrophobicContact CE1-CB 4.33Å; F57-L88 HydrophobicContact CE1-CD2 4Å; F57-L88 HydrophobicContact CE1-CG 4.11Å; F57-E89 HydrophobicContact CE1-CB 4.28Å; F57-E89 HydrophobicContact CZ-CB 4.21Å
58	L	92.3	Very high	93	Very high	20 Å²	20	40.5 Å²	40.5	11%	0.105	22%	0.215	C	C	.	.	H	α-helix	trans	-64	-42.1	178.8	-176.5	66.4	0	0	0	112.3	M8 T12 V54 Y55 N60 L92	M8-L58 HydrophobicContact CG-CD2 4.32Å; M8-L58 HydrophobicContact SD-CD2 4.46Å; T12-L58 HydrophobicContact CG2-CD1 4.07Å; T12-L58 HydrophobicContact CG2-CD2 4.2Å; T12-L58 WeakPolarHBondContact OG1-CD2 3.35Å; V54-L58 PolarHBondContact O-N 3.44Å; Y55-L58 PolarHBondContact O-N 3.23Å; L58-N60 VanDerWaalsContact C-N 3.3Å; L58-N60 PolarHBondContact O-N 3.32Å; L58-L92 HydrophobicContact CD1-CB 4.46Å; L58-L92 HydrophobicContact CD1-CD1 4.29Å
59	K	92	Very high	93.1	Very high	106 Å²	106	41.4 Å²	41.4	46%	0.461	22%	0.224	S	C	.	.	H	α-helix	trans	-61.1	-39.3	173.9	-78.9	-175.4	169.3	170.9	0	111.9	E20 Y55 F56	E20-K59 IonicContact OE2-NZ 2.63Å; E20-K59 PolarHBondContact OE2-NZ 2.81Å; Y55-K59 HydrophobicContact CD1-CD 4.48Å; Y55-K59 HydrophobicContact CE1-CD 3.96Å; Y55-K59 PolarHBondContact O-N 3.03Å; Y55-K59 WeakPolarHBondContact OH-CE 3.48Å; Y55-K59 PolarHBondContact OH-NZ 3.3Å; F56-K59 PolarHBondContact O-N 3.06Å
60	N	92	Very high	93.2	Very high	29 Å²	29	49.1 Å²	49.1	16%	0.155	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.1	29.5	-172.9	-72.3	-30.9	0	0	0	114.4	F56 F57 L58 S62 L63 Y68 E71	F56-N60 WeakPolarHBondContact CE2-ND2 3.46Å; F56-N60 WeakPolarHBondContact CZ-ND2 3.16Å; F56-N60 WeakPolarHBondContact O-CB 3.41Å; F56-N60 PolarHBondContact O-N 3.25Å; F56-N60 VanDerWaalsContact O-N 3.12Å; F57-N60 CarbonylContact O-C 3.59Å; F57-N60 PolarHBondContact O-N 2.96Å; L58-N60 VanDerWaalsContact C-N 3.3Å; L58-N60 PolarHBondContact O-N 3.32Å; N60-S62 VanDerWaalsContact C-N 3.29Å; N60-S62 PolarHBondContact O-N 3.34Å; N60-L63 HydrophobicContact CB-CD1 3.94Å; N60-L63 HydrophobicContact CB-CG 4.37Å; N60-L63 PolarHBondContact O-N 3.49Å; N60-Y68 HydrophobicContact CB-CD2 4.1Å; N60-E71 PolarHBondContact ND2-OE2 3.47Å
61	R	89.2	Confident	93.2	Very high	120 Å²	120	51.1 Å²	51.1	45%	0.453	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-29.8	-179	61.6	-179.7	156.4	178.7	-5.7	114.1	F57 L63	F57-R61 PolarHBondContact O-N 3.18Å; R61-L63 VanDerWaalsContact C-N 3.28Å; R61-L63 PolarHBondContact O-N 3.33Å
62	S	89.6	Confident	93.3	Very high	108 Å²	108	51.1 Å²	51.1	76%	0.755	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	-19.4	179.2	56	0	0	0	0	113.5	N60	N60-S62 VanDerWaalsContact C-N 3.29Å; N60-S62 PolarHBondContact O-N 3.34Å
63	L	91.7	Very high	93.3	Very high	51 Å²	51	51.4 Å²	51.4	27%	0.267	28%	0.277	S	S	.	.	S	Bend	trans	-74.6	140.4	-178.8	-62.5	-177.7	0	0	0	111.4	N60 R61 H65 E71 R85	N60-L63 HydrophobicContact CB-CD1 3.94Å; N60-L63 HydrophobicContact CB-CG 4.37Å; N60-L63 PolarHBondContact O-N 3.49Å; R61-L63 VanDerWaalsContact C-N 3.28Å; R61-L63 PolarHBondContact O-N 3.33Å; L63-H65 PolarHBondContact O-N 3.02Å; L63-E71 VanDerWaalsContact CD1-CD 3.44Å; L63-E71 VanDerWaalsContact CD1-OE1 3.24Å; L63-E71 WeakPolarHBondContact CD1-OE1 3.33Å; L63-E71 VanDerWaalsContact CD1-OE2 3.3Å; L63-E71 WeakPolarHBondContact CD1-OE2 3.3Å; L63-R85 PolarHBondContact O-NH2 3.04Å
64	V	93.5	Very high	93.3	Very high	98 Å²	98	55.3 Å²	55.3	59%	0.594	31%	0.31	S	S	*	.			trans	-55.8	137.8	167.7	-177.7	0	0	0	0	108.7	T66 S67 Y68	V64-T66 WeakPolarHBondContact CG1-OG1 3.41Å; V64-T66 PolarHBondContact O-N 3.39Å; V64-S67 WeakPolarHBondContact O-CB 3.28Å; V64-S67 PolarHBondContact O-N 2.84Å; V64-Y68 PolarHBondContact O-N 3.44Å
65	H	93.3	Very high	93.1	Very high	32 Å²	32	62.6 Å²	62.6	15%	0.148	34%	0.337	C	S	.	.	H	α-helix	trans	-52.3	-36.8	-172.8	-177.7	50.7	0	0	0	113.6	L63 S67 Y68 V69 V80 R85	L63-H65 PolarHBondContact O-N 3.02Å; H65-S67 PolarHBondContact O-N 3.2Å; H65-Y68 AromaticContact ND1-CD1 3.75Å; H65-Y68 PolarHBondContact O-N 3.2Å; H65-V69 WeakPolarHBondContact O-CG2 3.28Å; H65-V69 PolarHBondContact O-N 3.12Å; H65-V80 PolarHBondContact CE1-O 3.39Å; H65-V80 VanDerWaalsContact CE1-O 3.26Å; H65-R85 WeakPolarHBondContact ND1-CD 3.45Å; H65-R85 PolarHBondContact ND1-NH1 3.28Å; H65-R85 VanDerWaalsContact ND1-NH1 3.12Å
66	T	94.2	Very high	93	Very high	84 Å²	84	70.5 Å²	70.5	52%	0.515	38%	0.375	S	S	.	.	H	α-helix	trans	-63	-39	176.8	48.8	0	0	0	0	113	V64 K70	V64-T66 WeakPolarHBondContact CG1-OG1 3.41Å; V64-T66 PolarHBondContact O-N 3.39Å; T66-K70 WeakPolarHBondContact O-CG 3.37Å; T66-K70 PolarHBondContact O-N 2.82Å
67	S	94.5	Very high	92.8	Very high	52 Å²	52	71.3 Å²	71.3	36%	0.364	38%	0.379	S	S	.	.	H	α-helix	trans	-72.8	-43.2	176.7	-54.8	0	0	0	0	110.7	V64 H65 V69 K70 E71	V64-S67 WeakPolarHBondContact O-CB 3.28Å; V64-S67 PolarHBondContact O-N 2.84Å; H65-S67 PolarHBondContact O-N 3.2Å; S67-V69 VanDerWaalsContact C-N 3.32Å; S67-V69 PolarHBondContact O-N 2.89Å; S67-K70 WeakPolarHBondContact O-CB 2.79Å; S67-K70 PolarHBondContact O-N 2.77Å; S67-K70 VanDerWaalsContact O-N 3.13Å; S67-E71 PolarHBondContact O-N 2.86Å
68	Y	96.2	Very high	92.7	Very high	0 Å²	0	73.8 Å²	73.8	0%	0	39%	0.391	C	S	.	.	H	α-helix	trans	-55.7	-43.7	173.1	162.1	-95.2	0	0	0	112.6	F56 F57 N60 V64 H65 K70 E71 A72 V79 V80 R85	F56-Y68 HydrophobicContact CD1-CD2 4.29Å; F56-Y68 AromaticContact CD1-CE2 3.58Å; F56-Y68 HydrophobicContact CD1-CE2 3.58Å; F56-Y68 AromaticContact CE1-CD2 3.88Å; F56-Y68 HydrophobicContact CE1-CD2 3.88Å; F56-Y68 AromaticContact CE1-CE2 3.61Å; F56-Y68 HydrophobicContact CE1-CE2 3.61Å; F57-Y68 HydrophobicContact CB-CE2 4.02Å; F57-Y68 HydrophobicContact CD2-CE2 4.19Å; N60-Y68 HydrophobicContact CB-CD2 4.1Å; V64-Y68 PolarHBondContact O-N 3.44Å; H65-Y68 AromaticContact ND1-CD1 3.75Å; H65-Y68 PolarHBondContact O-N 3.2Å; Y68-K70 VanDerWaalsContact C-N 3.31Å; Y68-K70 PolarHBondContact O-N 3.33Å; Y68-E71 PolarHBondContact O-N 3.28Å; Y68-A72 WeakPolarHBondContact O-CB 3.33Å; Y68-A72 PolarHBondContact O-N 3.17Å; Y68-V79 HydrophobicContact CD1-CG1 4.26Å; Y68-V79 HydrophobicContact CE1-CG1 3.65Å; Y68-V80 HydrophobicContact CE1-CB 4.4Å; Y68-V80 PolarHBondContact OH-N 3.21Å; Y68-R85 VanDerWaalsContact CG-NH1 3.31Å
69	V	94.5	Very high	92.7	Very high	51 Å²	51	74.7 Å²	74.7	31%	0.309	40%	0.397	S	S	.	.	H	α-helix	trans	-61.4	-41.3	178.6	173.1	0	0	0	0	110.8	H65 S67 A73 V79	H65-V69 WeakPolarHBondContact O-CG2 3.28Å; H65-V69 PolarHBondContact O-N 3.12Å; S67-V69 VanDerWaalsContact C-N 3.32Å; S67-V69 PolarHBondContact O-N 2.89Å; V69-A73 VanDerWaalsContact O-CB 3.29Å; V69-A73 WeakPolarHBondContact O-CB 3.21Å; V69-A73 PolarHBondContact O-N 2.94Å; V69-V79 HydrophobicContact CB-CG1 4.32Å; V69-V79 HydrophobicContact CG1-CG1 4.37Å; V69-V79 HydrophobicContact CG1-CG2 4.47Å; V69-V79 HydrophobicContact CG2-CG1 3.71Å
70	K	94.4	Very high	92.8	Very high	161 Å²	161	69.7 Å²	69.7	70%	0.7	38%	0.375	S	S	*	.	H	α-helix	trans	-64.1	-44.3	177.4	-70.9	178.7	179.4	-174.1	0	111.6	T66 S67 Y68 A73 A74	T66-K70 WeakPolarHBondContact O-CG 3.37Å; T66-K70 PolarHBondContact O-N 2.82Å; S67-K70 WeakPolarHBondContact O-CB 2.79Å; S67-K70 PolarHBondContact O-N 2.77Å; S67-K70 VanDerWaalsContact O-N 3.13Å; Y68-K70 VanDerWaalsContact C-N 3.31Å; Y68-K70 PolarHBondContact O-N 3.33Å; K70-A73 PolarHBondContact O-N 2.89Å; K70-A74 WeakPolarHBondContact O-CB 3.19Å; K70-A74 PolarHBondContact O-N 2.95Å
71	E	94.2	Very high	92.8	Very high	71 Å²	71	70.3 Å²	70.3	33%	0.332	38%	0.378	S	S	.	.	H	α-helix	trans	-69.4	-39.2	178.8	-67	-175.8	-167.7	0	0	112.9	F56 N60 L63 S67 Y68 A74 R75	F56-E71 HydrophobicContact CZ-CB 3.82Å; N60-E71 PolarHBondContact ND2-OE2 3.47Å; L63-E71 VanDerWaalsContact CD1-CD 3.44Å; L63-E71 VanDerWaalsContact CD1-OE1 3.24Å; L63-E71 WeakPolarHBondContact CD1-OE1 3.33Å; L63-E71 VanDerWaalsContact CD1-OE2 3.3Å; L63-E71 WeakPolarHBondContact CD1-OE2 3.3Å; S67-E71 PolarHBondContact O-N 2.86Å; Y68-E71 PolarHBondContact O-N 3.28Å; E71-A74 PolarHBondContact O-N 3.34Å; E71-R75 PolarHBondContact O-N 3.44Å
72	A	94.3	Very high	92.9	Very high	0 Å²	0	72.6 Å²	72.6	0%	0	39%	0.387	C	S	.	.	H	α-helix	trans	-62.3	-44.7	174.8	0	0	0	0	0	111.2	F56 Y68 A74 R75 E76 L77 V79	F56-A72 HydrophobicContact CD1-CB 4.19Å; F56-A72 HydrophobicContact CE1-CB 3.66Å; Y68-A72 WeakPolarHBondContact O-CB 3.33Å; Y68-A72 PolarHBondContact O-N 3.17Å; A72-A74 VanDerWaalsContact C-N 3.32Å; A72-A74 PolarHBondContact O-N 3.47Å; A72-R75 CarbonylContact O-C 3.35Å; A72-R75 PolarHBondContact O-N 3.26Å; A72-R75 VanDerWaalsContact O-N 3.15Å; A72-E76 PolarHBondContact O-N 3.11Å; A72-L77 PolarHBondContact O-N 2.86Å; A72-V79 HydrophobicContact CB-CG2 3.78Å
73	A	93.5	Very high	93	Very high	63 Å²	63	70.2 Å²	70.2	52%	0.521	37%	0.369	S	S	.	.	H	α-helix	trans	-63.3	-37.7	176.6	0	0	0	0	0	112.2	V69 K70 R75 E76	V69-A73 VanDerWaalsContact O-CB 3.29Å; V69-A73 WeakPolarHBondContact O-CB 3.21Å; V69-A73 PolarHBondContact O-N 2.94Å; K70-A73 PolarHBondContact O-N 2.89Å; A73-R75 PolarHBondContact O-N 2.83Å; A73-E76 PolarHBondContact O-N 3.01Å; A73-E76 VanDerWaalsContact O-N 3.12Å
74	A	93.8	Very high	93	Very high	84 Å²	84	67.8 Å²	67.8	69%	0.694	36%	0.356	S	S	*	.	H	α-helix	trans	-65.1	-22.4	176	0	0	0	0	0	113.5	K70 E71 A72	K70-A74 WeakPolarHBondContact O-CB 3.19Å; K70-A74 PolarHBondContact O-N 2.95Å; E71-A74 PolarHBondContact O-N 3.34Å; A72-A74 VanDerWaalsContact C-N 3.32Å; A72-A74 PolarHBondContact O-N 3.47Å
75	R	90.5	Very high	92.9	Very high	153 Å²	153	64.3 Å²	64.3	58%	0.577	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.4	8.2	175.3	-63.7	-175.1	-174.9	179.6	4.9	113.3	E71 A72 A73 L77	E71-R75 PolarHBondContact O-N 3.44Å; A72-R75 CarbonylContact O-C 3.35Å; A72-R75 PolarHBondContact O-N 3.26Å; A72-R75 VanDerWaalsContact O-N 3.15Å; A73-R75 PolarHBondContact O-N 2.83Å; R75-L77 HydrophobicContact CB-CD1 4.01Å; R75-L77 HydrophobicContact CB-CG 3.82Å; R75-L77 PolarHBondContact O-N 3Å; R75-L77 VanDerWaalsContact O-N 3.16Å
76	E	91.5	Very high	92.7	Very high	187 Å²	187	69.9 Å²	69.9	87%	0.874	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.3	27.7	-176.8	-55.4	-174.5	165.8	0	0	114	A72 A73	A72-E76 PolarHBondContact O-N 3.11Å; A73-E76 PolarHBondContact O-N 3.01Å; A73-E76 VanDerWaalsContact O-N 3.12Å
77	L	90.3	Very high	92.4	Very high	25 Å²	25	67.8 Å²	67.8	13%	0.131	34%	0.344	C	S	.	.	P	Polyproline II helix	trans	-90.1	152.7	-178.7	-60.4	-178.2	0	0	0	112.2	E52 F56 A72 R75 V79	E52-L77 HydrophobicContact CG-CD1 4.23Å; E52-L77 HydrophobicContact CG-CD2 3.65Å; E52-L77 WeakPolarHBondContact OE2-CD2 3.42Å; F56-L77 HydrophobicContact CB-CD1 3.74Å; F56-L77 HydrophobicContact CD1-CD1 4.06Å; F56-L77 HydrophobicContact CD2-CD1 3.91Å; F56-L77 HydrophobicContact CG-CD1 3.61Å; A72-L77 PolarHBondContact O-N 2.86Å; R75-L77 HydrophobicContact CB-CD1 4.01Å; R75-L77 HydrophobicContact CB-CG 3.82Å; R75-L77 PolarHBondContact O-N 3Å; R75-L77 VanDerWaalsContact O-N 3.16Å; L77-V79 PolarHBondContact O-N 2.89Å
78	Q	91.3	Very high	92.3	Very high	54 Å²	54	65.3 Å²	65.3	25%	0.252	33%	0.327	S	S	.	.	P	Polyproline II helix	trans	-70.7	120.3	174.7	-176.6	-174.4	56.9	0	0	110.1	M42 Y49 S53	M42-Q78 HydrophobicContact CE-CG 4.23Å; M42-Q78 PolarHBondContact SD-NE2 2.89Å; Y49-Q78 VanDerWaalsContact CA-OE1 3.3Å; Y49-Q78 HydrophobicContact CD1-CG 4.34Å; S53-Q78 WeakPolarHBondContact CB-O 3.38Å; S53-Q78 WeakPolarHBondContact OG-CB 3.28Å; S53-Q78 PolarHBondContact OG-N 2.95Å; S53-Q78 PolarHBondContact OG-O 3.41Å
79	V	92.9	Very high	92	Very high	40 Å²	40	68.7 Å²	68.7	24%	0.242	34%	0.342	C	S	.	.	P	Polyproline II helix	trans	-76.2	127.4	-176	-177.2	0	0	0	0	110.9	Y68 V69 A72 L77 I81	Y68-V79 HydrophobicContact CD1-CG1 4.26Å; Y68-V79 HydrophobicContact CE1-CG1 3.65Å; V69-V79 HydrophobicContact CB-CG1 4.32Å; V69-V79 HydrophobicContact CG1-CG1 4.37Å; V69-V79 HydrophobicContact CG1-CG2 4.47Å; V69-V79 HydrophobicContact CG2-CG1 3.71Å; A72-V79 HydrophobicContact CB-CG2 3.78Å; L77-V79 PolarHBondContact O-N 2.89Å; V79-I81 PolarHBondContact O-N 2.79Å
80	V	93.1	Very high	91.7	Very high	0 Å²	0	69 Å²	69	0%	0	34%	0.342	C	S	.	.	P	Polyproline II helix	trans	-69.1	117.7	168.6	178.6	0	0	0	0	109.8	Y49 F57 H65 Y68 D84 R85 L88	Y49-V80 HydrophobicContact CD1-CG2 4.21Å; Y49-V80 HydrophobicContact CE1-CB 4.37Å; Y49-V80 HydrophobicContact CE1-CG2 4.18Å; F57-V80 HydrophobicContact CB-CB 4.47Å; F57-V80 HydrophobicContact CB-CG2 3.87Å; F57-V80 HydrophobicContact CD2-CB 4.29Å; F57-V80 HydrophobicContact CG-CB 4.31Å; F57-V80 HydrophobicContact CG-CG2 4.08Å; H65-V80 PolarHBondContact CE1-O 3.39Å; H65-V80 VanDerWaalsContact CE1-O 3.26Å; Y68-V80 HydrophobicContact CE1-CB 4.4Å; Y68-V80 PolarHBondContact OH-N 3.21Å; V80-D84 HydrophobicContact CG1-CB 4.15Å; V80-R85 HydrophobicContact CG1-CG 4.17Å; V80-L88 HydrophobicContact CG1-CD2 3.83Å; V80-L88 HydrophobicContact CG2-CD2 4.09Å
81	I	92.7	Very high	91.4	Very high	42 Å²	42	62 Å²	62	22%	0.215	31%	0.312	C	S	.	.	P	Polyproline II helix	trans	-71	147.4	-172.1	-46.4	170.6	0	0	0	110.1	M42 N44 Y49 V79 P83 D84 R85	M42-I81 HydrophobicContact CE-CD1 4.31Å; N44-I81 HydrophobicContact CB-CD1 4.07Å; N44-I81 WeakPolarHBondContact ND2-CD1 3.18Å; N44-I81 WeakPolarHBondContact OD1-CD1 3.29Å; Y49-I81 WeakPolarHBondContact OH-CG1 3.42Å; Y49-I81 PolarHBondContact OH-N 3.14Å; V79-I81 PolarHBondContact O-N 2.79Å; I81-P83 VanDerWaalsContact C-CD 3.45Å; I81-P83 VanDerWaalsContact CG2-CD 3.5Å; I81-P83 HydrophobicContact CG2-CG 4.49Å; I81-D84 WeakPolarHBondContact O-CB 3.45Å; I81-D84 PolarHBondContact O-N 3.36Å; I81-R85 PolarHBondContact O-N 2.76Å
82	R	91.5	Very high	91.2	Very high	168 Å²	168	58.6 Å²	58.6	63%	0.634	30%	0.296	S	S	*	.	H	α-helix	trans	-46.9	-44.6	-177.1	-160.8	175.7	179.9	115.7	1	115.9	D84	R82-D84 PolarHBondContact O-N 3.4Å
83	P	90.4	Very high	90.8	Very high	58 Å²	58	60.9 Å²	60.9	38%	0.377	31%	0.31	S	S	.	.	H	α-helix	trans	-64.1	-18.8	178.6	-22.3	35.6	0	0	0	114.2	W43 I81 P87	W43-P83 HydrophobicContact CD2-CB 4.41Å; W43-P83 HydrophobicContact CG-CB 4.3Å; W43-P83 HydrophobicContact CG-CG 4.36Å; I81-P83 VanDerWaalsContact C-CD 3.45Å; I81-P83 VanDerWaalsContact CG2-CD 3.5Å; I81-P83 HydrophobicContact CG2-CG 4.49Å; P83-P87 WeakPolarHBondContact O-CD 3.38Å
84	D	91.4	Very high	90.2	Very high	0 Å²	0	60.9 Å²	60.9	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-100.2	-20.6	-170.7	-61.2	3.6	0	0	0	111.5	F40 W43 Y49 V80 I81 R82 K86 P87 L88 R103	F40-D84 HydrophobicContact CE1-CB 4.12Å; W43-D84 VanDerWaalsContact CB-OD1 3.31Å; W43-D84 WeakPolarHBondContact CB-OD1 3.36Å; W43-D84 PolarHBondContact N-OD2 3.44Å; Y49-D84 HydrophobicContact CE2-CB 4.35Å; Y49-D84 WeakPolarHBondContact CE2-OD2 3.48Å; Y49-D84 PolarHBondContact OH-OD2 3.4Å; V80-D84 HydrophobicContact CG1-CB 4.15Å; I81-D84 WeakPolarHBondContact O-CB 3.45Å; I81-D84 PolarHBondContact O-N 3.36Å; R82-D84 PolarHBondContact O-N 3.4Å; D84-K86 PolarHBondContact O-N 3.37Å; D84-P87 WeakPolarHBondContact O-CD 3.19Å; D84-L88 WeakPolarHBondContact O-CB 3.35Å; D84-L88 PolarHBondContact O-N 2.82Å; D84-R103 IonicContact OD1-CZ 3.74Å; D84-R103 IonicContact OD1-NH1 3.35Å; D84-R103 PolarHBondContact OD1-NH1 2.76Å; D84-R103 IonicContact OD1-NH2 3.4Å; D84-R103 PolarHBondContact OD1-NH2 3.48Å; D84-R103 IonicContact OD2-NH1 3.91Å; D84-R103 PolarHBondContact OD2-NH1 2.86Å
85	R	92	Very high	88.8	Confident	25 Å²	25	63.9 Å²	63.9	9%	0.094	30%	0.301	C	S	.	.	H	α-helix	trans	-53.6	-52.6	-178	-67.6	-179	77.1	86	-6.7	112.2	F57 L63 H65 Y68 V80 I81 L88 E89	F57-R85 HydrophobicContact CE2-CB 3.99Å; F57-R85 HydrophobicContact CE2-CG 3.8Å; F57-R85 HydrophobicContact CZ-CB 3.96Å; F57-R85 HydrophobicContact CZ-CG 4.24Å; F57-R85 WeakPolarHBondContact CZ-O 3.35Å; L63-R85 PolarHBondContact O-NH2 3.04Å; H65-R85 WeakPolarHBondContact ND1-CD 3.45Å; H65-R85 PolarHBondContact ND1-NH1 3.28Å; H65-R85 VanDerWaalsContact ND1-NH1 3.12Å; Y68-R85 VanDerWaalsContact CG-NH1 3.31Å; V80-R85 HydrophobicContact CG1-CG 4.17Å; I81-R85 PolarHBondContact O-N 2.76Å; R85-L88 PolarHBondContact O-N 2.87Å; R85-E89 WeakPolarHBondContact O-CB 3.3Å; R85-E89 PolarHBondContact O-N 3.17Å
86	K	89	Confident	87.3	Confident	150 Å²	150	65.4 Å²	65.4	65%	0.652	31%	0.312	S	S	*	.	H	α-helix	trans	-67.4	-51.4	-176.2	-177.7	176.2	-175.9	170.3	0	112	D84 L88 E89 D90	D84-K86 PolarHBondContact O-N 3.37Å; K86-L88 VanDerWaalsContact C-N 3.28Å; K86-L88 PolarHBondContact O-N 2.68Å; K86-E89 PolarHBondContact O-N 2.96Å; K86-D90 VanDerWaalsContact O-CB 3.31Å; K86-D90 WeakPolarHBondContact O-CB 3.37Å; K86-D90 PolarHBondContact O-N 3.02Å
87	P	89.4	Confident	85.9	Confident	40 Å²	40	59.1 Å²	59.1	26%	0.26	28%	0.283	S	S	.	.	H	α-helix	trans	-58.4	-35.6	174.9	-25.6	33.4	0	0	0	114.6	F40 P83 D84 Y91	F40-P87 HydrophobicContact CZ-CB 4.48Å; P83-P87 WeakPolarHBondContact O-CD 3.38Å; D84-P87 WeakPolarHBondContact O-CD 3.19Å; P87-Y91 WeakPolarHBondContact O-CB 3.24Å; P87-Y91 PolarHBondContact O-N 3.4Å; P87-Y91 VanDerWaalsContact O-N 3.13Å
88	L	90.5	Very high	84.2	Confident	0 Å²	0	67.2 Å²	67.2	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-74.6	-42.2	179.5	-176.5	61.7	0	0	0	111.8	L5 F40 V54 F57 V80 D84 R85 K86 Y91 L92	L5-L88 HydrophobicContact CD1-CD1 4.34Å; F40-L88 HydrophobicContact CD1-CD1 4.5Å; F40-L88 HydrophobicContact CD2-CD1 3.6Å; F40-L88 HydrophobicContact CE2-CB 4.08Å; F40-L88 HydrophobicContact CE2-CD1 3.74Å; F40-L88 HydrophobicContact CG-CD1 3.99Å; F40-L88 HydrophobicContact CZ-CB 3.97Å; F40-L88 HydrophobicContact CZ-CD1 4.24Å; V54-L88 HydrophobicContact CG1-CD1 4.14Å; V54-L88 HydrophobicContact CG1-CD2 4.06Å; V54-L88 HydrophobicContact CG1-CG 4.34Å; V54-L88 HydrophobicContact CG2-CD2 4.37Å; F57-L88 HydrophobicContact CD1-CD2 3.83Å; F57-L88 HydrophobicContact CD1-CG 4.29Å; F57-L88 HydrophobicContact CE1-CB 4.33Å; F57-L88 HydrophobicContact CE1-CD2 4Å; F57-L88 HydrophobicContact CE1-CG 4.11Å; V80-L88 HydrophobicContact CG1-CD2 3.83Å; V80-L88 HydrophobicContact CG2-CD2 4.09Å; D84-L88 WeakPolarHBondContact O-CB 3.35Å; D84-L88 PolarHBondContact O-N 2.82Å; R85-L88 PolarHBondContact O-N 2.87Å; K86-L88 VanDerWaalsContact C-N 3.28Å; K86-L88 PolarHBondContact O-N 2.68Å; L88-Y91 PolarHBondContact O-N 2.83Å; L88-L92 HydrophobicContact CD1-CD1 4.33Å; L88-L92 HydrophobicContact CG-CD1 4.22Å; L88-L92 VanDerWaalsContact O-CG 3.31Å; L88-L92 WeakPolarHBondContact O-CG 3.44Å; L88-L92 PolarHBondContact O-N 3.08Å
89	E	90.2	Very high	82.7	Confident	70 Å²	70	70 Å²	70	33%	0.327	34%	0.342	S	S	.	.	H	α-helix	trans	-62	-50.1	173.9	-177.6	171	-163.5	0	0	110.8	F57 R85 K86 Y91 L92 T93	F57-E89 HydrophobicContact CE1-CB 4.28Å; F57-E89 HydrophobicContact CZ-CB 4.21Å; R85-E89 WeakPolarHBondContact O-CB 3.3Å; R85-E89 PolarHBondContact O-N 3.17Å; K86-E89 PolarHBondContact O-N 2.96Å; E89-Y91 PolarHBondContact O-N 2.85Å; E89-L92 PolarHBondContact O-N 3.04Å; E89-T93 HydrophobicContact CG-CG2 4.37Å; E89-T93 PolarHBondContact O-N 2.76Å; E89-T93 PolarHBondContact O-OG1 3.41Å
90	D	88.7	Confident	81.3	Confident	57 Å²	57	70.7 Å²	70.7	31%	0.305	35%	0.351	S	S	.	.	H	α-helix	trans	-55.9	-39.6	177	-73	-23.8	0	0	0	111.2	K86 N94	K86-D90 VanDerWaalsContact O-CB 3.31Å; K86-D90 WeakPolarHBondContact O-CB 3.37Å; K86-D90 PolarHBondContact O-N 3.02Å; D90-N94 WeakPolarHBondContact CA-ND2 3.37Å; D90-N94 WeakPolarHBondContact O-CB 3.31Å; D90-N94 PolarHBondContact O-N 2.8Å; D90-N94 VanDerWaalsContact O-N 3.09Å; D90-N94 PolarHBondContact O-ND2 2.92Å
91	Y	88.5	Confident	80.1	Confident	15 Å²	15	71.7 Å²	71.7	6%	0.059	36%	0.358	C	S	.	.	H	α-helix	trans	-67.5	-40.3	176.5	-178.8	-106.2	0	0	0	113.1	L5 R9 P87 L88 E89 L97 P101 I104	L5-Y91 HydrophobicContact CD2-CD1 4.17Å; L5-Y91 HydrophobicContact CD2-CE1 3.84Å; L5-Y91 HydrophobicContact CG-CD1 4.37Å; L5-Y91 HydrophobicContact CG-CE1 3.92Å; R9-Y91 HydrophobicContact CB-CE1 4.42Å; R9-Y91 WeakPolarHBondContact CD-O 3.41Å; R9-Y91 WeakPolarHBondContact CG-O 3.37Å; R9-Y91 PolarHBondContact NE-O 3.14Å; P87-Y91 WeakPolarHBondContact O-CB 3.24Å; P87-Y91 PolarHBondContact O-N 3.4Å; P87-Y91 VanDerWaalsContact O-N 3.13Å; L88-Y91 PolarHBondContact O-N 2.83Å; E89-Y91 PolarHBondContact O-N 2.85Å; Y91-L97 HydrophobicContact CD2-CD2 4.25Å; Y91-P101 VanDerWaalsContact CD2-CD 3.41Å; Y91-P101 HydrophobicContact CD2-CG 3.97Å; Y91-P101 HydrophobicContact CG-CG 4.15Å; Y91-I104 HydrophobicContact CD1-CD1 3.87Å; Y91-I104 HydrophobicContact CD2-CD1 3.63Å; Y91-I104 HydrophobicContact CE1-CD1 3.6Å; Y91-I104 HydrophobicContact CE2-CD1 3.33Å; Y91-I104 HydrophobicContact CG-CD1 3.88Å
92	L	88.6	Confident	79	Confident	0 Å²	0	77.1 Å²	77.1	0%	0	39%	0.393	C	S	.	.	H	α-helix	trans	-77.6	-30.9	-176.3	-70.1	171.9	0	0	0	113.2	L5 M8 R9 V54 L58 L88 E89	L5-L92 HydrophobicContact CD1-CD2 4.09Å; M8-L92 HydrophobicContact CE-CD1 4.46Å; M8-L92 HydrophobicContact CE-CD2 4.05Å; M8-L92 HydrophobicContact CG-CD2 4.42Å; R9-L92 HydrophobicContact CB-CD2 4.15Å; V54-L92 HydrophobicContact CG1-CD1 3.82Å; L58-L92 HydrophobicContact CD1-CB 4.46Å; L58-L92 HydrophobicContact CD1-CD1 4.29Å; L88-L92 HydrophobicContact CD1-CD1 4.33Å; L88-L92 HydrophobicContact CG-CD1 4.22Å; L88-L92 VanDerWaalsContact O-CG 3.31Å; L88-L92 WeakPolarHBondContact O-CG 3.44Å; L88-L92 PolarHBondContact O-N 3.08Å; E89-L92 PolarHBondContact O-N 3.04Å
93	T	87.2	Confident	78.4	Confident	47 Å²	47	71.1 Å²	71.1	29%	0.288	37%	0.37	S	S	.	.	H	α-helix	trans	-98.2	-32.4	-175.9	60.2	0	0	0	0	113.9	E89 E95	E89-T93 HydrophobicContact CG-CG2 4.37Å; E89-T93 PolarHBondContact O-N 2.76Å; E89-T93 PolarHBondContact O-OG1 3.41Å; T93-E95 PolarHBondContact O-N 3.25Å
94	N	79.8	Confident	78.1	Confident	63 Å²	63	69.8 Å²	69.8	34%	0.337	36%	0.36	S	S	.	.			trans	-84.3	121.6	-171.1	-59.8	-30.8	0	0	0	110.9	R9 D90 K96 L97	R9-N94 PolarHBondContact NH2-O 3.36Å; D90-N94 WeakPolarHBondContact CA-ND2 3.37Å; D90-N94 WeakPolarHBondContact O-CB 3.31Å; D90-N94 PolarHBondContact O-N 2.8Å; D90-N94 VanDerWaalsContact O-N 3.09Å; D90-N94 PolarHBondContact O-ND2 2.92Å; N94-K96 VanDerWaalsContact C-N 3.34Å; N94-L97 HydrophobicContact CB-CD1 3.72Å
95	E	65.3	Low	77.6	Confident	148 Å²	148	72.2 Å²	72.2	69%	0.692	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-38.8	175.8	-166.7	177.9	-174.5	0	0	111.5	R9 I13 T93	R9-E95 PolarHBondContact NH2-O 2.93Å; I13-E95 HydrophobicContact CG2-CB 4.25Å; I13-E95 HydrophobicContact CG2-CG 4.04Å; T93-E95 PolarHBondContact O-N 3.25Å
96	K	59.4	Low	76.8	Confident	185 Å²	185	75.3 Å²	75.3	80%	0.804	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.5	51	-171.7	-62.1	-176.3	-179.5	-180	0	114.2	N94 E98	N94-K96 VanDerWaalsContact C-N 3.34Å; K96-E98 PolarHBondContact O-N 2.85Å
97	L	61.4	Low	76.2	Confident	54 Å²	54	74.6 Å²	74.6	28%	0.283	40%	0.401	S	S	.	.			trans	-84.3	97.2	163.6	-118.2	85.6	0	0	0	108.6	Y91 N94 T99	Y91-L97 HydrophobicContact CD2-CD2 4.25Å; N94-L97 HydrophobicContact CB-CD1 3.72Å; L97-T99 VanDerWaalsContact CD2-O 3.31Å; L97-T99 WeakPolarHBondContact CD2-O 3.46Å; L97-T99 PolarHBondContact O-N 2.92Å
98	E	55.3	Low	75.5	Confident	196 Å²	196	73 Å²	73	92%	0.916	39%	0.39	S	S	*	.	S	Bend	trans	-65.7	-16.6	175.1	-66.3	-165.7	167.4	0	0	112.6	K96	K96-E98 PolarHBondContact O-N 2.85Å
99	T	59.4	Low	74.5	Confident	113 Å²	113	76.7 Å²	76.7	69%	0.693	42%	0.415	S	S	*	.	S	Bend	trans	-134.5	123.4	178.6	-54.7	0	0	0	0	109.2	L97	L97-T99 VanDerWaalsContact CD2-O 3.31Å; L97-T99 WeakPolarHBondContact CD2-O 3.46Å; L97-T99 PolarHBondContact O-N 2.92Å
100	A	63.2	Low	73.6	Confident	53 Å²	53	77.6 Å²	77.6	44%	0.438	42%	0.418	S	S	.	.			trans	-55.6	140.4	171.7	0	0	0	0	0	109.8	T102 I104	A100-T102 PolarHBondContact O-N 3.23Å; A100-I104 HydrophobicContact CB-CD1 4.38Å
101	P	67.9	Low	72.9	Confident	22 Å²	22	75.9 Å²	75.9	14%	0.143	41%	0.41	C	S	.	.			trans	-54.4	141.5	175	21.7	-32	0	0	0	109.3	F40 Y91 R103 I104	F40-P101 HydrophobicContact CE2-CG 4.35Å; Y91-P101 VanDerWaalsContact CD2-CD 3.41Å; Y91-P101 HydrophobicContact CD2-CG 3.97Å; Y91-P101 HydrophobicContact CG-CG 4.15Å; P101-R103 PolarHBondContact O-N 2.9Å; P101-I104 HydrophobicContact CG-CD1 3.62Å; P101-I104 HydrophobicContact CG-CG1 3.89Å; P101-I104 PolarHBondContact O-N 3.37Å
102	T	69.4	Low	72.5	Confident	155 Å²	155	81.5 Å²	81.5	95%	0.951	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.2	-8	-176	14.1	0	0	0	0	115	A100	A100-T102 PolarHBondContact O-N 3.23Å
103	R	79.3	Confident	72.2	Confident	42 Å²	42	85.2 Å²	85.2	16%	0.158	46%	0.457	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.9	-4.9	-178.6	-64.2	173.5	173.7	-137.9	33.9	114.5	F40 L41 W43 D84 P101 D105	F40-R103 HydrophobicContact CE1-CB 4.4Å; F40-R103 HydrophobicContact CZ-CB 4.29Å; L41-R103 WeakPolarHBondContact CB-O 3.35Å; L41-R103 PolarHBondContact N-O 2.86Å; W43-R103 VanDerWaalsContact CA-NH1 3.27Å; W43-R103 VanDerWaalsContact CB-NH1 3.32Å; D84-R103 IonicContact OD1-CZ 3.74Å; D84-R103 IonicContact OD1-NH1 3.35Å; D84-R103 PolarHBondContact OD1-NH1 2.76Å; D84-R103 IonicContact OD1-NH2 3.4Å; D84-R103 PolarHBondContact OD1-NH2 3.48Å; D84-R103 IonicContact OD2-NH1 3.91Å; D84-R103 PolarHBondContact OD2-NH1 2.86Å; P101-R103 PolarHBondContact O-N 2.9Å; R103-D105 PolarHBondContact O-N 3.21Å
104	I	83.7	Confident	72.1	Confident	31 Å²	31	85 Å²	85	16%	0.159	46%	0.456	C	S	.	.	B	Isolated β-bridge	trans	-82.6	115	171.8	-68	176.8	0	0	0	108	L5 N39 F40 Y91 A100 P101	L5-I104 HydrophobicContact CD2-CD1 4.44Å; N39-I104 WeakPolarHBondContact ND2-CG2 3.46Å; N39-I104 WeakPolarHBondContact O-CA 3.47Å; F40-I104 HydrophobicContact CD2-CG1 3.98Å; Y91-I104 HydrophobicContact CD1-CD1 3.87Å; Y91-I104 HydrophobicContact CD2-CD1 3.63Å; Y91-I104 HydrophobicContact CE1-CD1 3.6Å; Y91-I104 HydrophobicContact CE2-CD1 3.33Å; Y91-I104 HydrophobicContact CG-CD1 3.88Å; A100-I104 HydrophobicContact CB-CD1 4.38Å; P101-I104 HydrophobicContact CG-CD1 3.62Å; P101-I104 HydrophobicContact CG-CG1 3.89Å; P101-I104 PolarHBondContact O-N 3.37Å
105	D	81.1	Confident	72.2	Confident	51 Å²	51	85.5 Å²	85.5	27%	0.273	46%	0.458	S	S	.	.			trans	-92.8	117.4	177.2	-173.9	1.9	0	0	0	109.5	N39 Y48 R103 N107 A108	N39-D105 PolarHBondContact O-N 2.58Å; Y48-D105 HydrophobicContact CE1-CB 3.92Å; Y48-D105 PolarHBondContact OH-OD2 3.11Å; R103-D105 PolarHBondContact O-N 3.21Å; D105-N107 PolarHBondContact O-N 2.63Å; D105-N107 WeakPolarHBondContact OD1-CB 2.92Å; D105-N107 PolarHBondContact OD1-N 3.4Å; D105-A108 PolarHBondContact O-N 2.75Å
106	C	76	Confident	72.9	Confident	89 Å²	89	79.1 Å²	79.1	60%	0.601	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.6	-13.5	177.2	57.3	0	0	0	0	113.3	Y3	Y3-C106 PolarHBondContact OH-O 3.1Å
107	N	74.9	Confident	73.7	Confident	136 Å²	136	76.9 Å²	76.9	73%	0.727	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.9	10.2	179.8	-58.5	-48	0	0	0	113.4	D105	D105-N107 PolarHBondContact O-N 2.63Å; D105-N107 WeakPolarHBondContact OD1-CB 2.92Å; D105-N107 PolarHBondContact OD1-N 3.4Å
108	A	75.5	Confident	74.3	Confident	5 Å²	5	79.6 Å²	79.6	4%	0.041	44%	0.437	C	S	.	.	S	Bend	trans	-58.1	149.9	178.3	0	0	0	0	0	111.5	N39 Y48 D105 F110	N39-A108 HydrophobicContact CB-CB 3.65Å; Y48-A108 HydrophobicContact CD1-CB 4.17Å; Y48-A108 HydrophobicContact CE1-CB 3.66Å; Y48-A108 HydrophobicContact CE2-CB 4.36Å; D105-A108 PolarHBondContact O-N 2.75Å; A108-F110 PolarHBondContact O-N 2.92Å
109	P	70.2	Confident	75	Confident	79 Å²	79	70.8 Å²	70.8	51%	0.513	40%	0.397	S	S	.	.	P	Polyproline II helix	trans	-52	127.2	178.6	-24.8	32.9	0	0	0	111.5	Y48	Y48-P109 HydrophobicContact CE2-CG 4.39Å
110	F	71.1	Confident	75.4	Confident	88 Å²	88	71.6 Å²	71.6	39%	0.386	39%	0.387	S	S	.	.	P	Polyproline II helix	trans	-69	138.9	176.7	-172.2	-99.3	0	0	0	110.1	M1 A108	M1-F110 HydrophobicContact SD-CD2 4.31Å; M1-F110 HydrophobicContact SD-CE2 4.06Å; A108-F110 PolarHBondContact O-N 2.92Å
111	C	73.8	Confident	75.4	Confident	22 Å²	22	73.1 Å²	73.1	15%	0.149	39%	0.394	C	S	.	.			trans	-111	125.4	178.5	-175.3	0	0	0	0	109.7	C36	C36-C111 HydrophobicContact CB-CB 4.31Å; C36-C111 WeakPolarHBondContact CB-SG 3.44Å; C36-C111 WeakPolarHBondContact SG-CB 3.18Å; C36-C111 CovalentContact SG-SG 2Å; C36-C111 PolarHBondContact SG-SG 3Å
112	N	79.6	Confident	74.9	Confident	133 Å²	133	76.4 Å²	76.4	71%	0.711	41%	0.413	S	S	*	.			trans	-68.1	139.4	178.9	-65.9	-25.4	0	0	0	110.2
113	F	83.2	Confident	74	Confident	78 Å²	78	73.3 Å²	73.3	34%	0.342	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	156.9	168.5	62.9	-87	0	0	0	109.7	K30 A31 F32 L115	K30-F113 HydrophobicContact CB-CB 4.27Å; K30-F113 HydrophobicContact CB-CD2 4.03Å; K30-F113 HydrophobicContact CB-CG 4.31Å; K30-F113 HydrophobicContact CD-CD1 4.35Å; K30-F113 HydrophobicContact CD-CD2 3.84Å; K30-F113 HydrophobicContact CD-CE1 4.47Å; K30-F113 HydrophobicContact CD-CE2 3.96Å; K30-F113 HydrophobicContact CD-CG 4.06Å; K30-F113 HydrophobicContact CD-CZ 4.28Å; K30-F113 HydrophobicContact CG-CD2 3.67Å; K30-F113 HydrophobicContact CG-CE2 3.98Å; K30-F113 HydrophobicContact CG-CG 4.23Å; A31-F113 CarbonylContact O-C 3.56Å; A31-F113 VanDerWaalsContact O-CA 3.31Å; A31-F113 WeakPolarHBondContact O-CA 3.36Å; F32-F113 HydrophobicContact CD1-CB 3.91Å; F32-F113 HydrophobicContact CE1-CB 3.62Å; F32-F113 HydrophobicContact CE1-CD1 4.5Å; F32-F113 HydrophobicContact CE1-CG 4.5Å; F32-F113 HydrophobicContact CE2-CB 4.33Å; F32-F113 HydrophobicContact CG-CB 4.41Å; F32-F113 HydrophobicContact CZ-CB 3.85Å; F113-L115 HydrophobicContact CD2-CD2 4.48Å; F113-L115 HydrophobicContact CE2-CD2 4.11Å
114	V	83.8	Confident	72.3	Confident	43 Å²	43	76.9 Å²	76.9	26%	0.261	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	145.6	170.7	-179	0	0	0	0	107.5	Y24 A31 E118 L119	Y24-V114 HydrophobicContact CE1-CG2 4.24Å; A31-V114 PolarHBondContact N-O 3.16Å; A31-V114 PolarHBondContact O-N 2.93Å; V114-E118 HydrophobicContact CG1-CB 4.03Å; V114-L119 HydrophobicContact CB-CD1 3.91Å; V114-L119 HydrophobicContact CG1-CB 4.42Å; V114-L119 HydrophobicContact CG1-CD1 3.91Å; V114-L119 HydrophobicContact CG1-CG 4.11Å
115	L	83.8	Confident	70.1	Confident	73 Å²	73	81.2 Å²	81.2	38%	0.382	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	140.1	173.4	-68.4	173.7	0	0	0	109.8	D29 F113 D117 E118 L119	D29-L115 WeakPolarHBondContact O-CA 3.34Å; F113-L115 HydrophobicContact CD2-CD2 4.48Å; F113-L115 HydrophobicContact CE2-CD2 4.11Å; L115-D117 PolarHBondContact O-N 3.34Å; L115-E118 HydrophobicContact CB-CG 4.27Å; L115-E118 WeakPolarHBondContact O-CA 3.46Å; L115-E118 WeakPolarHBondContact O-CB 3.16Å; L115-E118 PolarHBondContact O-N 3.32Å; L115-L119 PolarHBondContact O-N 3.39Å; L115-L119 VanDerWaalsContact O-N 3.07Å
116	V	79.1	Confident	68.2	Low	13 Å²	13	85 Å²	85	8%	0.079	48%	0.478	C	S	.	.	H	α-helix	trans	-59	-35.4	-176.2	173.3	0	0	0	0	112.2	I26 G28 D29 A31 E118 L119 R120	I26-V116 HydrophobicContact CB-CG2 4.37Å; I26-V116 HydrophobicContact CD1-CG2 4.47Å; I26-V116 HydrophobicContact CG1-CG2 4.21Å; I26-V116 HydrophobicContact CG2-CG2 3.39Å; G28-V116 WeakPolarHBondContact O-CG2 3.1Å; D29-V116 PolarHBondContact O-N 2.64Å; A31-V116 HydrophobicContact CB-CG2 4.38Å; V116-E118 VanDerWaalsContact C-N 3.28Å; V116-E118 PolarHBondContact O-N 2.89Å; V116-L119 WeakPolarHBondContact O-CB 3.42Å; V116-L119 PolarHBondContact O-N 2.95Å; V116-L119 VanDerWaalsContact O-N 3.1Å; V116-R120 HydrophobicContact CG1-CG 4.13Å; V116-R120 VanDerWaalsContact CG1-NE 3.34Å; V116-R120 WeakPolarHBondContact O-CG 3.24Å; V116-R120 PolarHBondContact O-N 3.35Å
117	D	76.8	Confident	66.5	Low	138 Å²	138	85.6 Å²	85.6	74%	0.738	48%	0.484	S	S	*	.	H	α-helix	trans	-61.2	-37.2	175.6	-67.9	-22.9	0	0	0	112.1	L115 S121	L115-D117 PolarHBondContact O-N 3.34Å; D117-S121 PolarHBondContact O-N 3.24Å
118	E	74	Confident	64.8	Low	112 Å²	112	88.2 Å²	88.2	52%	0.523	49%	0.492	S	S	.	.	H	α-helix	trans	-70.5	-37.2	174.4	-63.9	179.1	155.8	0	0	111	V114 L115 V116 S121 V122	V114-E118 HydrophobicContact CG1-CB 4.03Å; L115-E118 HydrophobicContact CB-CG 4.27Å; L115-E118 WeakPolarHBondContact O-CA 3.46Å; L115-E118 WeakPolarHBondContact O-CB 3.16Å; L115-E118 PolarHBondContact O-N 3.32Å; V116-E118 VanDerWaalsContact C-N 3.28Å; V116-E118 PolarHBondContact O-N 2.89Å; E118-S121 PolarHBondContact O-N 2.74Å; E118-S121 PolarHBondContact O-OG 3.48Å; E118-V122 WeakPolarHBondContact O-CG2 3.19Å
119	L	70	Confident	63	Low	11 Å²	11	93.4 Å²	93.4	6%	0.058	53%	0.525	C	S	.	.	H	α-helix	trans	-69.5	-44.8	-178.4	-122.8	150.4	0	0	0	112.9	Y24 A31 V114 L115 V116 S121 V122 L123	Y24-L119 HydrophobicContact CD1-CD1 3.74Å; Y24-L119 HydrophobicContact CD2-CD1 4.24Å; Y24-L119 HydrophobicContact CD2-CD2 3.65Å; Y24-L119 HydrophobicContact CD2-CG 4.47Å; Y24-L119 HydrophobicContact CE1-CD1 4.11Å; Y24-L119 HydrophobicContact CE2-CD2 3.96Å; Y24-L119 HydrophobicContact CG-CD1 3.8Å; Y24-L119 HydrophobicContact CG-CD2 4.01Å; Y24-L119 HydrophobicContact CG-CG 4.5Å; A31-L119 HydrophobicContact CB-CD1 3.14Å; V114-L119 HydrophobicContact CB-CD1 3.91Å; V114-L119 HydrophobicContact CG1-CB 4.42Å; V114-L119 HydrophobicContact CG1-CD1 3.91Å; V114-L119 HydrophobicContact CG1-CG 4.11Å; L115-L119 PolarHBondContact O-N 3.39Å; L115-L119 VanDerWaalsContact O-N 3.07Å; V116-L119 WeakPolarHBondContact O-CB 3.42Å; V116-L119 PolarHBondContact O-N 2.95Å; V116-L119 VanDerWaalsContact O-N 3.1Å; L119-S121 PolarHBondContact O-N 3.02Å; L119-V122 PolarHBondContact O-N 3.3Å; L119-V122 VanDerWaalsContact O-N 3.13Å; L119-L123 HydrophobicContact CD2-CD1 4.33Å
120	R	67.7	Low	61.3	Low	130 Å²	130	95.6 Å²	95.6	49%	0.491	54%	0.539	S	S	.	.	H	α-helix	trans	-65.1	-24.9	177.5	-69.5	-179.6	-175.7	-75.7	-15.2	112.2	E21 V116 V122	E21-R120 IonicContact OE1-CZ 2.64Å; E21-R120 IonicContact OE1-NH1 2.69Å; E21-R120 PolarHBondContact OE1-NH1 3.25Å; E21-R120 IonicContact OE1-NH2 2.91Å; E21-R120 PolarHBondContact OE1-NH2 3.17Å; E21-R120 IonicContact OE2-NH2 2.79Å; V116-R120 HydrophobicContact CG1-CG 4.13Å; V116-R120 VanDerWaalsContact CG1-NE 3.34Å; V116-R120 WeakPolarHBondContact O-CG 3.24Å; V116-R120 PolarHBondContact O-N 3.35Å; R120-V122 PolarHBondContact O-N 3.08Å
121	S	61.9	Low	59.7	Low	85 Å²	85	96.9 Å²	96.9	59%	0.594	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.1	-12.4	176.1	79.2	0	0	0	0	114.5	D117 E118 L119	D117-S121 PolarHBondContact O-N 3.24Å; E118-S121 PolarHBondContact O-N 2.74Å; E118-S121 PolarHBondContact O-OG 3.48Å; L119-S121 PolarHBondContact O-N 3.02Å
122	V	57.7	Low	58	Low	90 Å²	90	101.8 Å²	101.8	55%	0.545	59%	0.585	S	S	.	*	T	Hydrogen-bonded Turn	trans	-111.2	-13.3	-173.6	-178.4	0	0	0	0	112.9	E118 L119 R120	E118-V122 WeakPolarHBondContact O-CG2 3.19Å; L119-V122 PolarHBondContact O-N 3.3Å; L119-V122 VanDerWaalsContact O-N 3.13Å; R120-V122 PolarHBondContact O-N 3.08Å
123	L	50.7	Low	55.8	Low	90 Å²	90	103.9 Å²	103.9	47%	0.471	59%	0.591	S	S	.	*	S	Bend	trans	-91.2	128.6	-180	-66.2	177.3	0	0	0	111.9	L119 C125	L119-L123 HydrophobicContact CD2-CD1 4.33Å; L123-C125 PolarHBondContact O-N 3.06Å
124	P	42.9	Very low	53.7	Low	117 Å²	117	109.7 Å²	109.7	76%	0.76	62%	0.619	S	S	*	*	P	Polyproline II helix	trans	-70.6	126.2	172.9	-9.6	24.8	0	0	0	110.6
125	C	38.2	Very low	51.2	Low	122 Å²	122	116.8 Å²	116.8	82%	0.824	65%	0.65	S	S	*	*	P	Polyproline II helix	trans	-61.1	132.3	172.2	-85.8	0	0	0	0	111.4	L123 S127	L123-C125 PolarHBondContact O-N 3.06Å; C125-S127 PolarHBondContact O-N 3.27Å
126	P	41.8	Very low	49.1	Very low	131 Å²	131	118.9 Å²	118.9	85%	0.851	67%	0.67	S	S	*	*			trans	-93.5	93.7	175.2	33.9	-27.7	0	0	0	110.6
127	S	39.1	Very low	47.1	Very low	102 Å²	102	128 Å²	128	71%	0.713	71%	0.709	S	S	*	*			trans	-168.7	90.1	160.2	56.2	0	0	0	0	111.6	C125	C125-S127 PolarHBondContact O-N 3.27Å
128	E	40.7	Very low	45.3	Very low	191 Å²	191	132.9 Å²	132.9	89%	0.893	72%	0.717	S	S	*	*			trans	-179.9	142.1	140.3	-102.7	174.1	176.3	0	0	110.6
129	P	37.4	Very low	43.6	Very low	114 Å²	114	133 Å²	133	74%	0.74	73%	0.728	S	S	*	*			trans	-82.2	156	-172.9	34.3	-33.1	0	0	0	112.3
130	P	35.2	Very low	41.9	Very low	125 Å²	125	144.6 Å²	144.6	81%	0.812	77%	0.77	S	S	*	*			trans	-87.6	150.8	-167.4	35.5	-33.1	0	0	0	112.7
131	P	36.1	Very low	40.4	Very low	114 Å²	114	145.9 Å²	145.9	74%	0.74	79%	0.785	S	S	*	*			trans	-126.6	119.7	146.6	24.8	-6.6	0	0	0	112.8
132	T	37.9	Very low	39.4	Very low	125 Å²	125	148.4 Å²	148.4	77%	0.767	79%	0.792	S	S	*	*			trans	47.7	112.4	130.1	-21.9	0	0	0	0	121
133	E	34.8	Very low	38.3	Very low	177 Å²	177	148.2 Å²	148.2	83%	0.827	79%	0.791	S	S	*	*			trans	19.1	121.1	141.6	-57.9	176.2	168	0	0	119.6
134	Q	38.1	Very low	37.4	Very low	200 Å²	200	150.1 Å²	150.1	94%	0.935	80%	0.802	S	S	*	*				-173.1	132.6	121.1	-102	171.8	9.5	0	0	112.7
135	E	31.3	Very low	36.9	Very low	193 Å²	193	153.6 Å²	153.6	90%	0.902	81%	0.805	S	S	*	*			trans	-65.3	134.3	177.3	-62	173.3	128.9	0	0	112.5
136	S	39.8	Very low	36.6	Very low	116 Å²	116	150.5 Å²	150.5	81%	0.811	79%	0.785	S	S	*	*			trans	179.7	115.9	136.5	35.6	0	0	0	0	114.8
137	K	36.4	Very low	36.1	Very low	204 Å²	204	148.7 Å²	148.7	89%	0.887	78%	0.775	S	S	*	*			trans	36.7	115.2	136.9	-64.3	174.6	-178.2	172	0	120.6
138	R	40.3	Very low	36.1	Very low	242 Å²	242	150.9 Å²	150.9	91%	0.913	77%	0.772	S	S	*	*			trans	104.3	145.1	147.4	-71.3	-167.5	-177.1	-164.7	3.2	118.3
139	P	38.8	Very low	36.3	Very low	115 Å²	115	150.9 Å²	150.9	75%	0.747	76%	0.764	S	S	*	*			trans	-106.9	154.8	-130.9	38.3	-32.1	0	0	0	113
140	R	33.8	Very low	36.6	Very low	253 Å²	253	151.5 Å²	151.5	96%	0.955	75%	0.751	S	S	*	*			trans	-155.6	132	162.2	-105.9	162.5	-167.1	174.4	2.9	112
141	I	36.3	Very low	37.2	Very low	157 Å²	157	152.4 Å²	152.4	81%	0.805	74%	0.738	S	S	*	*			trans	-61.3	147.3	176.8	-70	153.3	0	0	0	112.1
142	N	39.8	Very low	37.9	Very low	139 Å²	139	151.8 Å²	151.8	74%	0.743	73%	0.729	S	S	*	*			trans	146.9	141.9	135.5	-110.2	-1.5	0	0	0	110.4
143	V	34.9	Very low	39	Very low	85 Å²	85	151.5 Å²	151.5	52%	0.515	72%	0.722	S	S	.	*			cis	-169.1	162.5	-12.2	-112.3	0	0	0	0	106.5
144	N	32.1	Very low	40.1	Very low	130 Å²	130	149.2 Å²	149.2	70%	0.695	71%	0.711	S	S	*	*	S	Bend	trans	136.4	29.9	146.5	-66.6	-10.8	0	0	0	117.3
145	F	32.8	Very low	41.3	Very low	190 Å²	190	145.8 Å²	145.8	83%	0.833	70%	0.695	S	S	*	*	S	Bend	trans	-125.1	20.8	162.2	-139.2	-95.6	0	0	0	113.1
146	C	30.6	Very low	43	Very low	58 Å²	58	140.5 Å²	140.5	39%	0.392	68%	0.676	S	S	.	*			trans	-124.4	38.9	-150.7	-156.4	0	0	0	0	115.1	R150	C146-R150 PolarHBondContact O-NE 3.35Å; C146-R150 VanDerWaalsContact O-NE 3.15Å; C146-R150 PolarHBondContact SG-NE 3.29Å; C146-R150 PolarHBondContact SG-NH2 3.05Å
147	S	32.9	Very low	44.4	Very low	92 Å²	92	136.8 Å²	136.8	64%	0.643	65%	0.652	S	S	*	*	S	Bend	trans	-110.8	-29.8	174	58.7	0	0	0	0	114
148	F	37.5	Very low	45.8	Very low	148 Å²	148	136.1 Å²	136.1	65%	0.649	64%	0.644	S	S	*	*	H	α-helix	trans	-90.9	-41.4	-179.8	-123.4	-91.7	0	0	0	113.7	R150	F148-R150 VanDerWaalsContact C-N 3.27Å; F148-R150 PolarHBondContact O-N 3.27Å
149	R	45.5	Very low	47	Very low	192 Å²	192	132 Å²	132	73%	0.725	63%	0.633	S	S	*	*	H	α-helix	trans	-69.6	-22.4	174.9	-93	-174	-175.8	174.2	3.2	114	L153	R149-L153 HydrophobicContact CB-CD1 4.48Å; R149-L153 WeakPolarHBondContact O-CB 3.26Å; R149-L153 WeakPolarHBondContact O-CD1 3.36Å; R149-L153 PolarHBondContact O-N 3.13Å; R149-L153 VanDerWaalsContact O-N 3.14Å
150	R	43.6	Very low	48.4	Very low	126 Å²	126	132.9 Å²	132.9	48%	0.475	63%	0.627	S	S	.	*	H	α-helix	trans	-71.2	-35.9	-175.3	-152.3	-177.2	-74.8	171.9	-5	111.3	C146 F148 L153 E154	C146-R150 PolarHBondContact O-NE 3.35Å; C146-R150 VanDerWaalsContact O-NE 3.15Å; C146-R150 PolarHBondContact SG-NE 3.29Å; C146-R150 PolarHBondContact SG-NH2 3.05Å; F148-R150 VanDerWaalsContact C-N 3.27Å; F148-R150 PolarHBondContact O-N 3.27Å; R150-L153 PolarHBondContact O-N 3.45Å; R150-E154 WeakPolarHBondContact O-CB 3.39Å; R150-E154 PolarHBondContact O-N 3Å
151	R	48.5	Very low	50.1	Low	145 Å²	145	130 Å²	130	55%	0.547	62%	0.616	S	S	.	*	H	α-helix	trans	-63.3	-44.1	175	-108.8	-179.2	-78.7	129.7	-3.9	112.6	E154 E155	R151-E154 PolarHBondContact O-N 3.03Å; R151-E155 PolarHBondContact O-N 3.29Å
152	D	51.1	Low	51.4	Low	100 Å²	100	127 Å²	127	54%	0.535	60%	0.601	S	S	.	*	H	α-helix	trans	-70.1	-37.2	-179.9	-62.8	-20.9	0	0	0	112.4	V156	D152-V156 WeakPolarHBondContact O-CB 3.44Å; D152-V156 WeakPolarHBondContact O-CG2 3.3Å; D152-V156 PolarHBondContact O-N 3.19Å; D152-V156 VanDerWaalsContact O-N 3.15Å
153	L	59.4	Low	52.4	Low	120 Å²	120	128.6 Å²	128.6	63%	0.628	60%	0.602	S	S	*	*	H	α-helix	trans	-72	-33.3	176	-95.3	134.5	0	0	0	112.8	R149 R150 A157	R149-L153 HydrophobicContact CB-CD1 4.48Å; R149-L153 WeakPolarHBondContact O-CB 3.26Å; R149-L153 WeakPolarHBondContact O-CD1 3.36Å; R149-L153 PolarHBondContact O-N 3.13Å; R149-L153 VanDerWaalsContact O-N 3.14Å; R150-L153 PolarHBondContact O-N 3.45Å; L153-A157 VanDerWaalsContact O-CB 3.27Å; L153-A157 WeakPolarHBondContact O-CB 2.99Å; L153-A157 PolarHBondContact O-N 3.46Å
154	E	59.3	Low	53.8	Low	129 Å²	129	127.2 Å²	127.2	60%	0.603	60%	0.599	S	S	*	*	H	α-helix	trans	-78.7	-32.3	180	-158.5	145.2	-149.4	0	0	111.7	R150 R151 R158	R150-E154 WeakPolarHBondContact O-CB 3.39Å; R150-E154 PolarHBondContact O-N 3Å; R151-E154 PolarHBondContact O-N 3.03Å; E154-R158 WeakPolarHBondContact O-CB 3.2Å; E154-R158 PolarHBondContact O-N 3.04Å
155	E	63.1	Low	55	Low	128 Å²	128	128.5 Å²	128.5	60%	0.598	60%	0.603	S	S	*	*	H	α-helix	trans	-67.1	-39.9	167.7	-82.7	-168.6	172.7	0	0	112.9	R151 R158 K159	R151-E155 PolarHBondContact O-N 3.29Å; E155-R158 PolarHBondContact O-N 3.36Å; E155-K159 WeakPolarHBondContact O-CB 3.48Å; E155-K159 PolarHBondContact O-N 3.46Å
156	V	66.6	Low	56.2	Low	81 Å²	81	126.2 Å²	126.2	49%	0.491	60%	0.599	S	S	.	*	H	α-helix	trans	-66.9	-44.4	175.5	171.6	0	0	0	0	110.7	D152 R158 K159 E160	D152-V156 WeakPolarHBondContact O-CB 3.44Å; D152-V156 WeakPolarHBondContact O-CG2 3.3Å; D152-V156 PolarHBondContact O-N 3.19Å; D152-V156 VanDerWaalsContact O-N 3.15Å; V156-R158 VanDerWaalsContact C-N 3.34Å; V156-R158 PolarHBondContact O-N 3Å; V156-K159 PolarHBondContact O-N 3.05Å; V156-E160 WeakPolarHBondContact O-CG 3.25Å; V156-E160 PolarHBondContact O-N 3.07Å
157	A	68.7	Low	57.1	Low	38 Å²	38	126.4 Å²	126.4	31%	0.314	61%	0.611	S	S	.	*	H	α-helix	trans	-66.4	-33.5	175.9	0	0	0	0	0	112.8	L153 R161	L153-A157 VanDerWaalsContact O-CB 3.27Å; L153-A157 WeakPolarHBondContact O-CB 2.99Å; L153-A157 PolarHBondContact O-N 3.46Å; A157-R161 WeakPolarHBondContact O-CB 3.12Å; A157-R161 WeakPolarHBondContact O-CG 2.94Å; A157-R161 PolarHBondContact O-N 3Å
158	R	67.2	Low	57.5	Low	190 Å²	190	131.2 Å²	131.2	72%	0.717	62%	0.62	S	S	*	*	H	α-helix	trans	-70.2	-39.2	174.4	-163.7	174.9	-170.6	160.4	1.1	111.4	E154 E155 V156 L162	E154-R158 WeakPolarHBondContact O-CB 3.2Å; E154-R158 PolarHBondContact O-N 3.04Å; E155-R158 PolarHBondContact O-N 3.36Å; V156-R158 VanDerWaalsContact C-N 3.34Å; V156-R158 PolarHBondContact O-N 3Å; R158-L162 WeakPolarHBondContact O-CB 3.47Å; R158-L162 PolarHBondContact O-N 3.43Å
159	K	64.3	Low	57.3	Low	155 Å²	155	127.1 Å²	127.1	67%	0.674	62%	0.62	S	S	*	*	H	α-helix	trans	-64.8	-42.2	171.5	-93.7	175.8	175.6	163.4	0	112.5	E155 V156 L162 F163	E155-K159 WeakPolarHBondContact O-CB 3.48Å; E155-K159 PolarHBondContact O-N 3.46Å; V156-K159 PolarHBondContact O-N 3.05Å; K159-L162 PolarHBondContact O-N 3.38Å; K159-F163 WeakPolarHBondContact O-CB 3.39Å; K159-F163 PolarHBondContact O-N 3.39Å
160	E	69.4	Low	56.7	Low	134 Å²	134	123.5 Å²	123.5	63%	0.626	62%	0.624	S	S	*	*	H	α-helix	trans	-67.3	-38.2	176.4	-76.8	-175.9	164	0	0	112.4	V156 F163 A164	V156-E160 WeakPolarHBondContact O-CG 3.25Å; V156-E160 PolarHBondContact O-N 3.07Å; E160-F163 PolarHBondContact O-N 3.06Å; E160-A164 VanDerWaalsContact O-CB 3.26Å; E160-A164 WeakPolarHBondContact O-CB 3.43Å; E160-A164 PolarHBondContact O-N 2.83Å
161	R	69	Low	56.2	Low	193 Å²	193	124.4 Å²	124.4	73%	0.728	64%	0.643	S	S	*	*	H	α-helix	trans	-65.4	-40.7	172.9	-77.8	177.9	-179.3	169.5	1.7	112.6	A157 A164 M165	A157-R161 WeakPolarHBondContact O-CB 3.12Å; A157-R161 WeakPolarHBondContact O-CG 2.94Å; A157-R161 PolarHBondContact O-N 3Å; R161-A164 PolarHBondContact O-N 3.29Å; R161-M165 WeakPolarHBondContact O-CB 3.46Å; R161-M165 PolarHBondContact O-N 2.87Å
162	L	62.4	Low	55.4	Low	95 Å²	95	122 Å²	122	50%	0.497	65%	0.654	S	S	.	*	H	α-helix	trans	-64.6	-41.7	173.8	-111.4	156	0	0	0	111.7	R158 K159 M165 L166	R158-L162 WeakPolarHBondContact O-CB 3.47Å; R158-L162 PolarHBondContact O-N 3.43Å; K159-L162 PolarHBondContact O-N 3.38Å; L162-M165 PolarHBondContact O-N 3.34Å; L162-L166 HydrophobicContact CD2-CD1 3.91Å; L162-L166 PolarHBondContact O-N 3.36Å
163	F	61.2	Low	54.5	Low	172 Å²	172	125.9 Å²	125.9	75%	0.754	67%	0.669	S	S	*	*	H	α-helix	trans	-68.5	-33.9	177.1	-150.2	-95	0	0	0	112.1	K159 E160 G167	K159-F163 WeakPolarHBondContact O-CB 3.39Å; K159-F163 PolarHBondContact O-N 3.39Å; E160-F163 PolarHBondContact O-N 3.06Å; F163-G167 PolarHBondContact O-N 3.1Å
164	A	64.3	Low	53.3	Low	56 Å²	56	128.4 Å²	128.4	46%	0.463	68%	0.678	S	S	.	*	H	α-helix	trans	-73.9	-27.8	173.5	0	0	0	0	0	113.6	E160 R161	E160-A164 VanDerWaalsContact O-CB 3.26Å; E160-A164 WeakPolarHBondContact O-CB 3.43Å; E160-A164 PolarHBondContact O-N 2.83Å; R161-A164 PolarHBondContact O-N 3.29Å
165	M	58.4	Low	52.1	Low	156 Å²	156	128.8 Å²	128.8	77%	0.768	68%	0.684	S	S	*	*	H	α-helix	trans	-74.8	-35.1	171.2	-84.9	177.2	62.4	0	0	112.6	R161 L162	R161-M165 WeakPolarHBondContact O-CB 3.46Å; R161-M165 PolarHBondContact O-N 2.87Å; L162-M165 PolarHBondContact O-N 3.34Å
166	L	57.7	Low	50.8	Low	142 Å²	142	127.5 Å²	127.5	74%	0.743	69%	0.689	S	S	*	*	H	α-helix	trans	-84.4	-19.2	178.4	-87.9	144.3	0	0	0	113.9	L162	L162-L166 HydrophobicContact CD2-CD1 3.91Å; L162-L166 PolarHBondContact O-N 3.36Å
167	G	48.6	Very low	49.5	Very low	63 Å²	63	133 Å²	133	65%	0.649	71%	0.707	S	S	*	*	S	Bend	trans	-89.2	-10.5	179.4	0	0	0	0	0	115.6	F163 G169	F163-G167 PolarHBondContact O-N 3.1Å; G167-G169 PolarHBondContact O-N 3.17Å
168	K	42.8	Very low	48.1	Very low	193 Å²	193	139.5 Å²	139.5	84%	0.839	74%	0.735	S	S	*	*			trans	-96.8	68	177.6	-75.7	-176.2	176.5	-175.7	0	110.8
169	G	32.5	Very low	46.6	Very low	62 Å²	62	135 Å²	135	64%	0.639	73%	0.729	S	S	*	*			trans	-146	71.8	176.8	0	0	0	0	0	110.9	G167	G167-G169 PolarHBondContact O-N 3.17Å
170	S	32.5	Very low	45.8	Very low	115 Å²	115	136 Å²	136	80%	0.804	74%	0.736	S	S	*	*			trans	162.2	77.2	152.4	45.4	0	0	0	0	111.8
171	T	33.2	Very low	44.9	Very low	145 Å²	145	134.6 Å²	134.6	89%	0.89	74%	0.738	S	S	*	*			trans	-147	118.6	145.3	45.7	0	0	0	0	107.4
172	A	32.5	Very low	43.7	Very low	94 Å²	94	132.3 Å²	132.3	78%	0.777	74%	0.739	S	S	*	*			trans	-58.8	163.8	176.3	0	0	0	0	0	112.5
173	E	32.3	Very low	43	Very low	182 Å²	182	137.4 Å²	137.4	85%	0.85	75%	0.752	S	S	*	*			trans	110.1	125.5	164.4	-61.8	-176.5	155.5	0	0	115.7
174	Q	33.5	Very low	42.5	Very low	174 Å²	174	136.8 Å²	136.8	81%	0.813	75%	0.751	S	S	*	*			trans	99.8	113.7	162.4	-60.6	-176.3	-14.5	0	0	118.6
175	D	34.8	Very low	41.6	Very low	136 Å²	136	140.9 Å²	140.9	73%	0.727	77%	0.765	S	S	*	*			trans	96.7	73.3	140.8	-60.2	-7.1	0	0	0	120	K177	D175-K177 PolarHBondContact O-N 3.16Å
176	S	34.2	Very low	41.4	Very low	101 Å²	101	138.6 Å²	138.6	71%	0.706	76%	0.764	S	S	*	*				2.5	102.8	122.8	56.6	0	0	0	0	117.1
177	K	40.9	Very low	41.2	Very low	198 Å²	198	140.9 Å²	140.9	86%	0.861	77%	0.768	S	S	*	*			trans	-171.1	9.9	145.4	-116.4	168.6	-177.5	178.7	0	118.8	D175	D175-K177 PolarHBondContact O-N 3.16Å
178	L	38.8	Very low	41.5	Very low	173 Å²	173	145 Å²	145	91%	0.906	78%	0.775	S	S	*	*			trans	-137	48.5	-174.2	-67.2	170	0	0	0	113.1
179	T	36.3	Very low	42.1	Very low	97 Å²	97	142.4 Å²	142.4	60%	0.595	77%	0.77	S	S	*	*			trans	-124.9	51.9	-171.1	-24.7	0	0	0	0	112.6
180	E	47.3	Very low	42.8	Very low	175 Å²	175	143.1 Å²	143.1	82%	0.818	78%	0.777	S	S	*	*	S	Bend	trans	-127.5	-18.2	-178.9	-70.6	-147.5	156.7	0	0	119.3
181	P	48.9	Very low	44.2	Very low	104 Å²	104	142.6 Å²	142.6	68%	0.675	76%	0.764	S	S	*	*	S	Bend	trans	-94.7	-9.4	-179.5	10.5	4.7	0	0	0	116.4
182	I	43.9	Very low	45.7	Very low	145 Å²	145	140 Å²	140	74%	0.744	75%	0.748	S	S	*	*	S	Bend	trans	-109.5	-6.7	-167.1	-53.8	175.9	0	0	0	113	E184	I182-E184 VanDerWaalsContact C-N 3.34Å; I182-E184 PolarHBondContact O-N 3Å
183	R	49.4	Very low	47.4	Very low	202 Å²	202	139.3 Å²	139.3	76%	0.762	74%	0.743	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.2	-4.5	179.8	-100.3	179.3	176.1	166.1	-1.1	114.9
184	E	49.2	Very low	49.2	Very low	159 Å²	159	136.9 Å²	136.9	74%	0.743	74%	0.736	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.9	-13.6	-176.8	-76.2	177.4	153.4	0	0	114.3	I182	I182-E184 VanDerWaalsContact C-N 3.34Å; I182-E184 PolarHBondContact O-N 3Å
185	L	46.3	Very low	50.9	Low	143 Å²	143	134.8 Å²	134.8	75%	0.749	72%	0.724	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.6	-4.8	-176.6	-68.8	166.3	0	0	0	114.6
186	S	53.9	Low	52.4	Low	107 Å²	107	131.8 Å²	131.8	75%	0.748	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.3	-2.6	-174.9	-175.4	0	0	0	0	114.4
187	K	54.4	Low	54.1	Low	190 Å²	190	129.5 Å²	129.5	83%	0.826	69%	0.694	S	S	*	*	S	Bend	trans	-94.6	-21.2	-177.3	-100.5	174.6	176	173.4	0	114.3
188	D	54.9	Low	55.7	Low	151 Å²	151	123 Å²	123	81%	0.807	68%	0.678	S	S	*	*	S	Bend	trans	-93.5	-7.8	-169.6	-87.2	-0.7	0	0	0	115.5
189	L	53.7	Low	57.2	Low	138 Å²	138	120.4 Å²	120.4	72%	0.723	66%	0.664	S	S	*	*	S	Bend	trans	-123.3	90	178.3	-78.3	138.9	0	0	0	109.3	L191	L189-L191 PolarHBondContact O-N 2.97Å
190	G	48.6	Very low	58.8	Low	76 Å²	76	124.5 Å²	124.5	78%	0.784	67%	0.668	S	S	*	*			trans	-63	60.1	-178	0	0	0	0	0	115.8
191	L	60.5	Low	59.9	Low	104 Å²	104	120.2 Å²	120.2	55%	0.545	66%	0.658	S	S	.	*			trans	-97	98.4	164.6	-94.9	91.7	0	0	0	109.3	L189 I196	L189-L191 PolarHBondContact O-N 2.97Å; L191-I196 HydrophobicContact CD2-CG1 4.48Å
192	T	65.4	Low	61.2	Low	91 Å²	91	122.8 Å²	122.8	56%	0.558	66%	0.658	S	S	*	*			trans	-58.3	141.3	171.6	45.8	0	0	0	0	110.9	D194 K195	T192-D194 PolarHBondContact O-N 3.12Å; T192-K195 PolarHBondContact O-N 3.4Å
193	A	67.4	Low	62.1	Low	79 Å²	79	118.8 Å²	118.8	65%	0.653	65%	0.647	S	S	*	*	H	α-helix	trans	-51.4	-29.2	-179.7	0	0	0	0	0	113.4	I196 A197	A193-I196 PolarHBondContact O-N 3.34Å; A193-A197 PolarHBondContact O-N 2.89Å; A193-A197 VanDerWaalsContact O-N 3.07Å
194	D	71.7	Confident	62.7	Low	132 Å²	132	114.7 Å²	114.7	71%	0.706	64%	0.64	S	S	*	*	H	α-helix	trans	-65.2	-36.4	175.3	-80.4	-22.1	0	0	0	113.9	T192 I196 A197 A198	T192-D194 PolarHBondContact O-N 3.12Å; D194-I196 VanDerWaalsContact C-N 3.3Å; D194-I196 PolarHBondContact O-N 3.01Å; D194-A197 PolarHBondContact O-N 3.33Å; D194-A198 WeakPolarHBondContact O-CB 3.45Å; D194-A198 PolarHBondContact O-N 3.4Å
195	K	68.1	Low	63.5	Low	129 Å²	129	110 Å²	110	56%	0.561	63%	0.628	S	S	*	*	H	α-helix	trans	-67.3	-34.4	175.3	-96.2	176.2	176.1	175.2	0	111.4	T192 L199	T192-K195 PolarHBondContact O-N 3.4Å; K195-L199 WeakPolarHBondContact O-CB 3.46Å; K195-L199 PolarHBondContact O-N 3.45Å; K195-L199 VanDerWaalsContact O-N 3.08Å
196	I	65.9	Low	64.3	Low	74 Å²	74	112.4 Å²	112.4	38%	0.379	63%	0.627	S	S	.	*	H	α-helix	trans	-70.5	-36.7	177.7	-56.8	174	0	0	0	110.4	L191 A193 D194 R200	L191-I196 HydrophobicContact CD2-CG1 4.48Å; A193-I196 PolarHBondContact O-N 3.34Å; D194-I196 VanDerWaalsContact C-N 3.3Å; D194-I196 PolarHBondContact O-N 3.01Å; I196-R200 WeakPolarHBondContact O-CG 3.45Å; I196-R200 PolarHBondContact O-N 2.86Å
197	A	71.5	Confident	64.7	Low	52 Å²	52	116.3 Å²	116.3	43%	0.43	63%	0.63	S	S	.	*	H	α-helix	trans	-70.8	-38.8	175	0	0	0	0	0	113	A193 D194 R200 S201	A193-A197 PolarHBondContact O-N 2.89Å; A193-A197 VanDerWaalsContact O-N 3.07Å; D194-A197 PolarHBondContact O-N 3.33Å; A197-R200 PolarHBondContact O-N 3.09Å; A197-S201 PolarHBondContact O-N 3.1Å; A197-S201 VanDerWaalsContact O-N 3.14Å; A197-S201 PolarHBondContact O-OG 3.42Å; A197-S201 VanDerWaalsContact O-OG 3.09Å
198	A	74.3	Confident	64.8	Low	63 Å²	63	117.6 Å²	117.6	52%	0.521	63%	0.63	S	S	.	*	H	α-helix	trans	-66.6	-40.8	176.7	0	0	0	0	0	112.4	D194 S201 K202	D194-A198 WeakPolarHBondContact O-CB 3.45Å; D194-A198 PolarHBondContact O-N 3.4Å; A198-S201 PolarHBondContact O-N 3.25Å; A198-K202 PolarHBondContact O-N 3.06Å
199	L	69.8	Low	64.9	Low	117 Å²	117	115.8 Å²	115.8	61%	0.613	62%	0.624	S	S	*	*	H	α-helix	trans	-66.1	-38.8	176.7	-87.4	157	0	0	0	112.5	K195 K202 A203	K195-L199 WeakPolarHBondContact O-CB 3.46Å; K195-L199 PolarHBondContact O-N 3.45Å; K195-L199 VanDerWaalsContact O-N 3.08Å; L199-K202 PolarHBondContact O-N 3.42Å; L199-A203 PolarHBondContact O-N 3.03Å
200	R	70.6	Confident	64.8	Low	183 Å²	183	117.5 Å²	117.5	69%	0.691	63%	0.629	S	S	*	*	H	α-helix	trans	-65.7	-38.2	175.2	-77.5	-179.9	174.2	166.9	-0.1	112.8	I196 A197 A203 L204	I196-R200 WeakPolarHBondContact O-CG 3.45Å; I196-R200 PolarHBondContact O-N 2.86Å; A197-R200 PolarHBondContact O-N 3.09Å; R200-A203 PolarHBondContact O-N 3.3Å; R200-L204 PolarHBondContact O-N 3.34Å
201	S	69.3	Low	64.5	Low	85 Å²	85	121.1 Å²	121.1	59%	0.594	63%	0.629	S	S	*	*	H	α-helix	trans	-68.2	-35.2	178	-61.7	0	0	0	0	112.6	A197 A198 A205	A197-S201 PolarHBondContact O-N 3.1Å; A197-S201 VanDerWaalsContact O-N 3.14Å; A197-S201 PolarHBondContact O-OG 3.42Å; A197-S201 VanDerWaalsContact O-OG 3.09Å; A198-S201 PolarHBondContact O-N 3.25Å; S201-A205 PolarHBondContact O-N 3Å
202	K	77.2	Confident	63.8	Low	158 Å²	158	125.2 Å²	125.2	69%	0.687	65%	0.645	S	S	*	*	H	α-helix	trans	-72.1	-31.6	178.1	-153	173.6	-174.1	178.4	0	112.9	A198 L199	A198-K202 PolarHBondContact O-N 3.06Å; L199-K202 PolarHBondContact O-N 3.42Å
203	A	62.5	Low	62.4	Low	61 Å²	61	127.3 Å²	127.3	50%	0.504	66%	0.658	S	S	.	*	H	α-helix	trans	-72.7	-32.9	176.3	0	0	0	0	0	113.1	L199 R200	L199-A203 PolarHBondContact O-N 3.03Å; R200-A203 PolarHBondContact O-N 3.3Å
204	L	62.7	Low	61	Low	117 Å²	117	130.5 Å²	130.5	61%	0.613	66%	0.663	S	S	*	*	H	α-helix	trans	-74.5	-29.6	179.6	-122.6	143.7	0	0	0	112.8	R200	R200-L204 PolarHBondContact O-N 3.34Å
205	A	64.4	Low	59.3	Low	59 Å²	59	132.2 Å²	132.2	49%	0.488	67%	0.666	S	S	.	*	H	α-helix	trans	-69.4	-36.2	175.2	0	0	0	0	0	112.8	S201 R208	S201-A205 PolarHBondContact O-N 3Å; A205-R208 PolarHBondContact O-N 3.45Å
206	R	63.7	Low	57.9	Low	195 Å²	195	132.8 Å²	132.8	74%	0.736	68%	0.675	S	S	*	*	H	α-helix	trans	-72.1	-31.1	178.7	-78.9	-174.5	168.2	-173.2	-4.1	113.7	R208 T209	R206-R208 PolarHBondContact O-N 3.47Å; R206-T209 PolarHBondContact O-OG1 2.83Å
207	K	61.5	Low	56.7	Low	189 Å²	189	136.1 Å²	136.1	82%	0.822	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.9	-13.9	175.6	-80.2	-175	173.3	-177.4	0	113.9
208	R	57.9	Low	55	Low	216 Å²	216	141.3 Å²	141.3	82%	0.815	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90	-12.2	-179.2	-102	178.7	164.3	154.9	-4.1	114.5	A205 R206	A205-R208 PolarHBondContact O-N 3.45Å; R206-R208 PolarHBondContact O-N 3.47Å
209	T	56	Low	53.3	Low	113 Å²	113	146.6 Å²	146.6	69%	0.693	73%	0.728	S	S	*	*	S	Bend	trans	-114.6	10.1	-170.1	54.4	0	0	0	0	114.9	R206	R206-T209 PolarHBondContact O-OG1 2.83Å
210	Q	51.1	Low	51.9	Low	174 Å²	174	150.2 Å²	150.2	81%	0.813	74%	0.741	S	S	*	*			trans	-109.4	110	-177.1	-159.5	163.5	8.5	0	0	111.6
211	I	43.8	Very low	50.5	Low	153 Å²	153	149.4 Å²	149.4	79%	0.785	75%	0.75	S	S	*	*			trans	-78.4	130.3	178.7	-60.3	169.2	0	0	0	108.4
212	Q	45.9	Very low	49	Very low	190 Å²	190	150.4 Å²	150.4	89%	0.888	75%	0.754	S	S	*	*			trans	-95.5	122.1	172	-81.7	179.7	-6.9	0	0	109.7
213	T	35.8	Very low	47	Very low	135 Å²	135	148.8 Å²	148.8	83%	0.828	76%	0.758	S	S	*	*			trans	-109.1	146	163.6	37.5	0	0	0	0	109.7
214	I	37	Very low	45.6	Very low	146 Å²	146	152.8 Å²	152.8	75%	0.749	78%	0.776	S	S	*	*			trans	-91.9	156.2	-168.4	-65.1	158.9	0	0	0	109.4
215	E	36.6	Very low	44.4	Very low	167 Å²	167	150.6 Å²	150.6	78%	0.78	78%	0.782	S	S	*	*			trans	89.8	142	166.3	-79.4	137.8	-155.2	0	0	119.1
216	D	38.7	Very low	43.2	Very low	141 Å²	141	155.2 Å²	155.2	75%	0.754	80%	0.796	S	S	*	*			trans	69.8	140.4	168.8	-57.5	-8	0	0	0	117.9
217	D	39.7	Very low	41.8	Very low	144 Å²	144	154.8 Å²	154.8	77%	0.77	80%	0.803	S	S	*	*			cis	-168.2	157	-15.7	-112.3	-31.5	0	0	0	105.1
218	L	36.7	Very low	40.6	Very low	162 Å²	162	149.7 Å²	149.7	85%	0.848	80%	0.804	S	S	*	*			trans	-73.6	121.1	168.4	-103	124.8	0	0	0	109.5
219	E	39.4	Very low	39.5	Very low	174 Å²	174	148.5 Å²	148.5	81%	0.813	81%	0.807	S	S	*	*				164.2	150.5	120.2	-90.3	176.5	177.7	0	0	113.3
220	E	39.8	Very low	39	Very low	192 Å²	192	147.1 Å²	147.1	90%	0.897	81%	0.808	S	S	*	*			trans	90.4	102.7	166.6	-53.2	-161.5	156.2	0	0	120.2
221	L	40.6	Very low	38.5	Very low	166 Å²	166	144.7 Å²	144.7	87%	0.869	81%	0.807	S	S	*	*			trans	-64.6	-178.9	158.9	-65	161.5	0	0	0	111
222	P	37.3	Very low	38.7	Very low	106 Å²	106	143.1 Å²	143.1	69%	0.688	80%	0.804	S	S	*	*			cis	-145.6	177.1	10.8	32.9	-7.7	0	0	0	118
223	T	35.4	Very low	38.9	Very low	124 Å²	124	140.4 Å²	140.4	76%	0.761	79%	0.792	S	S	*	*			trans	87.8	124.2	137.9	27	0	0	0	0	124.1
224	V	34	Very low	39.4	Very low	146 Å²	146	140.6 Å²	140.6	89%	0.885	78%	0.783	S	S	*	*			trans	96.6	117.1	142	-177.8	0	0	0	0	117.8
225	G	36.4	Very low	39.9	Very low	71 Å²	71	141.2 Å²	141.2	73%	0.732	78%	0.783	S	S	*	*			trans	155.9	70.8	162.4	0	0	0	0	0	114.9
226	I	41	Very low	40.5	Very low	155 Å²	155	137.3 Å²	137.3	80%	0.795	77%	0.77	S	S	*	*			trans	-59	139.3	171.6	-49.1	176	0	0	0	108.1
227	E	32.7	Very low	41.1	Very low	187 Å²	187	134.9 Å²	134.9	87%	0.874	75%	0.754	S	S	*	*				170.3	137	93.4	-78.5	170.9	-154.8	0	0	109.8
228	G	36	Very low	41.8	Very low	82 Å²	82	133.7 Å²	133.7	85%	0.845	74%	0.742	S	S	*	*			trans	134.6	90.6	155.4	0	0	0	0	0	118.6
229	E	35.5	Very low	42.6	Very low	190 Å²	190	129.1 Å²	129.1	89%	0.888	72%	0.724	S	S	*	*			trans	-44.2	131.6	172.7	-73.5	160.8	127.8	0	0	117.1
230	A	45.2	Very low	43.7	Very low	85 Å²	85	124.4 Å²	124.4	70%	0.702	71%	0.707	S	S	*	*				86.5	139.6	89.7	0	0	0	0	0	114.3
231	P	40.2	Very low	44.8	Very low	123 Å²	123	120.5 Å²	120.5	80%	0.799	69%	0.688	S	S	*	*				-135	125.3	50.3	33.9	-13.6	0	0	0	115.9
232	V	49.7	Very low	45.9	Very low	120 Å²	120	118.5 Å²	118.5	73%	0.727	68%	0.678	S	S	*	*			trans	-138.8	39.3	172.5	-164.7	0	0	0	0	111
233	E	49	Very low	47.5	Very low	133 Å²	133	119.4 Å²	119.4	62%	0.621	68%	0.676	S	S	*	*			trans	-91	-39.5	-175.8	-79.6	177.4	156.1	0	0	113.7	H235 V236 E237	E233-H235 PolarHBondContact O-N 3.39Å; E233-H235 VanDerWaalsContact O-N 3.14Å; E233-V236 PolarHBondContact O-N 3.01Å; E233-E237 WeakPolarHBondContact O-CG 3.29Å; E233-E237 PolarHBondContact O-N 2.67Å
234	E	46.1	Very low	49.5	Very low	138 Å²	138	119 Å²	119	65%	0.645	67%	0.674	S	S	*	*	H	α-helix	trans	-71.3	-22.2	-162.8	-152.9	-174.3	164	0	0	116.2
235	H	47.3	Very low	51.5	Low	160 Å²	160	120 Å²	120	74%	0.741	67%	0.668	S	S	*	*	H	α-helix	trans	-96.9	-20.4	-178.8	-82.9	-62	0	0	0	114.2	E233 S239	E233-H235 PolarHBondContact O-N 3.39Å; E233-H235 VanDerWaalsContact O-N 3.14Å; H235-S239 PolarHBondContact O-OG 3.08Å
236	V	51	Low	53.7	Low	84 Å²	84	123.1 Å²	123.1	51%	0.509	66%	0.664	S	S	.	*	H	α-helix	trans	-85	-37.6	177.1	-177.1	0	0	0	0	109.6	E233 K238 S239 T240	E233-V236 PolarHBondContact O-N 3.01Å; V236-K238 PolarHBondContact O-N 2.98Å; V236-S239 WeakPolarHBondContact O-CB 3.14Å; V236-S239 PolarHBondContact O-N 2.93Å; V236-S239 VanDerWaalsContact O-N 3.1Å; V236-T240 PolarHBondContact O-N 3.3Å; V236-T240 PolarHBondContact O-OG1 3.12Å
237	E	49.5	Very low	55.7	Low	90 Å²	90	121.4 Å²	121.4	42%	0.421	66%	0.655	S	S	.	*	H	α-helix	trans	-61	-42.7	179.6	-75.2	173	159.9	0	0	113.1	E233 S239 T240 E241	E233-E237 WeakPolarHBondContact O-CG 3.29Å; E233-E237 PolarHBondContact O-N 2.67Å; E237-S239 PolarHBondContact O-N 3.23Å; E237-T240 VanDerWaalsContact CA-OG1 3.3Å; E237-T240 WeakPolarHBondContact CA-OG1 3.09Å; E237-T240 PolarHBondContact O-N 3.07Å; E237-T240 VanDerWaalsContact O-N 3.12Å; E237-T240 PolarHBondContact O-OG1 3.14Å; E237-E241 WeakPolarHBondContact O-CB 3.44Å; E237-E241 VanDerWaalsContact O-CG 3.28Å; E237-E241 WeakPolarHBondContact O-CG 3.28Å; E237-E241 PolarHBondContact O-N 2.91Å
238	K	55.9	Low	58.1	Low	119 Å²	119	116.3 Å²	116.3	52%	0.517	64%	0.636	S	S	.	*	H	α-helix	trans	-60.3	-31.1	175.7	-91.8	171.9	179.6	150.6	0	113.7	V236 L242	V236-K238 PolarHBondContact O-N 2.98Å; K238-L242 VanDerWaalsContact O-CD1 3.26Å; K238-L242 WeakPolarHBondContact O-CD1 3.46Å; K238-L242 VanDerWaalsContact O-CG 3.27Å; K238-L242 WeakPolarHBondContact O-CG 3.42Å; K238-L242 PolarHBondContact O-N 3.14Å
239	S	52.2	Low	60.1	Low	67 Å²	67	121.7 Å²	121.7	47%	0.469	63%	0.633	S	S	.	*	H	α-helix	trans	-76.2	-36.7	179.2	-47.9	0	0	0	0	110.8	H235 V236 E237 I243	H235-S239 PolarHBondContact O-OG 3.08Å; V236-S239 WeakPolarHBondContact O-CB 3.14Å; V236-S239 PolarHBondContact O-N 2.93Å; V236-S239 VanDerWaalsContact O-N 3.1Å; E237-S239 PolarHBondContact O-N 3.23Å; S239-I243 VanDerWaalsContact O-CD1 3.32Å; S239-I243 WeakPolarHBondContact O-CD1 3.49Å; S239-I243 VanDerWaalsContact O-CG1 3.31Å; S239-I243 WeakPolarHBondContact O-CG1 3.31Å
240	T	63.7	Low	62.5	Low	75 Å²	75	116.8 Å²	116.8	46%	0.46	62%	0.616	S	S	.	*	H	α-helix	trans	-76.6	-36.3	178	49.1	0	0	0	0	112.4	V236 E237 I243 T244	V236-T240 PolarHBondContact O-N 3.3Å; V236-T240 PolarHBondContact O-OG1 3.12Å; E237-T240 VanDerWaalsContact CA-OG1 3.3Å; E237-T240 WeakPolarHBondContact CA-OG1 3.09Å; E237-T240 PolarHBondContact O-N 3.07Å; E237-T240 VanDerWaalsContact O-N 3.12Å; E237-T240 PolarHBondContact O-OG1 3.14Å; T240-I243 PolarHBondContact O-N 3.1Å; T240-T244 PolarHBondContact O-N 3.22Å; T240-T244 VanDerWaalsContact O-N 3.13Å; T240-T244 PolarHBondContact O-OG1 3.47Å
241	E	62.5	Low	64.4	Low	109 Å²	109	117.7 Å²	117.7	51%	0.509	61%	0.609	S	S	.	*	H	α-helix	trans	-62.8	-42.3	176.7	-76.5	174.8	172.4	0	0	112	E237 I243 T244 E245	E237-E241 WeakPolarHBondContact O-CB 3.44Å; E237-E241 VanDerWaalsContact O-CG 3.28Å; E237-E241 WeakPolarHBondContact O-CG 3.28Å; E237-E241 PolarHBondContact O-N 2.91Å; E241-I243 VanDerWaalsContact C-N 3.3Å; E241-I243 PolarHBondContact O-N 3.09Å; E241-T244 WeakPolarHBondContact CA-OG1 3.48Å; E241-T244 PolarHBondContact O-N 3.28Å; E241-T244 PolarHBondContact O-OG1 3.12Å; E241-E245 PolarHBondContact O-N 3.32Å; E241-E245 VanDerWaalsContact O-N 3.07Å
242	L	63.2	Low	66.5	Low	125 Å²	125	122.5 Å²	122.5	65%	0.654	61%	0.611	S	S	*	*	H	α-helix	trans	-62.2	-35.4	176.5	-75	164.6	0	0	0	112.7	K238 E246	K238-L242 VanDerWaalsContact O-CD1 3.26Å; K238-L242 WeakPolarHBondContact O-CD1 3.46Å; K238-L242 VanDerWaalsContact O-CG 3.27Å; K238-L242 WeakPolarHBondContact O-CG 3.42Å; K238-L242 PolarHBondContact O-N 3.14Å; L242-E246 WeakPolarHBondContact O-CB 3.32Å; L242-E246 PolarHBondContact O-N 3.28Å
243	I	71.1	Confident	68	Low	125 Å²	125	122.8 Å²	122.8	64%	0.641	61%	0.608	S	S	*	*	H	α-helix	trans	-74.4	-31	178.4	-62.6	165	0	0	0	110.8	S239 T240 E241	S239-I243 VanDerWaalsContact O-CD1 3.32Å; S239-I243 WeakPolarHBondContact O-CD1 3.49Å; S239-I243 VanDerWaalsContact O-CG1 3.31Å; S239-I243 WeakPolarHBondContact O-CG1 3.31Å; T240-I243 PolarHBondContact O-N 3.1Å; E241-I243 VanDerWaalsContact C-N 3.3Å; E241-I243 PolarHBondContact O-N 3.09Å
244	T	77	Confident	69.6	Low	116 Å²	116	119.4 Å²	119.4	71%	0.712	60%	0.6	S	S	*	*	H	α-helix	trans	-79.4	-25.3	178.3	51	0	0	0	0	114.1	T240 E241	T240-T244 PolarHBondContact O-N 3.22Å; T240-T244 VanDerWaalsContact O-N 3.13Å; T240-T244 PolarHBondContact O-OG1 3.47Å; E241-T244 WeakPolarHBondContact CA-OG1 3.48Å; E241-T244 PolarHBondContact O-N 3.28Å; E241-T244 PolarHBondContact O-OG1 3.12Å
245	E	77.3	Confident	71.1	Confident	166 Å²	166	119 Å²	119	78%	0.776	60%	0.6	S	S	*	*	H	α-helix	trans	-91.2	-15.7	177.6	-67.7	-162.8	163.7	0	0	114.1	E241 I247	E241-E245 PolarHBondContact O-N 3.32Å; E241-E245 VanDerWaalsContact O-N 3.07Å; E245-I247 PolarHBondContact O-N 2.65Å
246	E	82.3	Confident	72.6	Confident	136 Å²	136	117.7 Å²	117.7	64%	0.636	60%	0.598	S	S	*	*			trans	-77.3	123.3	-177	-174.7	177.5	-176.4	0	0	112.6	L242 V248	L242-E246 WeakPolarHBondContact O-CB 3.32Å; L242-E246 PolarHBondContact O-N 3.28Å; E246-V248 HydrophobicContact CG-CG2 4.1Å
247	I	82.8	Confident	73.7	Confident	120 Å²	120	120.5 Å²	120.5	62%	0.615	61%	0.607	S	S	*	*			trans	-97.6	109.6	171.4	-56.2	175.9	0	0	0	109.8	E245 Y249	E245-I247 PolarHBondContact O-N 2.65Å; I247-Y249 HydrophobicContact CB-CE2 4.06Å; I247-Y249 HydrophobicContact CG2-CD2 4.05Å; I247-Y249 HydrophobicContact CG2-CE1 4.16Å; I247-Y249 HydrophobicContact CG2-CE2 3.63Å; I247-Y249 HydrophobicContact CG2-CG 4.48Å; I247-Y249 PolarHBondContact O-N 3.34Å
248	V	82.3	Confident	74.7	Confident	79 Å²	79	119.3 Å²	119.3	48%	0.479	61%	0.613	S	S	.	*			trans	-91.1	99.5	176.7	-175.5	0	0	0	0	110.7	E246 N251	E246-V248 HydrophobicContact CG-CG2 4.1Å; V248-N251 VanDerWaalsContact CG1-OD1 3.24Å; V248-N251 WeakPolarHBondContact CG1-OD1 3.26Å
249	Y	79.2	Confident	75.3	Confident	195 Å²	195	118.5 Å²	118.5	77%	0.765	63%	0.629	S	S	*	*			trans	-73.1	-28.3	-179.5	-70.6	-85.8	0	0	0	114.2	I247	I247-Y249 HydrophobicContact CB-CE2 4.06Å; I247-Y249 HydrophobicContact CG2-CD2 4.05Å; I247-Y249 HydrophobicContact CG2-CE1 4.16Å; I247-Y249 HydrophobicContact CG2-CE2 3.63Å; I247-Y249 HydrophobicContact CG2-CG 4.48Å; I247-Y249 PolarHBondContact O-N 3.34Å
250	V	84.6	Confident	76	Confident	88 Å²	88	121.3 Å²	121.3	53%	0.533	64%	0.643	S	S	.	*			trans	-143.3	125.7	-174.3	-175	0	0	0	0	110.1	I255	V250-I255 HydrophobicContact CG1-CD1 3.86Å; V250-I255 HydrophobicContact CG1-CG1 3.37Å
251	N	85.7	Confident	76.2	Confident	103 Å²	103	125 Å²	125	55%	0.551	65%	0.653	S	S	*	*			trans	-112.7	164	172.7	-88	-26.9	0	0	0	111.5	V248 N253 S254 I255	V248-N251 VanDerWaalsContact CG1-OD1 3.24Å; V248-N251 WeakPolarHBondContact CG1-OD1 3.26Å; N251-N253 PolarHBondContact O-N 3.4Å; N251-S254 WeakPolarHBondContact O-CA 3.29Å; N251-S254 WeakPolarHBondContact O-CB 3.22Å; N251-S254 PolarHBondContact O-N 2.67Å; N251-I255 PolarHBondContact O-N 3.05Å; N251-I255 VanDerWaalsContact O-N 3.17Å
252	R	84	Confident	76.6	Confident	224 Å²	224	126.3 Å²	126.3	85%	0.845	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-49.9	-36.4	176.5	-71	-177.2	-172.2	151.1	3.8	112.3
253	N	82.3	Confident	77.2	Confident	126 Å²	126	124.3 Å²	124.3	67%	0.674	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.7	-32.4	178.4	-62.9	-4.8	0	0	0	112.9	N251 I255 L256	N251-N253 PolarHBondContact O-N 3.4Å; N253-I255 VanDerWaalsContact C-N 3.33Å; N253-I255 PolarHBondContact O-N 3.39Å; N253-L256 PolarHBondContact O-N 3.04Å
254	S	81.8	Confident	77.5	Confident	63 Å²	63	122.9 Å²	122.9	44%	0.441	65%	0.645	S	S	.	*	G	3₁₀ helix	trans	-65.1	-37.2	177.3	178.6	0	0	0	0	111.4	N251 L256 M257	N251-S254 WeakPolarHBondContact O-CA 3.29Å; N251-S254 WeakPolarHBondContact O-CB 3.22Å; N251-S254 PolarHBondContact O-N 2.67Å; S254-L256 PolarHBondContact O-N 3.38Å; S254-M257 PolarHBondContact O-N 3.34Å; S254-M257 VanDerWaalsContact O-O 3.14Å
255	I	77.9	Confident	77.5	Confident	129 Å²	129	120.8 Å²	120.8	66%	0.662	64%	0.64	S	S	*	*	G	3₁₀ helix	trans	-64.4	-26.4	177.7	-59.3	169.7	0	0	0	112.3	V250 N251 N253	V250-I255 HydrophobicContact CG1-CD1 3.86Å; V250-I255 HydrophobicContact CG1-CG1 3.37Å; N251-I255 PolarHBondContact O-N 3.05Å; N251-I255 VanDerWaalsContact O-N 3.17Å; N253-I255 VanDerWaalsContact C-N 3.33Å; N253-I255 PolarHBondContact O-N 3.39Å
256	L	78.7	Confident	77.6	Confident	132 Å²	132	118.3 Å²	118.3	69%	0.691	64%	0.636	S	S	*	*	G	3₁₀ helix	trans	-82.7	-15.3	-179.3	-62.5	173.7	0	0	0	113	N253 S254	N253-L256 PolarHBondContact O-N 3.04Å; S254-L256 PolarHBondContact O-N 3.38Å
257	M	74.7	Confident	77.7	Confident	143 Å²	143	115.7 Å²	115.7	70%	0.704	63%	0.626	S	S	*	*	S	Bend	trans	-106.1	130.3	-177	-65.2	-68.7	116.5	0	0	110.2	S254 A259	S254-M257 PolarHBondContact O-N 3.34Å; S254-M257 VanDerWaalsContact O-O 3.14Å; M257-A259 PolarHBondContact O-N 2.88Å
258	A	69.5	Low	77.8	Confident	65 Å²	65	116 Å²	116	54%	0.537	62%	0.623	S	S	.	*			trans	-75.2	123.5	172.4	0	0	0	0	0	109.7	T260	A258-T260 PolarHBondContact O-N 3.04Å
259	A	69.3	Low	78	Confident	103 Å²	103	116.1 Å²	116.1	85%	0.851	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.6	-19.7	-171.2	0	0	0	0	0	115.7	M257	M257-A259 PolarHBondContact O-N 2.88Å
260	T	66.4	Low	78.3	Confident	125 Å²	125	109.6 Å²	109.6	77%	0.767	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-139.1	0.1	-165.9	51.2	0	0	0	0	115.1	A258	A258-T260 PolarHBondContact O-N 3.04Å
261	K	67.7	Low	78.4	Confident	152 Å²	152	109.6 Å²	109.6	66%	0.661	61%	0.607	S	S	*	*			trans	-144.3	115	-173.2	-62.7	-175.8	-177	179.6	0	111.2	I263	K261-I263 HydrophobicContact CB-CG1 3.96Å; K261-I263 PolarHBondContact O-N 3.13Å
262	D	70.7	Confident	78.5	Confident	137 Å²	137	110.7 Å²	110.7	73%	0.733	61%	0.609	S	S	*	*			trans	-79.5	77.6	168.7	-153.2	-2	0	0	0	108.8	L264 A265	D262-L264 PolarHBondContact O-N 3.42Å; D262-A265 PolarHBondContact O-N 3.01Å
263	I	75.9	Confident	78.7	Confident	83 Å²	83	105.2 Å²	105.2	43%	0.426	59%	0.593	S	S	.	*	T	Hydrogen-bonded Turn	trans	-62.6	-15.1	-175.5	-52.3	169.6	0	0	0	110.7	K261 A265 V266 I267	K261-I263 HydrophobicContact CB-CG1 3.96Å; K261-I263 PolarHBondContact O-N 3.13Å; I263-A265 PolarHBondContact O-N 3.32Å; I263-V266 PolarHBondContact O-N 3.46Å; I263-I267 HydrophobicContact CB-CD1 4.27Å; I263-I267 HydrophobicContact CG2-CD1 3.5Å; I263-I267 VanDerWaalsContact CG2-CD1 3.5Å; I263-I267 HydrophobicContact CG2-CG1 3.87Å; I263-I267 WeakPolarHBondContact O-CG1 3.31Å; I263-I267 PolarHBondContact O-N 3.12Å
264	L	78.6	Confident	78.9	Confident	95 Å²	95	103.9 Å²	103.9	50%	0.497	59%	0.589	S	S	.	*	H	α-helix	trans	-55.6	-36.9	177.9	-155.5	85.7	0	0	0	112.6	D262 V266 I267 K268	D262-L264 PolarHBondContact O-N 3.42Å; L264-V266 VanDerWaalsContact C-N 3.29Å; L264-V266 PolarHBondContact O-N 3.49Å; L264-I267 PolarHBondContact O-N 3.29Å; L264-K268 HydrophobicContact CD2-CD 4.34Å; L264-K268 HydrophobicContact CG-CD 4.33Å; L264-K268 HydrophobicContact CG-CG 4.39Å; L264-K268 WeakPolarHBondContact O-CB 3.49Å; L264-K268 VanDerWaalsContact O-CG 3.25Å; L264-K268 WeakPolarHBondContact O-CG 3.26Å; L264-K268 PolarHBondContact O-N 2.87Å
265	A	76.8	Confident	79.2	Confident	73 Å²	73	105.4 Å²	105.4	60%	0.603	59%	0.589	S	S	*	*	H	α-helix	trans	-67	-30.1	177.5	0	0	0	0	0	112.9	D262 I263 P269	D262-A265 PolarHBondContact O-N 3.01Å; I263-A265 PolarHBondContact O-N 3.32Å; A265-P269 VanDerWaalsContact O-CD 3.23Å; A265-P269 WeakPolarHBondContact O-CD 3.36Å
266	V	79.6	Confident	79.6	Confident	114 Å²	114	105.3 Å²	105.3	69%	0.691	58%	0.584	S	S	*	*	H	α-helix	trans	-82.3	-34	177.7	-177.6	0	0	0	0	111.2	I263 L264	I263-V266 PolarHBondContact O-N 3.46Å; L264-V266 VanDerWaalsContact C-N 3.29Å; L264-V266 PolarHBondContact O-N 3.49Å
267	I	83	Confident	79.9	Confident	80 Å²	80	102.9 Å²	102.9	41%	0.41	57%	0.571	S	S	.	*	H	α-helix	trans	-82	-35.6	-176.5	-68.9	168.3	0	0	0	112.2	I263 L264 A270 I271	I263-I267 HydrophobicContact CB-CD1 4.27Å; I263-I267 HydrophobicContact CG2-CD1 3.5Å; I263-I267 VanDerWaalsContact CG2-CD1 3.5Å; I263-I267 HydrophobicContact CG2-CG1 3.87Å; I263-I267 WeakPolarHBondContact O-CG1 3.31Å; I263-I267 PolarHBondContact O-N 3.12Å; L264-I267 PolarHBondContact O-N 3.29Å; I267-A270 WeakPolarHBondContact O-CB 3.32Å; I267-A270 PolarHBondContact O-N 3.48Å; I267-I271 HydrophobicContact CG2-CD1 3.5Å; I267-I271 VanDerWaalsContact CG2-CD1 3.5Å; I267-I271 HydrophobicContact CG2-CG1 3.78Å; I267-I271 PolarHBondContact O-N 3.13Å
268	K	85.6	Confident	80.3	Confident	128 Å²	128	98.5 Å²	98.5	56%	0.557	56%	0.557	S	S	*	*	H	α-helix	trans	-52	-47.3	-177.7	-87.1	172.9	176.4	174.4	0	113.8	L264 A270 I271 H272	L264-K268 HydrophobicContact CD2-CD 4.34Å; L264-K268 HydrophobicContact CG-CD 4.33Å; L264-K268 HydrophobicContact CG-CG 4.39Å; L264-K268 WeakPolarHBondContact O-CB 3.49Å; L264-K268 VanDerWaalsContact O-CG 3.25Å; L264-K268 WeakPolarHBondContact O-CG 3.26Å; L264-K268 PolarHBondContact O-N 2.87Å; K268-A270 VanDerWaalsContact C-N 3.34Å; K268-A270 PolarHBondContact O-N 3.03Å; K268-I271 PolarHBondContact O-N 2.91Å; K268-H272 PolarHBondContact O-N 3.35Å
269	P	87.2	Confident	81	Confident	81 Å²	81	101.9 Å²	101.9	53%	0.526	56%	0.56	S	S	.	*	H	α-helix	trans	-61.5	-40.2	176.9	-23.1	33.6	0	0	0	112.9	A265 H272 E273	A265-P269 VanDerWaalsContact O-CD 3.23Å; A265-P269 WeakPolarHBondContact O-CD 3.36Å; P269-H272 PolarHBondContact O-N 3.41Å; P269-E273 PolarHBondContact O-N 2.98Å
270	A	84	Confident	81.5	Confident	57 Å²	57	100.4 Å²	100.4	47%	0.471	54%	0.54	S	S	.	.	H	α-helix	trans	-66.9	-39.3	179	0	0	0	0	0	112.3	I267 K268 H272 E273 V274	I267-A270 WeakPolarHBondContact O-CB 3.32Å; I267-A270 PolarHBondContact O-N 3.48Å; K268-A270 VanDerWaalsContact C-N 3.34Å; K268-A270 PolarHBondContact O-N 3.03Å; A270-H272 VanDerWaalsContact C-N 3.35Å; A270-E273 PolarHBondContact O-N 3.36Å; A270-V274 WeakPolarHBondContact O-CG2 3.24Å; A270-V274 PolarHBondContact O-N 3.43Å; A270-V274 VanDerWaalsContact O-N 3.08Å
271	I	88.1	Confident	82	Confident	88 Å²	88	101.1 Å²	101.1	45%	0.451	53%	0.533	S	S	.	.	H	α-helix	trans	-62.4	-44.7	173.5	-67.7	177.6	0	0	0	110.2	I267 K268 E273 V274 E275	I267-I271 HydrophobicContact CG2-CD1 3.5Å; I267-I271 VanDerWaalsContact CG2-CD1 3.5Å; I267-I271 HydrophobicContact CG2-CG1 3.78Å; I267-I271 PolarHBondContact O-N 3.13Å; K268-I271 PolarHBondContact O-N 2.91Å; I271-E273 VanDerWaalsContact C-N 3.33Å; I271-E273 PolarHBondContact O-N 3.3Å; I271-V274 PolarHBondContact O-N 3.26Å; I271-E275 HydrophobicContact CG2-CG 4.4Å; I271-E275 WeakPolarHBondContact O-CG 3.45Å; I271-E275 PolarHBondContact O-N 3.04Å
272	H	87.5	Confident	82.2	Confident	127 Å²	127	100.5 Å²	100.5	59%	0.588	53%	0.534	S	S	*	.	H	α-helix	trans	-64.1	-37.2	-179.9	-156.2	63	0	0	0	112.5	K268 P269 A270 E275 K276	K268-H272 PolarHBondContact O-N 3.35Å; P269-H272 PolarHBondContact O-N 3.41Å; A270-H272 VanDerWaalsContact C-N 3.35Å; H272-E275 PolarHBondContact O-N 3.29Å; H272-K276 WeakPolarHBondContact O-CB 3.47Å; H272-K276 PolarHBondContact O-N 3.19Å
273	E	87	Confident	82.2	Confident	109 Å²	109	99.5 Å²	99.5	51%	0.509	53%	0.525	S	S	.	.	H	α-helix	trans	-63.5	-45.5	174.1	-164.2	69	-150.1	0	0	111.4	P269 A270 I271 K276 I277	P269-E273 PolarHBondContact O-N 2.98Å; A270-E273 PolarHBondContact O-N 3.36Å; I271-E273 VanDerWaalsContact C-N 3.33Å; I271-E273 PolarHBondContact O-N 3.3Å; E273-K276 WeakPolarHBondContact O-CB 3.29Å; E273-K276 PolarHBondContact O-N 3.35Å; E273-I277 HydrophobicContact CG-CD1 4.34Å; E273-I277 VanDerWaalsContact O-CG1 3.31Å; E273-I277 WeakPolarHBondContact O-CG1 3.47Å; E273-I277 PolarHBondContact O-N 3.2Å
274	V	87.5	Confident	81.7	Confident	98 Å²	98	102.8 Å²	102.8	59%	0.594	54%	0.536	S	S	*	.	H	α-helix	trans	-64.7	-41.7	177.5	173.4	0	0	0	0	111.4	A270 I271 K276 I277 A278	A270-V274 WeakPolarHBondContact O-CG2 3.24Å; A270-V274 PolarHBondContact O-N 3.43Å; A270-V274 VanDerWaalsContact O-N 3.08Å; I271-V274 PolarHBondContact O-N 3.26Å; V274-K276 VanDerWaalsContact C-N 3.34Å; V274-K276 PolarHBondContact O-N 3.12Å; V274-I277 PolarHBondContact O-N 2.91Å; V274-A278 WeakPolarHBondContact O-CB 3.04Å; V274-A278 PolarHBondContact O-N 3.26Å
275	E	88.2	Confident	81.1	Confident	95 Å²	95	102.9 Å²	102.9	44%	0.444	54%	0.54	S	S	.	.	H	α-helix	trans	-62.5	-39.8	174.3	-76.3	-175.4	168	0	0	112	I271 H272 A278 K279	I271-E275 HydrophobicContact CG2-CG 4.4Å; I271-E275 WeakPolarHBondContact O-CG 3.45Å; I271-E275 PolarHBondContact O-N 3.04Å; H272-E275 PolarHBondContact O-N 3.29Å; E275-A278 PolarHBondContact O-N 2.71Å; E275-K279 WeakPolarHBondContact O-CB 3.36Å; E275-K279 WeakPolarHBondContact O-CG 3.18Å; E275-K279 PolarHBondContact O-N 3.24Å
276	K	86.2	Confident	80.3	Confident	126 Å²	126	107.7 Å²	107.7	55%	0.548	54%	0.543	S	S	.	.	H	α-helix	trans	-65.2	-40.2	176	-170.5	-179.4	178.9	-174.5	0	111.8	H272 E273 V274 T280	H272-K276 WeakPolarHBondContact O-CB 3.47Å; H272-K276 PolarHBondContact O-N 3.19Å; E273-K276 WeakPolarHBondContact O-CB 3.29Å; E273-K276 PolarHBondContact O-N 3.35Å; V274-K276 VanDerWaalsContact C-N 3.34Å; V274-K276 PolarHBondContact O-N 3.12Å; K276-T280 WeakPolarHBondContact O-CG2 3.45Å; K276-T280 PolarHBondContact O-N 3.35Å; K276-T280 PolarHBondContact O-OG1 2.69Å
277	I	85.6	Confident	79.4	Confident	82 Å²	82	106 Å²	106	42%	0.421	53%	0.533	S	S	.	.	H	α-helix	trans	-66.4	-39.5	174.4	-66.5	165.4	0	0	0	111.1	E273 V274 T280 K281	E273-I277 HydrophobicContact CG-CD1 4.34Å; E273-I277 VanDerWaalsContact O-CG1 3.31Å; E273-I277 WeakPolarHBondContact O-CG1 3.47Å; E273-I277 PolarHBondContact O-N 3.2Å; V274-I277 PolarHBondContact O-N 2.91Å; I277-T280 WeakPolarHBondContact CA-OG1 3.34Å; I277-T280 PolarHBondContact O-OG1 2.74Å; I277-K281 WeakPolarHBondContact O-CB 3.47Å; I277-K281 WeakPolarHBondContact O-CG 3.5Å; I277-K281 PolarHBondContact O-N 2.59Å
278	A	82.1	Confident	78.2	Confident	51 Å²	51	105.6 Å²	105.6	42%	0.421	54%	0.537	S	S	.	.	H	α-helix	trans	-65.9	-44.4	176.7	0	0	0	0	0	111.9	V274 E275 K281 M282	V274-A278 WeakPolarHBondContact O-CB 3.04Å; V274-A278 PolarHBondContact O-N 3.26Å; E275-A278 PolarHBondContact O-N 2.71Å; A278-K281 PolarHBondContact O-N 3.18Å; A278-M282 PolarHBondContact O-N 2.91Å
279	K	84	Confident	76.9	Confident	135 Å²	135	106.1 Å²	106.1	59%	0.587	54%	0.539	S	S	*	.	H	α-helix	trans	-62	-46.8	175.9	-73.6	175.2	-176.9	175.5	0	111.8	E275 K281 M282 E283	E275-K279 WeakPolarHBondContact O-CB 3.36Å; E275-K279 WeakPolarHBondContact O-CG 3.18Å; E275-K279 PolarHBondContact O-N 3.24Å; K279-K281 VanDerWaalsContact C-N 3.35Å; K279-K281 PolarHBondContact O-N 3.22Å; K279-M282 PolarHBondContact O-N 3Å; K279-M282 VanDerWaalsContact O-N 3.16Å; K279-E283 PolarHBondContact O-N 2.75Å
280	T	79.3	Confident	75.3	Confident	72 Å²	72	108.7 Å²	108.7	44%	0.442	54%	0.544	S	S	.	.	H	α-helix	trans	-65.4	-33.6	178	47.4	0	0	0	0	113.3	K276 I277 K284	K276-T280 WeakPolarHBondContact O-CG2 3.45Å; K276-T280 PolarHBondContact O-N 3.35Å; K276-T280 PolarHBondContact O-OG1 2.69Å; I277-T280 WeakPolarHBondContact CA-OG1 3.34Å; I277-T280 PolarHBondContact O-OG1 2.74Å; T280-K284 WeakPolarHBondContact O-CG 3.47Å; T280-K284 PolarHBondContact O-N 2.75Å
281	K	76.8	Confident	74	Confident	140 Å²	140	109.8 Å²	109.8	61%	0.609	55%	0.545	S	S	*	.	H	α-helix	trans	-67	-41.7	170.6	-80.3	-177.1	177.7	179	0	112.1	I277 A278 K279 K284 V285	I277-K281 WeakPolarHBondContact O-CB 3.47Å; I277-K281 WeakPolarHBondContact O-CG 3.5Å; I277-K281 PolarHBondContact O-N 2.59Å; A278-K281 PolarHBondContact O-N 3.18Å; K279-K281 VanDerWaalsContact C-N 3.35Å; K279-K281 PolarHBondContact O-N 3.22Å; K281-K284 PolarHBondContact O-N 3.39Å; K281-V285 WeakPolarHBondContact O-CG2 3.33Å; K281-V285 PolarHBondContact O-N 2.97Å
282	M	72.3	Confident	72.3	Confident	139 Å²	139	111.7 Å²	111.7	69%	0.685	55%	0.552	S	S	*	*	H	α-helix	trans	-65.3	-39.3	175.8	-77	-171	164.6	0	0	112.5	A278 K279 V285 R286	A278-M282 PolarHBondContact O-N 2.91Å; K279-M282 PolarHBondContact O-N 3Å; K279-M282 VanDerWaalsContact O-N 3.16Å; M282-V285 PolarHBondContact O-N 3.09Å; M282-R286 PolarHBondContact O-N 3.31Å
283	E	71.3	Confident	70.6	Confident	116 Å²	116	111 Å²	111	54%	0.542	55%	0.551	S	S	.	*	H	α-helix	trans	-62.4	-46.1	175.2	-150.7	80.1	-151	0	0	111	K279 V285 R286 V287	K279-E283 PolarHBondContact O-N 2.75Å; E283-V285 VanDerWaalsContact C-N 3.31Å; E283-V285 PolarHBondContact O-N 3.14Å; E283-R286 PolarHBondContact O-N 3.46Å; E283-R286 VanDerWaalsContact O-N 3.13Å; E283-V287 WeakPolarHBondContact O-CG2 3.3Å; E283-V287 PolarHBondContact O-N 3.47Å
284	K	65.4	Low	68.9	Low	152 Å²	152	109.6 Å²	109.6	66%	0.661	55%	0.554	S	S	*	*	H	α-helix	trans	-62.8	-36.6	176.9	-75.1	179.2	179.6	-175.7	0	112.5	T280 K281 S288	T280-K284 WeakPolarHBondContact O-CG 3.47Å; T280-K284 PolarHBondContact O-N 2.75Å; K281-K284 PolarHBondContact O-N 3.39Å; K284-S288 VanDerWaalsContact O-CB 3.31Å; K284-S288 WeakPolarHBondContact O-CB 3.5Å; K284-S288 PolarHBondContact O-N 3.48Å; K284-S288 PolarHBondContact O-OG 3.39Å
285	V	65	Low	67.1	Low	97 Å²	97	110.1 Å²	110.1	59%	0.588	55%	0.553	S	S	*	*	H	α-helix	trans	-70.9	-36.6	174.1	175.8	0	0	0	0	111.3	K281 M282 E283 K289	K281-V285 WeakPolarHBondContact O-CG2 3.33Å; K281-V285 PolarHBondContact O-N 2.97Å; M282-V285 PolarHBondContact O-N 3.09Å; E283-V285 VanDerWaalsContact C-N 3.31Å; E283-V285 PolarHBondContact O-N 3.14Å; V285-K289 WeakPolarHBondContact O-CB 3.39Å; V285-K289 PolarHBondContact O-N 3.4Å
286	R	61.2	Low	65	Low	175 Å²	175	110.9 Å²	110.9	66%	0.66	56%	0.56	S	S	*	*	H	α-helix	trans	-66.2	-48.1	174.7	-81.2	-176.8	176	176.7	-2.2	112.4	M282 E283 S288 K289 E290	M282-R286 PolarHBondContact O-N 3.31Å; E283-R286 PolarHBondContact O-N 3.46Å; E283-R286 VanDerWaalsContact O-N 3.13Å; R286-S288 VanDerWaalsContact C-N 3.3Å; R286-S288 PolarHBondContact O-N 3.03Å; R286-K289 CarbonylContact O-C 3.52Å; R286-K289 WeakPolarHBondContact O-CA 3.13Å; R286-K289 PolarHBondContact O-N 3.42Å; R286-E290 PolarHBondContact O-N 3.44Å
287	V	60.1	Low	63.3	Low	78 Å²	78	111.6 Å²	111.6	47%	0.473	57%	0.57	S	S	.	*	H	α-helix	trans	-62.8	-38.2	177.1	177.1	0	0	0	0	111.1	E283 K289 E290 V291	E283-V287 WeakPolarHBondContact O-CG2 3.3Å; E283-V287 PolarHBondContact O-N 3.47Å; V287-K289 VanDerWaalsContact C-N 3.27Å; V287-K289 PolarHBondContact O-N 3.23Å; V287-E290 PolarHBondContact O-N 3.19Å; V287-V291 HydrophobicContact CG1-CG2 4.36Å; V287-V291 WeakPolarHBondContact O-CB 3.49Å; V287-V291 VanDerWaalsContact O-CG2 3.24Å; V287-V291 WeakPolarHBondContact O-CG2 3.48Å; V287-V291 PolarHBondContact O-N 3.45Å
288	S	58.5	Low	61.4	Low	72 Å²	72	116.4 Å²	116.4	50%	0.503	59%	0.59	S	S	.	*	H	α-helix	trans	-67.3	-28.5	174.5	-55.1	0	0	0	0	112.7	K284 R286 Q292	K284-S288 VanDerWaalsContact O-CB 3.31Å; K284-S288 WeakPolarHBondContact O-CB 3.5Å; K284-S288 PolarHBondContact O-N 3.48Å; K284-S288 PolarHBondContact O-OG 3.39Å; R286-S288 VanDerWaalsContact C-N 3.3Å; R286-S288 PolarHBondContact O-N 3.03Å; S288-Q292 VanDerWaalsContact O-CG 3.29Å; S288-Q292 WeakPolarHBondContact O-CG 3.35Å; S288-Q292 PolarHBondContact O-N 3.41Å
289	K	56.8	Low	59.6	Low	139 Å²	139	122.9 Å²	122.9	60%	0.604	61%	0.609	S	S	*	*	H	α-helix	trans	-83.1	-34.9	177.8	-141	171.3	-173.6	-178.8	0	112	V285 R286 V287 Q292 I293	V285-K289 WeakPolarHBondContact O-CB 3.39Å; V285-K289 PolarHBondContact O-N 3.4Å; R286-K289 CarbonylContact O-C 3.52Å; R286-K289 WeakPolarHBondContact O-CA 3.13Å; R286-K289 PolarHBondContact O-N 3.42Å; V287-K289 VanDerWaalsContact C-N 3.27Å; V287-K289 PolarHBondContact O-N 3.23Å; K289-Q292 PolarHBondContact O-N 3.06Å; K289-I293 HydrophobicContact CG-CD1 4.45Å; K289-I293 VanDerWaalsContact O-CD1 3.28Å; K289-I293 WeakPolarHBondContact O-CD1 3.47Å; K289-I293 WeakPolarHBondContact O-CG1 3.4Å; K289-I293 PolarHBondContact O-N 2.98Å
290	E	54.7	Low	57.4	Low	134 Å²	134	127.6 Å²	127.6	63%	0.626	62%	0.623	S	S	*	*	H	α-helix	trans	-72	-34.7	174.7	-90.8	171.3	161.3	0	0	113	R286 V287 Q292 I293 S294	R286-E290 PolarHBondContact O-N 3.44Å; V287-E290 PolarHBondContact O-N 3.19Å; E290-Q292 VanDerWaalsContact C-N 3.31Å; E290-I293 PolarHBondContact O-N 3.31Å; E290-S294 PolarHBondContact O-N 3.03Å; E290-S294 VanDerWaalsContact O-N 3.14Å; E290-S294 PolarHBondContact O-OG 3.26Å
291	V	55.8	Low	55.5	Low	81 Å²	81	127.1 Å²	127.1	49%	0.491	63%	0.633	S	S	.	*	H	α-helix	trans	-73.5	-22	173.7	176.8	0	0	0	0	112.3	V287 N295	V287-V291 HydrophobicContact CG1-CG2 4.36Å; V287-V291 WeakPolarHBondContact O-CB 3.49Å; V287-V291 VanDerWaalsContact O-CG2 3.24Å; V287-V291 WeakPolarHBondContact O-CG2 3.48Å; V287-V291 PolarHBondContact O-N 3.45Å; V291-N295 PolarHBondContact O-ND2 3.2Å
292	Q	53	Low	54.1	Low	128 Å²	128	125.9 Å²	125.9	60%	0.598	64%	0.641	S	S	*	*	H	α-helix	trans	-80.7	-40.2	170.6	-76.7	179.6	-14.6	0	0	111.8	S288 K289 E290 S294 N295 D296	S288-Q292 VanDerWaalsContact O-CG 3.29Å; S288-Q292 WeakPolarHBondContact O-CG 3.35Å; S288-Q292 PolarHBondContact O-N 3.41Å; K289-Q292 PolarHBondContact O-N 3.06Å; E290-Q292 VanDerWaalsContact C-N 3.31Å; Q292-S294 VanDerWaalsContact C-N 3.32Å; Q292-S294 PolarHBondContact O-N 2.86Å; Q292-N295 PolarHBondContact O-N 2.86Å; Q292-D296 WeakPolarHBondContact O-CB 3.37Å; Q292-D296 PolarHBondContact O-N 3.16Å; Q292-D296 VanDerWaalsContact O-N 3.07Å
293	I	51.9	Low	53.1	Low	111 Å²	111	128 Å²	128	57%	0.569	65%	0.65	S	S	*	*	H	α-helix	trans	-68.3	-29.3	179.2	-66.1	161.2	0	0	0	112.5	K289 E290	K289-I293 HydrophobicContact CG-CD1 4.45Å; K289-I293 VanDerWaalsContact O-CD1 3.28Å; K289-I293 WeakPolarHBondContact O-CD1 3.47Å; K289-I293 WeakPolarHBondContact O-CG1 3.4Å; K289-I293 PolarHBondContact O-N 2.98Å; E290-I293 PolarHBondContact O-N 3.31Å
294	S	50.8	Low	52.5	Low	80 Å²	80	127.9 Å²	127.9	56%	0.559	66%	0.659	S	S	*	*	H	α-helix	trans	-83.4	-19.8	177.7	40.5	0	0	0	0	114.3	E290 Q292	E290-S294 PolarHBondContact O-N 3.03Å; E290-S294 VanDerWaalsContact O-N 3.14Å; E290-S294 PolarHBondContact O-OG 3.26Å; Q292-S294 VanDerWaalsContact C-N 3.32Å; Q292-S294 PolarHBondContact O-N 2.86Å
295	N	49	Very low	52.1	Low	109 Å²	109	125 Å²	125	58%	0.583	66%	0.664	S	S	*	*	H	α-helix	trans	-93.8	-16	173	-76.8	-41.7	0	0	0	113.6	V291 Q292	V291-N295 PolarHBondContact O-ND2 3.2Å; Q292-N295 PolarHBondContact O-N 2.86Å
296	D	46.1	Very low	52	Low	111 Å²	111	129.3 Å²	129.3	59%	0.594	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.8	-3.8	179.6	-82	-30.7	0	0	0	114.3	Q292	Q292-D296 WeakPolarHBondContact O-CB 3.37Å; Q292-D296 PolarHBondContact O-N 3.16Å; Q292-D296 VanDerWaalsContact O-N 3.07Å
297	L	48.6	Very low	52.7	Low	142 Å²	142	123.3 Å²	123.3	74%	0.743	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91	-13.5	177.4	-128.1	77.1	0	0	0	114.6
298	E	46.5	Very low	52.9	Low	183 Å²	183	129.5 Å²	129.5	86%	0.855	67%	0.671	S	S	*	*	S	Bend	trans	-109.3	4.7	-179.2	-73.3	-168.9	154.6	0	0	114.7
299	K	44.7	Very low	53.5	Low	186 Å²	186	135.8 Å²	135.8	81%	0.809	69%	0.685	S	S	*	*			trans	-123.6	43	173.3	-77	-177	179.1	175.3	0	113.1	G301	K299-G301 VanDerWaalsContact C-N 3.31Å; K299-G301 PolarHBondContact O-N 3.15Å
300	R	36.9	Very low	54	Low	234 Å²	234	132.4 Å²	132.4	88%	0.883	67%	0.673	S	S	*	*			trans	-88.5	73.4	162.6	-87.7	-175.7	178.4	-178.3	0.7	110.3
301	G	40.8	Very low	54.3	Low	63 Å²	63	131.6 Å²	131.6	65%	0.649	67%	0.67	S	S	*	*	S	Bend	trans	-139.1	96.5	169	0	0	0	0	0	109.6	K299	K299-G301 VanDerWaalsContact C-N 3.31Å; K299-G301 PolarHBondContact O-N 3.15Å
302	S	46.8	Very low	54.6	Low	113 Å²	113	133 Å²	133	79%	0.79	67%	0.674	S	S	*	*			trans	50.8	93.3	161	-157.5	0	0	0	0	118.2
303	Q	51.8	Low	55	Low	184 Å²	184	137.2 Å²	137.2	86%	0.86	69%	0.685	S	S	*	*			trans	-133.6	120.3	151.1	-72.7	-73	-60.1	0	0	108.1
304	P	58.4	Low	55.1	Low	114 Å²	114	140.6 Å²	140.6	74%	0.74	70%	0.696	S	S	*	*			trans	-68.9	136.2	-174.5	26.4	-31.7	0	0	0	111.5	Y306	P304-Y306 PolarHBondContact O-N 3.02Å
305	A	56.9	Low	55.1	Low	92 Å²	92	143.4 Å²	143.4	76%	0.76	70%	0.698	S	S	*	*			trans	-59.2	129.5	176.6	0	0	0	0	0	110.9	S307	A305-S307 PolarHBondContact O-N 2.86Å
306	Y	63.2	Low	55.2	Low	186 Å²	186	147.7 Å²	147.7	73%	0.729	71%	0.711	S	S	*	*			trans	-61.3	102.6	179.6	-176.1	-97.8	0	0	0	110.9	P304 Q311	P304-Y306 PolarHBondContact O-N 3.02Å; Y306-Q311 PolarHBondContact OH-NE2 3.01Å
307	S	76.1	Confident	55.6	Low	50 Å²	50	147.3 Å²	147.3	35%	0.35	72%	0.717	S	S	.	*			trans	-85.9	127.4	169.1	-179.7	0	0	0	0	109.3	A305 Y309 D310	A305-S307 PolarHBondContact O-N 2.86Å; S307-Y309 PolarHBondContact O-N 3.16Å; S307-Y309 PolarHBondContact OG-N 3Å; S307-D310 WeakPolarHBondContact O-CB 3.5Å; S307-D310 PolarHBondContact O-N 3.43Å
308	R	63.1	Low	55.9	Low	208 Å²	208	146.8 Å²	146.8	79%	0.785	72%	0.719	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.4	-21.2	174.4	-177.2	175	176	168.5	-1.4	112.7
309	Y	72.2	Confident	56.4	Low	203 Å²	203	143.1 Å²	143.1	80%	0.796	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90	-7.3	177.5	-65.4	-77.8	0	0	0	114	S307 Q311	S307-Y309 PolarHBondContact O-N 3.16Å; S307-Y309 PolarHBondContact OG-N 3Å; Y309-Q311 VanDerWaalsContact C-N 3.25Å; Y309-Q311 PolarHBondContact O-N 3.48Å
310	D	66.8	Low	57	Low	69 Å²	69	142.1 Å²	142.1	37%	0.369	71%	0.708	S	S	.	*	G	3₁₀ helix	trans	-80.3	-2	176.5	-97.7	-30.4	0	0	0	113.5	S307 D312 R313	S307-D310 WeakPolarHBondContact O-CB 3.5Å; S307-D310 PolarHBondContact O-N 3.43Å; D310-D312 PolarHBondContact O-N 2.7Å; D310-D312 VanDerWaalsContact O-N 3.14Å; D310-R313 WeakPolarHBondContact O-CB 3.32Å; D310-R313 PolarHBondContact O-N 3.15Å
311	Q	61.4	Low	58	Low	117 Å²	117	138.2 Å²	138.2	55%	0.547	71%	0.705	S	S	.	*	G	3₁₀ helix	trans	-62.7	-18.6	175.1	-73.5	-170.8	-12.5	0	0	113.2	Y306 Y309	Y306-Q311 PolarHBondContact OH-NE2 3.01Å; Y309-Q311 VanDerWaalsContact C-N 3.25Å; Y309-Q311 PolarHBondContact O-N 3.48Å
312	D	62.3	Low	58.6	Low	110 Å²	110	142.8 Å²	142.8	59%	0.588	71%	0.707	S	S	*	*	G	3₁₀ helix	trans	-85.3	-10.5	174.8	-70.6	-43.3	0	0	0	114	D310 F314 K315	D310-D312 PolarHBondContact O-N 2.7Å; D310-D312 VanDerWaalsContact O-N 3.14Å; D312-F314 VanDerWaalsContact C-N 3.28Å; D312-F314 PolarHBondContact O-N 3.42Å; D312-K315 IonicContact OD1-NZ 2.86Å; D312-K315 PolarHBondContact OD1-NZ 3.21Å
313	R	60.8	Low	59.1	Low	216 Å²	216	145.2 Å²	145.2	82%	0.815	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72	-23.6	171.3	-103.2	-177.2	175.9	-152.2	-1.3	112.7	D310 K315	D310-R313 WeakPolarHBondContact O-CB 3.32Å; D310-R313 PolarHBondContact O-N 3.15Å; R313-K315 VanDerWaalsContact C-N 3.33Å; R313-K315 PolarHBondContact O-N 3.47Å
314	F	54.2	Low	59.4	Low	183 Å²	183	142.6 Å²	142.6	80%	0.803	70%	0.701	S	S	*	*	S	Bend	trans	-94.8	54.5	175.1	-64.7	-79.4	0	0	0	111.6	D312	D312-F314 VanDerWaalsContact C-N 3.28Å; D312-F314 PolarHBondContact O-N 3.42Å
315	K	51.2	Low	59.6	Low	139 Å²	139	141.5 Å²	141.5	60%	0.604	69%	0.689	S	S	*	*			trans	-142.9	90.9	168.1	-72.9	-178.7	-173.2	150.8	0	109.4	D312 R313	D312-K315 IonicContact OD1-NZ 2.86Å; D312-K315 PolarHBondContact OD1-NZ 3.21Å; R313-K315 VanDerWaalsContact C-N 3.33Å; R313-K315 PolarHBondContact O-N 3.47Å
316	K	50.9	Low	60	Low	199 Å²	199	143.3 Å²	143.3	87%	0.865	69%	0.691	S	S	*	*	S	Bend	trans	-173.2	-10.5	148.4	-110.2	167.6	-177.7	-179.6	0	116.9
317	S	54.3	Low	60.3	Low	102 Å²	102	143.3 Å²	143.3	71%	0.713	70%	0.695	S	S	*	*	S	Bend	trans	-135.7	2	-171.5	56.9	0	0	0	0	117.7
318	V	54.9	Low	59.2	Low	131 Å²	131	149.8 Å²	149.8	79%	0.794	71%	0.712	S	S	*	*	S	Bend	trans	-119	5.7	-178.8	-173.2	0	0	0	0	112.5
319	T	57.2	Low	58.6	Low	106 Å²	106	145.9 Å²	145.9	65%	0.65	71%	0.711	S	S	*	*	S	Bend	trans	-110.8	7.6	-177	-41.8	0	0	0	0	112.9	D321	T319-D321 VanDerWaalsContact C-N 3.32Å; T319-D321 PolarHBondContact O-N 2.75Å
320	E	57.6	Low	57.6	Low	165 Å²	165	145.2 Å²	145.2	77%	0.771	71%	0.713	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.4	-16.9	179.1	-67.2	-170	158.8	0	0	113.5
321	D	58.1	Low	57	Low	153 Å²	153	147.3 Å²	147.3	82%	0.818	73%	0.728	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.5	-4.6	-174.9	-74.5	-23	0	0	0	115.6	T319	T319-D321 VanDerWaalsContact C-N 3.32Å; T319-D321 PolarHBondContact O-N 2.75Å
322	F	52.1	Low	56.6	Low	159 Å²	159	148.3 Å²	148.3	70%	0.697	74%	0.742	S	S	*	*			trans	-107.9	100.6	173.9	-77.6	-85.2	0	0	0	109.8	I324	F322-I324 HydrophobicContact CB-CD1 4.12Å; F322-I324 HydrophobicContact CB-CG1 4.2Å; F322-I324 PolarHBondContact O-N 3.2Å
323	N	58.1	Low	56	Low	164 Å²	164	148.3 Å²	148.3	88%	0.877	75%	0.748	S	S	*	*			trans	-67.5	41.1	-179.5	-128.6	80.3	0	0	0	114	D325	N323-D325 PolarHBondContact O-N 3.35Å; N323-D325 VanDerWaalsContact O-N 3.17Å
324	I	58.2	Low	55.1	Low	128 Å²	128	144.2 Å²	144.2	66%	0.656	75%	0.747	S	S	*	*			trans	-82.2	96.3	-177.5	-57.7	172.7	0	0	0	108.4	F322 T326	F322-I324 HydrophobicContact CB-CD1 4.12Å; F322-I324 HydrophobicContact CB-CG1 4.2Å; F322-I324 PolarHBondContact O-N 3.2Å; I324-T326 HydrophobicContact CG2-CG2 4.44Å; I324-T326 PolarHBondContact O-N 2.79Å
325	D	61	Low	54.5	Low	91 Å²	91	142.6 Å²	142.6	49%	0.487	75%	0.752	S	S	.	*			trans	-69.4	96	174	-168.2	4.5	0	0	0	110.1	N323 K327 R328	N323-D325 PolarHBondContact O-N 3.35Å; N323-D325 VanDerWaalsContact O-N 3.17Å; D325-K327 PolarHBondContact O-N 2.84Å; D325-K327 VanDerWaalsContact O-N 3.12Å; D325-K327 PolarHBondContact OD1-N 2.76Å; D325-R328 PolarHBondContact O-N 3.41Å; D325-R328 IonicContact OD2-NE 3.54Å
326	T	65.2	Low	54	Low	131 Å²	131	144.4 Å²	144.4	80%	0.804	76%	0.762	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.3	2	-178.4	52	0	0	0	0	114	I324	I324-T326 HydrophobicContact CG2-CG2 4.44Å; I324-T326 PolarHBondContact O-N 2.79Å
327	K	70.8	Confident	53.2	Low	185 Å²	185	140.6 Å²	140.6	80%	0.804	76%	0.76	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.9	-0.3	178.1	-63.5	-175.9	-179.5	178.8	0	114.1	D325	D325-K327 PolarHBondContact O-N 2.84Å; D325-K327 VanDerWaalsContact O-N 3.12Å; D325-K327 PolarHBondContact OD1-N 2.76Å
328	R	52.2	Low	52.5	Low	186 Å²	186	139.9 Å²	139.9	70%	0.702	76%	0.761	S	S	*	*			trans	-97.7	106.4	178.4	-73.3	-175.4	173.8	-153.4	-5.3	111.9	D325 F330	D325-R328 PolarHBondContact O-N 3.41Å; D325-R328 IonicContact OD2-NE 3.54Å; R328-F330 PolarHBondContact O-N 3.02Å
329	T	50.6	Low	52	Low	127 Å²	127	140.2 Å²	140.2	78%	0.779	76%	0.763	S	S	*	*			trans	-68.7	107.4	167.5	-58.6	0	0	0	0	109.7	T331	T329-T331 HydrophobicContact CG2-CG2 4.19Å; T329-T331 PolarHBondContact O-N 3.28Å
330	F	51.9	Low	51.2	Low	188 Å²	188	139.8 Å²	139.8	83%	0.825	77%	0.77	S	S	*	*			trans	-84.1	95.2	169.4	-106.4	-91.6	0	0	0	109.7	R328	R328-F330 PolarHBondContact O-N 3.02Å
331	T	53.5	Low	50.3	Low	113 Å²	113	138.1 Å²	138.1	69%	0.693	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-76.5	116.4	161.2	50.4	0	0	0	0	108.4	T329 P333	T329-T331 HydrophobicContact CG2-CG2 4.19Å; T329-T331 PolarHBondContact O-N 3.28Å; T331-P333 WeakPolarHBondContact O-CD 3.03Å
332	V	53.4	Low	49.5	Very low	138 Å²	138	141.2 Å²	141.2	84%	0.836	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-77.7	120.3	170.6	-138.8	0	0	0	0	107.6
333	P	50.4	Low	49.2	Very low	111 Å²	111	140.7 Å²	140.7	72%	0.721	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-80.3	133.5	175.9	29.6	-26.8	0	0	0	110.1	T331	T331-P333 WeakPolarHBondContact O-CD 3.03Å
334	V	41.7	Very low	48.3	Very low	130 Å²	130	140.5 Å²	140.5	79%	0.788	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-61.7	132.3	166	166.5	0	0	0	0	108.7	E336	V334-E336 PolarHBondContact O-N 3.46Å
335	V	41.6	Very low	47.6	Very low	148 Å²	148	137.7 Å²	137.7	90%	0.897	77%	0.772	S	S	*	*			trans	-83.1	108	173.8	-174.7	0	0	0	0	108
336	E	39.8	Very low	47	Very low	178 Å²	178	138.9 Å²	138.9	83%	0.832	78%	0.784	S	S	*	*			trans	-133	127.3	163.9	-153.8	156.9	-154.5	0	0	108.5	V334	V334-E336 PolarHBondContact O-N 3.46Å
337	S	34.3	Very low	45.9	Very low	118 Å²	118	140 Å²	140	83%	0.825	79%	0.785	S	S	*	*			trans	-28.4	137.4	-178	-157.5	0	0	0	0	118.9
338	A	40.8	Very low	44.6	Very low	87 Å²	87	135.7 Å²	135.7	72%	0.719	78%	0.779	S	S	*	*				165.9	124.2	124.4	0	0	0	0	0	114.9
339	V	43.5	Very low	44.2	Very low	138 Å²	138	132.1 Å²	132.1	84%	0.836	78%	0.778	S	S	*	*				45.6	122.6	126.5	-156.6	0	0	0	0	121.1
340	A	41	Very low	43.9	Very low	97 Å²	97	133.6 Å²	133.6	80%	0.802	78%	0.776	S	S	*	*			trans	68.4	147.4	151.7	0	0	0	0	0	118.3
341	D	38.8	Very low	43.6	Very low	131 Å²	131	130.5 Å²	130.5	70%	0.701	77%	0.767	S	S	*	*			cis	-177.2	167.8	-11.9	-175.3	13	0	0	0	104
342	R	40.2	Very low	43.1	Very low	218 Å²	218	132.2 Å²	132.2	82%	0.823	77%	0.772	S	S	*	*			trans	99.9	80.2	165.1	-53.4	179.4	176.5	-174	-1.8	119.8
343	L	46.7	Very low	42.6	Very low	147 Å²	147	129.8 Å²	129.8	77%	0.77	77%	0.766	S	S	*	*				48.1	139.4	105.7	-67.9	163.1	0	0	0	123.5
344	N	39.9	Very low	42.4	Very low	161 Å²	161	128.8 Å²	128.8	86%	0.861	76%	0.762	S	S	*	*			trans	85.6	128	157.7	-67.8	-7.4	0	0	0	117.6
345	G	42.4	Very low	42.6	Very low	68 Å²	68	131.7 Å²	131.7	70%	0.701	77%	0.766	S	S	*	*			cis	149.4	166.3	13	0	0	0	0	0	109.8
346	P	49.6	Very low	42.5	Very low	116 Å²	116	128.1 Å²	128.1	75%	0.753	76%	0.759	S	S	*	*				-132.5	-168.7	-119.6	38.2	-20.9	0	0	0	116
347	N	40.7	Very low	42.5	Very low	154 Å²	154	129.8 Å²	129.8	82%	0.824	76%	0.764	S	S	*	*			trans	135.9	138.4	152.1	-68.4	-17.9	0	0	0	111.1
348	S	43.2	Very low	43	Very low	95 Å²	95	132.9 Å²	132.9	66%	0.664	77%	0.767	S	S	*	*			cis	-167.5	129.5	36.3	-165.4	0	0	0	0	112.9
349	T	43.7	Very low	42.8	Very low	111 Å²	111	135 Å²	135	68%	0.681	78%	0.778	S	S	*	*				60.9	120.7	129.5	63.7	0	0	0	0	124.3
350	H	45.3	Very low	42.6	Very low	159 Å²	159	133.1 Å²	133.1	74%	0.736	78%	0.776	S	S	*	*				175.5	116.2	98.5	-112.4	-95.6	0	0	0	114.1
351	L	44.8	Very low	42.6	Very low	123 Å²	123	133.4 Å²	133.4	64%	0.644	77%	0.772	S	S	*	*			trans	49.9	116	132.5	-52.9	-177.6	0	0	0	122.5
352	N	42.8	Very low	42.9	Very low	149 Å²	149	135.4 Å²	135.4	80%	0.797	78%	0.779	S	S	*	*				88	139.2	97.6	-76.3	-0.3	0	0	0	113.8
353	A	44	Very low	42.9	Very low	86 Å²	86	130.7 Å²	130.7	71%	0.711	78%	0.78	S	S	*	*			cis	-160.9	152.4	6.1	0	0	0	0	0	112
354	S	45.1	Very low	42.7	Very low	91 Å²	91	127.8 Å²	127.8	64%	0.636	78%	0.777	S	S	*	*			trans	49.5	114.6	141.5	65.2	0	0	0	0	123.5
355	H	46.9	Very low	42.8	Very low	190 Å²	190	126.8 Å²	126.8	88%	0.88	78%	0.777	S	S	*	*				142.5	136.8	117.7	-79.5	-59.6	0	0	0	114.3
356	G	39.3	Very low	43	Very low	73 Å²	73	134.4 Å²	134.4	75%	0.753	78%	0.784	S	S	*	*			trans	103.5	93.9	153.6	0	0	0	0	0	116.9	M358	G356-M358 PolarHBondContact O-N 2.93Å
357	K	40	Very low	42.5	Very low	214 Å²	214	135.8 Å²	135.8	93%	0.93	79%	0.785	S	S	*	*			trans	-71.1	113.5	165.5	-73.1	177	176.9	176.8	0	109.9
358	M	44.5	Very low	42.4	Very low	182 Å²	182	135.7 Å²	135.7	90%	0.897	79%	0.785	S	S	*	*			trans	-142.8	116.2	162.2	-58.1	-172.5	76.4	0	0	108.4	G356	G356-M358 PolarHBondContact O-N 2.93Å
359	S	37.3	Very low	42.4	Very low	133 Å²	133	136.3 Å²	136.3	93%	0.93	79%	0.785	S	S	*	*			trans	-92.6	95.7	178.6	174.4	0	0	0	0	109.4
360	A	38.6	Very low	42.3	Very low	97 Å²	97	138.9 Å²	138.9	80%	0.802	79%	0.792	S	S	*	*			trans	-159.9	102.7	164.9	0	0	0	0	0	110.6
361	S	41.1	Very low	42.4	Very low	104 Å²	104	137.6 Å²	137.6	73%	0.727	80%	0.796	S	S	*	*			trans	-173.7	139.3	163.2	95.9	0	0	0	0	106.4
362	M	45.2	Very low	42	Very low	172 Å²	172	135 Å²	135	85%	0.847	80%	0.798	S	S	*	*			cis	-147.4	143.3	18.5	-65.4	-159.6	-151.6	0	0	110.9
363	S	39.8	Very low	42	Very low	119 Å²	119	139.4 Å²	139.4	83%	0.832	80%	0.804	S	S	*	*			trans	-60.3	125	157.4	-53.7	0	0	0	0	110.2
364	A	43.6	Very low	41.7	Very low	87 Å²	87	141.1 Å²	141.1	72%	0.719	81%	0.808	S	S	*	*			trans	-109.3	99.2	153.6	0	0	0	0	0	106.7	R366	A364-R366 PolarHBondContact O-N 2.86Å; A364-R366 VanDerWaalsContact O-N 3.16Å
365	V	41.9	Very low	41.7	Very low	140 Å²	140	142 Å²	142	85%	0.848	81%	0.814	S	S	*	*			trans	-59.6	111.6	165.5	177.1	0	0	0	0	106.4
366	R	46.6	Very low	41.5	Very low	228 Å²	228	141 Å²	141	86%	0.86	81%	0.807	S	S	*	*			trans	-110.2	112.3	167.3	-75.9	-172.8	174.8	177.5	-0.7	107.4	A364	A364-R366 PolarHBondContact O-N 2.86Å; A364-R366 VanDerWaalsContact O-N 3.16Å
367	D	37.6	Very low	41.8	Very low	144 Å²	144	148.6 Å²	148.6	77%	0.77	81%	0.813	S	S	*	*			trans	-51.1	126.3	172.9	-155.4	-2	0	0	0	110.3	T369	D367-T369 PolarHBondContact O-N 3.32Å
368	D	38.5	Very low	42.5	Very low	153 Å²	153	141.8 Å²	141.8	82%	0.818	79%	0.792	S	S	*	*			trans	-97.9	71.9	-171.1	-150.8	10.9	0	0	0	108.5	I370	D368-I370 PolarHBondContact O-N 2.85Å
369	T	44.9	Very low	43.3	Very low	107 Å²	107	136 Å²	136	66%	0.656	77%	0.77	S	S	*	*			trans	-84.2	98	166.4	53.7	0	0	0	0	109.6	D367 V371	D367-T369 PolarHBondContact O-N 3.32Å; T369-V371 PolarHBondContact O-N 3.38Å
370	I	41.3	Very low	45.1	Very low	165 Å²	165	139.2 Å²	139.2	85%	0.846	76%	0.762	S	S	*	*			trans	-9.9	94.5	152.4	-54.8	170.9	0	0	0	113.3	D368	D368-I370 PolarHBondContact O-N 2.85Å
371	V	46	Very low	47.3	Very low	133 Å²	133	136.9 Å²	136.9	81%	0.806	74%	0.735	S	S	*	*			trans	-128.3	106.2	156	-178.2	0	0	0	0	106.9	T369 R373	T369-V371 PolarHBondContact O-N 3.38Å; V371-R373 PolarHBondContact O-N 3.45Å
372	G	37.7	Very low	49.6	Very low	68 Å²	68	133.5 Å²	133.5	70%	0.701	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-51.6	125.1	-175.3	0	0	0	0	0	112.2
373	R	41.2	Very low	51.8	Low	242 Å²	242	125.3 Å²	125.3	91%	0.913	67%	0.67	S	S	*	*	P	Polyproline II helix	trans	-61.5	125.3	168.4	-75.3	-179.8	179.5	179.6	0.3	108.4	V371 S375	V371-R373 PolarHBondContact O-N 3.45Å; R373-S375 PolarHBondContact O-N 3.36Å
374	P	38.6	Very low	54.4	Low	122 Å²	122	119.6 Å²	119.6	79%	0.792	63%	0.63	S	S	*	*	P	Polyproline II helix	trans	-62.8	133.3	179.2	25.4	-32.5	0	0	0	109.5	K376	P374-K376 PolarHBondContact O-N 3.13Å
375	S	45	Very low	56.8	Low	110 Å²	110	115.5 Å²	115.5	77%	0.769	60%	0.596	S	S	*	*	P	Polyproline II helix	trans	-54.8	140.9	176.1	77.1	0	0	0	0	109.9	R373 R377	R373-S375 PolarHBondContact O-N 3.36Å; S375-R377 PolarHBondContact O-N 3.02Å
376	K	42.8	Very low	59.3	Low	168 Å²	168	109 Å²	109	73%	0.73	56%	0.557	S	S	*	*			trans	-47.1	112.2	177	-92.4	177.7	171.8	-179.4	0	108.8	P374 S378	P374-K376 PolarHBondContact O-N 3.13Å; K376-S378 PolarHBondContact O-N 2.95Å
377	R	45.1	Very low	61.5	Low	232 Å²	232	98.3 Å²	98.3	88%	0.875	52%	0.517	S	S	*	.			trans	-50.8	111.2	173.8	-98.1	-179.8	-83	-162.5	-5.2	108.8	S375 S379	S375-R377 PolarHBondContact O-N 3.02Å; R377-S379 PolarHBondContact O-N 3.23Å
378	S	56.2	Low	63.9	Low	71 Å²	71	94.9 Å²	94.9	50%	0.497	50%	0.504	S	S	.	.			trans	-57	131.5	163.7	56	0	0	0	0	107.6	K376 R380	K376-S378 PolarHBondContact O-N 2.95Å; S378-R380 PolarHBondContact O-N 3.37Å; S378-R380 VanDerWaalsContact O-N 3.14Å
379	S	59.9	Low	66.3	Low	60 Å²	60	88.7 Å²	88.7	42%	0.42	47%	0.472	S	S	.	.			trans	-62.2	118.1	-179.8	57.7	0	0	0	0	108.8	R377 I381 R476	R377-S379 PolarHBondContact O-N 3.23Å; S379-I381 PolarHBondContact O-N 3.28Å; S379-I381 VanDerWaalsContact O-N 3.08Å; S379-R476 PolarHBondContact O-NE 3.27Å; S379-R476 PolarHBondContact O-NH1 3.42Å; S379-R476 PolarHBondContact O-NH2 2.96Å; S379-R476 PolarHBondContact OG-NH2 2.73Å
380	R	74.7	Confident	68.4	Low	202 Å²	202	88.8 Å²	88.8	76%	0.762	47%	0.472	S	S	*	.			trans	-81.6	30.2	176.4	-61.7	178.9	-173.5	159.9	-2.1	112.5	S378 P382	S378-R380 PolarHBondContact O-N 3.37Å; S378-R380 VanDerWaalsContact O-N 3.14Å; R380-P382 WeakPolarHBondContact O-CD 3.43Å
381	I	86.2	Confident	70.7	Confident	48 Å²	48	85.1 Å²	85.1	25%	0.246	46%	0.461	C	S	.	.			trans	-73.9	122.7	-178.9	-61.1	172.5	0	0	0	107.4	S379 L426 P438 R440 R476	S379-I381 PolarHBondContact O-N 3.28Å; S379-I381 VanDerWaalsContact O-N 3.08Å; I381-L426 HydrophobicContact CG2-CD1 4.15Å; I381-P438 HydrophobicContact CG1-CG 4.28Å; I381-P438 HydrophobicContact CG2-CB 4.27Å; I381-P438 HydrophobicContact CG2-CG 4.41Å; I381-R440 HydrophobicContact CG2-CB 4.2Å; I381-R476 PolarHBondContact O-NE 3.07Å; I381-R476 PolarHBondContact O-NH2 3.01Å
382	P	89.8	Confident	72.9	Confident	32 Å²	32	79.5 Å²	79.5	21%	0.208	43%	0.428	C	S	.	.			trans	-63.6	148	177.9	26.6	-35.3	0	0	0	111.5	R380 P438 F439 R440 R476 V478	R380-P382 WeakPolarHBondContact O-CD 3.43Å; P382-P438 WeakPolarHBondContact CD-O 2.79Å; P382-F439 HydrophobicContact CB-CD1 3.77Å; P382-F439 HydrophobicContact CB-CE1 3.8Å; P382-F439 HydrophobicContact CG-CD1 3.37Å; P382-F439 HydrophobicContact CG-CD2 4.47Å; P382-F439 HydrophobicContact CG-CE1 3.41Å; P382-F439 VanDerWaalsContact CG-CE1 3.41Å; P382-F439 HydrophobicContact CG-CE2 4.5Å; P382-F439 HydrophobicContact CG-CG 3.93Å; P382-F439 HydrophobicContact CG-CZ 4.01Å; P382-R440 PolarHBondContact O-N 3.43Å; P382-R476 CarbonylContact C-O 3.59Å; P382-R476 WeakPolarHBondContact CA-O 3.27Å; P382-V478 HydrophobicContact CB-CB 4.48Å; P382-V478 HydrophobicContact CB-CG1 3.69Å; P382-V478 HydrophobicContact CB-CG2 3.89Å
383	I	91.3	Very high	75.5	Confident	0 Å²	0	77.8 Å²	77.8	0%	0	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	131	-172.4	-57.2	173.1	0	0	0	109.3	V385 R440 V442 F448 E452 R476 V477 V478	I383-V385 HydrophobicContact CG2-CG2 4.35Å; I383-R440 CarbonylContact C-O 3.56Å; I383-R440 WeakPolarHBondContact CA-O 3.44Å; I383-R440 HydrophobicContact CG1-CB 4.4Å; I383-V442 HydrophobicContact CG2-CG2 4.25Å; I383-F448 HydrophobicContact CD1-CE2 4.25Å; I383-F448 HydrophobicContact CG2-CE2 3.82Å; I383-F448 HydrophobicContact CG2-CZ 3.67Å; I383-E452 HydrophobicContact CD1-CB 4.08Å; I383-E452 HydrophobicContact CD1-CG 4.05Å; I383-R476 HydrophobicContact CD1-CB 3.78Å; I383-R476 HydrophobicContact CG1-CB 4.04Å; I383-R476 PolarHBondContact N-O 3.22Å; I383-V477 HydrophobicContact CB-CG2 4.32Å; I383-V477 HydrophobicContact CG2-CG2 4.45Å; I383-V477 WeakPolarHBondContact O-CA 3.41Å; I383-V478 WeakPolarHBondContact O-CG2 3.39Å; I383-V478 PolarHBondContact O-N 3.47Å
384	I	93.8	Very high	78.1	Confident	0 Å²	0	66.3 Å²	66.3	0%	0	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	123.5	172.3	-59.8	171.1	0	0	0	107.6	L403 F439 R440 I441 V442 V478 A479 F481 F546 W547	I384-L403 HydrophobicContact CD1-CD1 4.25Å; I384-F439 HydrophobicContact CD1-CB 4.21Å; I384-F439 HydrophobicContact CD1-CD1 3.9Å; I384-F439 HydrophobicContact CD1-CG 4.29Å; I384-F439 HydrophobicContact CG1-CD1 4.2Å; I384-R440 PolarHBondContact N-O 2.97Å; I384-I441 WeakPolarHBondContact O-CA 3.33Å; I384-V442 PolarHBondContact O-N 3.47Å; I384-V478 HydrophobicContact CG1-CG2 4.15Å; I384-A479 WeakPolarHBondContact CA-O 3.45Å; I384-A479 HydrophobicContact CG1-CB 4.45Å; I384-A479 HydrophobicContact CG2-CB 4.4Å; I384-F481 HydrophobicContact CG2-CD2 3.98Å; I384-F481 HydrophobicContact CG2-CE2 3.89Å; I384-F546 HydrophobicContact CD1-CZ 4.15Å; I384-W547 HydrophobicContact CD1-CH2 4.2Å; I384-W547 HydrophobicContact CD1-CZ3 4.46Å
385	V	93.7	Very high	80.7	Confident	1 Å²	1	60.9 Å²	60.9	1%	0.006	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	128.4	179.3	-177.5	0	0	0	0	109.8	I383 V442 P445 F448 W453 V477 A479 V480 F481 W492	I383-V385 HydrophobicContact CG2-CG2 4.35Å; V385-V442 CarbonylContact C-O 3.59Å; V385-V442 VanDerWaalsContact CA-O 3.31Å; V385-V442 WeakPolarHBondContact CA-O 3.12Å; V385-P445 HydrophobicContact CG1-CB 4.34Å; V385-P445 HydrophobicContact CG1-CG 4.36Å; V385-F448 HydrophobicContact CG2-CE2 4.06Å; V385-F448 HydrophobicContact CG2-CZ 4.15Å; V385-W453 HydrophobicContact CG2-CH2 4.23Å; V385-W453 HydrophobicContact CG2-CZ2 4.32Å; V385-V477 HydrophobicContact CG2-CG1 3.86Å; V385-A479 PolarHBondContact N-O 2.97Å; V385-V480 HydrophobicContact CB-CG2 4.2Å; V385-V480 CarbonylContact O-C 3.3Å; V385-V480 WeakPolarHBondContact O-CA 3.46Å; V385-F481 PolarHBondContact O-N 3.37Å; V385-W492 HydrophobicContact CB-CH2 4.18Å; V385-W492 HydrophobicContact CG1-CH2 3.72Å; V385-W492 HydrophobicContact CG1-CZ2 3.86Å
386	I	94.4	Very high	83	Confident	2 Å²	2	56.4 Å²	56.4	1%	0.01	29%	0.291	C	S	.	.			trans	-111.3	158.1	174.5	57.1	162.4	0	0	0	111	V394 T395 L396 I441 V442 N443 F481	I386-V394 HydrophobicContact CG2-CG1 3.84Å; I386-T395 VanDerWaalsContact CD1-C 3.43Å; I386-L396 HydrophobicContact CD1-CB 4.32Å; I386-L396 HydrophobicContact CD1-CD2 3.71Å; I386-L396 HydrophobicContact CD1-CG 3.62Å; I386-L396 VanDerWaalsContact CD1-N 3.3Å; I386-L396 HydrophobicContact CG1-CD2 4.37Å; I386-L396 HydrophobicContact CG1-CG 4.49Å; I386-I441 HydrophobicContact CD1-CG2 4.07Å; I386-I441 HydrophobicContact CG1-CG2 4.02Å; I386-I441 HydrophobicContact CG2-CG2 3.98Å; I386-V442 PolarHBondContact N-O 2.89Å; I386-N443 HydrophobicContact CD1-CB 4.36Å; I386-N443 HydrophobicContact CG1-CB 3.96Å; I386-N443 WeakPolarHBondContact O-CA 3.09Å; I386-F481 HydrophobicContact CG2-CB 4.26Å; I386-F481 HydrophobicContact CG2-CD2 3.71Å; I386-F481 HydrophobicContact CG2-CE2 4.46Å; I386-F481 HydrophobicContact CG2-CG 4.25Å
387	P	92.9	Very high	85.3	Confident	5 Å²	5	50.9 Å²	50.9	3%	0.032	27%	0.267	C	S	.	.			trans	-57.5	143.5	174.9	-22.9	32.9	0	0	0	111.4	T389 F481 Q483	P387-T389 PolarHBondContact O-N 3.35Å; P387-F481 WeakPolarHBondContact CD-O 3.5Å; P387-F481 HydrophobicContact CG-CB 4.49Å; P387-F481 WeakPolarHBondContact CG-O 3.42Å; P387-Q483 HydrophobicContact CB-CB 4.41Å; P387-Q483 HydrophobicContact CG-CB 4.13Å
388	S	88.8	Confident	87.6	Confident	71 Å²	71	39.9 Å²	39.9	50%	0.497	23%	0.225	S	C	.	.	S	Bend	trans	-76	-6.6	174.4	61.3	0	0	0	0	113.4
389	T	88.9	Confident	89.4	Confident	24 Å²	24	36.5 Å²	36.5	15%	0.147	20%	0.201	C	C	.	.			trans	-77.2	143.5	-176.9	61	0	0	0	0	111.9	P387 S391 S392 Q483 W487	P387-T389 PolarHBondContact O-N 3.35Å; T389-S391 VanDerWaalsContact C-N 3.28Å; T389-S392 WeakPolarHBondContact OG1-CB 3.37Å; T389-Q483 VanDerWaalsContact OG1-CD 3.27Å; T389-Q483 PolarHBondContact OG1-NE2 3.08Å; T389-Q483 PolarHBondContact OG1-OE1 2.89Å; T389-W487 HydrophobicContact CG2-CH2 3.45Å; T389-W487 VanDerWaalsContact CG2-CH2 3.45Å; T389-W487 HydrophobicContact CG2-CZ2 4.16Å; T389-W487 HydrophobicContact CG2-CZ3 4.44Å
390	T	87.5	Confident	91	Very high	108 Å²	108	39.8 Å²	39.8	66%	0.663	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.5	-16.7	173.3	50.7	0	0	0	0	112.9
391	S	89.3	Confident	91.8	Very high	88 Å²	88	32.4 Å²	32.4	62%	0.615	18%	0.179	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85	-9.7	179.5	55.6	0	0	0	0	114.1	T389 Q483	T389-S391 VanDerWaalsContact C-N 3.28Å; S391-Q483 PolarHBondContact OG-NE2 3.46Å; S391-Q483 VanDerWaalsContact OG-NE2 3.1Å
392	S	92.1	Very high	92.2	Very high	16 Å²	16	30.1 Å²	30.1	11%	0.112	17%	0.167	C	C	.	.	S	Bend	trans	-65.5	145.9	175.6	173.5	0	0	0	0	111.2	T389 V394 T395	T389-S392 WeakPolarHBondContact OG1-CB 3.37Å; S392-V394 VanDerWaalsContact CB-O 3.3Å; S392-V394 WeakPolarHBondContact CB-O 3.43Å; S392-V394 PolarHBondContact O-N 3.03Å; S392-V394 PolarHBondContact OG-N 2.83Å; S392-V394 VanDerWaalsContact OG-N 3.17Å; S392-V394 PolarHBondContact OG-O 2.95Å; S392-T395 WeakPolarHBondContact O-CG2 3.41Å
393	L	93.9	Very high	92.4	Very high	32 Å²	32	28.8 Å²	28.8	17%	0.168	16%	0.158	C	C	.	.	S	Bend	trans	-64.4	-28.4	172.4	-61.6	-172.9	0	0	0	111.9	N398 Y408 L510 W512	L393-N398 PolarHBondContact O-ND2 3.49Å; L393-Y408 HydrophobicContact CB-CE2 4.12Å; L393-Y408 WeakPolarHBondContact O-CE2 3.33Å; L393-Y408 PolarHBondContact O-OH 3.39Å; L393-L510 HydrophobicContact CB-CD2 3.84Å; L393-L510 HydrophobicContact CB-CG 4.28Å; L393-L510 HydrophobicContact CD1-CG 4.27Å; L393-W512 HydrophobicContact CD1-CD2 4.21Å; L393-W512 HydrophobicContact CD1-CG 4.2Å; L393-W512 HydrophobicContact CD1-CZ2 4.48Å; L393-W512 HydrophobicContact CD2-CZ2 3.89Å
394	V	94.3	Very high	92.5	Very high	1 Å²	1	32.2 Å²	32.2	1%	0.006	17%	0.174	C	C	.	.	S	Bend	trans	-107.9	120.3	173	-169.3	0	0	0	0	108.9	I386 S392 A399 L402 F481 L510	I386-V394 HydrophobicContact CG2-CG1 3.84Å; S392-V394 VanDerWaalsContact CB-O 3.3Å; S392-V394 WeakPolarHBondContact CB-O 3.43Å; S392-V394 PolarHBondContact O-N 3.03Å; S392-V394 PolarHBondContact OG-N 2.83Å; S392-V394 VanDerWaalsContact OG-N 3.17Å; S392-V394 PolarHBondContact OG-O 2.95Å; V394-A399 HydrophobicContact CG1-CB 4.16Å; V394-L402 HydrophobicContact CG2-CD1 3.87Å; V394-L402 HydrophobicContact CG2-CD2 4.44Å; V394-F481 HydrophobicContact CB-CD1 4.5Å; V394-F481 HydrophobicContact CG2-CD1 3.88Å; V394-F481 HydrophobicContact CG2-CE1 3.99Å; V394-F481 HydrophobicContact CG2-CG 4.47Å; V394-L510 HydrophobicContact CG2-CB 4.1Å; V394-L510 HydrophobicContact CG2-CD2 3.31Å; V394-L510 HydrophobicContact CG2-CG 4.35Å
395	T	93.8	Very high	92.4	Very high	7 Å²	7	36.6 Å²	36.6	4%	0.043	20%	0.198	C	C	.	.			trans	-132.2	167.4	175	71.7	0	0	0	0	109.6	I386 S392 Y397 N398 A399 S411	I386-T395 VanDerWaalsContact CD1-C 3.43Å; S392-T395 WeakPolarHBondContact O-CG2 3.41Å; T395-Y397 PolarHBondContact O-N 2.98Å; T395-Y397 VanDerWaalsContact O-N 3.14Å; T395-Y397 PolarHBondContact OG1-N 2.89Å; T395-N398 PolarHBondContact N-OD1 2.9Å; T395-N398 PolarHBondContact O-N 3.32Å; T395-N398 PolarHBondContact O-OD1 3.35Å; T395-A399 WeakPolarHBondContact O-CB 3.39Å; T395-A399 PolarHBondContact O-N 3.42Å; T395-S411 VanDerWaalsContact CG2-OG 3.28Å; T395-S411 WeakPolarHBondContact CG2-OG 3.47Å; T395-S411 PolarHBondContact OG1-OG 2.81Å
396	L	92.6	Very high	92.4	Very high	16 Å²	16	37.7 Å²	37.7	8%	0.084	20%	0.203	C	C	.	.	H	α-helix	trans	-58.6	-29.1	176.7	-73.1	170.3	0	0	0	111.7	I386 N398 D422 I425 I441 N443	I386-L396 HydrophobicContact CD1-CB 4.32Å; I386-L396 HydrophobicContact CD1-CD2 3.71Å; I386-L396 HydrophobicContact CD1-CG 3.62Å; I386-L396 VanDerWaalsContact CD1-N 3.3Å; I386-L396 HydrophobicContact CG1-CD2 4.37Å; I386-L396 HydrophobicContact CG1-CG 4.49Å; L396-N398 PolarHBondContact O-N 3.32Å; L396-D422 WeakPolarHBondContact CD1-O 3.44Å; L396-I425 HydrophobicContact CB-CD1 3.9Å; L396-I425 HydrophobicContact CD2-CD1 3.92Å; L396-I425 HydrophobicContact CD2-CG1 4.08Å; L396-I425 WeakPolarHBondContact O-CD1 2.97Å; L396-I441 HydrophobicContact CD2-CB 4.48Å; L396-I441 HydrophobicContact CD2-CG2 3.93Å; L396-N443 HydrophobicContact CD1-CB 3.76Å; L396-N443 VanDerWaalsContact CD1-CG 3.45Å; L396-N443 HydrophobicContact CG-CB 4.11Å
397	Y	92.2	Very high	92.4	Very high	53 Å²	53	43.8 Å²	43.8	21%	0.208	23%	0.226	C	C	.	.	H	α-helix	trans	-64.4	-39.7	179	-60.5	-77.8	0	0	0	113.6	T395 A414 K415 A419 R421	T395-Y397 PolarHBondContact O-N 2.98Å; T395-Y397 VanDerWaalsContact O-N 3.14Å; T395-Y397 PolarHBondContact OG1-N 2.89Å; Y397-A414 WeakPolarHBondContact O-CB 3.44Å; Y397-K415 HydrophobicContact CD1-CG 3.9Å; Y397-K415 HydrophobicContact CE1-CG 4Å; Y397-K415 HydrophobicContact CG-CG 4.24Å; Y397-A419 HydrophobicContact CD1-CB 4.23Å; Y397-R421 HydrophobicContact CE1-CB 4.01Å; Y397-R421 HydrophobicContact CE1-CG 4.4Å; Y397-R421 WeakPolarHBondContact OH-CB 3.38Å; Y397-R421 WeakPolarHBondContact OH-CD 3.48Å; Y397-R421 VanDerWaalsContact OH-CG 3.3Å; Y397-R421 WeakPolarHBondContact OH-CG 3.42Å
398	N	93.4	Very high	92.4	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-107.2	-10.8	-174.9	70.3	-6.3	0	0	0	114.2	L393 T395 L396 R400 E401 L402 A409 A414	L393-N398 PolarHBondContact O-ND2 3.49Å; T395-N398 PolarHBondContact N-OD1 2.9Å; T395-N398 PolarHBondContact O-N 3.32Å; T395-N398 PolarHBondContact O-OD1 3.35Å; L396-N398 PolarHBondContact O-N 3.32Å; N398-R400 PolarHBondContact O-N 3.28Å; N398-R400 VanDerWaalsContact O-N 3.17Å; N398-E401 PolarHBondContact O-N 3.46Å; N398-E401 VanDerWaalsContact O-N 3.12Å; N398-L402 WeakPolarHBondContact O-CB 3.17Å; N398-L402 PolarHBondContact O-N 3.47Å; N398-A409 WeakPolarHBondContact CB-O 3.31Å; N398-A409 PolarHBondContact ND2-O 3.24Å; N398-A414 HydrophobicContact CB-CB 4.44Å
399	A	94	Very high	92.6	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-58.2	-33.3	-175.1	0	0	0	0	0	113.3	V394 T395 L403 I441	V394-A399 HydrophobicContact CG1-CB 4.16Å; T395-A399 WeakPolarHBondContact O-CB 3.39Å; T395-A399 PolarHBondContact O-N 3.42Å; A399-L403 WeakPolarHBondContact O-CB 3.43Å; A399-L403 PolarHBondContact O-N 3.48Å; A399-I441 HydrophobicContact CB-CD1 3.91Å; A399-I441 HydrophobicContact CB-CG2 4.23Å
400	R	92.7	Very high	92.8	Very high	130 Å²	130	41.2 Å²	41.2	49%	0.491	21%	0.208	S	C	.	.	H	α-helix	trans	-62.6	-54.4	174.3	-175.3	179.7	-70.7	-168.8	-1.8	111.6	N398 L402 L403 E404 I425 I427	N398-R400 PolarHBondContact O-N 3.28Å; N398-R400 VanDerWaalsContact O-N 3.17Å; R400-L402 VanDerWaalsContact C-N 3.25Å; R400-L402 PolarHBondContact O-N 3.36Å; R400-L403 PolarHBondContact O-N 3.05Å; R400-E404 HydrophobicContact CG-CB 4.5Å; R400-E404 WeakPolarHBondContact CG-OE2 3.46Å; R400-E404 WeakPolarHBondContact O-CB 3.1Å; R400-E404 PolarHBondContact O-N 3.24Å; R400-I425 HydrophobicContact CB-CG2 4.44Å; R400-I427 HydrophobicContact CB-CG2 4.29Å; R400-I427 HydrophobicContact CG-CG2 4.19Å
401	E	92.6	Very high	92.9	Very high	47 Å²	47	36.8 Å²	36.8	22%	0.22	18%	0.181	C	C	.	.	H	α-helix	trans	-60.4	-39.5	179.3	-171.5	72.8	174.9	0	0	111.4	N398 N405 L406 R407 A409	N398-E401 PolarHBondContact O-N 3.46Å; N398-E401 VanDerWaalsContact O-N 3.12Å; E401-N405 CarbonylContact O-C 3.48Å; E401-N405 WeakPolarHBondContact O-CA 3.43Å; E401-N405 WeakPolarHBondContact O-CB 3.36Å; E401-N405 PolarHBondContact O-N 3.12Å; E401-N405 PolarHBondContact OE2-ND2 3.36Å; E401-L406 PolarHBondContact O-N 3.2Å; E401-R407 CarbonylContact C-O 3.49Å; E401-R407 VanDerWaalsContact C-O 3.27Å; E401-R407 HydrophobicContact CG-CB 4.35Å; E401-R407 WeakPolarHBondContact CG-O 3.39Å; E401-R407 PolarHBondContact O-N 2.92Å; E401-R407 VanDerWaalsContact O-O 3.14Å; E401-R407 IonicContact OE1-NH1 3.79Å; E401-A409 HydrophobicContact CB-CB 4.4Å; E401-A409 HydrophobicContact CG-CB 4.03Å
402	L	94.4	Very high	92.9	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-68.6	-45.3	-177.5	-167.6	148.8	0	0	0	112.7	V394 N398 R400 L406 R407 Y408 L510 L543	V394-L402 HydrophobicContact CG2-CD1 3.87Å; V394-L402 HydrophobicContact CG2-CD2 4.44Å; N398-L402 WeakPolarHBondContact O-CB 3.17Å; N398-L402 PolarHBondContact O-N 3.47Å; R400-L402 VanDerWaalsContact C-N 3.25Å; R400-L402 PolarHBondContact O-N 3.36Å; L402-L406 WeakPolarHBondContact O-CA 3.31Å; L402-R407 VanDerWaalsContact CA-O 3.31Å; L402-R407 WeakPolarHBondContact CA-O 3.43Å; L402-R407 PolarHBondContact N-O 3.28Å; L402-Y408 HydrophobicContact CD1-CD2 3.65Å; L402-Y408 HydrophobicContact CD1-CE2 4.09Å; L402-L510 HydrophobicContact CD1-CD2 3.79Å; L402-L543 HydrophobicContact CD2-CD2 3.59Å; L402-L543 HydrophobicContact CG-CD1 4.18Å; L402-L543 HydrophobicContact CG-CD2 4.01Å; L402-L543 WeakPolarHBondContact O-CD1 3.46Å
403	L	94	Very high	92.9	Very high	3 Å²	3	40.7 Å²	40.7	2%	0.016	19%	0.191	C	C	.	.	H	α-helix	trans	-94.4	-32.8	-173.5	-65.9	178.2	0	0	0	113.7	I384 A399 R400 I427 I441 F481 F546 W547	I384-L403 HydrophobicContact CD1-CD1 4.25Å; A399-L403 WeakPolarHBondContact O-CB 3.43Å; A399-L403 PolarHBondContact O-N 3.48Å; R400-L403 PolarHBondContact O-N 3.05Å; L403-I427 HydrophobicContact CB-CD1 3.63Å; L403-I427 HydrophobicContact CD1-CD1 4.15Å; L403-I441 HydrophobicContact CD1-CD1 3.78Å; L403-I441 HydrophobicContact CD1-CG1 4.44Å; L403-F481 HydrophobicContact CD1-CE2 4.4Å; L403-F481 HydrophobicContact CD2-CE2 4.39Å; L403-F481 HydrophobicContact CD2-CZ 4.07Å; L403-F546 HydrophobicContact CD2-CD1 3.85Å; L403-F546 HydrophobicContact CD2-CE1 3.62Å; L403-F546 HydrophobicContact CD2-CG 4.49Å; L403-F546 HydrophobicContact CD2-CZ 4.08Å; L403-W547 HydrophobicContact CB-CZ2 4.03Å; L403-W547 WeakPolarHBondContact O-CZ2 3.43Å; L403-W547 PolarHBondContact O-NE1 2.83Å
404	E	92.5	Very high	92.5	Very high	72 Å²	72	39.6 Å²	39.6	34%	0.336	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.5	-48.6	-178.8	-170.5	169.7	-173.3	0	0	111.7	R400	R400-E404 HydrophobicContact CG-CB 4.5Å; R400-E404 WeakPolarHBondContact CG-OE2 3.46Å; R400-E404 WeakPolarHBondContact O-CB 3.1Å; R400-E404 PolarHBondContact O-N 3.24Å
405	N	92.1	Very high	92.1	Very high	93 Å²	93	43.9 Å²	43.9	50%	0.497	21%	0.205	S	C	.	.	S	Bend	trans	-91.7	-4.2	-178.3	-65	-33.7	0	0	0	113.4	E401 R407	E401-N405 CarbonylContact O-C 3.48Å; E401-N405 WeakPolarHBondContact O-CA 3.43Å; E401-N405 WeakPolarHBondContact O-CB 3.36Å; E401-N405 PolarHBondContact O-N 3.12Å; E401-N405 PolarHBondContact OE2-ND2 3.36Å; N405-R407 PolarHBondContact O-N 3.02Å
406	L	93.9	Very high	91.8	Very high	23 Å²	23	49.5 Å²	49.5	12%	0.12	24%	0.24	C	C	.	.			trans	53.9	38.2	-179.6	-53.6	179.3	0	0	0	113	E401 L402 R540 L543	E401-L406 PolarHBondContact O-N 3.2Å; L402-L406 WeakPolarHBondContact O-CA 3.31Å; L406-R540 HydrophobicContact CB-CB 4.35Å; L406-R540 HydrophobicContact CB-CG 4.05Å; L406-R540 HydrophobicContact CD1-CG 4.05Å; L406-R540 WeakPolarHBondContact O-CA 3.23Å; L406-R540 PolarHBondContact O-N 2.99Å; L406-L543 HydrophobicContact CB-CB 4.36Å; L406-L543 HydrophobicContact CD2-CB 3.97Å
407	R	93.5	Very high	91.3	Very high	130 Å²	130	55.6 Å²	55.6	49%	0.491	27%	0.266	S	S	.	.			trans	-132.2	130.8	-179.2	-178.1	-174.8	173.7	-165.3	4.8	108.8	E401 L402 N405	E401-R407 CarbonylContact C-O 3.49Å; E401-R407 VanDerWaalsContact C-O 3.27Å; E401-R407 HydrophobicContact CG-CB 4.35Å; E401-R407 WeakPolarHBondContact CG-O 3.39Å; E401-R407 PolarHBondContact O-N 2.92Å; E401-R407 VanDerWaalsContact O-O 3.14Å; E401-R407 IonicContact OE1-NH1 3.79Å; L402-R407 VanDerWaalsContact CA-O 3.31Å; L402-R407 WeakPolarHBondContact CA-O 3.43Å; L402-R407 PolarHBondContact N-O 3.28Å; N405-R407 PolarHBondContact O-N 3.02Å
408	Y	94.8	Very high	90.5	Very high	13 Å²	13	55.9 Å²	55.9	5%	0.051	28%	0.284	C	S	.	.			trans	-69.4	145	172.4	-172.8	-100.1	0	0	0	109.5	L393 L402 L510 W512 L531 R536 D539	L393-Y408 HydrophobicContact CB-CE2 4.12Å; L393-Y408 WeakPolarHBondContact O-CE2 3.33Å; L393-Y408 PolarHBondContact O-OH 3.39Å; L402-Y408 HydrophobicContact CD1-CD2 3.65Å; L402-Y408 HydrophobicContact CD1-CE2 4.09Å; Y408-L510 HydrophobicContact CD2-CD2 4.44Å; Y408-L510 HydrophobicContact CE2-CD2 4.33Å; Y408-W512 AromaticContact CD1-CH2 3.63Å; Y408-W512 HydrophobicContact CD1-CH2 3.63Å; Y408-W512 HydrophobicContact CD1-CZ2 4.39Å; Y408-W512 HydrophobicContact CD1-CZ3 4.48Å; Y408-W512 AromaticContact CE1-CH2 3.31Å; Y408-W512 HydrophobicContact CE1-CH2 3.31Å; Y408-W512 AromaticContact CE1-CZ2 3.62Å; Y408-W512 HydrophobicContact CE1-CZ2 3.62Å; Y408-W512 HydrophobicContact CE1-CZ3 4.48Å; Y408-W512 HydrophobicContact CG-CH2 4.39Å; Y408-W512 AromaticContact CZ-CH2 3.81Å; Y408-W512 AromaticContact CZ-CZ2 3.77Å; Y408-L531 HydrophobicContact CD2-CD1 3.43Å; Y408-L531 VanDerWaalsContact CD2-CD1 3.43Å; Y408-L531 HydrophobicContact CE2-CD1 4.15Å; Y408-L531 HydrophobicContact CG-CD1 3.83Å; Y408-R536 PolarHBondContact O-NH2 3.1Å; Y408-D539 WeakPolarHBondContact CB-OD2 3.44Å; Y408-D539 PolarHBondContact N-OD2 3.48Å; Y408-D539 VanDerWaalsContact N-OD2 3.08Å
409	A	92.2	Very high	89.4	Confident	4 Å²	4	57.8 Å²	57.8	3%	0.033	30%	0.3	C	S	.	.			trans	-139.4	141.1	163.5	0	0	0	0	0	106.9	N398 E401	N398-A409 WeakPolarHBondContact CB-O 3.31Å; N398-A409 PolarHBondContact ND2-O 3.24Å; E401-A409 HydrophobicContact CB-CB 4.4Å; E401-A409 HydrophobicContact CG-CB 4.03Å
410	S	92.1	Very high	88.3	Confident	30 Å²	30	67.9 Å²	67.9	21%	0.21	34%	0.338	C	S	.	.			trans	-68.4	153.6	176.9	66.1	0	0	0	0	110.3	D412 E413 A414	S410-D412 PolarHBondContact O-N 3.28Å; S410-E413 PolarHBondContact O-N 3.03Å; S410-E413 WeakPolarHBondContact OG-CB 3.24Å; S410-E413 WeakPolarHBondContact OG-CG 3.3Å; S410-E413 PolarHBondContact OG-N 3.07Å; S410-E413 PolarHBondContact OG-OE1 3.23Å; S410-A414 PolarHBondContact O-N 3.03Å
411	S	90.3	Very high	87.2	Confident	15 Å²	15	69.9 Å²	69.9	11%	0.105	35%	0.346	C	S	.	.	H	α-helix	trans	-57.9	-30.9	176.8	-61.1	0	0	0	0	112	T395 K415	T395-S411 VanDerWaalsContact CG2-OG 3.28Å; T395-S411 WeakPolarHBondContact CG2-OG 3.47Å; T395-S411 PolarHBondContact OG1-OG 2.81Å; S411-K415 VanDerWaalsContact O-CG 3.28Å; S411-K415 WeakPolarHBondContact O-CG 3.28Å; S411-K415 PolarHBondContact O-N 3.23Å; S411-K415 VanDerWaalsContact O-N 3.11Å
412	D	90.5	Very high	86.6	Confident	100 Å²	100	71.6 Å²	71.6	54%	0.535	36%	0.357	S	S	.	.	H	α-helix	trans	-80.7	-36.4	-179.4	-59.1	-38.8	0	0	0	112.6	S410 A414 K415 T416	S410-D412 PolarHBondContact O-N 3.28Å; D412-A414 VanDerWaalsContact C-N 3.29Å; D412-A414 PolarHBondContact O-N 2.93Å; D412-K415 PolarHBondContact O-N 2.93Å; D412-K415 IonicContact OD1-NZ 2.76Å; D412-K415 PolarHBondContact OD1-NZ 2.92Å; D412-T416 PolarHBondContact O-N 3.38Å; D412-T416 PolarHBondContact O-OG1 3.46Å
413	E	90.2	Very high	86	Confident	85 Å²	85	77 Å²	77	40%	0.397	39%	0.385	S	S	.	.	H	α-helix	trans	-59.2	-42.2	167.7	-77.8	160.4	-132.4	0	0	111.3	S410 T416 K417	S410-E413 PolarHBondContact O-N 3.03Å; S410-E413 WeakPolarHBondContact OG-CB 3.24Å; S410-E413 WeakPolarHBondContact OG-CG 3.3Å; S410-E413 PolarHBondContact OG-N 3.07Å; S410-E413 PolarHBondContact OG-OE1 3.23Å; E413-T416 PolarHBondContact O-N 3.24Å; E413-K417 WeakPolarHBondContact O-CG 3.37Å; E413-K417 PolarHBondContact O-N 2.93Å
414	A	86.7	Confident	85.8	Confident	9 Å²	9	81.4 Å²	81.4	7%	0.074	41%	0.406	C	S	.	.	H	α-helix	trans	-66.5	-40.4	179.6	0	0	0	0	0	112.4	Y397 N398 S410 D412 T416 K417 A419	Y397-A414 WeakPolarHBondContact O-CB 3.44Å; N398-A414 HydrophobicContact CB-CB 4.44Å; S410-A414 PolarHBondContact O-N 3.03Å; D412-A414 VanDerWaalsContact C-N 3.29Å; D412-A414 PolarHBondContact O-N 2.93Å; A414-T416 VanDerWaalsContact C-N 3.33Å; A414-T416 PolarHBondContact O-N 2Å; A414-K417 PolarHBondContact O-N 2.87Å; A414-A419 WeakPolarHBondContact O-CB 3.01Å; A414-A419 PolarHBondContact O-N 3.42Å
415	K	86.2	Confident	85.7	Confident	91 Å²	91	78.7 Å²	78.7	40%	0.396	39%	0.393	S	S	.	.	H	α-helix	trans	-62.2	-41	173.4	-71.7	168.5	-163.1	159.5	0	112	Y397 S411 D412 K417 G418	Y397-K415 HydrophobicContact CD1-CG 3.9Å; Y397-K415 HydrophobicContact CE1-CG 4Å; Y397-K415 HydrophobicContact CG-CG 4.24Å; S411-K415 VanDerWaalsContact O-CG 3.28Å; S411-K415 WeakPolarHBondContact O-CG 3.28Å; S411-K415 PolarHBondContact O-N 3.23Å; S411-K415 VanDerWaalsContact O-N 3.11Å; D412-K415 PolarHBondContact O-N 2.93Å; D412-K415 IonicContact OD1-NZ 2.76Å; D412-K415 PolarHBondContact OD1-NZ 2.92Å; K415-K417 PolarHBondContact O-N 3.3Å; K415-G418 PolarHBondContact O-N 3.45Å
416	T	86.8	Confident	85.7	Confident	126 Å²	126	78 Å²	78	77%	0.773	39%	0.389	S	S	*	.	H	α-helix	trans	-63.9	-31.8	179.8	-52.7	0	0	0	0	111.9	D412 E413 A414 G418	D412-T416 PolarHBondContact O-N 3.38Å; D412-T416 PolarHBondContact O-OG1 3.46Å; E413-T416 PolarHBondContact O-N 3.24Å; A414-T416 VanDerWaalsContact C-N 3.33Å; A414-T416 PolarHBondContact O-N 2Å; T416-G418 PolarHBondContact O-N 3.15Å
417	K	81.8	Confident	85.7	Confident	144 Å²	144	76.9 Å²	76.9	63%	0.626	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.7	4.4	172.8	-67.7	178	-177.2	178.7	0	114.2	E413 A414 K415	E413-K417 WeakPolarHBondContact O-CG 3.37Å; E413-K417 PolarHBondContact O-N 2.93Å; A414-K417 PolarHBondContact O-N 2.87Å; K415-K417 PolarHBondContact O-N 3.3Å
418	G	75.4	Confident	85.5	Confident	58 Å²	58	74.6 Å²	74.6	60%	0.598	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.4	18.9	177	0	0	0	0	0	115	K415 T416 R420	K415-G418 PolarHBondContact O-N 3.45Å; T416-G418 PolarHBondContact O-N 3.15Å; G418-R420 PolarHBondContact O-N 2.85Å
419	A	70.1	Confident	85.2	Confident	41 Å²	41	75.3 Å²	75.3	34%	0.339	38%	0.381	S	S	.	.			trans	-63.2	121.3	176.4	0	0	0	0	0	111.1	Y397 A414	Y397-A419 HydrophobicContact CD1-CB 4.23Å; A414-A419 WeakPolarHBondContact O-CB 3.01Å; A414-A419 PolarHBondContact O-N 3.42Å
420	R	70.7	Confident	84.9	Confident	212 Å²	212	85.8 Å²	85.8	80%	0.8	42%	0.42	S	S	*	.			trans	-74.8	150.5	173.8	-67.9	-169.1	176.1	-149	-0.7	110.5	G418 D422	G418-R420 PolarHBondContact O-N 2.85Å; R420-D422 VanDerWaalsContact C-N 3.28Å; R420-D422 PolarHBondContact O-N 3.39Å
421	R	71.1	Confident	84.4	Confident	172 Å²	172	89 Å²	89	65%	0.649	43%	0.427	S	S	*	.			trans	-79.2	80.3	174.5	-168.6	-177	-177.1	172	-0.8	109.6	Y397	Y397-R421 HydrophobicContact CE1-CB 4.01Å; Y397-R421 HydrophobicContact CE1-CG 4.4Å; Y397-R421 WeakPolarHBondContact OH-CB 3.38Å; Y397-R421 WeakPolarHBondContact OH-CD 3.48Å; Y397-R421 VanDerWaalsContact OH-CG 3.3Å; Y397-R421 WeakPolarHBondContact OH-CG 3.42Å
422	D	78.7	Confident	83.7	Confident	83 Å²	83	97.5 Å²	97.5	44%	0.444	47%	0.465	S	S	.	.			trans	-74.7	152.2	169.7	-61.3	-34.5	0	0	0	109.7	L396 R420 E424 I425	L396-D422 WeakPolarHBondContact CD1-O 3.44Å; R420-D422 VanDerWaalsContact C-N 3.28Å; R420-D422 PolarHBondContact O-N 3.39Å; D422-E424 VanDerWaalsContact C-N 3.3Å; D422-E424 WeakPolarHBondContact CB-O 3.46Å; D422-I425 HydrophobicContact CB-CG1 4.41Å
423	N	82.2	Confident	83	Confident	112 Å²	112	98.2 Å²	98.2	60%	0.599	47%	0.469	S	S	*	.	S	Bend	trans	-82.1	-16.4	173.5	-68.2	-44.4	0	0	0	112
424	E	89	Confident	82.5	Confident	96 Å²	96	97.6 Å²	97.6	45%	0.449	49%	0.485	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	150.7	-178.8	62	-178.1	-168.4	0	0	110	D422 R440 I441 V442	D422-E424 VanDerWaalsContact C-N 3.3Å; D422-E424 WeakPolarHBondContact CB-O 3.46Å; E424-R440 IonicContact OE2-CZ 2.98Å; E424-R440 IonicContact OE2-NE 3.8Å; E424-R440 PolarHBondContact OE2-NE 3.36Å; E424-R440 IonicContact OE2-NH2 2.59Å; E424-R440 PolarHBondContact OE2-NH2 3.25Å; E424-I441 CarbonylContact C-O 3.54Å; E424-I441 VanDerWaalsContact CA-O 3.24Å; E424-I441 WeakPolarHBondContact CA-O 2.92Å; E424-V442 HydrophobicContact CB-CG2 4.21Å
425	I	91.2	Very high	82.2	Confident	15 Å²	15	100.7 Å²	100.7	8%	0.077	50%	0.503	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	132.1	178.9	-61.6	172.5	0	0	0	108.4	L396 R400 D422 I427 R440 I441	L396-I425 HydrophobicContact CB-CD1 3.9Å; L396-I425 HydrophobicContact CD2-CD1 3.92Å; L396-I425 HydrophobicContact CD2-CG1 4.08Å; L396-I425 WeakPolarHBondContact O-CD1 2.97Å; R400-I425 HydrophobicContact CB-CG2 4.44Å; D422-I425 HydrophobicContact CB-CG1 4.41Å; I425-I427 HydrophobicContact CG2-CG2 3.97Å; I425-R440 CarbonylContact O-C 3.58Å; I425-I441 HydrophobicContact CB-CB 4.42Å; I425-I441 PolarHBondContact N-O 2.88Å; I425-I441 PolarHBondContact O-N 2.94Å
426	L	92.2	Very high	82.2	Confident	79 Å²	79	99.3 Å²	99.3	41%	0.414	51%	0.505	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	123	169.1	-166.8	71.6	0	0	0	108.8	I381 P438 F439 R440	I381-L426 HydrophobicContact CG2-CD1 4.15Å; L426-P438 HydrophobicContact CD1-CB 4.1Å; L426-F439 WeakPolarHBondContact CA-O 3.19Å; L426-R440 HydrophobicContact CD1-CB 4.45Å
427	I	93	Very high	82.2	Confident	0 Å²	0	94.4 Å²	94.4	0%	0	48%	0.476	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	156.5	173.6	63.7	161.1	0	0	0	110	R400 L403 I425 P438 F439 I441 W547	R400-I427 HydrophobicContact CB-CG2 4.29Å; R400-I427 HydrophobicContact CG-CG2 4.19Å; L403-I427 HydrophobicContact CB-CD1 3.63Å; L403-I427 HydrophobicContact CD1-CD1 4.15Å; I425-I427 HydrophobicContact CG2-CG2 3.97Å; I427-P438 CarbonylContact O-C 3.49Å; I427-P438 WeakPolarHBondContact O-CA 3.49Å; I427-F439 HydrophobicContact CD1-CB 4.23Å; I427-F439 HydrophobicContact CG1-CB 3.8Å; I427-F439 PolarHBondContact N-O 3.08Å; I427-F439 PolarHBondContact O-N 3Å; I427-I441 HydrophobicContact CB-CD1 4.43Å; I427-I441 HydrophobicContact CD1-CD1 3.9Å; I427-I441 HydrophobicContact CD1-CG1 4.41Å; I427-I441 HydrophobicContact CG1-CD1 4Å; I427-I441 HydrophobicContact CG1-CG1 4.28Å; I427-I441 HydrophobicContact CG2-CD1 3.58Å; I427-I441 HydrophobicContact CG2-CG1 4.46Å; I427-W547 HydrophobicContact CD1-CH2 4.05Å; I427-W547 HydrophobicContact CD1-CZ2 4.05Å
428	H	91.1	Very high	82.7	Confident	82 Å²	82	89.5 Å²	89.5	38%	0.38	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	113.5	178.3	-74.1	91.9	0	0	0	110.2	S436	H428-S436 WeakPolarHBondContact CB-OG 3.49Å
429	R	88.7	Confident	83.5	Confident	28 Å²	28	87.2 Å²	87.2	11%	0.106	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	120.8	175.2	-177.3	-172.5	174.4	-177.7	-6.2	109.8	S436 S437 F439 W547 D551	R429-S436 CarbonylContact O-C 3.52Å; R429-S436 VanDerWaalsContact O-CA 3.32Å; R429-S436 WeakPolarHBondContact O-CA 3.16Å; R429-S437 PolarHBondContact N-O 3.37Å; R429-S437 PolarHBondContact O-N 3.17Å; R429-F439 HydrophobicContact CB-CD2 4.04Å; R429-F439 HydrophobicContact CB-CE2 3.84Å; R429-W547 HydrophobicContact CB-CH2 4.16Å; R429-W547 HydrophobicContact CB-CZ2 4.31Å; R429-W547 VanDerWaalsContact CD-CE3 3.45Å; R429-W547 HydrophobicContact CG-CD2 4.39Å; R429-W547 HydrophobicContact CG-CE3 4.47Å; R429-W547 HydrophobicContact CG-CH2 4.32Å; R429-W547 HydrophobicContact CG-CZ2 4.25Å; R429-W547 HydrophobicContact CG-CZ3 4.43Å; R429-W547 PolarHBondContact NH1-O 3.31Å; R429-D551 IonicContact CZ-OD1 2.69Å; R429-D551 IonicContact CZ-OD2 2.59Å; R429-D551 IonicContact NH1-OD1 3.46Å; R429-D551 PolarHBondContact NH1-OD1 2.81Å; R429-D551 IonicContact NH1-OD2 2.99Å; R429-D551 PolarHBondContact NH1-OD2 3.28Å; R429-D551 IonicContact NH2-OD1 3.85Å; R429-D551 IonicContact NH2-OD2 3.18Å; R429-D551 PolarHBondContact NH2-OD2 3.19Å
430	R	85	Confident	84.6	Confident	223 Å²	223	87.7 Å²	87.7	84%	0.842	43%	0.426	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.4	117.9	168.3	-60.7	-178.7	-174.2	-174.5	1	109.3
431	R	81.5	Confident	85.7	Confident	99 Å²	99	77.6 Å²	77.6	37%	0.374	39%	0.388	S	S	.	.	P	Polyproline II helix	trans	-84.5	159.8	171.2	-65.8	-173	-176.6	-139.9	-6.3	110.1	N433 G434 T435 S437 D551	R431-N433 WeakPolarHBondContact CB-OD1 3.26Å; R431-N433 PolarHBondContact O-N 3.41Å; R431-G434 PolarHBondContact O-N 2.97Å; R431-T435 WeakPolarHBondContact CB-O 3.31Å; R431-T435 PolarHBondContact N-O 2.92Å; R431-S437 PolarHBondContact NE-OG 3.24Å; R431-S437 VanDerWaalsContact NE-OG 3.17Å; R431-D551 IonicContact NH2-OD1 2.86Å
432	E	75.7	Confident	86.7	Confident	193 Å²	193	69.9 Å²	69.9	90%	0.902	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-28.7	178.8	-64.3	-178.6	170.4	0	0	112.8	G434	E432-G434 PolarHBondContact O-N 3.06Å; E432-G434 VanDerWaalsContact O-N 3.14Å
433	N	75.8	Confident	87.3	Confident	115 Å²	115	67.3 Å²	67.3	62%	0.615	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.5	9.2	175.7	71.4	-2.4	0	0	0	114.1	R431 T435	R431-N433 WeakPolarHBondContact CB-OD1 3.26Å; R431-N433 PolarHBondContact O-N 3.41Å; N433-T435 PolarHBondContact O-N 2.94Å; N433-T435 WeakPolarHBondContact OD1-CB 3.41Å; N433-T435 PolarHBondContact OD1-N 3.09Å; N433-T435 PolarHBondContact OD1-OG1 3.11Å
434	G	78.7	Confident	87.5	Confident	71 Å²	71	64.6 Å²	64.6	73%	0.732	33%	0.331	S	S	*	.	S	Bend	trans	77.1	-3.3	-178.4	0	0	0	0	0	115	R431 E432	R431-G434 PolarHBondContact O-N 2.97Å; E432-G434 PolarHBondContact O-N 3.06Å; E432-G434 VanDerWaalsContact O-N 3.14Å
435	T	82	Confident	87.3	Confident	74 Å²	74	60.4 Å²	60.4	45%	0.454	31%	0.312	S	S	.	.	P	Polyproline II helix	trans	-80.1	135.4	178.7	-53.1	0	0	0	0	110.5	R431 N433	R431-T435 WeakPolarHBondContact CB-O 3.31Å; R431-T435 PolarHBondContact N-O 2.92Å; N433-T435 PolarHBondContact O-N 2.94Å; N433-T435 WeakPolarHBondContact OD1-CB 3.41Å; N433-T435 PolarHBondContact OD1-N 3.09Å; N433-T435 PolarHBondContact OD1-OG1 3.11Å
436	S	85.6	Confident	86.8	Confident	62 Å²	62	64.9 Å²	64.9	43%	0.434	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	118	173	-174.9	0	0	0	0	110.3	H428 R429	H428-S436 WeakPolarHBondContact CB-OG 3.49Å; R429-S436 CarbonylContact O-C 3.52Å; R429-S436 VanDerWaalsContact O-CA 3.32Å; R429-S436 WeakPolarHBondContact O-CA 3.16Å
437	S	87.1	Confident	86.1	Confident	23 Å²	23	70.7 Å²	70.7	16%	0.161	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	123.6	177.2	-58.4	0	0	0	0	110.5	R429 R431 F439	R429-S437 PolarHBondContact N-O 3.37Å; R429-S437 PolarHBondContact O-N 3.17Å; R431-S437 PolarHBondContact NE-OG 3.24Å; R431-S437 VanDerWaalsContact NE-OG 3.17Å; S437-F439 WeakPolarHBondContact O-CD2 3.21Å
438	P	92.1	Very high	85.4	Confident	42 Å²	42	71.8 Å²	71.8	27%	0.273	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	140.3	176.3	29.8	-33.3	0	0	0	111.1	I381 P382 L426 I427	I381-P438 HydrophobicContact CG1-CG 4.28Å; I381-P438 HydrophobicContact CG2-CB 4.27Å; I381-P438 HydrophobicContact CG2-CG 4.41Å; P382-P438 WeakPolarHBondContact CD-O 2.79Å; L426-P438 HydrophobicContact CD1-CB 4.1Å; I427-P438 CarbonylContact O-C 3.49Å; I427-P438 WeakPolarHBondContact O-CA 3.49Å
439	F	92.9	Very high	84.5	Confident	10 Å²	10	71.6 Å²	71.6	4%	0.044	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	138.4	169.9	-70.8	-102	0	0	0	109.6	P382 I384 L426 I427 R429 S437 V478 W547 L550	P382-F439 HydrophobicContact CB-CD1 3.77Å; P382-F439 HydrophobicContact CB-CE1 3.8Å; P382-F439 HydrophobicContact CG-CD1 3.37Å; P382-F439 HydrophobicContact CG-CD2 4.47Å; P382-F439 HydrophobicContact CG-CE1 3.41Å; P382-F439 VanDerWaalsContact CG-CE1 3.41Å; P382-F439 HydrophobicContact CG-CE2 4.5Å; P382-F439 HydrophobicContact CG-CG 3.93Å; P382-F439 HydrophobicContact CG-CZ 4.01Å; I384-F439 HydrophobicContact CD1-CB 4.21Å; I384-F439 HydrophobicContact CD1-CD1 3.9Å; I384-F439 HydrophobicContact CD1-CG 4.29Å; I384-F439 HydrophobicContact CG1-CD1 4.2Å; L426-F439 WeakPolarHBondContact CA-O 3.19Å; I427-F439 HydrophobicContact CD1-CB 4.23Å; I427-F439 HydrophobicContact CG1-CB 3.8Å; I427-F439 PolarHBondContact N-O 3.08Å; I427-F439 PolarHBondContact O-N 3Å; R429-F439 HydrophobicContact CB-CD2 4.04Å; R429-F439 HydrophobicContact CB-CE2 3.84Å; S437-F439 WeakPolarHBondContact O-CD2 3.21Å; F439-V478 HydrophobicContact CD1-CG2 4.35Å; F439-V478 HydrophobicContact CE1-CG2 4.19Å; F439-W547 HydrophobicContact CD1-CZ3 4.41Å; F439-W547 HydrophobicContact CD2-CH2 4.04Å; F439-W547 HydrophobicContact CD2-CZ3 4.25Å; F439-W547 HydrophobicContact CE1-CZ3 4.11Å; F439-W547 HydrophobicContact CE2-CH2 4.16Å; F439-W547 AromaticContact CE2-CZ3 3.94Å; F439-W547 HydrophobicContact CE2-CZ3 3.94Å; F439-W547 HydrophobicContact CG-CH2 4.26Å; F439-W547 HydrophobicContact CG-CZ3 4.49Å; F439-W547 HydrophobicContact CZ-CH2 4.48Å; F439-W547 AromaticContact CZ-CZ3 3.87Å; F439-W547 HydrophobicContact CZ-CZ3 3.87Å; F439-L550 HydrophobicContact CE1-CD2 3.85Å; F439-L550 HydrophobicContact CZ-CD2 4.27Å
440	R	92.7	Very high	83.5	Confident	51 Å²	51	76.8 Å²	76.8	19%	0.192	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	126	175.9	-176.4	177.8	171.1	-155	5.6	109.5	I381 P382 I383 I384 E424 I425 L426 V442 E452	I381-R440 HydrophobicContact CG2-CB 4.2Å; P382-R440 PolarHBondContact O-N 3.43Å; I383-R440 CarbonylContact C-O 3.56Å; I383-R440 WeakPolarHBondContact CA-O 3.44Å; I383-R440 HydrophobicContact CG1-CB 4.4Å; I384-R440 PolarHBondContact N-O 2.97Å; E424-R440 IonicContact OE2-CZ 2.98Å; E424-R440 IonicContact OE2-NE 3.8Å; E424-R440 PolarHBondContact OE2-NE 3.36Å; E424-R440 IonicContact OE2-NH2 2.59Å; E424-R440 PolarHBondContact OE2-NH2 3.25Å; I425-R440 CarbonylContact O-C 3.58Å; L426-R440 HydrophobicContact CD1-CB 4.45Å; R440-V442 HydrophobicContact CG-CG2 3.95Å; R440-E452 IonicContact CZ-OE1 3.51Å; R440-E452 IonicContact NH1-OE1 3.34Å; R440-E452 PolarHBondContact NH1-OE1 2.95Å; R440-E452 IonicContact NH2-OE1 3.09Å
441	I	93.9	Very high	82.7	Confident	0 Å²	0	70.6 Å²	70.6	0%	0	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	129	177.8	-53.3	172.9	0	0	0	108	I384 I386 L396 A399 L403 E424 I425 I427	I384-I441 WeakPolarHBondContact O-CA 3.33Å; I386-I441 HydrophobicContact CD1-CG2 4.07Å; I386-I441 HydrophobicContact CG1-CG2 4.02Å; I386-I441 HydrophobicContact CG2-CG2 3.98Å; L396-I441 HydrophobicContact CD2-CB 4.48Å; L396-I441 HydrophobicContact CD2-CG2 3.93Å; A399-I441 HydrophobicContact CB-CD1 3.91Å; A399-I441 HydrophobicContact CB-CG2 4.23Å; L403-I441 HydrophobicContact CD1-CD1 3.78Å; L403-I441 HydrophobicContact CD1-CG1 4.44Å; E424-I441 CarbonylContact C-O 3.54Å; E424-I441 VanDerWaalsContact CA-O 3.24Å; E424-I441 WeakPolarHBondContact CA-O 2.92Å; I425-I441 HydrophobicContact CB-CB 4.42Å; I425-I441 PolarHBondContact N-O 2.88Å; I425-I441 PolarHBondContact O-N 2.94Å; I427-I441 HydrophobicContact CB-CD1 4.43Å; I427-I441 HydrophobicContact CD1-CD1 3.9Å; I427-I441 HydrophobicContact CD1-CG1 4.41Å; I427-I441 HydrophobicContact CG1-CD1 4Å; I427-I441 HydrophobicContact CG1-CG1 4.28Å; I427-I441 HydrophobicContact CG2-CD1 3.58Å; I427-I441 HydrophobicContact CG2-CG1 4.46Å
442	V	92.5	Very high	82.2	Confident	9 Å²	9	66.9 Å²	66.9	6%	0.055	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	145.9	179.1	-171.1	0	0	0	0	109.9	I383 I384 V385 I386 E424 R440 F448	I383-V442 HydrophobicContact CG2-CG2 4.25Å; I384-V442 PolarHBondContact O-N 3.47Å; V385-V442 CarbonylContact C-O 3.59Å; V385-V442 VanDerWaalsContact CA-O 3.31Å; V385-V442 WeakPolarHBondContact CA-O 3.12Å; I386-V442 PolarHBondContact N-O 2.89Å; E424-V442 HydrophobicContact CB-CG2 4.21Å; R440-V442 HydrophobicContact CG-CG2 3.95Å; V442-F448 HydrophobicContact CB-CE1 3.9Å; V442-F448 HydrophobicContact CB-CZ 3.85Å; V442-F448 HydrophobicContact CG1-CE1 3.69Å; V442-F448 HydrophobicContact CG1-CZ 4.1Å; V442-F448 HydrophobicContact CG2-CE1 3.96Å; V442-F448 HydrophobicContact CG2-CZ 4.04Å
443	N	90.7	Very high	81.8	Confident	30 Å²	30	58.2 Å²	58.2	16%	0.16	32%	0.321	C	S	.	.	S	Bend	trans	-101	-16.4	177.5	71.4	-26.4	0	0	0	114.1	I386 L396	I386-N443 HydrophobicContact CD1-CB 4.36Å; I386-N443 HydrophobicContact CG1-CB 3.96Å; I386-N443 WeakPolarHBondContact O-CA 3.09Å; L396-N443 HydrophobicContact CD1-CB 3.76Å; L396-N443 VanDerWaalsContact CD1-CG 3.45Å; L396-N443 HydrophobicContact CG-CB 4.11Å
444	N	86.4	Confident	81	Confident	55 Å²	55	55.8 Å²	55.8	29%	0.294	30%	0.304	S	S	.	.			trans	-121	100.4	-179.8	-167.9	-4.9	0	0	0	111.8	L446	N444-L446 VanDerWaalsContact C-N 3.26Å; N444-L446 PolarHBondContact O-N 3.24Å; N444-L446 VanDerWaalsContact OD1-CB 3.29Å; N444-L446 WeakPolarHBondContact OD1-CB 3.41Å; N444-L446 VanDerWaalsContact OD1-CG 3.32Å; N444-L446 WeakPolarHBondContact OD1-CG 3.31Å; N444-L446 PolarHBondContact OD1-N 2.97Å; N444-L446 VanDerWaalsContact OD1-N 3.08Å
445	P	84.3	Confident	79.6	Confident	8 Å²	8	55 Å²	55	5%	0.052	28%	0.284	C	S	.	.	G	3₁₀ helix	trans	-72.9	-15.8	-179.8	29.2	-34.6	0	0	0	114.1	V385 R447 F448 W453 W492	V385-P445 HydrophobicContact CG1-CB 4.34Å; V385-P445 HydrophobicContact CG1-CG 4.36Å; P445-R447 PolarHBondContact O-N 3.04Å; P445-F448 WeakPolarHBondContact O-CB 3.34Å; P445-F448 WeakPolarHBondContact O-CG 3.5Å; P445-F448 PolarHBondContact O-N 3.29Å; P445-W453 HydrophobicContact CB-CH2 3.92Å; P445-W453 HydrophobicContact CB-CZ2 3.12Å; P445-W453 HydrophobicContact CG-CZ2 4.4Å; P445-W453 PolarHBondContact O-NE1 3.42Å; P445-W492 HydrophobicContact CB-CD2 4.45Å; P445-W492 HydrophobicContact CB-CZ2 4.37Å; P445-W492 HydrophobicContact CG-CD2 4.1Å; P445-W492 VanDerWaalsContact CG-CE2 3.41Å; P445-W492 HydrophobicContact CG-CG 4.33Å; P445-W492 HydrophobicContact CG-CZ2 3.72Å; P445-W492 VanDerWaalsContact CG-NE1 3.26Å
446	L	81.6	Confident	78	Confident	108 Å²	108	52.3 Å²	52.3	57%	0.565	27%	0.27	S	S	*	.	G	3₁₀ helix	trans	-70.6	-16.9	-172.1	-57.7	175.2	0	0	0	113.7	N444 G491	N444-L446 VanDerWaalsContact C-N 3.26Å; N444-L446 PolarHBondContact O-N 3.24Å; N444-L446 VanDerWaalsContact OD1-CB 3.29Å; N444-L446 WeakPolarHBondContact OD1-CB 3.41Å; N444-L446 VanDerWaalsContact OD1-CG 3.32Å; N444-L446 WeakPolarHBondContact OD1-CG 3.31Å; N444-L446 PolarHBondContact OD1-N 2.97Å; N444-L446 VanDerWaalsContact OD1-N 3.08Å; L446-G491 VanDerWaalsContact CD2-O 3.22Å; L446-G491 WeakPolarHBondContact CD2-O 3.43Å
447	R	76.8	Confident	76	Confident	202 Å²	202	56.6 Å²	56.6	76%	0.762	29%	0.287	S	S	*	.	G	3₁₀ helix	trans	-93.4	-0.6	-179.6	-65.5	-168.6	176.9	-163.3	-0.6	113.8	P445	P445-R447 PolarHBondContact O-N 3.04Å
448	F	77.4	Confident	73.9	Confident	23 Å²	23	64.1 Å²	64.1	10%	0.101	32%	0.317	C	S	.	.			trans	-71.1	138.2	-176.4	-74.6	10.7	0	0	0	110.1	I383 V385 V442 P445 E452 W453 V477	I383-F448 HydrophobicContact CD1-CE2 4.25Å; I383-F448 HydrophobicContact CG2-CE2 3.82Å; I383-F448 HydrophobicContact CG2-CZ 3.67Å; V385-F448 HydrophobicContact CG2-CE2 4.06Å; V385-F448 HydrophobicContact CG2-CZ 4.15Å; V442-F448 HydrophobicContact CB-CE1 3.9Å; V442-F448 HydrophobicContact CB-CZ 3.85Å; V442-F448 HydrophobicContact CG1-CE1 3.69Å; V442-F448 HydrophobicContact CG1-CZ 4.1Å; V442-F448 HydrophobicContact CG2-CE1 3.96Å; V442-F448 HydrophobicContact CG2-CZ 4.04Å; P445-F448 WeakPolarHBondContact O-CB 3.34Å; P445-F448 WeakPolarHBondContact O-CG 3.5Å; P445-F448 PolarHBondContact O-N 3.29Å; F448-E452 WeakPolarHBondContact CA-OE2 3.29Å; F448-E452 HydrophobicContact CB-CB 3.76Å; F448-E452 HydrophobicContact CD2-CB 4.01Å; F448-E452 HydrophobicContact CG-CB 3.95Å; F448-W453 HydrophobicContact CB-CG 4.23Å; F448-W453 AromaticContact CD2-CD1 3.47Å; F448-W453 VanDerWaalsContact CD2-CD1 3.47Å; F448-W453 HydrophobicContact CD2-CD2 4.08Å; F448-W453 AromaticContact CD2-CE2 3.28Å; F448-W453 HydrophobicContact CD2-CG 4.07Å; F448-W453 AromaticContact CD2-CZ2 3.59Å; F448-W453 HydrophobicContact CD2-CZ2 3.59Å; F448-W453 AromaticContact CD2-NE1 2.98Å; F448-W453 AromaticContact CE2-CE2 3.8Å; F448-W453 AromaticContact CE2-CZ2 3.57Å; F448-W453 HydrophobicContact CE2-CZ2 3.57Å; F448-W453 AromaticContact CE2-NE1 3.89Å; F448-W453 AromaticContact CG-CD1 3.71Å; F448-W453 AromaticContact CG-NE1 3.32Å; F448-W453 VanDerWaalsContact CG-NE1 3.32Å; F448-V477 HydrophobicContact CD2-CG2 4.05Å; F448-V477 HydrophobicContact CE2-CG2 3.71Å
449	T	73.7	Confident	71.8	Confident	78 Å²	78	65.9 Å²	65.9	48%	0.479	32%	0.324	S	S	.	.			trans	-66.3	160.2	169.6	54.8	0	0	0	0	110.2	D451 E452 W453	T449-D451 PolarHBondContact O-N 2.69Å; T449-D451 VanDerWaalsContact O-N 3.12Å; T449-E452 PolarHBondContact N-OE2 2.97Å; T449-E452 WeakPolarHBondContact O-CB 3.35Å; T449-E452 PolarHBondContact O-N 2.75Å; T449-E452 WeakPolarHBondContact OG1-CG 3.45Å; T449-E452 PolarHBondContact OG1-OE2 2.82Å; T449-E452 VanDerWaalsContact OG1-OE2 3.06Å; T449-W453 PolarHBondContact O-N 2.99Å
450	N	67.7	Low	69.6	Low	136 Å²	136	74.2 Å²	74.2	73%	0.727	36%	0.36	S	S	*	.	H	α-helix	trans	-55.3	-31.8	175.5	-72.3	-38	0	0	0	112	E452 Y454	N450-E452 PolarHBondContact O-N 3.2Å; N450-Y454 CarbonylContact O-C 3.49Å; N450-Y454 VanDerWaalsContact O-C 3.3Å; N450-Y454 PolarHBondContact O-N 2.99Å; N450-Y454 VanDerWaalsContact O-O 3.12Å
451	D	66.9	Low	67.7	Low	94 Å²	94	75.9 Å²	75.9	50%	0.503	39%	0.385	S	S	.	.	H	α-helix	trans	-68.1	-19.5	176.2	-67.9	-16.3	0	0	0	113.9	T449	T449-D451 PolarHBondContact O-N 2.69Å; T449-D451 VanDerWaalsContact O-N 3.12Å
452	E	71.6	Confident	65.7	Low	20 Å²	20	84.2 Å²	84.2	9%	0.093	42%	0.417	C	S	.	.	H	α-helix	trans	-90.6	-32.9	179.9	-76.6	168.3	146.4	0	0	112.9	I383 R440 F448 T449 N450 R476	I383-E452 HydrophobicContact CD1-CB 4.08Å; I383-E452 HydrophobicContact CD1-CG 4.05Å; R440-E452 IonicContact CZ-OE1 3.51Å; R440-E452 IonicContact NH1-OE1 3.34Å; R440-E452 PolarHBondContact NH1-OE1 2.95Å; R440-E452 IonicContact NH2-OE1 3.09Å; F448-E452 WeakPolarHBondContact CA-OE2 3.29Å; F448-E452 HydrophobicContact CB-CB 3.76Å; F448-E452 HydrophobicContact CD2-CB 4.01Å; F448-E452 HydrophobicContact CG-CB 3.95Å; T449-E452 PolarHBondContact N-OE2 2.97Å; T449-E452 WeakPolarHBondContact O-CB 3.35Å; T449-E452 PolarHBondContact O-N 2.75Å; T449-E452 WeakPolarHBondContact OG1-CG 3.45Å; T449-E452 PolarHBondContact OG1-OE2 2.82Å; T449-E452 VanDerWaalsContact OG1-OE2 3.06Å; N450-E452 PolarHBondContact O-N 3.2Å; E452-R476 WeakPolarHBondContact O-CB 3.15Å; E452-R476 IonicContact OE1-NH1 2.64Å
453	W	66.6	Low	63.5	Low	11 Å²	11	91.7 Å²	91.7	4%	0.042	46%	0.457	C	S	.	.	H	α-helix	trans	-91.5	-55.2	177.8	-85.4	104.5	0	0	0	113.9	V385 P445 F448 T449 V477 W492 P493 L494	V385-W453 HydrophobicContact CG2-CH2 4.23Å; V385-W453 HydrophobicContact CG2-CZ2 4.32Å; P445-W453 HydrophobicContact CB-CH2 3.92Å; P445-W453 HydrophobicContact CB-CZ2 3.12Å; P445-W453 HydrophobicContact CG-CZ2 4.4Å; P445-W453 PolarHBondContact O-NE1 3.42Å; F448-W453 HydrophobicContact CB-CG 4.23Å; F448-W453 AromaticContact CD2-CD1 3.47Å; F448-W453 VanDerWaalsContact CD2-CD1 3.47Å; F448-W453 HydrophobicContact CD2-CD2 4.08Å; F448-W453 AromaticContact CD2-CE2 3.28Å; F448-W453 HydrophobicContact CD2-CG 4.07Å; F448-W453 AromaticContact CD2-CZ2 3.59Å; F448-W453 HydrophobicContact CD2-CZ2 3.59Å; F448-W453 AromaticContact CD2-NE1 2.98Å; F448-W453 AromaticContact CE2-CE2 3.8Å; F448-W453 AromaticContact CE2-CZ2 3.57Å; F448-W453 HydrophobicContact CE2-CZ2 3.57Å; F448-W453 AromaticContact CE2-NE1 3.89Å; F448-W453 AromaticContact CG-CD1 3.71Å; F448-W453 AromaticContact CG-NE1 3.32Å; F448-W453 VanDerWaalsContact CG-NE1 3.32Å; T449-W453 PolarHBondContact O-N 2.99Å; W453-V477 HydrophobicContact CD2-CG2 4.13Å; W453-V477 HydrophobicContact CE3-CB 4.48Å; W453-V477 HydrophobicContact CE3-CG2 3.98Å; W453-V477 HydrophobicContact CH2-CB 4.43Å; W453-V477 HydrophobicContact CH2-CG1 4.06Å; W453-V477 HydrophobicContact CH2-CG2 3.94Å; W453-V477 HydrophobicContact CZ2-CG2 4.01Å; W453-V477 HydrophobicContact CZ3-CB 4.22Å; W453-V477 HydrophobicContact CZ3-CG1 4.13Å; W453-V477 HydrophobicContact CZ3-CG2 3.95Å; W453-W492 HydrophobicContact CH2-CD2 4.18Å; W453-W492 AromaticContact CH2-CE3 3.52Å; W453-W492 HydrophobicContact CH2-CE3 3.52Å; W453-W492 HydrophobicContact CH2-CH2 4.27Å; W453-W492 AromaticContact CH2-CZ3 3.57Å; W453-W492 HydrophobicContact CH2-CZ3 3.57Å; W453-W492 HydrophobicContact CZ2-CE3 4.45Å; W453-W492 AromaticContact CZ3-CE3 3.87Å; W453-W492 HydrophobicContact CZ3-CE3 3.87Å; W453-W492 HydrophobicContact CZ3-CZ3 4.09Å; W453-P493 HydrophobicContact CB-CG 3.76Å; W453-P493 HydrophobicContact CD2-CG 3.36Å; W453-P493 HydrophobicContact CE3-CG 3.94Å; W453-P493 HydrophobicContact CG-CB 4.42Å; W453-P493 HydrophobicContact CG-CG 3.2Å; W453-L494 HydrophobicContact CE3-CD1 3.75Å; W453-L494 HydrophobicContact CE3-CG 3.86Å; W453-L494 HydrophobicContact CZ3-CD1 3.65Å; W453-L494 HydrophobicContact CZ3-CG 4.16Å
454	Y	59.5	Low	61.7	Low	64 Å²	64	94.7 Å²	94.7	25%	0.251	48%	0.477	S	S	.	.			trans	-172.7	120.2	-164.5	-144.3	-106.5	0	0	0	111.7	N450 A456 I471 N475 L494	N450-Y454 CarbonylContact O-C 3.49Å; N450-Y454 VanDerWaalsContact O-C 3.3Å; N450-Y454 PolarHBondContact O-N 2.99Å; N450-Y454 VanDerWaalsContact O-O 3.12Å; Y454-A456 HydrophobicContact CD1-CB 3.47Å; Y454-A456 VanDerWaalsContact CD1-CB 3.47Å; Y454-A456 HydrophobicContact CE1-CB 3.14Å; Y454-A456 PolarHBondContact O-N 2.91Å; Y454-I471 HydrophobicContact CE1-CG2 4.49Å; Y454-I471 WeakPolarHBondContact OH-CG2 3.43Å; Y454-N475 WeakPolarHBondContact CD2-OD1 3.31Å; Y454-N475 VanDerWaalsContact CE2-ND2 3.34Å; Y454-N475 WeakPolarHBondContact CE2-ND2 3.38Å; Y454-N475 WeakPolarHBondContact CE2-OD1 3.5Å; Y454-L494 HydrophobicContact CD2-CD2 3.93Å; Y454-L494 HydrophobicContact CE2-CD2 4.36Å; Y454-L494 HydrophobicContact CG-CD2 4.33Å
455	V	49	Very low	60.1	Low	54 Å²	54	98.7 Å²	98.7	33%	0.327	50%	0.503	S	S	.	.	S	Bend	trans	-96.4	69.3	165.1	-171.5	0	0	0	0	108.7
456	A	48.2	Very low	58.4	Low	18 Å²	18	106.8 Å²	106.8	15%	0.149	54%	0.54	C	S	.	.			trans	-151.4	16.9	171.4	0	0	0	0	0	117.4	Y454 I471	Y454-A456 HydrophobicContact CD1-CB 3.47Å; Y454-A456 VanDerWaalsContact CD1-CB 3.47Å; Y454-A456 HydrophobicContact CE1-CB 3.14Å; Y454-A456 PolarHBondContact O-N 2.91Å; A456-I471 HydrophobicContact CB-CG2 4.29Å
457	L	44.6	Very low	56.7	Low	153 Å²	153	104 Å²	104	80%	0.801	52%	0.524	S	S	*	.	S	Bend	trans	-80.1	-18	162.2	-80.8	166.8	0	0	0	113.1
458	F	43.3	Very low	55.1	Low	181 Å²	181	98.1 Å²	98.1	79%	0.794	52%	0.519	S	S	*	.	S	Bend	trans	-83.2	-14.7	179.6	-138.7	-93.5	0	0	0	114.5
459	L	48.3	Very low	53.3	Low	78 Å²	78	107.2 Å²	107.2	41%	0.408	55%	0.554	S	S	.	*	S	Bend	trans	-95	-13.4	-174.9	-71.8	168.8	0	0	0	114.1	A461 Y462	L459-A461 PolarHBondContact O-N 2.87Å; L459-Y462 PolarHBondContact O-N 3.38Å
460	K	46.4	Very low	51.8	Low	185 Å²	185	107.4 Å²	107.4	80%	0.804	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.3	-14.8	173.3	-80.4	-174.1	174.3	-175.6	0	113.7
461	A	51.5	Low	50.6	Low	86 Å²	86	103.4 Å²	103.4	71%	0.711	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-14.9	176.6	0	0	0	0	0	113.8	L459	L459-A461 PolarHBondContact O-N 2.87Å
462	Y	52.8	Low	49.6	Very low	175 Å²	175	105 Å²	105	69%	0.686	54%	0.537	S	S	*	.	S	Bend	trans	-123.2	106.7	176.8	-86.7	-94.9	0	0	0	107.5	L459 V464	L459-Y462 PolarHBondContact O-N 3.38Å; Y462-V464 PolarHBondContact O-N 3.49Å
463	N	47	Very low	48.6	Very low	167 Å²	167	110.5 Å²	110.5	89%	0.893	57%	0.568	S	S	*	*			trans	-55.1	76.4	175.8	-82.3	-32.6	0	0	0	112.4
464	V	52.3	Low	48	Very low	93 Å²	93	115.6 Å²	115.6	56%	0.564	59%	0.587	S	S	*	*			trans	-120.1	94.7	-179.1	-177.9	0	0	0	0	107.7	Y462 H466	Y462-V464 PolarHBondContact O-N 3.49Å; V464-H466 PolarHBondContact O-N 3.14Å
465	T	53.4	Low	48.5	Very low	139 Å²	139	114 Å²	114	85%	0.853	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.3	-2	-175	6.2	0	0	0	0	114.4
466	H	47.1	Very low	50.1	Low	177 Å²	177	112.7 Å²	112.7	82%	0.819	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.6	1.5	-170.1	-102.9	-88.1	0	0	0	116.4	V464	V464-H466 PolarHBondContact O-N 3.14Å
467	H	47	Very low	52.1	Low	50 Å²	50	112 Å²	112	23%	0.231	57%	0.566	C	S	.	*			trans	-100.5	6	-169.2	-153.8	-95.9	0	0	0	115.2	Y469 I470 I471	H467-Y469 PolarHBondContact O-N 2.95Å; H467-I470 WeakPolarHBondContact CE1-CB 3.09Å; H467-I470 WeakPolarHBondContact CE1-CG2 3.38Å; H467-I470 WeakPolarHBondContact NE2-CB 3.02Å; H467-I470 WeakPolarHBondContact NE2-CG2 3.33Å; H467-I470 PolarHBondContact O-N 3.44Å; H467-I471 WeakPolarHBondContact O-CG1 3.48Å; H467-I471 PolarHBondContact O-N 3.43Å
468	A	42.7	Very low	54.2	Low	79 Å²	79	106.8 Å²	106.8	65%	0.653	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.9	-28.2	-176.3	0	0	0	0	0	114.3
469	Y	40.5	Very low	56.6	Low	214 Å²	214	98.2 Å²	98.2	84%	0.839	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.9	-22.2	178.6	-165.9	-103.5	0	0	0	114.3	H467	H467-Y469 PolarHBondContact O-N 2.95Å
470	I	41.9	Very low	58.8	Low	82 Å²	82	94.5 Å²	94.5	42%	0.421	48%	0.483	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.1	-9	-176.1	-56.5	164.7	0	0	0	111.3	H467 N472	H467-I470 WeakPolarHBondContact CE1-CB 3.09Å; H467-I470 WeakPolarHBondContact CE1-CG2 3.38Å; H467-I470 WeakPolarHBondContact NE2-CB 3.02Å; H467-I470 WeakPolarHBondContact NE2-CG2 3.33Å; H467-I470 PolarHBondContact O-N 3.44Å; I470-N472 PolarHBondContact O-N 2.93Å
471	I	42.7	Very low	61.2	Low	51 Å²	51	85.9 Å²	85.9	26%	0.262	45%	0.445	S	S	.	.	S	Bend	trans	-69	-32.3	-177.6	-36.9	-171.5	0	0	0	112.1	Y454 A456 H467 D473	Y454-I471 HydrophobicContact CE1-CG2 4.49Å; Y454-I471 WeakPolarHBondContact OH-CG2 3.43Å; A456-I471 HydrophobicContact CB-CG2 4.29Å; H467-I471 WeakPolarHBondContact O-CG1 3.48Å; H467-I471 PolarHBondContact O-N 3.43Å; I471-D473 PolarHBondContact O-N 2.68Å
472	N	45.9	Very low	63.2	Low	128 Å²	128	82 Å²	82	68%	0.684	41%	0.413	S	S	*	.	G	3₁₀ helix	trans	-71.2	-31.5	-175.3	-71.4	-13.4	0	0	0	113.3	I470 R474 N475	I470-N472 PolarHBondContact O-N 2.93Å; N472-R474 PolarHBondContact O-N 2.87Å; N472-R474 VanDerWaalsContact O-N 3.13Å; N472-N475 PolarHBondContact O-N 3.14Å
473	D	49.9	Very low	65.1	Low	136 Å²	136	75.9 Å²	75.9	73%	0.727	39%	0.391	S	S	*	.	G	3₁₀ helix	trans	-75.7	-2.5	-174	-155.2	25.3	0	0	0	113.6	I471	I471-D473 PolarHBondContact O-N 2.68Å
474	R	54.7	Low	67.1	Low	117 Å²	117	67.9 Å²	67.9	44%	0.442	35%	0.348	S	S	.	.	G	3₁₀ helix	trans	-110.6	-5.8	-179.1	-65.5	-172	-179.4	175.4	1.2	114.3	N472 R476	N472-R474 PolarHBondContact O-N 2.87Å; N472-R474 VanDerWaalsContact O-N 3.13Å; R474-R476 PolarHBondContact O-N 3.33Å
475	N	69	Low	68.9	Low	30 Å²	30	65.4 Å²	65.4	16%	0.16	33%	0.334	C	S	.	.			trans	-84.7	104.4	175.9	-63.3	-16.6	0	0	0	108.5	Y454 N472 V477	Y454-N475 WeakPolarHBondContact CD2-OD1 3.31Å; Y454-N475 VanDerWaalsContact CE2-ND2 3.34Å; Y454-N475 WeakPolarHBondContact CE2-ND2 3.38Å; Y454-N475 WeakPolarHBondContact CE2-OD1 3.5Å; N472-N475 PolarHBondContact O-N 3.14Å; N475-V477 VanDerWaalsContact C-N 3.28Å
476	R	84	Confident	70.7	Confident	28 Å²	28	61 Å²	61	11%	0.106	31%	0.311	C	S	.	.			trans	-73	-27.5	177.5	-64.2	-176.5	55.2	-164.6	-0.6	111.4	S379 I381 P382 I383 E452 R474 V478	S379-R476 PolarHBondContact O-NE 3.27Å; S379-R476 PolarHBondContact O-NH1 3.42Å; S379-R476 PolarHBondContact O-NH2 2.96Å; S379-R476 PolarHBondContact OG-NH2 2.73Å; I381-R476 PolarHBondContact O-NE 3.07Å; I381-R476 PolarHBondContact O-NH2 3.01Å; P382-R476 CarbonylContact C-O 3.59Å; P382-R476 WeakPolarHBondContact CA-O 3.27Å; I383-R476 HydrophobicContact CD1-CB 3.78Å; I383-R476 HydrophobicContact CG1-CB 4.04Å; I383-R476 PolarHBondContact N-O 3.22Å; E452-R476 WeakPolarHBondContact O-CB 3.15Å; E452-R476 IonicContact OE1-NH1 2.64Å; R474-R476 PolarHBondContact O-N 3.33Å; R476-V478 PolarHBondContact O-N 2.94Å
477	V	88.7	Confident	72.7	Confident	4 Å²	4	59.7 Å²	59.7	2%	0.024	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	108.2	176.4	-173.2	0	0	0	0	110	I383 V385 F448 W453 N475 V480 V505	I383-V477 HydrophobicContact CB-CG2 4.32Å; I383-V477 HydrophobicContact CG2-CG2 4.45Å; I383-V477 WeakPolarHBondContact O-CA 3.41Å; V385-V477 HydrophobicContact CG2-CG1 3.86Å; F448-V477 HydrophobicContact CD2-CG2 4.05Å; F448-V477 HydrophobicContact CE2-CG2 3.71Å; W453-V477 HydrophobicContact CD2-CG2 4.13Å; W453-V477 HydrophobicContact CE3-CB 4.48Å; W453-V477 HydrophobicContact CE3-CG2 3.98Å; W453-V477 HydrophobicContact CH2-CB 4.43Å; W453-V477 HydrophobicContact CH2-CG1 4.06Å; W453-V477 HydrophobicContact CH2-CG2 3.94Å; W453-V477 HydrophobicContact CZ2-CG2 4.01Å; W453-V477 HydrophobicContact CZ3-CB 4.22Å; W453-V477 HydrophobicContact CZ3-CG1 4.13Å; W453-V477 HydrophobicContact CZ3-CG2 3.95Å; N475-V477 VanDerWaalsContact C-N 3.28Å; V477-V480 HydrophobicContact CG1-CG2 4.28Å; V477-V505 HydrophobicContact CG1-CG1 4.03Å
478	V	90	Very high	74.7	Confident	43 Å²	43	58.3 Å²	58.3	26%	0.261	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	-30.1	-176.4	-64	0	0	0	0	112.9	P382 I383 I384 F439 R476 C506 L550	P382-V478 HydrophobicContact CB-CB 4.48Å; P382-V478 HydrophobicContact CB-CG1 3.69Å; P382-V478 HydrophobicContact CB-CG2 3.89Å; I383-V478 WeakPolarHBondContact O-CG2 3.39Å; I383-V478 PolarHBondContact O-N 3.47Å; I384-V478 HydrophobicContact CG1-CG2 4.15Å; F439-V478 HydrophobicContact CD1-CG2 4.35Å; F439-V478 HydrophobicContact CE1-CG2 4.19Å; R476-V478 PolarHBondContact O-N 2.94Å; V478-C506 PolarHBondContact O-N 3.28Å; V478-L550 HydrophobicContact CB-CD1 4.35Å; V478-L550 HydrophobicContact CG2-CD1 4.18Å; V478-L550 HydrophobicContact CG2-CD2 4.42Å
479	A	93.4	Very high	77	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148	154.8	179.6	0	0	0	0	0	114.1	I384 V385 C506 F508 F546 L550	I384-A479 WeakPolarHBondContact CA-O 3.45Å; I384-A479 HydrophobicContact CG1-CB 4.45Å; I384-A479 HydrophobicContact CG2-CB 4.4Å; V385-A479 PolarHBondContact N-O 2.97Å; A479-C506 CarbonylContact C-O 3.57Å; A479-C506 WeakPolarHBondContact CA-O 3.49Å; A479-F508 HydrophobicContact CB-CD2 4.12Å; A479-F508 HydrophobicContact CB-CE2 3.92Å; A479-F546 HydrophobicContact CB-CE2 4.43Å; A479-L550 HydrophobicContact CB-CD1 3.43Å; A479-L550 VanDerWaalsContact CB-CD1 3.43Å
480	V	94.1	Very high	79.2	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	127.9	179.9	174.8	0	0	0	0	110.1	V385 V477 V482 F489 W492 V505 C506 A507 F508	V385-V480 HydrophobicContact CB-CG2 4.2Å; V385-V480 CarbonylContact O-C 3.3Å; V385-V480 WeakPolarHBondContact O-CA 3.46Å; V477-V480 HydrophobicContact CG1-CG2 4.28Å; V480-V482 HydrophobicContact CG1-CG2 4.37Å; V480-F489 HydrophobicContact CG1-CE1 3.94Å; V480-W492 HydrophobicContact CB-CH2 4.3Å; V480-W492 HydrophobicContact CG1-CH2 3.52Å; V480-W492 HydrophobicContact CG1-CZ3 4.09Å; V480-W492 HydrophobicContact CG2-CH2 3.72Å; V480-W492 HydrophobicContact CG2-CZ3 3.64Å; V480-V505 HydrophobicContact CB-CG1 4.48Å; V480-V505 HydrophobicContact CG2-CB 4.48Å; V480-V505 HydrophobicContact CG2-CG1 3.67Å; V480-C506 PolarHBondContact N-O 3.28Å; V480-A507 CarbonylContact O-C 3.55Å; V480-A507 WeakPolarHBondContact O-CA 3.47Å; V480-F508 PolarHBondContact O-N 2.68Å
481	F	95.7	Very high	81.1	Confident	4 Å²	4	50.4 Å²	50.4	2%	0.018	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	125.6	168	-78.7	-90.7	0	0	0	110.4	I384 V385 I386 P387 V394 L403 Q488 F508 L529 F546	I384-F481 HydrophobicContact CG2-CD2 3.98Å; I384-F481 HydrophobicContact CG2-CE2 3.89Å; V385-F481 PolarHBondContact O-N 3.37Å; I386-F481 HydrophobicContact CG2-CB 4.26Å; I386-F481 HydrophobicContact CG2-CD2 3.71Å; I386-F481 HydrophobicContact CG2-CE2 4.46Å; I386-F481 HydrophobicContact CG2-CG 4.25Å; P387-F481 WeakPolarHBondContact CD-O 3.5Å; P387-F481 HydrophobicContact CG-CB 4.49Å; P387-F481 WeakPolarHBondContact CG-O 3.42Å; V394-F481 HydrophobicContact CB-CD1 4.5Å; V394-F481 HydrophobicContact CG2-CD1 3.88Å; V394-F481 HydrophobicContact CG2-CE1 3.99Å; V394-F481 HydrophobicContact CG2-CG 4.47Å; L403-F481 HydrophobicContact CD1-CE2 4.4Å; L403-F481 HydrophobicContact CD2-CE2 4.39Å; L403-F481 HydrophobicContact CD2-CZ 4.07Å; F481-Q488 PolarHBondContact O-NE2 3Å; F481-F508 CarbonylContact C-O 3.57Å; F481-F508 VanDerWaalsContact CA-O 3.28Å; F481-F508 WeakPolarHBondContact CA-O 3.38Å; F481-F508 HydrophobicContact CD1-CB 4.13Å; F481-F508 HydrophobicContact CE1-CB 4.06Å; F481-L529 HydrophobicContact CE1-CD1 4.4Å; F481-F546 AromaticContact CE2-CE2 3.77Å; F481-F546 HydrophobicContact CE2-CE2 3.77Å; F481-F546 HydrophobicContact CE2-CZ 4.12Å; F481-F546 AromaticContact CZ-CD2 3.89Å; F481-F546 HydrophobicContact CZ-CD2 3.89Å; F481-F546 AromaticContact CZ-CE2 3.61Å; F481-F546 HydrophobicContact CZ-CE2 3.61Å; F481-F546 HydrophobicContact CZ-CZ 4.2Å
482	V	94.7	Very high	83.1	Confident	5 Å²	5	48.7 Å²	48.7	3%	0.03	25%	0.25	C	C	.	.			trans	-103.9	131.7	-176.4	-175.4	0	0	0	0	109.3	V480 F489 F502 A507 F508 H509 W524 V526	V480-V482 HydrophobicContact CG1-CG2 4.37Å; V482-F489 HydrophobicContact CB-CZ 4.31Å; V482-F489 HydrophobicContact CG1-CE2 4.16Å; V482-F489 HydrophobicContact CG1-CZ 3.82Å; V482-F489 HydrophobicContact CG2-CZ 3.87Å; V482-F502 HydrophobicContact CG1-CZ 4.39Å; V482-F502 HydrophobicContact CG2-CE1 3.84Å; V482-F502 HydrophobicContact CG2-CZ 3.69Å; V482-A507 HydrophobicContact CG2-CB 3.98Å; V482-F508 PolarHBondContact N-O 3.42Å; V482-H509 PolarHBondContact O-ND1 3.25Å; V482-W524 HydrophobicContact CG1-CE3 3.97Å; V482-W524 HydrophobicContact CG1-CZ3 3.71Å; V482-V526 HydrophobicContact CB-CG1 4.42Å; V482-V526 HydrophobicContact CG2-CG1 4.22Å; V482-V526 HydrophobicContact CG2-CG2 4.32Å
483	Q	91.7	Very high	84.3	Confident	46 Å²	46	46.1 Å²	46.1	22%	0.215	24%	0.24	C	C	.	.			trans	-90.1	-32.2	175.4	-174	171.9	7.2	0	0	112.4	P387 T389 S391 P485 H509	P387-Q483 HydrophobicContact CB-CB 4.41Å; P387-Q483 HydrophobicContact CG-CB 4.13Å; T389-Q483 VanDerWaalsContact OG1-CD 3.27Å; T389-Q483 PolarHBondContact OG1-NE2 3.08Å; T389-Q483 PolarHBondContact OG1-OE1 2.89Å; S391-Q483 PolarHBondContact OG-NE2 3.46Å; S391-Q483 VanDerWaalsContact OG-NE2 3.1Å; Q483-P485 VanDerWaalsContact C-CD 3.49Å; Q483-H509 PolarHBondContact O-CE1 3.15Å
484	G	89.7	Confident	85.3	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	21%	0.211	C	C	.	.	S	Bend	trans	131.8	-41.7	176.9	0	0	0	0	0	114.9	N520 V521 W524	G484-N520 WeakPolarHBondContact O-CB 3.33Å; G484-V521 VanDerWaalsContact CA-CG2 3.42Å; G484-W524 WeakPolarHBondContact O-CH2 3.37Å; G484-W524 WeakPolarHBondContact O-CZ3 3.33Å
485	P	91	Very high	86.3	Confident	40 Å²	40	36.5 Å²	36.5	26%	0.26	20%	0.204	S	C	.	.			trans	-70.7	134.1	176.3	-22.2	34	0	0	0	113.2	Q483 W487 Q488	Q483-P485 VanDerWaalsContact C-CD 3.49Å; P485-W487 HydrophobicContact CB-CD2 4.33Å; P485-W487 HydrophobicContact CB-CG 4.07Å; P485-W487 HydrophobicContact CB-CZ2 4.45Å; P485-W487 HydrophobicContact CG-CZ2 4.5Å; P485-W487 PolarHBondContact O-N 2.96Å; P485-Q488 VanDerWaalsContact O-CB 3.3Å; P485-Q488 WeakPolarHBondContact O-CB 3.47Å; P485-Q488 PolarHBondContact O-N 3.48Å; P485-Q488 VanDerWaalsContact O-N 3.16Å
486	A	89.3	Confident	86.9	Confident	47 Å²	47	39 Å²	39	39%	0.388	22%	0.22	S	C	.	.	G	3₁₀ helix	trans	-62.4	-25.7	-179.4	0	0	0	0	0	113.6	Q488 F489 P498 W524	A486-Q488 PolarHBondContact O-N 3.45Å; A486-Q488 VanDerWaalsContact O-N 3.1Å; A486-F489 PolarHBondContact O-N 2.88Å; A486-F489 VanDerWaalsContact O-N 3.14Å; A486-P498 HydrophobicContact CB-CG 4.34Å; A486-W524 HydrophobicContact CB-CH2 4.2Å; A486-W524 HydrophobicContact CB-CZ2 4.13Å
487	W	89.4	Confident	87.1	Confident	149 Å²	149	42.1 Å²	42.1	56%	0.564	24%	0.239	S	C	*	.	G	3₁₀ helix	trans	-61.1	-20.7	178.3	66.2	-108.1	0	0	0	113	T389 P485 F489 K490	T389-W487 HydrophobicContact CG2-CH2 3.45Å; T389-W487 VanDerWaalsContact CG2-CH2 3.45Å; T389-W487 HydrophobicContact CG2-CZ2 4.16Å; T389-W487 HydrophobicContact CG2-CZ3 4.44Å; P485-W487 HydrophobicContact CB-CD2 4.33Å; P485-W487 HydrophobicContact CB-CG 4.07Å; P485-W487 HydrophobicContact CB-CZ2 4.45Å; P485-W487 HydrophobicContact CG-CZ2 4.5Å; P485-W487 PolarHBondContact O-N 2.96Å; W487-F489 PolarHBondContact O-N 2.99Å; W487-F489 VanDerWaalsContact O-N 3.12Å; W487-K490 VanDerWaalsContact O-CB 3.26Å; W487-K490 WeakPolarHBondContact O-CB 3.16Å; W487-K490 PolarHBondContact O-N 2.82Å
488	Q	90.6	Very high	87.1	Confident	21 Å²	21	42.4 Å²	42.4	10%	0.098	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-52.4	-33.6	174.8	179	-178.5	-16.5	0	0	112.2	F481 P485 A486 W492	F481-Q488 PolarHBondContact O-NE2 3Å; P485-Q488 VanDerWaalsContact O-CB 3.3Å; P485-Q488 WeakPolarHBondContact O-CB 3.47Å; P485-Q488 PolarHBondContact O-N 3.48Å; P485-Q488 VanDerWaalsContact O-N 3.16Å; A486-Q488 PolarHBondContact O-N 3.45Å; A486-Q488 VanDerWaalsContact O-N 3.1Å; Q488-W492 PolarHBondContact O-NE1 3.26Å; Q488-W492 VanDerWaalsContact O-NE1 3.1Å
489	F	89.8	Confident	87	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	-95.9	5.3	-174.9	-52.2	-73.1	0	0	0	113.6	V480 V482 A486 W487 G491 W492 P498 I501 F502 W524	V480-F489 HydrophobicContact CG1-CE1 3.94Å; V482-F489 HydrophobicContact CB-CZ 4.31Å; V482-F489 HydrophobicContact CG1-CE2 4.16Å; V482-F489 HydrophobicContact CG1-CZ 3.82Å; V482-F489 HydrophobicContact CG2-CZ 3.87Å; A486-F489 PolarHBondContact O-N 2.88Å; A486-F489 VanDerWaalsContact O-N 3.14Å; W487-F489 PolarHBondContact O-N 2.99Å; W487-F489 VanDerWaalsContact O-N 3.12Å; F489-G491 PolarHBondContact O-N 2.94Å; F489-W492 VanDerWaalsContact C-CD1 3.49Å; F489-W492 HydrophobicContact CD1-CD2 4.11Å; F489-W492 AromaticContact CD1-CE2 3.96Å; F489-W492 HydrophobicContact CD1-CE3 4.12Å; F489-W492 AromaticContact CD1-CH2 3.99Å; F489-W492 HydrophobicContact CD1-CH2 3.99Å; F489-W492 AromaticContact CD1-CZ2 3.91Å; F489-W492 HydrophobicContact CD1-CZ2 3.91Å; F489-W492 HydrophobicContact CD1-CZ3 4.06Å; F489-W492 HydrophobicContact CE1-CH2 4.08Å; F489-W492 HydrophobicContact CE1-CZ2 4.25Å; F489-W492 HydrophobicContact CE1-CZ3 4.36Å; F489-W492 WeakPolarHBondContact O-CB 3.5Å; F489-W492 PolarHBondContact O-N 3.21Å; F489-P498 HydrophobicContact CD2-CB 4.01Å; F489-P498 HydrophobicContact CD2-CG 3.63Å; F489-P498 HydrophobicContact CE2-CB 4.05Å; F489-P498 HydrophobicContact CE2-CG 4.03Å; F489-P498 HydrophobicContact CG-CG 4.44Å; F489-I501 HydrophobicContact CB-CD1 3.67Å; F489-I501 HydrophobicContact CD1-CD1 3.8Å; F489-I501 HydrophobicContact CG-CD1 3.88Å; F489-F502 AromaticContact CE1-CE1 3.88Å; F489-F502 HydrophobicContact CE1-CE1 3.88Å; F489-F502 HydrophobicContact CE1-CZ 4.09Å; F489-F502 HydrophobicContact CE2-CE1 4.49Å; F489-F502 AromaticContact CE2-CZ 3.89Å; F489-F502 HydrophobicContact CE2-CZ 3.89Å; F489-F502 AromaticContact CZ-CE1 3.75Å; F489-F502 HydrophobicContact CZ-CE1 3.75Å; F489-F502 AromaticContact CZ-CZ 3.49Å; F489-F502 HydrophobicContact CZ-CZ 3.49Å; F489-F502 VanDerWaalsContact CZ-CZ 3.49Å; F489-W524 HydrophobicContact CE2-CH2 4.28Å; F489-W524 HydrophobicContact CE2-CZ3 4.07Å
490	K	87.4	Confident	86.7	Confident	159 Å²	159	47.2 Å²	47.2	69%	0.691	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	127	-179.7	-172.3	177.7	179.4	-179.4	0	110.5	W487 W492	W487-K490 VanDerWaalsContact O-CB 3.26Å; W487-K490 WeakPolarHBondContact O-CB 3.16Å; W487-K490 PolarHBondContact O-N 2.82Å; K490-W492 VanDerWaalsContact C-N 3.34Å
491	G	82	Confident	86.3	Confident	50 Å²	50	47.2 Å²	47.2	52%	0.515	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.4	7	177.6	0	0	0	0	0	114.8	L446 F489	L446-G491 VanDerWaalsContact CD2-O 3.22Å; L446-G491 WeakPolarHBondContact CD2-O 3.43Å; F489-G491 PolarHBondContact O-N 2.94Å
492	W	84.5	Confident	86	Confident	15 Å²	15	47.8 Å²	47.8	6%	0.057	27%	0.272	C	S	.	.			trans	-70.2	140.9	174.7	-74	37	0	0	0	110.5	V385 P445 W453 V480 Q488 F489 K490 L494 G495 I501	V385-W492 HydrophobicContact CB-CH2 4.18Å; V385-W492 HydrophobicContact CG1-CH2 3.72Å; V385-W492 HydrophobicContact CG1-CZ2 3.86Å; P445-W492 HydrophobicContact CB-CD2 4.45Å; P445-W492 HydrophobicContact CB-CZ2 4.37Å; P445-W492 HydrophobicContact CG-CD2 4.1Å; P445-W492 VanDerWaalsContact CG-CE2 3.41Å; P445-W492 HydrophobicContact CG-CG 4.33Å; P445-W492 HydrophobicContact CG-CZ2 3.72Å; P445-W492 VanDerWaalsContact CG-NE1 3.26Å; W453-W492 HydrophobicContact CH2-CD2 4.18Å; W453-W492 AromaticContact CH2-CE3 3.52Å; W453-W492 HydrophobicContact CH2-CE3 3.52Å; W453-W492 HydrophobicContact CH2-CH2 4.27Å; W453-W492 AromaticContact CH2-CZ3 3.57Å; W453-W492 HydrophobicContact CH2-CZ3 3.57Å; W453-W492 HydrophobicContact CZ2-CE3 4.45Å; W453-W492 AromaticContact CZ3-CE3 3.87Å; W453-W492 HydrophobicContact CZ3-CE3 3.87Å; W453-W492 HydrophobicContact CZ3-CZ3 4.09Å; V480-W492 HydrophobicContact CB-CH2 4.3Å; V480-W492 HydrophobicContact CG1-CH2 3.52Å; V480-W492 HydrophobicContact CG1-CZ3 4.09Å; V480-W492 HydrophobicContact CG2-CH2 3.72Å; V480-W492 HydrophobicContact CG2-CZ3 3.64Å; Q488-W492 PolarHBondContact O-NE1 3.26Å; Q488-W492 VanDerWaalsContact O-NE1 3.1Å; F489-W492 VanDerWaalsContact C-CD1 3.49Å; F489-W492 HydrophobicContact CD1-CD2 4.11Å; F489-W492 AromaticContact CD1-CE2 3.96Å; F489-W492 HydrophobicContact CD1-CE3 4.12Å; F489-W492 AromaticContact CD1-CH2 3.99Å; F489-W492 HydrophobicContact CD1-CH2 3.99Å; F489-W492 AromaticContact CD1-CZ2 3.91Å; F489-W492 HydrophobicContact CD1-CZ2 3.91Å; F489-W492 HydrophobicContact CD1-CZ3 4.06Å; F489-W492 HydrophobicContact CE1-CH2 4.08Å; F489-W492 HydrophobicContact CE1-CZ2 4.25Å; F489-W492 HydrophobicContact CE1-CZ3 4.36Å; F489-W492 WeakPolarHBondContact O-CB 3.5Å; F489-W492 PolarHBondContact O-N 3.21Å; K490-W492 VanDerWaalsContact C-N 3.34Å; W492-L494 PolarHBondContact O-N 3.11Å; W492-G495 PolarHBondContact O-N 3.19Å; W492-G495 VanDerWaalsContact O-N 3.09Å; W492-I501 HydrophobicContact CE3-CD1 4.16Å; W492-I501 HydrophobicContact CE3-CG2 4.21Å; W492-I501 HydrophobicContact CZ3-CG2 4.17Å
493	P	71.8	Confident	85.7	Confident	75 Å²	75	53.1 Å²	53.1	49%	0.487	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-18.1	-175.9	25.7	-32.7	0	0	0	113.7	W453 G495	W453-P493 HydrophobicContact CB-CG 3.76Å; W453-P493 HydrophobicContact CD2-CG 3.36Å; W453-P493 HydrophobicContact CE3-CG 3.94Å; W453-P493 HydrophobicContact CG-CB 4.42Å; W453-P493 HydrophobicContact CG-CG 3.2Å; P493-G495 PolarHBondContact O-N 3.25Å
494	L	70.8	Confident	85.3	Confident	22 Å²	22	55.6 Å²	55.6	12%	0.115	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-7.8	174.7	-68.1	175.3	0	0	0	113.6	W453 Y454 W492 I501 K504 V505	W453-L494 HydrophobicContact CE3-CD1 3.75Å; W453-L494 HydrophobicContact CE3-CG 3.86Å; W453-L494 HydrophobicContact CZ3-CD1 3.65Å; W453-L494 HydrophobicContact CZ3-CG 4.16Å; Y454-L494 HydrophobicContact CD2-CD2 3.93Å; Y454-L494 HydrophobicContact CE2-CD2 4.36Å; Y454-L494 HydrophobicContact CG-CD2 4.33Å; W492-L494 PolarHBondContact O-N 3.11Å; L494-I501 HydrophobicContact CB-CG1 4.19Å; L494-I501 HydrophobicContact CD1-CG2 4.34Å; L494-K504 HydrophobicContact CD2-CD 3.95Å; L494-V505 HydrophobicContact CD1-CG2 3.97Å
495	G	74.5	Confident	85.2	Confident	29 Å²	29	56 Å²	56	30%	0.299	32%	0.317	S	S	.	.			trans	119.6	172.3	-175.1	0	0	0	0	0	112.2	W492 P493	W492-G495 PolarHBondContact O-N 3.19Å; W492-G495 VanDerWaalsContact O-N 3.09Å; P493-G495 PolarHBondContact O-N 3.25Å
496	T	81.5	Confident	85.2	Confident	81 Å²	81	56.2 Å²	56.2	50%	0.497	32%	0.319	S	S	.	.	S	Bend	trans	-93.1	-19.6	179	-52.5	0	0	0	0	112.3	P498	T496-P498 WeakPolarHBondContact O-CD 3.49Å
497	N	87.9	Confident	85.5	Confident	94 Å²	94	54 Å²	54	50%	0.503	30%	0.301	S	S	.	.			trans	-80.6	120.7	-175.8	-65	-27.1	0	0	0	110.8	D500 I501	N497-D500 HydrophobicContact CB-CB 4.27Å; N497-D500 VanDerWaalsContact CB-OD2 3.26Å; N497-D500 WeakPolarHBondContact CB-OD2 3.41Å; N497-D500 PolarHBondContact ND2-OD2 3.49Å; N497-D500 VanDerWaalsContact ND2-OD2 3.12Å; N497-D500 PolarHBondContact O-N 2.88Å; N497-I501 WeakPolarHBondContact O-CG1 3.24Å; N497-I501 PolarHBondContact O-N 3.06Å
498	P	88.8	Confident	85.8	Confident	10 Å²	10	47 Å²	47	7%	0.065	27%	0.274	C	S	.	.	H	α-helix	trans	-60.2	-43.1	-178.1	-24	35.4	0	0	0	114.7	A486 F489 T496 D500 I501 F502 W524	A486-P498 HydrophobicContact CB-CG 4.34Å; F489-P498 HydrophobicContact CD2-CB 4.01Å; F489-P498 HydrophobicContact CD2-CG 3.63Å; F489-P498 HydrophobicContact CE2-CB 4.05Å; F489-P498 HydrophobicContact CE2-CG 4.03Å; F489-P498 HydrophobicContact CG-CG 4.44Å; T496-P498 WeakPolarHBondContact O-CD 3.49Å; P498-D500 VanDerWaalsContact C-N 3.3Å; P498-D500 PolarHBondContact O-N 3.05Å; P498-I501 WeakPolarHBondContact O-CB 3.48Å; P498-I501 PolarHBondContact O-N 3.44Å; P498-I501 VanDerWaalsContact O-N 3.09Å; P498-F502 HydrophobicContact CB-CD2 4.26Å; P498-F502 HydrophobicContact CB-CE2 3.48Å; P498-F502 VanDerWaalsContact CB-CE2 3.48Å; P498-F502 HydrophobicContact CB-CZ 3.66Å; P498-F502 WeakPolarHBondContact O-CD1 3.49Å; P498-F502 WeakPolarHBondContact O-CD2 3.49Å; P498-F502 WeakPolarHBondContact O-CG 3.41Å; P498-F502 PolarHBondContact O-N 2.72Å; P498-W524 HydrophobicContact CB-CD2 3.91Å; P498-W524 HydrophobicContact CB-CE3 4.29Å; P498-W524 HydrophobicContact CB-CG 4.39Å; P498-W524 HydrophobicContact CB-CH2 4.21Å; P498-W524 HydrophobicContact CB-CZ2 3.85Å; P498-W524 HydrophobicContact CB-CZ3 4.43Å; P498-W524 HydrophobicContact CG-CD2 4.48Å; P498-W524 HydrophobicContact CG-CH2 3.89Å; P498-W524 HydrophobicContact CG-CZ2 3.49Å; P498-W524 VanDerWaalsContact CG-CZ2 3.49Å
499	P	88.9	Confident	86.1	Confident	65 Å²	65	46.8 Å²	46.8	42%	0.422	27%	0.273	S	S	.	.	H	α-helix	trans	-57.2	-41.6	178.2	-25.9	35.5	0	0	0	113.2	I501 F502 T503	P499-I501 VanDerWaalsContact C-N 3.26Å; P499-I501 PolarHBondContact O-N 2.95Å; P499-F502 PolarHBondContact O-N 3.05Å; P499-T503 WeakPolarHBondContact O-CG2 3.39Å; P499-T503 PolarHBondContact O-N 3.17Å; P499-T503 VanDerWaalsContact O-N 3.1Å
500	D	86.6	Confident	86.3	Confident	79 Å²	79	47.4 Å²	47.4	42%	0.422	28%	0.276	S	S	.	.	H	α-helix	trans	-65.2	-31.3	179.7	-61.7	-24.3	0	0	0	112	N497 P498 T503	N497-D500 HydrophobicContact CB-CB 4.27Å; N497-D500 VanDerWaalsContact CB-OD2 3.26Å; N497-D500 WeakPolarHBondContact CB-OD2 3.41Å; N497-D500 PolarHBondContact ND2-OD2 3.49Å; N497-D500 VanDerWaalsContact ND2-OD2 3.12Å; N497-D500 PolarHBondContact O-N 2.88Å; P498-D500 VanDerWaalsContact C-N 3.3Å; P498-D500 PolarHBondContact O-N 3.05Å; D500-T503 PolarHBondContact O-OG1 3.25Å
501	I	86.7	Confident	86.7	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-73	-44	175.3	-60.5	168	0	0	0	109.9	F489 W492 L494 N497 P498 P499 T503 K504 V505	F489-I501 HydrophobicContact CB-CD1 3.67Å; F489-I501 HydrophobicContact CD1-CD1 3.8Å; F489-I501 HydrophobicContact CG-CD1 3.88Å; W492-I501 HydrophobicContact CE3-CD1 4.16Å; W492-I501 HydrophobicContact CE3-CG2 4.21Å; W492-I501 HydrophobicContact CZ3-CG2 4.17Å; L494-I501 HydrophobicContact CB-CG1 4.19Å; L494-I501 HydrophobicContact CD1-CG2 4.34Å; N497-I501 WeakPolarHBondContact O-CG1 3.24Å; N497-I501 PolarHBondContact O-N 3.06Å; P498-I501 WeakPolarHBondContact O-CB 3.48Å; P498-I501 PolarHBondContact O-N 3.44Å; P498-I501 VanDerWaalsContact O-N 3.09Å; P499-I501 VanDerWaalsContact C-N 3.26Å; P499-I501 PolarHBondContact O-N 2.95Å; I501-T503 VanDerWaalsContact C-N 3.28Å; I501-T503 PolarHBondContact O-N 3.4Å; I501-K504 PolarHBondContact O-N 2.98Å; I501-V505 PolarHBondContact O-N 2.85Å
502	F	89.4	Confident	87.3	Confident	17 Å²	17	40.1 Å²	40.1	8%	0.075	23%	0.23	C	C	.	.	H	α-helix	trans	-73.5	-18	-173.9	-54.3	-25.7	0	0	0	113.9	V482 F489 P498 P499 K504 V505 A507 W524 V526	V482-F502 HydrophobicContact CG1-CZ 4.39Å; V482-F502 HydrophobicContact CG2-CE1 3.84Å; V482-F502 HydrophobicContact CG2-CZ 3.69Å; F489-F502 AromaticContact CE1-CE1 3.88Å; F489-F502 HydrophobicContact CE1-CE1 3.88Å; F489-F502 HydrophobicContact CE1-CZ 4.09Å; F489-F502 HydrophobicContact CE2-CE1 4.49Å; F489-F502 AromaticContact CE2-CZ 3.89Å; F489-F502 HydrophobicContact CE2-CZ 3.89Å; F489-F502 AromaticContact CZ-CE1 3.75Å; F489-F502 HydrophobicContact CZ-CE1 3.75Å; F489-F502 AromaticContact CZ-CZ 3.49Å; F489-F502 HydrophobicContact CZ-CZ 3.49Å; F489-F502 VanDerWaalsContact CZ-CZ 3.49Å; P498-F502 HydrophobicContact CB-CD2 4.26Å; P498-F502 HydrophobicContact CB-CE2 3.48Å; P498-F502 VanDerWaalsContact CB-CE2 3.48Å; P498-F502 HydrophobicContact CB-CZ 3.66Å; P498-F502 WeakPolarHBondContact O-CD1 3.49Å; P498-F502 WeakPolarHBondContact O-CD2 3.49Å; P498-F502 WeakPolarHBondContact O-CG 3.41Å; P498-F502 PolarHBondContact O-N 2.72Å; P499-F502 PolarHBondContact O-N 3.05Å; F502-K504 PolarHBondContact O-N 3.3Å; F502-V505 WeakPolarHBondContact CA-O 3.39Å; F502-A507 HydrophobicContact CB-CB 4.3Å; F502-A507 HydrophobicContact CD1-CB 3.41Å; F502-A507 VanDerWaalsContact CD1-CB 3.41Å; F502-A507 HydrophobicContact CD2-CB 4.36Å; F502-A507 HydrophobicContact CE1-CB 3.72Å; F502-A507 HydrophobicContact CG-CB 3.76Å; F502-A507 HydrophobicContact CZ-CB 4.32Å; F502-W524 HydrophobicContact CD2-CB 3.9Å; F502-W524 HydrophobicContact CD2-CG 4.33Å; F502-W524 HydrophobicContact CE2-CB 3.66Å; F502-W524 AromaticContact CE2-CD2 3.82Å; F502-W524 HydrophobicContact CE2-CD2 3.82Å; F502-W524 AromaticContact CE2-CE3 3.79Å; F502-W524 HydrophobicContact CE2-CE3 3.79Å; F502-W524 AromaticContact CE2-CG 3.79Å; F502-W524 HydrophobicContact CE2-CG 3.79Å; F502-W524 HydrophobicContact CZ-CE3 4.18Å; F502-V526 HydrophobicContact CD2-CG2 3.85Å; F502-V526 HydrophobicContact CE2-CG2 3.65Å; F502-V526 HydrophobicContact CZ-CG2 4.18Å
503	T	87	Confident	87.8	Confident	117 Å²	117	44.1 Å²	44.1	72%	0.718	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-24.6	167.6	58	0	0	0	0	113	P499 D500 I501	P499-T503 WeakPolarHBondContact O-CG2 3.39Å; P499-T503 PolarHBondContact O-N 3.17Å; P499-T503 VanDerWaalsContact O-N 3.1Å; D500-T503 PolarHBondContact O-OG1 3.25Å; I501-T503 VanDerWaalsContact C-N 3.28Å; I501-T503 PolarHBondContact O-N 3.4Å
504	K	82.9	Confident	88.9	Confident	97 Å²	97	46.3 Å²	46.3	42%	0.422	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.4	-26.6	-175.6	-62.7	174.1	-173.2	165.7	0	113.3	L494 I501 F502	L494-K504 HydrophobicContact CD2-CD 3.95Å; I501-K504 PolarHBondContact O-N 2.98Å; F502-K504 PolarHBondContact O-N 3.3Å
505	V	88	Confident	89.9	Confident	9 Å²	9	48.5 Å²	48.5	6%	0.055	27%	0.269	C	S	.	.	S	Bend	trans	-134	135.4	-172.6	-175.7	0	0	0	0	109.8	V477 V480 L494 I501 F502 A507	V477-V505 HydrophobicContact CG1-CG1 4.03Å; V480-V505 HydrophobicContact CB-CG1 4.48Å; V480-V505 HydrophobicContact CG2-CB 4.48Å; V480-V505 HydrophobicContact CG2-CG1 3.67Å; L494-V505 HydrophobicContact CD1-CG2 3.97Å; I501-V505 PolarHBondContact O-N 2.85Å; F502-V505 WeakPolarHBondContact CA-O 3.39Å; V505-A507 PolarHBondContact O-N 3.13Å
506	C	92.1	Very high	90.8	Very high	44 Å²	44	57 Å²	57	30%	0.297	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	117.9	178.7	-63.4	0	0	0	0	111.2	V478 A479 V480 F508 L550	V478-C506 PolarHBondContact O-N 3.28Å; A479-C506 CarbonylContact C-O 3.57Å; A479-C506 WeakPolarHBondContact CA-O 3.49Å; V480-C506 PolarHBondContact N-O 3.28Å; C506-F508 HydrophobicContact CB-CE2 3.82Å; C506-F508 HydrophobicContact CB-CZ 4.38Å; C506-L550 HydrophobicContact CB-CD1 4.47Å
507	A	94.6	Very high	91.3	Very high	2 Å²	2	56 Å²	56	2%	0.017	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	140.1	179	0	0	0	0	0	111.7	V480 V482 F502 V505 V526 N527	V480-A507 CarbonylContact O-C 3.55Å; V480-A507 WeakPolarHBondContact O-CA 3.47Å; V482-A507 HydrophobicContact CG2-CB 3.98Å; F502-A507 HydrophobicContact CB-CB 4.3Å; F502-A507 HydrophobicContact CD1-CB 3.41Å; F502-A507 VanDerWaalsContact CD1-CB 3.41Å; F502-A507 HydrophobicContact CD2-CB 4.36Å; F502-A507 HydrophobicContact CE1-CB 3.72Å; F502-A507 HydrophobicContact CG-CB 3.76Å; F502-A507 HydrophobicContact CZ-CB 4.32Å; V505-A507 PolarHBondContact O-N 3.13Å; A507-V526 HydrophobicContact CB-CB 4.25Å; A507-V526 HydrophobicContact CB-CG1 4.01Å; A507-V526 HydrophobicContact CB-CG2 3.85Å; A507-N527 PolarHBondContact O-N 3.1Å; A507-N527 PolarHBondContact O-ND2 3.07Å
508	F	96.8	Very high	91.5	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	139.1	177	-63.6	-89.4	0	0	0	111.1	A479 V480 F481 V482 C506 V526 N527 L529 F546 T549 L550	A479-F508 HydrophobicContact CB-CD2 4.12Å; A479-F508 HydrophobicContact CB-CE2 3.92Å; V480-F508 PolarHBondContact O-N 2.68Å; F481-F508 CarbonylContact C-O 3.57Å; F481-F508 VanDerWaalsContact CA-O 3.28Å; F481-F508 WeakPolarHBondContact CA-O 3.38Å; F481-F508 HydrophobicContact CD1-CB 4.13Å; F481-F508 HydrophobicContact CE1-CB 4.06Å; V482-F508 PolarHBondContact N-O 3.42Å; C506-F508 HydrophobicContact CB-CE2 3.82Å; C506-F508 HydrophobicContact CB-CZ 4.38Å; F508-V526 VanDerWaalsContact C-CG1 3.48Å; F508-N527 CarbonylContact C-O 3.56Å; F508-N527 VanDerWaalsContact CA-O 3.29Å; F508-N527 WeakPolarHBondContact CA-O 3.36Å; F508-N527 HydrophobicContact CD1-CB 3.54Å; F508-N527 HydrophobicContact CE1-CB 3.75Å; F508-N527 HydrophobicContact CG-CB 4.37Å; F508-L529 HydrophobicContact CB-CD1 4.36Å; F508-L529 HydrophobicContact CD1-CD1 4.05Å; F508-L529 HydrophobicContact CD1-CG 4.34Å; F508-F546 HydrophobicContact CB-CD2 4.36Å; F508-F546 AromaticContact CD1-CD2 3.55Å; F508-F546 HydrophobicContact CD1-CD2 3.55Å; F508-F546 HydrophobicContact CD1-CE2 4.23Å; F508-F546 AromaticContact CD2-CD2 3.65Å; F508-F546 HydrophobicContact CD2-CD2 3.65Å; F508-F546 AromaticContact CD2-CE2 3.44Å; F508-F546 HydrophobicContact CD2-CE2 3.44Å; F508-F546 VanDerWaalsContact CD2-CE2 3.44Å; F508-F546 HydrophobicContact CE1-CB 4.38Å; F508-F546 AromaticContact CE1-CD2 3.59Å; F508-F546 HydrophobicContact CE1-CD2 3.59Å; F508-F546 HydrophobicContact CE1-CE2 4.27Å; F508-F546 HydrophobicContact CE1-CG 4.33Å; F508-F546 AromaticContact CE2-CD2 3.68Å; F508-F546 HydrophobicContact CE2-CD2 3.68Å; F508-F546 AromaticContact CE2-CE2 3.48Å; F508-F546 HydrophobicContact CE2-CE2 3.48Å; F508-F546 VanDerWaalsContact CE2-CE2 3.48Å; F508-F546 HydrophobicContact CE2-CZ 4.48Å; F508-F546 AromaticContact CG-CD2 3.58Å; F508-F546 HydrophobicContact CG-CD2 3.58Å; F508-F546 AromaticContact CG-CE2 3.82Å; F508-F546 HydrophobicContact CG-CE2 3.82Å; F508-F546 AromaticContact CZ-CD2 3.64Å; F508-F546 HydrophobicContact CZ-CD2 3.64Å; F508-F546 AromaticContact CZ-CE2 3.9Å; F508-F546 HydrophobicContact CZ-CE2 3.9Å; F508-F546 HydrophobicContact CZ-CG 4.46Å; F508-T549 HydrophobicContact CE1-CG2 3.91Å; F508-T549 HydrophobicContact CZ-CG2 3.8Å; F508-L550 HydrophobicContact CE2-CD1 4.27Å
509	H	95.9	Very high	91.6	Very high	17 Å²	17	57.1 Å²	57.1	8%	0.079	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	119.8	173.1	178.3	65.6	0	0	0	109.1	V482 Q483 V521 V526 N527 L529	V482-H509 PolarHBondContact O-ND1 3.25Å; Q483-H509 PolarHBondContact O-CE1 3.15Å; H509-V521 HydrophobicContact CB-CG1 3.81Å; H509-V526 HydrophobicContact CB-CG1 3.7Å; H509-N527 PolarHBondContact N-O 3.27Å; H509-L529 PolarHBondContact O-N 3.34Å
510	L	95.2	Very high	91.8	Very high	13 Å²	13	56.8 Å²	56.8	7%	0.068	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	123.9	176.5	-166.8	68.4	0	0	0	109.1	L393 V394 L402 Y408 L529 L531	L393-L510 HydrophobicContact CB-CD2 3.84Å; L393-L510 HydrophobicContact CB-CG 4.28Å; L393-L510 HydrophobicContact CD1-CG 4.27Å; V394-L510 HydrophobicContact CG2-CB 4.1Å; V394-L510 HydrophobicContact CG2-CD2 3.31Å; V394-L510 HydrophobicContact CG2-CG 4.35Å; L402-L510 HydrophobicContact CD1-CD2 3.79Å; Y408-L510 HydrophobicContact CD2-CD2 4.44Å; Y408-L510 HydrophobicContact CE2-CD2 4.33Å; L510-L529 WeakPolarHBondContact CA-O 3.24Å; L510-L529 HydrophobicContact CD1-CB 3.55Å; L510-L529 HydrophobicContact CD1-CD1 4.38Å; L510-L531 HydrophobicContact CD1-CD1 3.68Å; L510-L531 HydrophobicContact CD1-CG 3.72Å; L510-L531 HydrophobicContact CD2-CD1 3.75Å; L510-L531 HydrophobicContact CG-CD1 3.94Å; L510-L531 HydrophobicContact CG-CG 4.37Å
511	K	94.6	Very high	92.1	Very high	38 Å²	38	53.1 Å²	53.1	17%	0.165	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	163.1	177.2	71.2	165.5	-160	141.8	0	112.2	D515 L517 I528 L529 T530 L531	K511-D515 PolarHBondContact NZ-O 2.77Å; K511-L517 HydrophobicContact CD-CD1 4.14Å; K511-I528 HydrophobicContact CD-CG2 4.09Å; K511-I528 HydrophobicContact CG-CG2 4.07Å; K511-L529 PolarHBondContact N-O 2.77Å; K511-T530 WeakPolarHBondContact O-CA 3.5Å; K511-L531 PolarHBondContact O-N 3.45Å
512	W	95.6	Very high	92.4	Very high	19 Å²	19	56.7 Å²	56.7	7%	0.072	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	152	166.2	-61.5	110.8	0	0	0	111.3	L393 Y408 D514 D515 L531 R533	L393-W512 HydrophobicContact CD1-CD2 4.21Å; L393-W512 HydrophobicContact CD1-CG 4.2Å; L393-W512 HydrophobicContact CD1-CZ2 4.48Å; L393-W512 HydrophobicContact CD2-CZ2 3.89Å; Y408-W512 AromaticContact CD1-CH2 3.63Å; Y408-W512 HydrophobicContact CD1-CH2 3.63Å; Y408-W512 HydrophobicContact CD1-CZ2 4.39Å; Y408-W512 HydrophobicContact CD1-CZ3 4.48Å; Y408-W512 AromaticContact CE1-CH2 3.31Å; Y408-W512 HydrophobicContact CE1-CH2 3.31Å; Y408-W512 AromaticContact CE1-CZ2 3.62Å; Y408-W512 HydrophobicContact CE1-CZ2 3.62Å; Y408-W512 HydrophobicContact CE1-CZ3 4.48Å; Y408-W512 HydrophobicContact CG-CH2 4.39Å; Y408-W512 AromaticContact CZ-CH2 3.81Å; Y408-W512 AromaticContact CZ-CZ2 3.77Å; W512-D514 VanDerWaalsContact C-N 3.3Å; W512-D514 PolarHBondContact O-N 2.78Å; W512-D515 HydrophobicContact CB-CB 4.09Å; W512-D515 VanDerWaalsContact CD1-OD2 3.28Å; W512-D515 PolarHBondContact O-N 3Å; W512-L531 CarbonylContact C-O 3.27Å; W512-L531 WeakPolarHBondContact CA-O 3.44Å; W512-L531 HydrophobicContact CE3-CB 3.96Å; W512-L531 HydrophobicContact CZ3-CB 3.9Å; W512-R533 VanDerWaalsContact CD1-CZ 3.43Å; W512-R533 HydrophobicContact CD2-CG 3.69Å; W512-R533 HydrophobicContact CE3-CB 4.39Å; W512-R533 HydrophobicContact CE3-CG 3.46Å; W512-R533 VanDerWaalsContact CE3-CG 3.46Å; W512-R533 HydrophobicContact CG-CG 4.2Å; W512-R533 HydrophobicContact CH2-CG 4.43Å; W512-R533 HydrophobicContact CZ3-CB 4.46Å; W512-R533 HydrophobicContact CZ3-CG 3.87Å
513	E	94.3	Very high	92.5	Very high	99 Å²	99	65.5 Å²	65.5	46%	0.463	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-43.1	175.2	-170.9	171.9	-160.2	0	0	112	D515 T530 L531 S532	E513-D515 VanDerWaalsContact C-N 3.33Å; E513-D515 PolarHBondContact O-N 2.97Å; E513-T530 HydrophobicContact CB-CG2 3.76Å; E513-T530 HydrophobicContact CG-CG2 4.17Å; E513-L531 PolarHBondContact N-O 3.47Å; E513-S532 WeakPolarHBondContact OE2-CB 3.26Å; E513-S532 PolarHBondContact OE2-OG 2.98Å; E513-S532 VanDerWaalsContact OE2-OG 3.11Å
514	D	94.1	Very high	92.8	Very high	120 Å²	120	61.6 Å²	61.6	64%	0.642	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.8	-12.7	-177.7	-48.8	-50.8	0	0	0	113.6	W512	W512-D514 VanDerWaalsContact C-N 3.3Å; W512-D514 PolarHBondContact O-N 2.78Å
515	D	92.5	Very high	93.2	Very high	68 Å²	68	60.9 Å²	60.9	36%	0.364	32%	0.317	S	S	.	.	S	Bend	trans	-86.5	136.9	-175.7	-73.2	9.1	0	0	0	111.2	K511 W512 E513 R533	K511-D515 PolarHBondContact NZ-O 2.77Å; W512-D515 HydrophobicContact CB-CB 4.09Å; W512-D515 VanDerWaalsContact CD1-OD2 3.28Å; W512-D515 PolarHBondContact O-N 3Å; E513-D515 VanDerWaalsContact C-N 3.33Å; E513-D515 PolarHBondContact O-N 2.97Å; D515-R533 IonicContact OD1-NH2 3.94Å; D515-R533 PolarHBondContact OD1-NH2 3.45Å; D515-R533 IonicContact OD2-NH2 3.82Å
516	K	93.2	Very high	93.5	Very high	207 Å²	207	61.4 Å²	61.4	90%	0.9	32%	0.32	S	S	*	.	P	Polyproline II helix	trans	-65	139.4	172.9	-67.4	-177.1	-179	178.9	0	110.1
517	L	92.3	Very high	93.6	Very high	60 Å²	60	62.4 Å²	62.4	31%	0.314	32%	0.323	S	S	.	.	P	Polyproline II helix	trans	-70.3	134	175.9	-173.3	67.7	0	0	0	109.8	K511 V521 I528	K511-L517 HydrophobicContact CD-CD1 4.14Å; L517-V521 HydrophobicContact CD1-CB 4.23Å; L517-V521 HydrophobicContact CD1-CG1 3.92Å; L517-I528 HydrophobicContact CD1-CD1 3.83Å; L517-I528 HydrophobicContact CD1-CG1 4.29Å; L517-I528 HydrophobicContact CD2-CD1 3.59Å; L517-I528 HydrophobicContact CG-CD1 4.39Å
518	D	91.2	Very high	93.7	Very high	58 Å²	58	66 Å²	66	31%	0.31	34%	0.341	S	S	.	.	P	Polyproline II helix	trans	-61.3	140.5	175.5	-174.7	-97.3	0	0	0	111	N520 V521 S522	D518-N520 PolarHBondContact O-N 3.21Å; D518-N520 VanDerWaalsContact OD1-CB 3.25Å; D518-N520 WeakPolarHBondContact OD1-CB 3.44Å; D518-N520 PolarHBondContact OD1-N 3.38Å; D518-N520 PolarHBondContact OD1-ND2 3.01Å; D518-V521 HydrophobicContact CB-CB 4.3Å; D518-V521 HydrophobicContact CB-CG2 3.91Å; D518-V521 PolarHBondContact O-N 3.11Å; D518-S522 PolarHBondContact O-N 3.25Å; D518-S522 VanDerWaalsContact O-N 3.08Å
519	S	92.5	Very high	93.6	Very high	71 Å²	71	66.3 Å²	66.3	50%	0.497	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67	-22.8	-175.3	58.9	0	0	0	0	113.6	S522 R523	S519-S522 PolarHBondContact O-OG 3.13Å; S519-R523 WeakPolarHBondContact O-CG 3.21Å
520	N	92.8	Very high	93.6	Very high	57 Å²	57	68.3 Å²	68.3	31%	0.305	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.2	-43.1	174.7	-54.6	-63	0	0	0	110.6	G484 D518 S522 R523 W524	G484-N520 WeakPolarHBondContact O-CB 3.33Å; D518-N520 PolarHBondContact O-N 3.21Å; D518-N520 VanDerWaalsContact OD1-CB 3.25Å; D518-N520 WeakPolarHBondContact OD1-CB 3.44Å; D518-N520 PolarHBondContact OD1-N 3.38Å; D518-N520 PolarHBondContact OD1-ND2 3.01Å; N520-S522 VanDerWaalsContact C-N 3.27Å; N520-S522 PolarHBondContact O-N 3.02Å; N520-R523 PolarHBondContact O-N 3.28Å; N520-W524 HydrophobicContact CB-CD2 4.46Å; N520-W524 HydrophobicContact CB-CH2 3.75Å; N520-W524 HydrophobicContact CB-CZ2 3.63Å; N520-W524 HydrophobicContact CB-CZ3 4.19Å; N520-W524 VanDerWaalsContact O-CG 3.27Å; N520-W524 PolarHBondContact O-N 3.41Å
521	V	93.4	Very high	93.6	Very high	3 Å²	3	67.8 Å²	67.8	2%	0.018	35%	0.353	C	S	.	.	G	3₁₀ helix	trans	-61.4	-37.2	178.9	-178.1	0	0	0	0	111.2	G484 H509 L517 D518 R523 W524 V526	G484-V521 VanDerWaalsContact CA-CG2 3.42Å; H509-V521 HydrophobicContact CB-CG1 3.81Å; L517-V521 HydrophobicContact CD1-CB 4.23Å; L517-V521 HydrophobicContact CD1-CG1 3.92Å; D518-V521 HydrophobicContact CB-CB 4.3Å; D518-V521 HydrophobicContact CB-CG2 3.91Å; D518-V521 PolarHBondContact O-N 3.11Å; V521-R523 PolarHBondContact O-N 2.79Å; V521-W524 HydrophobicContact CG2-CE3 4.45Å; V521-W524 PolarHBondContact O-N 2.95Å; V521-W524 VanDerWaalsContact O-N 3.17Å; V521-V526 HydrophobicContact CG1-CB 4.39Å
522	S	92	Very high	93.6	Very high	75 Å²	75	66.4 Å²	66.4	52%	0.524	35%	0.349	S	S	.	.	G	3₁₀ helix	trans	-63.8	-24.1	177	69.7	0	0	0	0	113.9	D518 S519 N520	D518-S522 PolarHBondContact O-N 3.25Å; D518-S522 VanDerWaalsContact O-N 3.08Å; S519-S522 PolarHBondContact O-OG 3.13Å; N520-S522 VanDerWaalsContact C-N 3.27Å; N520-S522 PolarHBondContact O-N 3.02Å
523	R	91.8	Very high	93.5	Very high	201 Å²	201	71.4 Å²	71.4	76%	0.758	37%	0.367	S	S	*	.	G	3₁₀ helix	trans	-89.9	-15.9	177.9	-63.6	174.9	-175.7	-176.7	0.6	112.9	S519 N520 V521	S519-R523 WeakPolarHBondContact O-CG 3.21Å; N520-R523 PolarHBondContact O-N 3.28Å; V521-R523 PolarHBondContact O-N 2.79Å
524	W	92.7	Very high	93.5	Very high	35 Å²	35	72.3 Å²	72.3	13%	0.133	38%	0.38	C	S	.	.	S	Bend	trans	-96.4	148.6	-176.1	-63	-21.6	0	0	0	111.6	V482 G484 A486 F489 P498 F502 N520 V521 V526	V482-W524 HydrophobicContact CG1-CE3 3.97Å; V482-W524 HydrophobicContact CG1-CZ3 3.71Å; G484-W524 WeakPolarHBondContact O-CH2 3.37Å; G484-W524 WeakPolarHBondContact O-CZ3 3.33Å; A486-W524 HydrophobicContact CB-CH2 4.2Å; A486-W524 HydrophobicContact CB-CZ2 4.13Å; F489-W524 HydrophobicContact CE2-CH2 4.28Å; F489-W524 HydrophobicContact CE2-CZ3 4.07Å; P498-W524 HydrophobicContact CB-CD2 3.91Å; P498-W524 HydrophobicContact CB-CE3 4.29Å; P498-W524 HydrophobicContact CB-CG 4.39Å; P498-W524 HydrophobicContact CB-CH2 4.21Å; P498-W524 HydrophobicContact CB-CZ2 3.85Å; P498-W524 HydrophobicContact CB-CZ3 4.43Å; P498-W524 HydrophobicContact CG-CD2 4.48Å; P498-W524 HydrophobicContact CG-CH2 3.89Å; P498-W524 HydrophobicContact CG-CZ2 3.49Å; P498-W524 VanDerWaalsContact CG-CZ2 3.49Å; F502-W524 HydrophobicContact CD2-CB 3.9Å; F502-W524 HydrophobicContact CD2-CG 4.33Å; F502-W524 HydrophobicContact CE2-CB 3.66Å; F502-W524 AromaticContact CE2-CD2 3.82Å; F502-W524 HydrophobicContact CE2-CD2 3.82Å; F502-W524 AromaticContact CE2-CE3 3.79Å; F502-W524 HydrophobicContact CE2-CE3 3.79Å; F502-W524 AromaticContact CE2-CG 3.79Å; F502-W524 HydrophobicContact CE2-CG 3.79Å; F502-W524 HydrophobicContact CZ-CE3 4.18Å; N520-W524 HydrophobicContact CB-CD2 4.46Å; N520-W524 HydrophobicContact CB-CH2 3.75Å; N520-W524 HydrophobicContact CB-CZ2 3.63Å; N520-W524 HydrophobicContact CB-CZ3 4.19Å; N520-W524 VanDerWaalsContact O-CG 3.27Å; N520-W524 PolarHBondContact O-N 3.41Å; V521-W524 HydrophobicContact CG2-CE3 4.45Å; V521-W524 PolarHBondContact O-N 2.95Å; V521-W524 VanDerWaalsContact O-N 3.17Å; W524-V526 HydrophobicContact CB-CG2 3.65Å; W524-V526 PolarHBondContact O-N 3.43Å
525	A	91.2	Very high	93.4	Very high	83 Å²	83	71.3 Å²	71.3	69%	0.686	37%	0.37	S	S	*	.			trans	-74	76.1	174.3	0	0	0	0	0	110.8
526	V	94.2	Very high	93.4	Very high	19 Å²	19	71.6 Å²	71.6	12%	0.115	37%	0.366	C	S	.	.			trans	-125.6	136.9	-174.8	-175.8	0	0	0	0	110.1	V482 F502 A507 F508 H509 V521 W524 I528	V482-V526 HydrophobicContact CB-CG1 4.42Å; V482-V526 HydrophobicContact CG2-CG1 4.22Å; V482-V526 HydrophobicContact CG2-CG2 4.32Å; F502-V526 HydrophobicContact CD2-CG2 3.85Å; F502-V526 HydrophobicContact CE2-CG2 3.65Å; F502-V526 HydrophobicContact CZ-CG2 4.18Å; A507-V526 HydrophobicContact CB-CB 4.25Å; A507-V526 HydrophobicContact CB-CG1 4.01Å; A507-V526 HydrophobicContact CB-CG2 3.85Å; F508-V526 VanDerWaalsContact C-CG1 3.48Å; H509-V526 HydrophobicContact CB-CG1 3.7Å; V521-V526 HydrophobicContact CG1-CB 4.39Å; W524-V526 HydrophobicContact CB-CG2 3.65Å; W524-V526 PolarHBondContact O-N 3.43Å; V526-I528 PolarHBondContact O-N 2.76Å
527	N	95.5	Very high	93.4	Very high	66 Å²	66	68.8 Å²	68.8	35%	0.353	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	119	175.9	-65.1	-72	0	0	0	110.5	A507 F508 H509	A507-N527 PolarHBondContact O-N 3.1Å; A507-N527 PolarHBondContact O-ND2 3.07Å; F508-N527 CarbonylContact C-O 3.56Å; F508-N527 VanDerWaalsContact CA-O 3.29Å; F508-N527 WeakPolarHBondContact CA-O 3.36Å; F508-N527 HydrophobicContact CD1-CB 3.54Å; F508-N527 HydrophobicContact CE1-CB 3.75Å; F508-N527 HydrophobicContact CG-CB 4.37Å; H509-N527 PolarHBondContact N-O 3.27Å
528	I	95.4	Very high	93.5	Very high	78 Å²	78	69.9 Å²	69.9	40%	0.4	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	121.7	-177	-56.9	167.1	0	0	0	109.6	K511 L517 V526	K511-I528 HydrophobicContact CD-CG2 4.09Å; K511-I528 HydrophobicContact CG-CG2 4.07Å; L517-I528 HydrophobicContact CD1-CD1 3.83Å; L517-I528 HydrophobicContact CD1-CG1 4.29Å; L517-I528 HydrophobicContact CD2-CD1 3.59Å; L517-I528 HydrophobicContact CG-CD1 4.39Å; V526-I528 PolarHBondContact O-N 2.76Å
529	L	95.8	Very high	93.6	Very high	6 Å²	6	67.2 Å²	67.2	3%	0.031	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	119.3	173.8	-59.7	173.3	0	0	0	108.3	F481 F508 H509 L510 K511 K545 F546	F481-L529 HydrophobicContact CE1-CD1 4.4Å; F508-L529 HydrophobicContact CB-CD1 4.36Å; F508-L529 HydrophobicContact CD1-CD1 4.05Å; F508-L529 HydrophobicContact CD1-CG 4.34Å; H509-L529 PolarHBondContact O-N 3.34Å; L510-L529 WeakPolarHBondContact CA-O 3.24Å; L510-L529 HydrophobicContact CD1-CB 3.55Å; L510-L529 HydrophobicContact CD1-CD1 4.38Å; K511-L529 PolarHBondContact N-O 2.77Å; L529-K545 HydrophobicContact CD2-CB 4.4Å; L529-F546 HydrophobicContact CD1-CB 3.82Å; L529-F546 HydrophobicContact CD1-CD2 4.19Å; L529-F546 HydrophobicContact CD1-CG 4.42Å; L529-F546 HydrophobicContact CD2-CB 4.38Å
530	T	95.2	Very high	93.7	Very high	58 Å²	58	72 Å²	72	36%	0.356	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	118.8	-176.2	-55.5	0	0	0	0	109.9	K511 E513 C542	K511-T530 WeakPolarHBondContact O-CA 3.5Å; E513-T530 HydrophobicContact CB-CG2 3.76Å; E513-T530 HydrophobicContact CG-CG2 4.17Å; T530-C542 PolarHBondContact N-SG 3.31Å; T530-C542 PolarHBondContact O-SG 3.24Å
531	L	95.5	Very high	93.7	Very high	2 Å²	2	72.3 Å²	72.3	1%	0.01	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	147.8	174.4	-65.4	178.4	0	0	0	111.2	Y408 L510 K511 W512 E513 D539 C542 L543	Y408-L531 HydrophobicContact CD2-CD1 3.43Å; Y408-L531 VanDerWaalsContact CD2-CD1 3.43Å; Y408-L531 HydrophobicContact CE2-CD1 4.15Å; Y408-L531 HydrophobicContact CG-CD1 3.83Å; L510-L531 HydrophobicContact CD1-CD1 3.68Å; L510-L531 HydrophobicContact CD1-CG 3.72Å; L510-L531 HydrophobicContact CD2-CD1 3.75Å; L510-L531 HydrophobicContact CG-CD1 3.94Å; L510-L531 HydrophobicContact CG-CG 4.37Å; K511-L531 PolarHBondContact O-N 3.45Å; W512-L531 CarbonylContact C-O 3.27Å; W512-L531 WeakPolarHBondContact CA-O 3.44Å; W512-L531 HydrophobicContact CE3-CB 3.96Å; W512-L531 HydrophobicContact CZ3-CB 3.9Å; E513-L531 PolarHBondContact N-O 3.47Å; L531-D539 HydrophobicContact CD2-CB 4.42Å; L531-C542 HydrophobicContact CD2-CB 4.18Å; L531-L543 HydrophobicContact CD2-CG 4.44Å
532	S	94.9	Very high	93.8	Very high	10 Å²	10	73 Å²	73	7%	0.07	37%	0.37	C	S	.	.			trans	-97.3	136.6	174.2	-167.2	0	0	0	0	110	E513 T534 K535 R536	E513-S532 WeakPolarHBondContact OE2-CB 3.26Å; E513-S532 PolarHBondContact OE2-OG 2.98Å; E513-S532 VanDerWaalsContact OE2-OG 3.11Å; S532-T534 VanDerWaalsContact C-N 3.28Å; S532-T534 PolarHBondContact O-N 3.04Å; S532-K535 PolarHBondContact OG-N 3.37Å; S532-R536 WeakPolarHBondContact O-CD 3.31Å
533	R	93.1	Very high	93.9	Very high	124 Å²	124	69.6 Å²	69.6	47%	0.468	35%	0.345	S	S	.	.	S	Bend	trans	-66.9	-33	178.1	-67.6	178	-177.2	-93.2	5.7	111.8	W512 D515	W512-R533 VanDerWaalsContact CD1-CZ 3.43Å; W512-R533 HydrophobicContact CD2-CG 3.69Å; W512-R533 HydrophobicContact CE3-CB 4.39Å; W512-R533 HydrophobicContact CE3-CG 3.46Å; W512-R533 VanDerWaalsContact CE3-CG 3.46Å; W512-R533 HydrophobicContact CG-CG 4.2Å; W512-R533 HydrophobicContact CH2-CG 4.43Å; W512-R533 HydrophobicContact CZ3-CB 4.46Å; W512-R533 HydrophobicContact CZ3-CG 3.87Å; D515-R533 IonicContact OD1-NH2 3.94Å; D515-R533 PolarHBondContact OD1-NH2 3.45Å; D515-R533 IonicContact OD2-NH2 3.82Å
534	T	93.7	Very high	93.9	Very high	118 Å²	118	63.1 Å²	63.1	72%	0.724	32%	0.324	S	S	*	.	S	Bend	trans	-101.6	-41.3	-175.4	55.3	0	0	0	0	112.9	S532 R536	S532-T534 VanDerWaalsContact C-N 3.28Å; S532-T534 PolarHBondContact O-N 3.04Å; T534-R536 PolarHBondContact O-N 3.27Å; T534-R536 VanDerWaalsContact O-N 3.08Å
535	K	93.2	Very high	94	Very high	99 Å²	99	67.5 Å²	67.5	43%	0.43	34%	0.344	S	S	.	.			trans	-88.3	65.5	-172.8	-58.3	175.7	-174.3	166.7	0	113.2	S532 H537 L538	S532-K535 PolarHBondContact OG-N 3.37Å; K535-H537 PolarHBondContact O-N 3.12Å; K535-L538 HydrophobicContact CB-CD1 3.79Å; K535-L538 HydrophobicContact CB-CG 4.16Å; K535-L538 HydrophobicContact CD-CD1 3.89Å; K535-L538 HydrophobicContact CG-CD1 4.5Å; K535-L538 WeakPolarHBondContact O-CB 3.32Å; K535-L538 PolarHBondContact O-N 3.1Å
536	R	92.3	Very high	94.1	Very high	73 Å²	73	63.6 Å²	63.6	28%	0.275	31%	0.311	S	S	.	.	G	3₁₀ helix	trans	-68.5	-14.6	-174.5	-56	-58.7	-75.7	-94.7	-24.8	116.1	Y408 S532 T534 L538 D539	Y408-R536 PolarHBondContact O-NH2 3.1Å; S532-R536 WeakPolarHBondContact O-CD 3.31Å; T534-R536 PolarHBondContact O-N 3.27Å; T534-R536 VanDerWaalsContact O-N 3.08Å; R536-L538 PolarHBondContact O-N 3.43Å; R536-D539 IonicContact CZ-OD2 2.98Å; R536-D539 IonicContact NE-OD1 3.8Å; R536-D539 IonicContact NE-OD2 2.74Å; R536-D539 PolarHBondContact NE-OD2 3.43Å; R536-D539 WeakPolarHBondContact O-CB 3.27Å; R536-D539 VanDerWaalsContact O-CG 3.26Å; R536-D539 PolarHBondContact O-N 3.18Å
537	H	92.4	Very high	94.1	Very high	149 Å²	149	63 Å²	63	69%	0.69	31%	0.307	S	S	*	.	G	3₁₀ helix	trans	-68.7	-18.8	171.2	59.5	-87.5	0	0	0	112.4	K535	K535-H537 PolarHBondContact O-N 3.12Å
538	L	94.1	Very high	93.9	Very high	82 Å²	82	63.8 Å²	63.8	43%	0.429	31%	0.308	S	S	.	.	G	3₁₀ helix	trans	-85.4	-13.7	177.3	-58.7	178.8	0	0	0	113.2	K535 R536 R540 A541 C542	K535-L538 HydrophobicContact CB-CD1 3.79Å; K535-L538 HydrophobicContact CB-CG 4.16Å; K535-L538 HydrophobicContact CD-CD1 3.89Å; K535-L538 HydrophobicContact CG-CD1 4.5Å; K535-L538 WeakPolarHBondContact O-CB 3.32Å; K535-L538 PolarHBondContact O-N 3.1Å; R536-L538 PolarHBondContact O-N 3.43Å; L538-R540 PolarHBondContact O-N 3.23Å; L538-A541 PolarHBondContact O-N 3.2Å; L538-A541 VanDerWaalsContact O-N 3.14Å; L538-C542 PolarHBondContact O-N 3.43Å; L538-C542 VanDerWaalsContact O-N 3.11Å
539	D	94.6	Very high	93.8	Very high	2 Å²	2	61.8 Å²	61.8	1%	0.011	30%	0.3	C	S	.	.	H	α-helix	trans	-52.8	-45.3	-179.1	-67.5	-1.1	0	0	0	110.8	Y408 L531 R536 A541 C542 L543	Y408-D539 WeakPolarHBondContact CB-OD2 3.44Å; Y408-D539 PolarHBondContact N-OD2 3.48Å; Y408-D539 VanDerWaalsContact N-OD2 3.08Å; L531-D539 HydrophobicContact CD2-CB 4.42Å; R536-D539 IonicContact CZ-OD2 2.98Å; R536-D539 IonicContact NE-OD1 3.8Å; R536-D539 IonicContact NE-OD2 2.74Å; R536-D539 PolarHBondContact NE-OD2 3.43Å; R536-D539 WeakPolarHBondContact O-CB 3.27Å; R536-D539 VanDerWaalsContact O-CG 3.26Å; R536-D539 PolarHBondContact O-N 3.18Å; D539-A541 PolarHBondContact O-N 2.82Å; D539-C542 PolarHBondContact O-N 2.82Å; D539-L543 HydrophobicContact CB-CD1 4.27Å; D539-L543 WeakPolarHBondContact O-CB 3.28Å; D539-L543 VanDerWaalsContact O-CG 3.27Å; D539-L543 WeakPolarHBondContact O-CG 3.39Å; D539-L543 PolarHBondContact O-N 3.14Å
540	R	93.5	Very high	93.6	Very high	171 Å²	171	62.5 Å²	62.5	65%	0.645	30%	0.304	S	S	*	.	H	α-helix	trans	-59.2	-45.4	-178.6	-176.7	176.2	177.2	131	-2.3	112.2	L406 L538 H544	L406-R540 HydrophobicContact CB-CB 4.35Å; L406-R540 HydrophobicContact CB-CG 4.05Å; L406-R540 HydrophobicContact CD1-CG 4.05Å; L406-R540 WeakPolarHBondContact O-CA 3.23Å; L406-R540 PolarHBondContact O-N 2.99Å; L538-R540 PolarHBondContact O-N 3.23Å; R540-H544 VanDerWaalsContact O-CB 3.28Å; R540-H544 WeakPolarHBondContact O-CB 3.3Å; R540-H544 PolarHBondContact O-N 3.35Å
541	A	93.7	Very high	93.2	Very high	64 Å²	64	63.4 Å²	63.4	53%	0.529	31%	0.306	S	S	.	.	H	α-helix	trans	-67.5	-38.1	179.9	0	0	0	0	0	111.6	L538 D539	L538-A541 PolarHBondContact O-N 3.2Å; L538-A541 VanDerWaalsContact O-N 3.14Å; D539-A541 PolarHBondContact O-N 2.82Å
542	C	94.1	Very high	92.6	Very high	19 Å²	19	74.4 Å²	74.4	13%	0.128	35%	0.348	C	S	.	.	H	α-helix	trans	-68.6	-46.5	177.1	-171.7	0	0	0	0	112.1	T530 L531 L538 D539 H544 K545	T530-C542 PolarHBondContact N-SG 3.31Å; T530-C542 PolarHBondContact O-SG 3.24Å; L531-C542 HydrophobicContact CD2-CB 4.18Å; L538-C542 PolarHBondContact O-N 3.43Å; L538-C542 VanDerWaalsContact O-N 3.11Å; D539-C542 PolarHBondContact O-N 2.82Å; C542-H544 VanDerWaalsContact C-N 3.29Å; C542-H544 PolarHBondContact O-N 3.46Å; C542-K545 WeakPolarHBondContact O-CB 3.25Å; C542-K545 PolarHBondContact O-N 3.05Å
543	L	94.7	Very high	92.5	Very high	2 Å²	2	77.6 Å²	77.6	1%	0.01	36%	0.361	C	S	.	.	H	α-helix	trans	-73.5	-20.9	-179.5	-64.6	167	0	0	0	112.4	L402 L406 L531 D539 K545 F546	L402-L543 HydrophobicContact CD2-CD2 3.59Å; L402-L543 HydrophobicContact CG-CD1 4.18Å; L402-L543 HydrophobicContact CG-CD2 4.01Å; L402-L543 WeakPolarHBondContact O-CD1 3.46Å; L406-L543 HydrophobicContact CB-CB 4.36Å; L406-L543 HydrophobicContact CD2-CB 3.97Å; L531-L543 HydrophobicContact CD2-CG 4.44Å; D539-L543 HydrophobicContact CB-CD1 4.27Å; D539-L543 WeakPolarHBondContact O-CB 3.28Å; D539-L543 VanDerWaalsContact O-CG 3.27Å; D539-L543 WeakPolarHBondContact O-CG 3.39Å; D539-L543 PolarHBondContact O-N 3.14Å; L543-K545 VanDerWaalsContact C-N 3.32Å; L543-F546 WeakPolarHBondContact O-CB 3.34Å; L543-F546 PolarHBondContact O-N 3.35Å
544	H	92.9	Very high	92.4	Very high	65 Å²	65	75.2 Å²	75.2	30%	0.301	36%	0.356	S	S	.	.	H	α-helix	trans	-64.2	-37.7	168.9	-163.7	-98.9	0	0	0	111.9	R540 C542 F546 W547 E548	R540-H544 VanDerWaalsContact O-CB 3.28Å; R540-H544 WeakPolarHBondContact O-CB 3.3Å; R540-H544 PolarHBondContact O-N 3.35Å; C542-H544 VanDerWaalsContact C-N 3.29Å; C542-H544 PolarHBondContact O-N 3.46Å; H544-F546 VanDerWaalsContact C-N 3.26Å; H544-F546 PolarHBondContact O-N 3.47Å; H544-W547 PolarHBondContact O-N 3.28Å; H544-E548 IonicContact CE1-OE1 3.29Å; H544-E548 PolarHBondContact CE1-OE1 2.79Å; H544-E548 VanDerWaalsContact CE1-OE1 3.29Å; H544-E548 IonicContact ND1-OE1 2.75Å; H544-E548 PolarHBondContact ND1-OE1 3.37Å; H544-E548 PolarHBondContact O-N 3.5Å
545	K	93.3	Very high	92.4	Very high	127 Å²	127	72.8 Å²	72.8	55%	0.552	34%	0.335	S	S	*	.	H	α-helix	trans	-59.4	-36.7	176.7	-63.7	180	178.4	-178.4	0	112.4	L529 C542 L543 W547 E548 T549	L529-K545 HydrophobicContact CD2-CB 4.4Å; C542-K545 WeakPolarHBondContact O-CB 3.25Å; C542-K545 PolarHBondContact O-N 3.05Å; L543-K545 VanDerWaalsContact C-N 3.32Å; K545-W547 VanDerWaalsContact C-N 3.29Å; K545-W547 PolarHBondContact O-N 2.88Å; K545-E548 PolarHBondContact O-N 3.32Å; K545-T549 WeakPolarHBondContact O-CB 3.41Å; K545-T549 PolarHBondContact O-N 3.24Å; K545-T549 PolarHBondContact O-OG1 3.45Å; K545-T549 VanDerWaalsContact O-OG1 3.06Å
546	F	94.8	Very high	92.3	Very high	1 Å²	1	71.2 Å²	71.2	0%	0.004	33%	0.33	C	S	.	.	H	α-helix	trans	-53.8	-49.5	173.1	165.6	-95.7	0	0	0	111.1	I384 L403 A479 F481 F508 L529 L543 H544 T549 L550	I384-F546 HydrophobicContact CD1-CZ 4.15Å; L403-F546 HydrophobicContact CD2-CD1 3.85Å; L403-F546 HydrophobicContact CD2-CE1 3.62Å; L403-F546 HydrophobicContact CD2-CG 4.49Å; L403-F546 HydrophobicContact CD2-CZ 4.08Å; A479-F546 HydrophobicContact CB-CE2 4.43Å; F481-F546 AromaticContact CE2-CE2 3.77Å; F481-F546 HydrophobicContact CE2-CE2 3.77Å; F481-F546 HydrophobicContact CE2-CZ 4.12Å; F481-F546 AromaticContact CZ-CD2 3.89Å; F481-F546 HydrophobicContact CZ-CD2 3.89Å; F481-F546 AromaticContact CZ-CE2 3.61Å; F481-F546 HydrophobicContact CZ-CE2 3.61Å; F481-F546 HydrophobicContact CZ-CZ 4.2Å; F508-F546 HydrophobicContact CB-CD2 4.36Å; F508-F546 AromaticContact CD1-CD2 3.55Å; F508-F546 HydrophobicContact CD1-CD2 3.55Å; F508-F546 HydrophobicContact CD1-CE2 4.23Å; F508-F546 AromaticContact CD2-CD2 3.65Å; F508-F546 HydrophobicContact CD2-CD2 3.65Å; F508-F546 AromaticContact CD2-CE2 3.44Å; F508-F546 HydrophobicContact CD2-CE2 3.44Å; F508-F546 VanDerWaalsContact CD2-CE2 3.44Å; F508-F546 HydrophobicContact CE1-CB 4.38Å; F508-F546 AromaticContact CE1-CD2 3.59Å; F508-F546 HydrophobicContact CE1-CD2 3.59Å; F508-F546 HydrophobicContact CE1-CE2 4.27Å; F508-F546 HydrophobicContact CE1-CG 4.33Å; F508-F546 AromaticContact CE2-CD2 3.68Å; F508-F546 HydrophobicContact CE2-CD2 3.68Å; F508-F546 AromaticContact CE2-CE2 3.48Å; F508-F546 HydrophobicContact CE2-CE2 3.48Å; F508-F546 VanDerWaalsContact CE2-CE2 3.48Å; F508-F546 HydrophobicContact CE2-CZ 4.48Å; F508-F546 AromaticContact CG-CD2 3.58Å; F508-F546 HydrophobicContact CG-CD2 3.58Å; F508-F546 AromaticContact CG-CE2 3.82Å; F508-F546 HydrophobicContact CG-CE2 3.82Å; F508-F546 AromaticContact CZ-CD2 3.64Å; F508-F546 HydrophobicContact CZ-CD2 3.64Å; F508-F546 AromaticContact CZ-CE2 3.9Å; F508-F546 HydrophobicContact CZ-CE2 3.9Å; F508-F546 HydrophobicContact CZ-CG 4.46Å; L529-F546 HydrophobicContact CD1-CB 3.82Å; L529-F546 HydrophobicContact CD1-CD2 4.19Å; L529-F546 HydrophobicContact CD1-CG 4.42Å; L529-F546 HydrophobicContact CD2-CB 4.38Å; L543-F546 WeakPolarHBondContact O-CB 3.34Å; L543-F546 PolarHBondContact O-N 3.35Å; H544-F546 VanDerWaalsContact C-N 3.26Å; H544-F546 PolarHBondContact O-N 3.47Å; F546-T549 PolarHBondContact O-N 2.9Å; F546-L550 HydrophobicContact CE1-CD2 4.33Å; F546-L550 HydrophobicContact CZ-CD2 4.31Å; F546-L550 WeakPolarHBondContact O-CB 3.35Å; F546-L550 PolarHBondContact O-N 3.07Å
547	W	93.2	Very high	92.3	Very high	7 Å²	7	71.1 Å²	71.1	3%	0.027	33%	0.333	C	S	.	.	H	α-helix	trans	-71.9	-33.5	-177.5	-76.9	125.8	0	0	0	113.4	I384 L403 I427 R429 F439 H544 K545 L550 D551	I384-W547 HydrophobicContact CD1-CH2 4.2Å; I384-W547 HydrophobicContact CD1-CZ3 4.46Å; L403-W547 HydrophobicContact CB-CZ2 4.03Å; L403-W547 WeakPolarHBondContact O-CZ2 3.43Å; L403-W547 PolarHBondContact O-NE1 2.83Å; I427-W547 HydrophobicContact CD1-CH2 4.05Å; I427-W547 HydrophobicContact CD1-CZ2 4.05Å; R429-W547 HydrophobicContact CB-CH2 4.16Å; R429-W547 HydrophobicContact CB-CZ2 4.31Å; R429-W547 VanDerWaalsContact CD-CE3 3.45Å; R429-W547 HydrophobicContact CG-CD2 4.39Å; R429-W547 HydrophobicContact CG-CE3 4.47Å; R429-W547 HydrophobicContact CG-CH2 4.32Å; R429-W547 HydrophobicContact CG-CZ2 4.25Å; R429-W547 HydrophobicContact CG-CZ3 4.43Å; R429-W547 PolarHBondContact NH1-O 3.31Å; F439-W547 HydrophobicContact CD1-CZ3 4.41Å; F439-W547 HydrophobicContact CD2-CH2 4.04Å; F439-W547 HydrophobicContact CD2-CZ3 4.25Å; F439-W547 HydrophobicContact CE1-CZ3 4.11Å; F439-W547 HydrophobicContact CE2-CH2 4.16Å; F439-W547 AromaticContact CE2-CZ3 3.94Å; F439-W547 HydrophobicContact CE2-CZ3 3.94Å; F439-W547 HydrophobicContact CG-CH2 4.26Å; F439-W547 HydrophobicContact CG-CZ3 4.49Å; F439-W547 HydrophobicContact CZ-CH2 4.48Å; F439-W547 AromaticContact CZ-CZ3 3.87Å; F439-W547 HydrophobicContact CZ-CZ3 3.87Å; H544-W547 PolarHBondContact O-N 3.28Å; K545-W547 VanDerWaalsContact C-N 3.29Å; K545-W547 PolarHBondContact O-N 2.88Å; W547-L550 HydrophobicContact CE3-CB 4.46Å; W547-L550 HydrophobicContact CE3-CD2 3.59Å; W547-L550 HydrophobicContact CZ3-CD2 3.41Å; W547-L550 VanDerWaalsContact CZ3-CD2 3.41Å; W547-L550 PolarHBondContact O-N 3.03Å; W547-D551 WeakPolarHBondContact O-CB 3.47Å; W547-D551 PolarHBondContact O-N 3.39Å
548	E	91.9	Very high	92.3	Very high	82 Å²	82	65.9 Å²	65.9	38%	0.383	31%	0.309	S	S	.	.	H	α-helix	trans	-65.8	-36.9	171.2	-73.2	176	-162.7	0	0	112.6	H544 K545 R552	H544-E548 IonicContact CE1-OE1 3.29Å; H544-E548 PolarHBondContact CE1-OE1 2.79Å; H544-E548 VanDerWaalsContact CE1-OE1 3.29Å; H544-E548 IonicContact ND1-OE1 2.75Å; H544-E548 PolarHBondContact ND1-OE1 3.37Å; H544-E548 PolarHBondContact O-N 3.5Å; K545-E548 PolarHBondContact O-N 3.32Å; E548-R552 WeakPolarHBondContact O-CG 3.15Å; E548-R552 PolarHBondContact O-NE 3.13Å
549	T	92.7	Very high	92.2	Very high	36 Å²	36	64.8 Å²	64.8	22%	0.221	30%	0.301	C	S	.	.	H	α-helix	trans	-74.2	-34.2	176	-60.2	0	0	0	0	111.5	F508 K545 F546	F508-T549 HydrophobicContact CE1-CG2 3.91Å; F508-T549 HydrophobicContact CZ-CG2 3.8Å; K545-T549 WeakPolarHBondContact O-CB 3.41Å; K545-T549 PolarHBondContact O-N 3.24Å; K545-T549 PolarHBondContact O-OG1 3.45Å; K545-T549 VanDerWaalsContact O-OG1 3.06Å; F546-T549 PolarHBondContact O-N 2.9Å
550	L	91.4	Very high	92	Very high	22 Å²	22	69.6 Å²	69.6	12%	0.115	32%	0.323	C	S	.	.	H	α-helix	trans	-74.5	-30.9	179	-165.6	79.7	0	0	0	113.5	F439 V478 A479 C506 F508 F546 W547 R552	F439-L550 HydrophobicContact CE1-CD2 3.85Å; F439-L550 HydrophobicContact CZ-CD2 4.27Å; V478-L550 HydrophobicContact CB-CD1 4.35Å; V478-L550 HydrophobicContact CG2-CD1 4.18Å; V478-L550 HydrophobicContact CG2-CD2 4.42Å; A479-L550 HydrophobicContact CB-CD1 3.43Å; A479-L550 VanDerWaalsContact CB-CD1 3.43Å; C506-L550 HydrophobicContact CB-CD1 4.47Å; F508-L550 HydrophobicContact CE2-CD1 4.27Å; F546-L550 HydrophobicContact CE1-CD2 4.33Å; F546-L550 HydrophobicContact CZ-CD2 4.31Å; F546-L550 WeakPolarHBondContact O-CB 3.35Å; F546-L550 PolarHBondContact O-N 3.07Å; W547-L550 HydrophobicContact CE3-CB 4.46Å; W547-L550 HydrophobicContact CE3-CD2 3.59Å; W547-L550 HydrophobicContact CZ3-CD2 3.41Å; W547-L550 VanDerWaalsContact CZ3-CD2 3.41Å; W547-L550 PolarHBondContact O-N 3.03Å; L550-R552 VanDerWaalsContact C-N 3.34Å
551	D	86.9	Confident	91.9	Very high	76 Å²	76	61.2 Å²	61.2	41%	0.406	30%	0.296	S	S	.	.	H	α-helix	trans	-78.1	-20.4	178.5	-86.6	-11.7	0	0	0	113.8	R429 R431 W547	R429-D551 IonicContact CZ-OD1 2.69Å; R429-D551 IonicContact CZ-OD2 2.59Å; R429-D551 IonicContact NH1-OD1 3.46Å; R429-D551 PolarHBondContact NH1-OD1 2.81Å; R429-D551 IonicContact NH1-OD2 2.99Å; R429-D551 PolarHBondContact NH1-OD2 3.28Å; R429-D551 IonicContact NH2-OD1 3.85Å; R429-D551 IonicContact NH2-OD2 3.18Å; R429-D551 PolarHBondContact NH2-OD2 3.19Å; R431-D551 IonicContact NH2-OD1 2.86Å; W547-D551 WeakPolarHBondContact O-CB 3.47Å; W547-D551 PolarHBondContact O-N 3.39Å
552	R	83	Confident	91.7	Very high	233 Å²	233	60.9 Å²	60.9	88%	0.879	28%	0.275	S	S	*	.			trans	-76.3	0	171.4	-75	-176.8	-123	-165.7	-3.4	109.7	E548 L550	E548-R552 WeakPolarHBondContact O-CG 3.15Å; E548-R552 PolarHBondContact O-NE 3.13Å; L550-R552 VanDerWaalsContact C-N 3.34Å

Retrieved 552 of 552 residues in 303.2 ms (Link to these results)

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