A0A3Q0KN13_SCHMA Loading...

PAT complex subunit CCDC47

AlphaFold DB , UniProt , Accession A0A3Q0KN13, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 525 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	48.5	Very low	50.8	Low	212 Å²	212	118.3 Å²	118.3	100%	1.044	60%	0.602	S	S	*	*				0	-55.2	0	-114.8	-176.9	-108.5	0	0	112.6	L3 A4 F5	M1-L3 PolarHBondContact O-N 3.1Å; M1-A4 PolarHBondContact O-N 3.22Å; M1-F5 WeakPolarHBondContact O-CB 3.48Å; M1-F5 PolarHBondContact O-N 3.1Å
2	I	50.5	Low	51.5	Low	136 Å²	136	112.5 Å²	112.5	70%	0.697	58%	0.576	S	S	*	*	H	α-helix	trans	-60.6	-44.3	-179.8	-64.4	166.1	0	0	0	112.8	A4 F5 L6	I2-A4 PolarHBondContact O-N 3.47Å; I2-F5 PolarHBondContact O-N 3.12Å; I2-L6 HydrophobicContact CG2-CD1 3.78Å; I2-L6 WeakPolarHBondContact O-CB 3.49Å; I2-L6 WeakPolarHBondContact O-CD1 3.37Å; I2-L6 WeakPolarHBondContact O-CG 3.49Å; I2-L6 PolarHBondContact O-N 2.93Å
3	L	46.1	Very low	52.1	Low	148 Å²	148	108.5 Å²	108.5	78%	0.775	56%	0.563	S	S	*	*	H	α-helix	trans	-65.9	-31.7	175.9	-93.9	147.1	0	0	0	114.2	M1 R7	M1-L3 PolarHBondContact O-N 3.1Å; L3-R7 WeakPolarHBondContact O-CB 3.42Å; L3-R7 PolarHBondContact O-N 2.92Å
4	A	53.1	Low	52.9	Low	64 Å²	64	107.1 Å²	107.1	53%	0.529	56%	0.556	S	S	.	*	H	α-helix	trans	-79.4	-34.7	177.5	0	0	0	0	0	111.8	M1 I2 R7 S8	M1-A4 PolarHBondContact O-N 3.22Å; I2-A4 PolarHBondContact O-N 3.47Å; A4-R7 PolarHBondContact O-N 3.21Å; A4-S8 WeakPolarHBondContact O-CB 3.47Å; A4-S8 PolarHBondContact O-N 2.96Å
5	F	49.4	Very low	53.8	Low	132 Å²	132	109.1 Å²	109.1	58%	0.579	55%	0.554	S	S	*	*	H	α-helix	trans	-66.6	-42.5	171.1	-176.7	-98.5	0	0	0	111.5	M1 I2 Q9	M1-F5 WeakPolarHBondContact O-CB 3.48Å; M1-F5 PolarHBondContact O-N 3.1Å; I2-F5 PolarHBondContact O-N 3.12Å; F5-Q9 PolarHBondContact O-N 3.34Å
6	L	44.6	Very low	54.5	Low	72 Å²	72	104.2 Å²	104.2	38%	0.377	53%	0.533	S	S	.	.	H	α-helix	trans	-57.4	-50.7	170.3	-82.6	156.6	0	0	0	110.1	I2 S8 Q9 L10	I2-L6 HydrophobicContact CG2-CD1 3.78Å; I2-L6 WeakPolarHBondContact O-CB 3.49Å; I2-L6 WeakPolarHBondContact O-CD1 3.37Å; I2-L6 WeakPolarHBondContact O-CG 3.49Å; I2-L6 PolarHBondContact O-N 2.93Å; L6-S8 PolarHBondContact O-N 3.22Å; L6-Q9 PolarHBondContact O-N 3.25Å; L6-L10 HydrophobicContact CD2-CD1 4.06Å; L6-L10 HydrophobicContact CD2-CD2 4.27Å; L6-L10 WeakPolarHBondContact O-CB 3.48Å; L6-L10 VanDerWaalsContact O-CD1 3.25Å; L6-L10 WeakPolarHBondContact O-CD1 3.38Å; L6-L10 WeakPolarHBondContact O-CG 3.38Å; L6-L10 PolarHBondContact O-N 2.96Å; L6-L10 VanDerWaalsContact O-N 3.07Å
7	R	50.7	Low	55.3	Low	192 Å²	192	103.4 Å²	103.4	73%	0.725	53%	0.529	S	S	*	.	H	α-helix	trans	-64	-37.6	-178.4	-160.2	171.8	-176.4	169.7	1.1	114.2	L3 A4	L3-R7 WeakPolarHBondContact O-CB 3.42Å; L3-R7 PolarHBondContact O-N 2.92Å; A4-R7 PolarHBondContact O-N 3.21Å
8	S	58.9	Low	56.5	Low	78 Å²	78	106.1 Å²	106.1	55%	0.545	53%	0.532	S	S	.	.	H	α-helix	trans	-69.6	-30	-179.1	165.8	0	0	0	0	114	A4 L6	A4-S8 WeakPolarHBondContact O-CB 3.47Å; A4-S8 PolarHBondContact O-N 2.96Å; L6-S8 PolarHBondContact O-N 3.22Å
9	Q	51.4	Low	57.5	Low	112 Å²	112	104.3 Å²	104.3	52%	0.523	52%	0.524	S	S	.	.	H	α-helix	trans	-99.1	-15.7	-179	-65	-69.8	-30	0	0	113.4	F5 L6	F5-Q9 PolarHBondContact O-N 3.34Å; L6-Q9 PolarHBondContact O-N 3.25Å
10	L	50.9	Low	58.3	Low	38 Å²	38	102.6 Å²	102.6	20%	0.199	52%	0.515	C	S	.	.	H	α-helix	trans	-89.9	-14.8	-170.5	-100.2	56.4	0	0	0	116.7	L6 V12 P13 L14	L6-L10 HydrophobicContact CD2-CD1 4.06Å; L6-L10 HydrophobicContact CD2-CD2 4.27Å; L6-L10 WeakPolarHBondContact O-CB 3.48Å; L6-L10 VanDerWaalsContact O-CD1 3.25Å; L6-L10 WeakPolarHBondContact O-CD1 3.38Å; L6-L10 WeakPolarHBondContact O-CG 3.38Å; L6-L10 PolarHBondContact O-N 2.96Å; L6-L10 VanDerWaalsContact O-N 3.07Å; L10-V12 PolarHBondContact O-N 3.48Å; L10-V12 VanDerWaalsContact O-N 3.1Å; L10-P13 WeakPolarHBondContact O-CD 3.37Å; L10-L14 HydrophobicContact CB-CB 4.48Å; L10-L14 HydrophobicContact CD2-CD1 3.85Å; L10-L14 HydrophobicContact CG-CD1 3.92Å; L10-L14 VanDerWaalsContact O-CB 3.28Å; L10-L14 WeakPolarHBondContact O-CB 3.35Å; L10-L14 PolarHBondContact O-N 3.2Å; L10-L14 VanDerWaalsContact O-N 3.16Å
11	D	54.5	Low	59.1	Low	117 Å²	117	99.9 Å²	99.9	63%	0.626	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-21.8	-166	-77.1	-19.1	0	0	0	115	Y15	D11-Y15 VanDerWaalsContact O-CB 3.29Å; D11-Y15 WeakPolarHBondContact O-CB 3.25Å
12	V	59.8	Low	60.6	Low	49 Å²	49	92 Å²	92	30%	0.297	47%	0.473	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.7	-53.7	179.4	-172.4	0	0	0	0	112.5	L10 L14 Y15 C16 I182	L10-V12 PolarHBondContact O-N 3.48Å; L10-V12 VanDerWaalsContact O-N 3.1Å; V12-L14 PolarHBondContact O-N 3.26Å; V12-Y15 PolarHBondContact O-N 3.31Å; V12-C16 PolarHBondContact O-N 3.11Å; V12-C16 PolarHBondContact O-SG 2.95Å; V12-I182 HydrophobicContact CG1-CD1 4.25Å
13	P	59	Low	61.6	Low	61 Å²	61	87.2 Å²	87.2	40%	0.396	45%	0.453	S	S	.	.	H	α-helix	trans	-69.9	-33.5	-177.2	27.3	-34.5	0	0	0	112.6	L10 L17	L10-P13 WeakPolarHBondContact O-CD 3.37Å; P13-L17 WeakPolarHBondContact O-CB 3.37Å; P13-L17 VanDerWaalsContact O-CG 3.27Å; P13-L17 WeakPolarHBondContact O-CG 3.41Å; P13-L17 PolarHBondContact O-N 3.16Å
14	L	62.9	Low	63.1	Low	89 Å²	89	86.1 Å²	86.1	47%	0.466	44%	0.442	S	S	.	.	H	α-helix	trans	-74.1	-34.8	179.6	-135.4	96.6	0	0	0	111.7	L10 V12 W18	L10-L14 HydrophobicContact CB-CB 4.48Å; L10-L14 HydrophobicContact CD2-CD1 3.85Å; L10-L14 HydrophobicContact CG-CD1 3.92Å; L10-L14 VanDerWaalsContact O-CB 3.28Å; L10-L14 WeakPolarHBondContact O-CB 3.35Å; L10-L14 PolarHBondContact O-N 3.2Å; L10-L14 VanDerWaalsContact O-N 3.16Å; V12-L14 PolarHBondContact O-N 3.26Å; L14-W18 WeakPolarHBondContact O-CB 3.16Å; L14-W18 PolarHBondContact O-N 3.46Å
15	Y	66.8	Low	64.2	Low	136 Å²	136	88 Å²	88	53%	0.533	44%	0.443	S	S	.	.	H	α-helix	trans	-68.6	-40.4	173.7	-171	-105.1	0	0	0	111.2	D11 V12 W18 L19	D11-Y15 VanDerWaalsContact O-CB 3.29Å; D11-Y15 WeakPolarHBondContact O-CB 3.25Å; V12-Y15 PolarHBondContact O-N 3.31Å; Y15-W18 HydrophobicContact CD2-CE3 4.42Å; Y15-W18 HydrophobicContact CE2-CE3 4.3Å; Y15-W18 HydrophobicContact CE2-CZ3 4.37Å; Y15-W18 PolarHBondContact O-N 2.93Å; Y15-L19 HydrophobicContact CD1-CD1 3.71Å; Y15-L19 HydrophobicContact CD1-CG 4.16Å; Y15-L19 HydrophobicContact CE1-CD1 3.35Å; Y15-L19 HydrophobicContact CE1-CD2 4.43Å; Y15-L19 HydrophobicContact CE1-CG 3.92Å; Y15-L19 WeakPolarHBondContact O-CB 3.37Å; Y15-L19 VanDerWaalsContact O-CG 3.27Å; Y15-L19 WeakPolarHBondContact O-CG 3.36Å; Y15-L19 PolarHBondContact O-N 3.31Å
16	C	65.2	Low	65.3	Low	31 Å²	31	85 Å²	85	21%	0.209	44%	0.437	C	S	.	.	H	α-helix	trans	-65	-43.7	173.5	-67.9	0	0	0	0	112.3	V12 L19 I20 I175	V12-C16 PolarHBondContact O-N 3.11Å; V12-C16 PolarHBondContact O-SG 2.95Å; C16-L19 PolarHBondContact O-N 2.85Å; C16-I20 WeakPolarHBondContact O-CD1 3.17Å; C16-I20 VanDerWaalsContact O-CG1 3.23Å; C16-I20 WeakPolarHBondContact O-CG1 3.5Å; C16-I20 PolarHBondContact O-N 2.89Å; C16-I175 HydrophobicContact CB-CG2 4.07Å
17	L	67.6	Low	66.4	Low	91 Å²	91	85.2 Å²	85.2	48%	0.476	44%	0.439	S	S	.	.	H	α-helix	trans	-67	-36.9	175.4	-74.5	172.8	0	0	0	112.1	P13 I20 A21	P13-L17 WeakPolarHBondContact O-CB 3.37Å; P13-L17 VanDerWaalsContact O-CG 3.27Å; P13-L17 WeakPolarHBondContact O-CG 3.41Å; P13-L17 PolarHBondContact O-N 3.16Å; L17-I20 PolarHBondContact O-N 3.13Å; L17-A21 VanDerWaalsContact O-CB 3.25Å; L17-A21 WeakPolarHBondContact O-CB 3.42Å; L17-A21 PolarHBondContact O-N 3.42Å
18	W	76.4	Confident	67	Low	152 Å²	152	80 Å²	80	58%	0.576	43%	0.425	S	S	*	.	H	α-helix	trans	-67.7	-40.8	174.3	-175.5	80.1	0	0	0	111.2	L14 Y15 A21 V22	L14-W18 WeakPolarHBondContact O-CB 3.16Å; L14-W18 PolarHBondContact O-N 3.46Å; Y15-W18 HydrophobicContact CD2-CE3 4.42Å; Y15-W18 HydrophobicContact CE2-CE3 4.3Å; Y15-W18 HydrophobicContact CE2-CZ3 4.37Å; Y15-W18 PolarHBondContact O-N 2.93Å; W18-A21 PolarHBondContact O-N 3.17Å; W18-V22 HydrophobicContact CD2-CG2 3.82Å; W18-V22 HydrophobicContact CE3-CG2 4.14Å; W18-V22 HydrophobicContact CG-CG2 4.36Å; W18-V22 HydrophobicContact CH2-CG2 4.07Å; W18-V22 HydrophobicContact CZ2-CG2 3.74Å; W18-V22 HydrophobicContact CZ3-CG2 4.25Å; W18-V22 VanDerWaalsContact O-CB 3.28Å; W18-V22 WeakPolarHBondContact O-CB 3.37Å; W18-V22 WeakPolarHBondContact O-CG2 3.35Å; W18-V22 PolarHBondContact O-N 3.4Å
19	L	75.6	Confident	67	Low	72 Å²	72	81.9 Å²	81.9	38%	0.377	43%	0.429	S	S	.	.	H	α-helix	trans	-64.3	-39.8	172.8	-76.8	179.8	0	0	0	112.1	Y15 C16 V22 A23	Y15-L19 HydrophobicContact CD1-CD1 3.71Å; Y15-L19 HydrophobicContact CD1-CG 4.16Å; Y15-L19 HydrophobicContact CE1-CD1 3.35Å; Y15-L19 HydrophobicContact CE1-CD2 4.43Å; Y15-L19 HydrophobicContact CE1-CG 3.92Å; Y15-L19 WeakPolarHBondContact O-CB 3.37Å; Y15-L19 VanDerWaalsContact O-CG 3.27Å; Y15-L19 WeakPolarHBondContact O-CG 3.36Å; Y15-L19 PolarHBondContact O-N 3.31Å; C16-L19 PolarHBondContact O-N 2.85Å; L19-V22 PolarHBondContact O-N 3.4Å; L19-A23 VanDerWaalsContact O-CB 3.26Å; L19-A23 WeakPolarHBondContact O-CB 3.41Å; L19-A23 PolarHBondContact O-N 3.18Å
20	I	73.3	Confident	67.2	Low	70 Å²	70	80.2 Å²	80.2	36%	0.359	43%	0.427	S	S	.	.	H	α-helix	trans	-65.1	-44.5	173.4	-67.8	162.6	0	0	0	110.1	C16 L17 V22 A23 F24 L171 I175	C16-I20 WeakPolarHBondContact O-CD1 3.17Å; C16-I20 VanDerWaalsContact O-CG1 3.23Å; C16-I20 WeakPolarHBondContact O-CG1 3.5Å; C16-I20 PolarHBondContact O-N 2.89Å; L17-I20 PolarHBondContact O-N 3.13Å; I20-V22 PolarHBondContact O-N 3.39Å; I20-A23 PolarHBondContact O-N 3.3Å; I20-F24 WeakPolarHBondContact O-CB 3.49Å; I20-F24 PolarHBondContact O-N 3.03Å; I20-L171 HydrophobicContact CG1-CD2 4.39Å; I20-I175 HydrophobicContact CD1-CD1 3.67Å; I20-I175 HydrophobicContact CG1-CD1 3.64Å
21	A	76.6	Confident	67.2	Low	46 Å²	46	82.7 Å²	82.7	38%	0.38	44%	0.443	S	S	.	.	H	α-helix	trans	-65.4	-38.5	178.3	0	0	0	0	0	112	L17 W18 F24 L25	L17-A21 VanDerWaalsContact O-CB 3.25Å; L17-A21 WeakPolarHBondContact O-CB 3.42Å; L17-A21 PolarHBondContact O-N 3.42Å; W18-A21 PolarHBondContact O-N 3.17Å; A21-F24 PolarHBondContact O-N 2.72Å; A21-L25 VanDerWaalsContact O-CB 3.26Å; A21-L25 WeakPolarHBondContact O-CB 3.44Å; A21-L25 VanDerWaalsContact O-CG 3.3Å; A21-L25 WeakPolarHBondContact O-CG 3.43Å; A21-L25 PolarHBondContact O-N 3.45Å
22	V	78.7	Confident	66.8	Low	47 Å²	47	82.1 Å²	82.1	29%	0.285	45%	0.447	S	S	.	.	H	α-helix	trans	-68	-42.1	174.2	169.5	0	0	0	0	110.4	W18 L19 I20 L25 C26	W18-V22 HydrophobicContact CD2-CG2 3.82Å; W18-V22 HydrophobicContact CE3-CG2 4.14Å; W18-V22 HydrophobicContact CG-CG2 4.36Å; W18-V22 HydrophobicContact CH2-CG2 4.07Å; W18-V22 HydrophobicContact CZ2-CG2 3.74Å; W18-V22 HydrophobicContact CZ3-CG2 4.25Å; W18-V22 VanDerWaalsContact O-CB 3.28Å; W18-V22 WeakPolarHBondContact O-CB 3.37Å; W18-V22 WeakPolarHBondContact O-CG2 3.35Å; W18-V22 PolarHBondContact O-N 3.4Å; L19-V22 PolarHBondContact O-N 3.4Å; I20-V22 PolarHBondContact O-N 3.39Å; V22-L25 PolarHBondContact O-N 3.5Å; V22-C26 VanDerWaalsContact O-CB 3.29Å; V22-C26 WeakPolarHBondContact O-CB 3.49Å; V22-C26 PolarHBondContact O-N 2.98Å; V22-C26 PolarHBondContact O-SG 3.16Å
23	A	73.1	Confident	66.3	Low	34 Å²	34	83 Å²	83	28%	0.281	47%	0.466	S	S	.	.	H	α-helix	trans	-61.3	-45.4	173.6	0	0	0	0	0	111.1	L19 I20 L25 C26 D27	L19-A23 VanDerWaalsContact O-CB 3.26Å; L19-A23 WeakPolarHBondContact O-CB 3.41Å; L19-A23 PolarHBondContact O-N 3.18Å; I20-A23 PolarHBondContact O-N 3.3Å; A23-L25 PolarHBondContact O-N 2.98Å; A23-C26 PolarHBondContact O-N 3.03Å; A23-D27 WeakPolarHBondContact O-CB 3.39Å; A23-D27 PolarHBondContact O-N 3Å
24	F	77	Confident	65.6	Low	125 Å²	125	82.9 Å²	82.9	55%	0.548	47%	0.47	S	S	.	.	H	α-helix	trans	-65	-38.9	177.9	-148.4	-98.1	0	0	0	112.2	I20 A21 D27 L28	I20-F24 WeakPolarHBondContact O-CB 3.49Å; I20-F24 PolarHBondContact O-N 3.03Å; A21-F24 PolarHBondContact O-N 2.72Å; F24-D27 PolarHBondContact O-N 3.32Å; F24-L28 HydrophobicContact CD1-CD1 3.55Å; F24-L28 HydrophobicContact CD1-CG 4.43Å; F24-L28 HydrophobicContact CE1-CD1 3.8Å; F24-L28 WeakPolarHBondContact O-CB 3.31Å; F24-L28 WeakPolarHBondContact O-CD1 3.5Å; F24-L28 WeakPolarHBondContact O-CG 3.44Å; F24-L28 PolarHBondContact O-N 2.7Å
25	L	76.3	Confident	64.4	Low	103 Å²	103	85.9 Å²	85.9	54%	0.539	49%	0.487	S	S	.	.	H	α-helix	trans	-69.5	-37.4	174	-81.3	163.9	0	0	0	112.3	A21 V22 A23 N29	A21-L25 VanDerWaalsContact O-CB 3.26Å; A21-L25 WeakPolarHBondContact O-CB 3.44Å; A21-L25 VanDerWaalsContact O-CG 3.3Å; A21-L25 WeakPolarHBondContact O-CG 3.43Å; A21-L25 PolarHBondContact O-N 3.45Å; V22-L25 PolarHBondContact O-N 3.5Å; A23-L25 PolarHBondContact O-N 2.98Å; L25-N29 WeakPolarHBondContact O-CB 3.46Å; L25-N29 PolarHBondContact O-N 3.05Å
26	C	71.8	Confident	63.3	Low	69 Å²	69	87.6 Å²	87.6	47%	0.466	50%	0.504	S	S	.	.	H	α-helix	trans	-66.4	-41.1	173.6	-74.9	0	0	0	0	111.1	V22 A23 N29 T30	V22-C26 VanDerWaalsContact O-CB 3.29Å; V22-C26 WeakPolarHBondContact O-CB 3.49Å; V22-C26 PolarHBondContact O-N 2.98Å; V22-C26 PolarHBondContact O-SG 3.16Å; A23-C26 PolarHBondContact O-N 3.03Å; C26-N29 PolarHBondContact O-N 3.14Å; C26-T30 WeakPolarHBondContact O-CB 3.14Å; C26-T30 PolarHBondContact O-N 2.85Å; C26-T30 PolarHBondContact O-OG1 3.2Å
27	D	68	Low	62.1	Low	78 Å²	78	93.1 Å²	93.1	42%	0.417	53%	0.532	S	S	.	.	H	α-helix	trans	-67.9	-41.5	175.8	-74.1	-30.2	0	0	0	111.3	A23 F24 T30 V31	A23-D27 WeakPolarHBondContact O-CB 3.39Å; A23-D27 PolarHBondContact O-N 3Å; F24-D27 PolarHBondContact O-N 3.32Å; D27-T30 PolarHBondContact O-N 2.95Å; D27-V31 WeakPolarHBondContact O-CB 3.34Å; D27-V31 VanDerWaalsContact O-CG2 3.25Å; D27-V31 WeakPolarHBondContact O-CG2 3.4Å; D27-V31 PolarHBondContact O-N 3.46Å
28	L	63.2	Low	61	Low	81 Å²	81	95.9 Å²	95.9	42%	0.424	55%	0.547	S	S	.	.	H	α-helix	trans	-62.6	-41.9	172.9	-87.1	156	0	0	0	112.3	F24 T30 V31 C32	F24-L28 HydrophobicContact CD1-CD1 3.55Å; F24-L28 HydrophobicContact CD1-CG 4.43Å; F24-L28 HydrophobicContact CE1-CD1 3.8Å; F24-L28 WeakPolarHBondContact O-CB 3.31Å; F24-L28 WeakPolarHBondContact O-CD1 3.5Å; F24-L28 WeakPolarHBondContact O-CG 3.44Å; F24-L28 PolarHBondContact O-N 2.7Å; L28-T30 VanDerWaalsContact C-N 3.28Å; L28-T30 PolarHBondContact O-N 3.12Å; L28-V31 PolarHBondContact O-N 3.24Å; L28-C32 WeakPolarHBondContact O-CB 3.39Å; L28-C32 PolarHBondContact O-N 3.08Å
29	N	59	Low	59.8	Low	118 Å²	118	96.5 Å²	96.5	63%	0.631	56%	0.562	S	S	*	*	H	α-helix	trans	-68.4	-29.3	175.4	-82.9	-11.4	0	0	0	112.4	L25 C26 G33	L25-N29 WeakPolarHBondContact O-CB 3.46Å; L25-N29 PolarHBondContact O-N 3.05Å; C26-N29 PolarHBondContact O-N 3.14Å; N29-G33 WeakPolarHBondContact O-CA 3.18Å; N29-G33 PolarHBondContact O-N 3.03Å
30	T	55.7	Low	58.5	Low	77 Å²	77	103.1 Å²	103.1	47%	0.472	59%	0.588	S	S	.	*	H	α-helix	trans	-78.2	-30.4	175.6	-49.1	0	0	0	0	111.4	C26 D27 L28 A34	C26-T30 WeakPolarHBondContact O-CB 3.14Å; C26-T30 PolarHBondContact O-N 2.85Å; C26-T30 PolarHBondContact O-OG1 3.2Å; D27-T30 PolarHBondContact O-N 2.95Å; L28-T30 VanDerWaalsContact C-N 3.28Å; L28-T30 PolarHBondContact O-N 3.12Å; T30-A34 WeakPolarHBondContact O-CB 3.44Å; T30-A34 PolarHBondContact O-N 3.32Å
31	V	51.4	Low	57.4	Low	90 Å²	90	104.4 Å²	104.4	55%	0.545	61%	0.609	S	S	.	*	H	α-helix	trans	-77.1	-36.8	173.9	171.8	0	0	0	0	111.7	D27 L28	D27-V31 WeakPolarHBondContact O-CB 3.34Å; D27-V31 VanDerWaalsContact O-CG2 3.25Å; D27-V31 WeakPolarHBondContact O-CG2 3.4Å; D27-V31 PolarHBondContact O-N 3.46Å; L28-V31 PolarHBondContact O-N 3.24Å
32	C	46.5	Very low	56.2	Low	105 Å²	105	110.6 Å²	110.6	71%	0.709	63%	0.63	S	S	*	*	H	α-helix	trans	-79.8	-15.8	172.6	-73.2	0	0	0	0	113.4	L28	L28-C32 WeakPolarHBondContact O-CB 3.39Å; L28-C32 PolarHBondContact O-N 3.08Å
33	G	49	Very low	54.6	Low	67 Å²	67	117.4 Å²	117.4	69%	0.691	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95	-0.6	179.4	0	0	0	0	0	114.9	N29	N29-G33 WeakPolarHBondContact O-CA 3.18Å; N29-G33 PolarHBondContact O-N 3.03Å
34	A	44.3	Very low	53.1	Low	59 Å²	59	125.2 Å²	125.2	49%	0.488	69%	0.687	S	S	.	*	S	Bend	trans	-118.8	106.9	179.6	0	0	0	0	0	110.2	T30	T30-A34 WeakPolarHBondContact O-CB 3.44Å; T30-A34 PolarHBondContact O-N 3.32Å
35	N	37.6	Very low	51.5	Low	153 Å²	153	127.1 Å²	127.1	82%	0.818	70%	0.703	S	S	*	*			trans	71.3	80.6	169.2	-60.5	-21.4	0	0	0	117.2
36	L	42.3	Very low	49.8	Very low	171 Å²	171	127.3 Å²	127.3	90%	0.895	71%	0.71	S	S	*	*			trans	-135.6	61.7	145.7	-81.2	169.1	0	0	0	107.7
37	D	41.8	Very low	48.4	Very low	148 Å²	148	132 Å²	132	79%	0.791	73%	0.73	S	S	*	*			trans	-108.5	104.9	166.6	-75.8	-29.5	0	0	0	107.8
38	D	44.3	Very low	47.1	Very low	149 Å²	149	135.2 Å²	135.2	80%	0.797	75%	0.748	S	S	*	*	S	Bend	trans	28.1	82.8	147.1	-73.3	-23.7	0	0	0	120.3
39	D	50.5	Low	46.1	Very low	164 Å²	164	136.5 Å²	136.5	88%	0.877	76%	0.764	S	S	*	*			trans	-136.5	13.4	164.8	-96.1	-21.3	0	0	0	114.8
40	F	47.5	Very low	45.1	Very low	211 Å²	211	139.5 Å²	139.5	93%	0.925	77%	0.772	S	S	*	*	S	Bend	trans	-127.9	19.5	-177.1	-138.3	-95.2	0	0	0	116.3
41	A	51.9	Low	44.4	Very low	98 Å²	98	140.5 Å²	140.5	81%	0.81	78%	0.777	S	S	*	*	S	Bend	trans	-103.8	7.9	-173	0	0	0	0	0	116.3
42	E	49.9	Very low	43.9	Very low	175 Å²	175	140.2 Å²	140.2	82%	0.818	79%	0.785	S	S	*	*	S	Bend	trans	-115.4	8.7	-168.5	-147.2	178.9	175	0	0	117.3
43	F	44.6	Very low	43.3	Very low	191 Å²	191	142.4 Å²	142.4	84%	0.838	79%	0.789	S	S	*	*			trans	-143.8	97.2	177.8	-84.1	-91	0	0	0	112
44	E	42.5	Very low	43.2	Very low	197 Å²	197	146.8 Å²	146.8	92%	0.921	80%	0.795	S	S	*	*				177.1	123.1	114.2	-100.6	171.8	157.3	0	0	110.6
45	D	43.2	Very low	43	Very low	165 Å²	165	148.6 Å²	148.6	88%	0.882	81%	0.805	S	S	*	*			trans	-67.6	165	-178.8	-91.4	-41.4	0	0	0	113.6
46	P	40.7	Very low	43.2	Very low	108 Å²	108	149.4 Å²	149.4	70%	0.701	80%	0.803	S	S	*	*			trans	-98.5	141.9	-161.6	36.4	-29	0	0	0	113.1
47	D	43.2	Very low	43.1	Very low	166 Å²	166	147.6 Å²	147.6	89%	0.888	80%	0.802	S	S	*	*			trans	-115.7	126.7	165	-85.2	-23.7	0	0	0	112.5
48	D	40.6	Very low	43.3	Very low	146 Å²	146	146.3 Å²	146.3	78%	0.781	80%	0.799	S	S	*	*			trans	-38.3	141.5	167.2	-75.6	-47.3	0	0	0	117.7
49	S	41.3	Very low	43.1	Very low	109 Å²	109	144.6 Å²	144.6	76%	0.762	80%	0.796	S	S	*	*			trans	85.2	138.7	131.5	84.3	0	0	0	0	121.3
50	F	37.8	Very low	42.8	Very low	181 Å²	181	143.1 Å²	143.1	79%	0.794	79%	0.793	S	S	*	*			trans	94.7	99.2	135.2	-143.5	-111.1	0	0	0	118.1
51	T	42.1	Very low	42.2	Very low	97 Å²	97	142.2 Å²	142.2	60%	0.595	79%	0.791	S	S	*	*				87.7	125.6	129.1	54.4	0	0	0	0	123.5
52	A	39.6	Very low	41.6	Very low	84 Å²	84	142.8 Å²	142.8	69%	0.694	79%	0.789	S	S	*	*				79.9	108.3	123.4	0	0	0	0	0	119.1
53	D	35	Very low	40.8	Very low	151 Å²	151	138.7 Å²	138.7	81%	0.807	79%	0.785	S	S	*	*				34.5	129.8	124.8	-71.4	-25.8	0	0	0	118.9
54	I	45.6	Very low	40.4	Very low	159 Å²	159	138 Å²	138	82%	0.815	79%	0.785	S	S	*	*				179.1	126.8	114.8	-88.6	154	0	0	0	111.8
55	S	41.4	Very low	39.9	Very low	98 Å²	98	137.4 Å²	137.4	69%	0.685	78%	0.782	S	S	*	*			trans	65.6	112.2	146.3	69.9	0	0	0	0	124.1
56	E	41.3	Very low	39.7	Very low	170 Å²	170	138 Å²	138	79%	0.794	78%	0.779	S	S	*	*				48.4	137.5	120.4	-64.5	-169.8	160.1	0	0	123.5
57	P	40.3	Very low	39.3	Very low	133 Å²	133	141.1 Å²	141.1	86%	0.864	78%	0.781	S	S	*	*			trans	-115.3	132.7	147.5	34.7	-22	0	0	0	112.7
58	V	46.3	Very low	39	Very low	121 Å²	121	138 Å²	138	73%	0.733	78%	0.778	S	S	*	*			trans	-116	144.5	174.6	174.1	0	0	0	0	111
59	P	40.6	Very low	38.6	Very low	113 Å²	113	138.5 Å²	138.5	73%	0.734	78%	0.776	S	S	*	*			trans	-105.4	172.7	-165.3	40.3	-30.2	0	0	0	113.6
60	V	43.2	Very low	38.4	Very low	133 Å²	133	138.5 Å²	138.5	81%	0.806	78%	0.776	S	S	*	*			trans	-143.6	118.5	163.8	-174.6	0	0	0	0	112
61	Q	34.9	Very low	38.3	Very low	192 Å²	192	136.1 Å²	136.1	90%	0.897	78%	0.776	S	S	*	*			trans	-90.8	139.2	152.7	-71.6	175.5	-9.2	0	0	108.3
62	S	39.3	Very low	37.9	Very low	109 Å²	109	139.5 Å²	139.5	76%	0.762	78%	0.784	S	S	*	*			trans	-166.3	133.8	149.3	50.3	0	0	0	0	112.2
63	A	33	Very low	37.7	Very low	89 Å²	89	144.7 Å²	144.7	74%	0.736	79%	0.791	S	S	*	*			trans	-66.7	156.2	176.1	0	0	0	0	0	113.7
64	H	37.2	Very low	37.6	Very low	178 Å²	178	144.7 Å²	144.7	82%	0.824	79%	0.791	S	S	*	*			trans	-145.7	115.8	148.2	-96.8	-61.8	0	0	0	111.7
65	Q	32.3	Very low	37.3	Very low	184 Å²	184	144 Å²	144	86%	0.86	79%	0.788	S	S	*	*			trans	-67.2	137.7	155.1	-76.4	169.9	-21	0	0	109.1
66	H	38.5	Very low	36.8	Very low	178 Å²	178	144.7 Å²	144.7	82%	0.824	79%	0.792	S	S	*	*			trans	-143.2	109.4	150.6	-100.1	-78	0	0	0	110.6
67	K	31.4	Very low	36.6	Very low	173 Å²	173	144.6 Å²	144.6	75%	0.752	79%	0.792	S	S	*	*			trans	-80.3	129.1	161.3	-179.7	-176.8	179.3	-168.1	0	107.3	E69	K67-E69 WeakPolarHBondContact CE-OE2 3.17Å; K67-E69 IonicContact NZ-OE2 2.81Å; K67-E69 PolarHBondContact NZ-OE2 3.15Å
68	A	36.6	Very low	36.4	Very low	99 Å²	99	143 Å²	143	82%	0.818	78%	0.784	S	S	*	*			trans	-136.3	103.7	167.1	0	0	0	0	0	109.4
69	E	33	Very low	35.6	Very low	158 Å²	158	142.6 Å²	142.6	74%	0.738	79%	0.787	S	S	*	*			trans	-82.8	127.9	157	-84.4	166.3	116.7	0	0	108.1	K67	K67-E69 WeakPolarHBondContact CE-OE2 3.17Å; K67-E69 IonicContact NZ-OE2 2.81Å; K67-E69 PolarHBondContact NZ-OE2 3.15Å
70	S	36.8	Very low	35.2	Very low	108 Å²	108	145.7 Å²	145.7	76%	0.755	79%	0.789	S	S	*	*			trans	-137.7	101.3	159.8	64.4	0	0	0	0	107.3
71	V	36.5	Very low	34.6	Very low	131 Å²	131	144.6 Å²	144.6	79%	0.794	79%	0.787	S	S	*	*				70.7	104.4	92.5	177	0	0	0	0	113
72	H	32.9	Very low	34.6	Very low	168 Å²	168	141.4 Å²	141.4	78%	0.778	78%	0.775	S	S	*	*			trans	36.4	121.8	139.4	-88.6	-100.1	0	0	0	119.9
73	K	36.5	Very low	34.3	Very low	194 Å²	194	143.6 Å²	143.6	84%	0.843	78%	0.779	S	S	*	*				-162.1	105.7	118.4	-108.6	168.4	-175.9	178.4	0	111.3
74	N	32.7	Very low	34.4	Very low	150 Å²	150	144.2 Å²	144.2	80%	0.802	77%	0.773	S	S	*	*			trans	-69.4	130.4	154.7	-83.1	-23	0	0	0	108.1
75	I	38.7	Very low	34.2	Very low	146 Å²	146	144.7 Å²	144.7	75%	0.749	78%	0.776	S	S	*	*			trans	-123.9	112.4	158.3	-68.5	175.5	0	0	0	106.4
76	S	31.3	Very low	34.5	Very low	111 Å²	111	142.9 Å²	142.9	78%	0.776	77%	0.771	S	S	*	*			trans	-111.1	108.1	165.1	53.1	0	0	0	0	107.1
77	E	37.3	Very low	34.2	Very low	168 Å²	168	141.4 Å²	141.4	79%	0.785	77%	0.769	S	S	*	*			trans	-144.5	100.4	164.6	-79.7	-169.7	166.9	0	0	105.7
78	S	34.6	Very low	34.5	Very low	100 Å²	100	144.2 Å²	144.2	70%	0.699	78%	0.775	S	S	*	*				79.5	97.4	95.2	71.2	0	0	0	0	113.2
79	S	31.1	Very low	34.3	Very low	112 Å²	112	147.3 Å²	147.3	78%	0.783	78%	0.777	S	S	*	*			trans	28.4	115.2	132.7	58.6	0	0	0	0	119
80	F	30.7	Very low	34.5	Very low	179 Å²	179	145.2 Å²	145.2	79%	0.785	78%	0.78	S	S	*	*			trans	-155.1	100.4	135.3	-160.8	-112.5	0	0	0	110.9	L82	F80-L82 HydrophobicContact CD1-CB 4.27Å; F80-L82 HydrophobicContact CE1-CB 3.77Å; F80-L82 HydrophobicContact CE1-CD1 3.7Å; F80-L82 HydrophobicContact CE1-CG 4.24Å; F80-L82 HydrophobicContact CZ-CB 4.43Å; F80-L82 HydrophobicContact CZ-CD1 3.57Å
81	S	31	Very low	34.4	Very low	109 Å²	109	149.2 Å²	149.2	76%	0.762	79%	0.787	S	S	*	*			trans	-89.7	118.5	162.8	49.6	0	0	0	0	108.3
82	L	36.4	Very low	34.4	Very low	125 Å²	125	147.4 Å²	147.4	65%	0.654	79%	0.786	S	S	*	*			trans	-114.2	100.5	164.4	-158.4	88.3	0	0	0	108.3	F80	F80-L82 HydrophobicContact CD1-CB 4.27Å; F80-L82 HydrophobicContact CE1-CB 3.77Å; F80-L82 HydrophobicContact CE1-CD1 3.7Å; F80-L82 HydrophobicContact CE1-CG 4.24Å; F80-L82 HydrophobicContact CZ-CB 4.43Å; F80-L82 HydrophobicContact CZ-CD1 3.57Å
83	N	32.1	Very low	34.4	Very low	156 Å²	156	144.1 Å²	144.1	83%	0.834	79%	0.788	S	S	*	*			trans	-80.8	130.7	158.9	-75.1	-8.7	0	0	0	107.4
84	T	36	Very low	34.2	Very low	101 Å²	101	144.9 Å²	144.9	62%	0.62	79%	0.791	S	S	*	*			trans	-142.8	102.2	157.7	-49	0	0	0	0	107.4	I86	T84-I86 HydrophobicContact CG2-CD1 4.44Å; T84-I86 HydrophobicContact CG2-CG1 4.15Å
85	E	32.1	Very low	34.4	Very low	189 Å²	189	145.3 Å²	145.3	88%	0.883	79%	0.788	S	S	*	*			trans	-65	129.5	160.8	-70.3	170.1	143.8	0	0	108.6
86	I	38.4	Very low	34.2	Very low	146 Å²	146	143.3 Å²	143.3	75%	0.749	78%	0.783	S	S	*	*			trans	-136.2	96.7	157.7	-59.2	-178.6	0	0	0	106.8	T84	T84-I86 HydrophobicContact CG2-CD1 4.44Å; T84-I86 HydrophobicContact CG2-CG1 4.15Å
87	D	31.8	Very low	34.2	Very low	146 Å²	146	143.5 Å²	143.5	78%	0.781	78%	0.78	S	S	*	*			trans	-65.1	138	152.1	-81.1	-37.4	0	0	0	109.3
88	R	37.7	Very low	34.1	Very low	233 Å²	233	144.3 Å²	144.3	88%	0.879	78%	0.781	S	S	*	*			trans	-179.7	108.4	137.8	-99.2	161	-170.7	149.1	4.4	111.2
89	D	32	Very low	34	Very low	163 Å²	163	144.3 Å²	144.3	87%	0.872	78%	0.781	S	S	*	*			trans	-57.9	140.3	157.3	-62.4	-47.6	0	0	0	111.1
90	S	38.2	Very low	34.2	Very low	115 Å²	115	145.4 Å²	145.4	80%	0.804	78%	0.783	S	S	*	*			trans	-160.3	116.7	148.4	2.6	0	0	0	0	109.7
91	E	34.7	Very low	34.4	Very low	192 Å²	192	144.7 Å²	144.7	90%	0.897	79%	0.787	S	S	*	*			trans	-59.3	172.5	171.4	-67.5	174.1	119.8	0	0	113.9
92	A	36.1	Very low	34.6	Very low	92 Å²	92	143.3 Å²	143.3	76%	0.76	79%	0.79	S	S	*	*			trans	106.2	92.8	147	0	0	0	0	0	117.1
93	A	33	Very low	34.6	Very low	100 Å²	100	141.8 Å²	141.8	83%	0.826	80%	0.796	S	S	*	*				54.4	110.1	118.7	0	0	0	0	0	118.9
94	F	33.3	Very low	34.6	Very low	209 Å²	209	139.3 Å²	139.3	92%	0.917	80%	0.797	S	S	*	*			trans	-142.6	122.7	134.9	-164.5	-106.6	0	0	0	111.3
95	H	35.2	Very low	34.8	Very low	159 Å²	159	141.2 Å²	141.2	74%	0.736	81%	0.808	S	S	*	*			trans	-89.4	164.6	-176.6	-140	-78.1	0	0	0	109.4
96	T	34.7	Very low	34.9	Very low	104 Å²	104	140.5 Å²	140.5	64%	0.638	80%	0.804	S	S	*	*			trans	112.1	94.4	142.1	-53.4	0	0	0	0	119
97	T	31.9	Very low	34.8	Very low	115 Å²	115	140.5 Å²	140.5	71%	0.706	81%	0.806	S	S	*	*				50.4	128.8	124.5	73.6	0	0	0	0	123.2
98	K	34.5	Very low	35.2	Very low	185 Å²	185	139 Å²	139	80%	0.804	81%	0.807	S	S	*	*				159.5	116.1	111.1	-100.3	-176.4	168.2	178.3	0	109.2
99	S	33.6	Very low	35	Very low	100 Å²	100	137 Å²	137	70%	0.699	81%	0.808	S	S	*	*				72.6	114.9	87.1	-52.1	0	0	0	0	114.3
100	T	35.5	Very low	35.3	Very low	135 Å²	135	137.2 Å²	137.2	83%	0.828	81%	0.808	S	S	*	*			trans	163.9	104.9	147.3	29.6	0	0	0	0	107.5
101	D	33.6	Very low	35.1	Very low	165 Å²	165	140.7 Å²	140.7	88%	0.882	81%	0.812	S	S	*	*				73.9	129.2	73.7	-79	-17.3	0	0	0	115.7
102	G	35.4	Very low	35.2	Very low	80 Å²	80	134.8 Å²	134.8	83%	0.825	80%	0.802	S	S	*	*			trans	90.2	145.3	163.4	0	0	0	0	0	115.2
103	A	36.6	Very low	35.2	Very low	93 Å²	93	139.3 Å²	139.3	77%	0.769	81%	0.807	S	S	*	*			cis	-172.2	150.6	-9.4	0	0	0	0	0	105
104	A	31.7	Very low	35.2	Very low	104 Å²	104	139.5 Å²	139.5	86%	0.86	80%	0.803	S	S	*	*			trans	-61.9	139.4	173.6	0	0	0	0	0	111.6
105	V	40.6	Very low	35.3	Very low	140 Å²	140	138.3 Å²	138.3	85%	0.848	80%	0.8	S	S	*	*			trans	-143.2	118.2	163.8	176.4	0	0	0	0	107.3
106	E	35.1	Very low	35.2	Very low	174 Å²	174	138.6 Å²	138.6	81%	0.813	81%	0.807	S	S	*	*			trans	-68	177	165.8	-70.7	173.4	141.1	0	0	111.3
107	D	36.4	Very low	35.3	Very low	147 Å²	147	141 Å²	141	79%	0.786	81%	0.813	S	S	*	*			trans	78.7	109.7	172.7	-67.5	-14.3	0	0	0	117.6
108	S	38.6	Very low	35.6	Very low	114 Å²	114	144.9 Å²	144.9	80%	0.797	82%	0.815	S	S	*	*				-167.7	91.8	126.8	-69	0	0	0	0	108.4
109	E	34.3	Very low	35.8	Very low	191 Å²	191	142.8 Å²	142.8	89%	0.893	81%	0.811	S	S	*	*			trans	-54.6	130.8	154.4	-70.5	172.3	136.9	0	0	108.7
110	L	38.7	Very low	36.1	Very low	167 Å²	167	142.2 Å²	142.2	87%	0.874	80%	0.801	S	S	*	*			trans	-119.7	91.2	167.5	-95.5	161.4	0	0	0	106.9
111	E	32.9	Very low	36.4	Very low	189 Å²	189	143 Å²	143	88%	0.883	80%	0.8	S	S	*	*			trans	-80.8	144.7	149.8	-68	-162.5	160.3	0	0	109
112	G	37.7	Very low	37.1	Very low	68 Å²	68	141.7 Å²	141.7	70%	0.701	79%	0.793	S	S	*	*			trans	128.6	126.2	-179.5	0	0	0	0	0	110
113	E	35.7	Very low	38	Very low	186 Å²	186	147.2 Å²	147.2	87%	0.869	80%	0.797	S	S	*	*			cis	-158.7	143.4	14	-88.4	167.7	154.3	0	0	106.3
114	S	32.8	Very low	39	Very low	104 Å²	104	152 Å²	152	73%	0.727	80%	0.804	S	S	*	*			trans	18.7	119.3	149.2	55.9	0	0	0	0	118.8
115	E	35.4	Very low	39.5	Very low	185 Å²	185	156.5 Å²	156.5	86%	0.864	80%	0.804	S	S	*	*				-149.1	108.2	118.8	-74.5	-158.3	155.4	0	0	108.2	M117	E115-M117 PolarHBondContact O-N 3.37Å
116	D	32.8	Very low	39.8	Very low	164 Å²	164	159.6 Å²	159.6	88%	0.877	81%	0.809	S	S	*	*			trans	-58.8	118.6	164	-85.1	-44.6	0	0	0	109.4
117	M	38.2	Very low	40.4	Very low	154 Å²	154	154 Å²	154	76%	0.759	80%	0.798	S	S	*	*			trans	-140.2	72.3	155	-141.6	-177.2	-62.6	0	0	108.9	E115 L119	E115-M117 PolarHBondContact O-N 3.37Å; M117-L119 PolarHBondContact O-N 2.98Å
118	R	37.3	Very low	40.6	Very low	198 Å²	198	154.8 Å²	154.8	75%	0.747	80%	0.801	S	S	*	*			trans	-77.9	98.9	163.2	-177.4	170.3	172.5	172.3	-11.8	107.3	D120	R118-D120 VanDerWaalsContact C-N 3.26Å; R118-D120 IonicContact CZ-OD1 3.95Å; R118-D120 IonicContact CZ-OD2 3.17Å; R118-D120 VanDerWaalsContact CZ-OD2 3.26Å; R118-D120 VanDerWaalsContact NE-CG 3.27Å; R118-D120 IonicContact NE-OD1 3.26Å; R118-D120 PolarHBondContact NE-OD1 3.2Å; R118-D120 IonicContact NE-OD2 2.69Å; R118-D120 PolarHBondContact NE-OD2 3.38Å; R118-D120 IonicContact NH2-OD1 3.24Å; R118-D120 IonicContact NH2-OD2 2.87Å; R118-D120 PolarHBondContact NH2-OD2 3.07Å; R118-D120 PolarHBondContact O-N 3.03Å; R118-D120 VanDerWaalsContact O-N 3.11Å
119	L	38.2	Very low	40.6	Very low	141 Å²	141	154.4 Å²	154.4	74%	0.738	80%	0.798	S	S	*	*			trans	-76.7	83.4	165.7	-90.7	144	0	0	0	107.7	M117	M117-L119 PolarHBondContact O-N 2.98Å
120	D	40.9	Very low	40.9	Very low	88 Å²	88	151.3 Å²	151.3	47%	0.471	80%	0.795	S	S	.	*			trans	-82.3	98.8	157.6	-74.7	-15.6	0	0	0	106.1	R118 D122	R118-D120 VanDerWaalsContact C-N 3.26Å; R118-D120 IonicContact CZ-OD1 3.95Å; R118-D120 IonicContact CZ-OD2 3.17Å; R118-D120 VanDerWaalsContact CZ-OD2 3.26Å; R118-D120 VanDerWaalsContact NE-CG 3.27Å; R118-D120 IonicContact NE-OD1 3.26Å; R118-D120 PolarHBondContact NE-OD1 3.2Å; R118-D120 IonicContact NE-OD2 2.69Å; R118-D120 PolarHBondContact NE-OD2 3.38Å; R118-D120 IonicContact NH2-OD1 3.24Å; R118-D120 IonicContact NH2-OD2 2.87Å; R118-D120 PolarHBondContact NH2-OD2 3.07Å; R118-D120 PolarHBondContact O-N 3.03Å; R118-D120 VanDerWaalsContact O-N 3.11Å; D120-D122 VanDerWaalsContact C-N 3.27Å; D120-D122 PolarHBondContact O-N 3.4Å; D120-D122 VanDerWaalsContact O-N 3.17Å
121	D	40.9	Very low	41	Very low	152 Å²	152	150.2 Å²	150.2	81%	0.813	79%	0.79	S	S	*	*			trans	-82.5	76.7	168.5	-107.4	-14.6	0	0	0	108
122	D	48.5	Very low	41.8	Very low	137 Å²	137	149.4 Å²	149.4	73%	0.733	79%	0.786	S	S	*	*			trans	-119.6	50.7	175.3	-64.8	-29.6	0	0	0	110.6	D120	D120-D122 VanDerWaalsContact C-N 3.27Å; D120-D122 PolarHBondContact O-N 3.4Å; D120-D122 VanDerWaalsContact O-N 3.17Å
123	E	54.3	Low	42.1	Very low	195 Å²	195	151.2 Å²	151.2	91%	0.911	79%	0.785	S	S	*	*			trans	-141	78.8	174	-72.9	-170	174.9	0	0	112.3
124	E	58.7	Low	42.2	Very low	195 Å²	195	149.4 Å²	149.4	91%	0.911	78%	0.78	S	S	*	*	S	Bend	trans	-146.8	25.4	163.9	-146.4	-171.8	164.5	0	0	115.6
125	F	42.3	Very low	42.6	Very low	197 Å²	197	152 Å²	152	86%	0.864	79%	0.785	S	S	*	*			trans	-152.4	80.5	168.1	-152.1	-98.1	0	0	0	114.4
126	E	45	Very low	42.9	Very low	206 Å²	206	148.9 Å²	148.9	96%	0.963	77%	0.774	S	S	*	*			trans	-114.2	110.7	161.7	-68.9	-159.7	162.4	0	0	109.9
127	G	49.6	Very low	43.3	Very low	55 Å²	55	146.5 Å²	146.5	57%	0.567	77%	0.766	S	S	*	*			trans	-162.6	68.9	-175.1	0	0	0	0	0	113.6
128	L	40.2	Very low	43.4	Very low	164 Å²	164	144.9 Å²	144.9	86%	0.859	76%	0.76	S	S	*	*			trans	88.4	86.2	148.1	-54.3	169.5	0	0	0	119.5
129	S	37.4	Very low	43.6	Very low	106 Å²	106	144 Å²	144	74%	0.741	76%	0.762	S	S	*	*				63.9	113.2	116.7	-45.5	0	0	0	0	121.3
130	P	40.3	Very low	43.6	Very low	126 Å²	126	143 Å²	143	82%	0.818	76%	0.762	S	S	*	*			trans	-91.6	121.4	167.1	33	-26.2	0	0	0	112.2
131	N	42.5	Very low	43.6	Very low	144 Å²	144	148.3 Å²	148.3	77%	0.77	78%	0.781	S	S	*	*			trans	-163	104.7	159	-115.8	-16.5	0	0	0	112.5
132	Q	48.9	Very low	43.6	Very low	173 Å²	173	147.3 Å²	147.3	81%	0.808	79%	0.786	S	S	*	*			trans	45.6	162.6	136.5	-68.7	-172	-3.1	0	0	122.4
133	P	43.2	Very low	43.3	Very low	105 Å²	105	144.3 Å²	144.3	68%	0.682	79%	0.787	S	S	*	*			cis	-140.2	154.5	-36.1	36.9	-18.7	0	0	0	115.3
134	I	38.4	Very low	42.8	Very low	149 Å²	149	144.5 Å²	144.5	76%	0.764	79%	0.785	S	S	*	*			trans	13.4	128.7	140.4	-47.8	168.1	0	0	0	120.1
135	L	42.4	Very low	41.9	Very low	159 Å²	159	147 Å²	147	83%	0.832	79%	0.786	S	S	*	*			trans	-151.6	113.1	138.8	-142.2	92.5	0	0	0	112.3
136	N	41.7	Very low	41.9	Very low	119 Å²	119	144.2 Å²	144.2	64%	0.636	78%	0.78	S	S	*	*				31.9	138.8	129.9	-59.6	-15.6	0	0	0	118.6
137	T	40	Very low	42.5	Very low	113 Å²	113	142.4 Å²	142.4	69%	0.693	78%	0.776	S	S	*	*			cis	172.2	140.8	28.9	22.5	0	0	0	0	102.9
138	D	40.3	Very low	42.9	Very low	121 Å²	121	147.5 Å²	147.5	65%	0.647	79%	0.789	S	S	*	*				-177.1	132.6	65.5	-105.5	-41.3	0	0	0	110.9
139	K	41	Very low	43.7	Very low	178 Å²	178	146.7 Å²	146.7	77%	0.774	78%	0.784	S	S	*	*				26.6	131.2	128.4	-68.6	172.5	-170.2	164	0	117.3
140	T	38.8	Very low	44.7	Very low	122 Å²	122	145.4 Å²	145.4	75%	0.748	78%	0.78	S	S	*	*			cis	178.9	140.2	31.9	36.9	0	0	0	0	105.3
141	K	41.9	Very low	45.5	Very low	198 Å²	198	148.7 Å²	148.7	86%	0.861	78%	0.781	S	S	*	*				179.3	118.9	82.4	-104.9	174.8	-179.6	172.7	0	109.1
142	S	40.8	Very low	46	Very low	131 Å²	131	146.4 Å²	146.4	92%	0.916	77%	0.772	S	S	*	*			trans	31.9	113.6	141.2	-176.6	0	0	0	0	121.2
143	G	42.2	Very low	46.2	Very low	74 Å²	74	141.7 Å²	141.7	76%	0.763	76%	0.757	S	S	*	*			trans	173.6	88.7	154.8	0	0	0	0	0	114.9
144	K	42.3	Very low	46.6	Very low	199 Å²	199	143.1 Å²	143.1	87%	0.865	75%	0.754	S	S	*	*			trans	53	112.2	166.1	-72.3	175.7	178.6	176.3	0	118.3	N146	K144-N146 PolarHBondContact O-N 2.9Å
145	R	40.4	Very low	47.5	Very low	247 Å²	247	143 Å²	143	93%	0.932	75%	0.75	S	S	*	*			trans	-70.9	112.1	168	-55.5	178.2	-172.7	105.8	-0	109.2
146	N	42.3	Very low	48	Very low	140 Å²	140	141.8 Å²	141.8	75%	0.749	74%	0.743	S	S	*	*			trans	-96.5	125.5	162.7	-74.1	-23.9	0	0	0	107.7	K144 I148	K144-N146 PolarHBondContact O-N 2.9Å; N146-I148 PolarHBondContact O-N 2.84Å
147	L	58.8	Low	48.5	Very low	168 Å²	168	139.5 Å²	139.5	88%	0.88	73%	0.734	S	S	*	*			trans	-61.9	106.2	169.1	-86.9	86	0	0	0	107.8	I149	L147-I149 VanDerWaalsContact C-N 3.35Å; L147-I149 PolarHBondContact O-N 3.27Å; L147-I149 VanDerWaalsContact O-N 3.12Å
148	I	56.1	Low	49.2	Very low	162 Å²	162	145.8 Å²	145.8	83%	0.831	75%	0.745	S	S	*	*			trans	-76.2	97.3	165.7	-61.4	170.4	0	0	0	104.9	N146 A150	N146-I148 PolarHBondContact O-N 2.84Å; I148-A150 PolarHBondContact O-N 3.24Å; I148-A150 VanDerWaalsContact O-N 3.08Å
149	I	57.9	Low	49.9	Very low	146 Å²	146	141.7 Å²	141.7	75%	0.749	73%	0.726	S	S	*	*			trans	-51.6	116.7	166.3	-76.5	162.3	0	0	0	106.3	L147 K151	L147-I149 VanDerWaalsContact C-N 3.35Å; L147-I149 PolarHBondContact O-N 3.27Å; L147-I149 VanDerWaalsContact O-N 3.12Å; I149-K151 PolarHBondContact O-N 2.86Å
150	A	58.2	Low	50.7	Low	80 Å²	80	144 Å²	144	66%	0.661	73%	0.73	S	S	*	*			trans	-52.1	114.4	171.9	0	0	0	0	0	107	I148 V152	I148-A150 PolarHBondContact O-N 3.24Å; I148-A150 VanDerWaalsContact O-N 3.08Å; A150-V152 PolarHBondContact O-N 3.37Å
151	K	56.6	Low	51.6	Low	195 Å²	195	143.3 Å²	143.3	85%	0.848	72%	0.721	S	S	*	*			trans	-69.9	87	178.6	-163.4	165.6	-174.6	172.6	0	106.1	I149	I149-K151 PolarHBondContact O-N 2.86Å
152	V	54.9	Low	52.7	Low	95 Å²	95	139.3 Å²	139.3	58%	0.576	71%	0.71	S	S	*	*			trans	-55.3	124	173	-166.5	0	0	0	0	105.9	A150 H154	A150-V152 PolarHBondContact O-N 3.37Å; V152-H154 PolarHBondContact O-N 3.02Å
153	P	52.4	Low	54.7	Low	75 Å²	75	137.6 Å²	137.6	49%	0.487	69%	0.686	S	S	.	*			trans	-56.1	133.3	-174.9	21.1	-31.8	0	0	0	109.7	H155 L156	P153-H155 PolarHBondContact O-N 2.8Å; P153-L156 PolarHBondContact O-N 3.26Å
154	H	50.8	Low	56.5	Low	134 Å²	134	140.7 Å²	140.7	62%	0.62	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61	0.5	-162.7	-143.5	-76.1	0	0	0	115.5	V152 T157	V152-H154 PolarHBondContact O-N 3.02Å; H154-T157 PolarHBondContact O-OG1 3.23Å
155	H	57.2	Low	58.4	Low	147 Å²	147	136 Å²	136	68%	0.681	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.8	-7.2	-175.4	67.9	-89.1	0	0	0	114	P153	P153-H155 PolarHBondContact O-N 2.8Å
156	L	53	Low	60.6	Low	133 Å²	133	130.5 Å²	130.5	70%	0.696	64%	0.643	S	S	*	*	S	Bend	trans	-112.1	-10.4	176.4	-81.2	149.9	0	0	0	113.3	P153 R158	P153-L156 PolarHBondContact O-N 3.26Å; L156-R158 PolarHBondContact O-N 2.78Å
157	T	52.5	Low	62.8	Low	71 Å²	71	128.6 Å²	128.6	44%	0.436	63%	0.632	S	S	.	*	S	Bend	trans	-74.2	116	164.2	53	0	0	0	0	107.5	H154 S159	H154-T157 PolarHBondContact O-OG1 3.23Å; T157-S159 PolarHBondContact O-N 3.06Å
158	R	55.2	Low	64.2	Low	245 Å²	245	124.2 Å²	124.2	93%	0.925	61%	0.609	S	S	*	*			trans	-56.8	61.6	160.9	-161.4	175.7	-172.3	172.5	2	108.9	L156	L156-R158 PolarHBondContact O-N 2.78Å
159	S	55.1	Low	65.7	Low	35 Å²	35	122.9 Å²	122.9	25%	0.245	60%	0.597	C	S	.	*			trans	-80.1	152.3	-176.8	64.4	0	0	0	0	107.5	T157 D161	T157-S159 PolarHBondContact O-N 3.06Å; S159-D161 PolarHBondContact O-N 3.12Å; S159-D161 PolarHBondContact OG-OD2 3.25Å
160	W	57.4	Low	67.3	Low	227 Å²	227	119.6 Å²	119.6	86%	0.86	58%	0.584	S	S	*	*	G	3₁₀ helix	trans	-60.4	-10.4	-163.2	-69.9	48.1	0	0	0	113.2	N162 F163	W160-N162 PolarHBondContact O-N 3.09Å; W160-F163 WeakPolarHBondContact O-CB 3.46Å; W160-F163 WeakPolarHBondContact O-CD1 3.26Å; W160-F163 PolarHBondContact O-N 2.83Å
161	D	58.1	Low	68.8	Low	107 Å²	107	119.5 Å²	119.5	57%	0.572	57%	0.572	S	S	*	*	G	3₁₀ helix	trans	-56.1	-22.5	-178.8	-56.5	-55.6	0	0	0	115.8	S159 F163	S159-D161 PolarHBondContact O-N 3.12Å; S159-D161 PolarHBondContact OG-OD2 3.25Å; D161-F163 PolarHBondContact O-N 2.94Å
162	N	65.3	Low	70.3	Confident	115 Å²	115	112.4 Å²	112.4	62%	0.615	55%	0.55	S	S	*	.	G	3₁₀ helix	trans	-74.3	-1.4	170.4	-78.8	-17.1	0	0	0	113.9	W160 R164 L165 E166	W160-N162 PolarHBondContact O-N 3.09Å; N162-R164 PolarHBondContact O-N 3Å; N162-R164 VanDerWaalsContact O-N 3.1Å; N162-L165 PolarHBondContact O-N 2.78Å; N162-L165 VanDerWaalsContact O-N 3.1Å; N162-E166 PolarHBondContact O-N 3.07Å
163	F	81.5	Confident	72	Confident	94 Å²	94	113 Å²	113	41%	0.412	55%	0.549	S	S	.	.	H	α-helix	trans	-56.8	-27	175.9	79.6	-103.8	0	0	0	111.5	W160 D161 E166 I167	W160-F163 WeakPolarHBondContact O-CB 3.46Å; W160-F163 WeakPolarHBondContact O-CD1 3.26Å; W160-F163 PolarHBondContact O-N 2.83Å; D161-F163 PolarHBondContact O-N 2.94Å; F163-E166 PolarHBondContact O-N 2.87Å; F163-I167 HydrophobicContact CD2-CD1 3.51Å; F163-I167 HydrophobicContact CD2-CG1 4.24Å; F163-I167 HydrophobicContact CE2-CD1 3.88Å; F163-I167 WeakPolarHBondContact O-CB 3.47Å; F163-I167 VanDerWaalsContact O-CG1 3.29Å; F163-I167 WeakPolarHBondContact O-CG1 3.43Å; F163-I167 PolarHBondContact O-N 3.34Å
164	R	81.2	Confident	73.8	Confident	139 Å²	139	114.3 Å²	114.3	53%	0.525	55%	0.55	S	S	.	*	H	α-helix	trans	-62.4	-44.7	177.6	-63.6	-174.3	-174.6	-174.3	2.1	111.9	N162 I167 L168	N162-R164 PolarHBondContact O-N 3Å; N162-R164 VanDerWaalsContact O-N 3.1Å; R164-I167 PolarHBondContact O-N 3.22Å; R164-L168 WeakPolarHBondContact O-CB 3.4Å; R164-L168 PolarHBondContact O-N 3.49Å
165	L	82.2	Confident	75.6	Confident	100 Å²	100	108.9 Å²	108.9	52%	0.524	53%	0.525	S	S	.	.	H	α-helix	trans	-67.3	-39.9	174.9	-67.8	178.7	0	0	0	110.5	N162 L168 F169	N162-L165 PolarHBondContact O-N 2.78Å; N162-L165 VanDerWaalsContact O-N 3.1Å; L165-L168 PolarHBondContact O-N 3.27Å; L165-F169 WeakPolarHBondContact O-CD2 3.26Å; L165-F169 PolarHBondContact O-N 3.35Å
166	E	85.9	Confident	77.2	Confident	133 Å²	133	107.2 Å²	107.2	62%	0.621	51%	0.514	S	S	*	.	H	α-helix	trans	-60.4	-45.8	175.2	-169.6	177.1	175.6	0	0	112.1	N162 F163 L168 F169 V170	N162-E166 PolarHBondContact O-N 3.07Å; F163-E166 PolarHBondContact O-N 2.87Å; E166-L168 PolarHBondContact O-N 2.85Å; E166-F169 PolarHBondContact O-N 3.44Å; E166-V170 WeakPolarHBondContact O-CB 3.38Å; E166-V170 VanDerWaalsContact O-CG2 3.26Å; E166-V170 WeakPolarHBondContact O-CG2 3.46Å; E166-V170 PolarHBondContact O-N 3.49Å
167	I	88.4	Confident	78.9	Confident	100 Å²	100	103.8 Å²	103.8	51%	0.513	50%	0.498	S	S	.	.	H	α-helix	trans	-62.6	-42	175.4	-70.6	177.8	0	0	0	110.9	F163 R164 V170 L171	F163-I167 HydrophobicContact CD2-CD1 3.51Å; F163-I167 HydrophobicContact CD2-CG1 4.24Å; F163-I167 HydrophobicContact CE2-CD1 3.88Å; F163-I167 WeakPolarHBondContact O-CB 3.47Å; F163-I167 VanDerWaalsContact O-CG1 3.29Å; F163-I167 WeakPolarHBondContact O-CG1 3.43Å; F163-I167 PolarHBondContact O-N 3.34Å; R164-I167 PolarHBondContact O-N 3.22Å; I167-V170 PolarHBondContact O-N 3.29Å; I167-L171 WeakPolarHBondContact O-CB 3.42Å; I167-L171 PolarHBondContact O-N 2.85Å
168	L	87.9	Confident	80.7	Confident	76 Å²	76	104.6 Å²	104.6	40%	0.398	50%	0.5	S	S	.	.	H	α-helix	trans	-61.7	-45.3	176.2	-170.8	161.4	0	0	0	110.8	R164 L165 E166 L171 A172	R164-L168 WeakPolarHBondContact O-CB 3.4Å; R164-L168 PolarHBondContact O-N 3.49Å; L165-L168 PolarHBondContact O-N 3.27Å; E166-L168 PolarHBondContact O-N 2.85Å; L168-L171 PolarHBondContact O-N 2.94Å; L168-A172 WeakPolarHBondContact O-CB 3.39Å; L168-A172 PolarHBondContact O-N 3.49Å
169	F	88.7	Confident	82.4	Confident	133 Å²	133	94.2 Å²	94.2	58%	0.583	46%	0.463	S	S	*	.	H	α-helix	trans	-61.3	-44	174.6	-81.6	-64.7	0	0	0	111.8	L165 E166 L171 A172 L173	L165-F169 WeakPolarHBondContact O-CD2 3.26Å; L165-F169 PolarHBondContact O-N 3.35Å; E166-F169 PolarHBondContact O-N 3.44Å; F169-L171 PolarHBondContact O-N 2.89Å; F169-A172 PolarHBondContact O-N 2.88Å; F169-L173 WeakPolarHBondContact O-CB 3.48Å; F169-L173 VanDerWaalsContact O-CG 3.26Å; F169-L173 WeakPolarHBondContact O-CG 3.21Å; F169-L173 PolarHBondContact O-N 2.84Å
170	V	90.7	Very high	84.1	Confident	78 Å²	78	95.7 Å²	95.7	47%	0.473	47%	0.465	S	S	.	.	H	α-helix	trans	-62.3	-43.3	176.2	171.1	0	0	0	0	110.9	E166 I167 L173 M174	E166-V170 WeakPolarHBondContact O-CB 3.38Å; E166-V170 VanDerWaalsContact O-CG2 3.26Å; E166-V170 WeakPolarHBondContact O-CG2 3.46Å; E166-V170 PolarHBondContact O-N 3.49Å; I167-V170 PolarHBondContact O-N 3.29Å; V170-L173 PolarHBondContact O-N 3.27Å; V170-M174 HydrophobicContact CG1-CG 4.41Å; V170-M174 WeakPolarHBondContact O-CB 3.39Å; V170-M174 VanDerWaalsContact O-CG 3.26Å; V170-M174 WeakPolarHBondContact O-CG 3.33Å; V170-M174 PolarHBondContact O-N 2.92Å
171	L	90.3	Very high	85.7	Confident	77 Å²	77	89.9 Å²	89.9	40%	0.403	45%	0.45	S	S	.	.	H	α-helix	trans	-65	-41.7	177.4	-176	133.8	0	0	0	111.7	I20 I167 L168 F169 M174 I175	I20-L171 HydrophobicContact CG1-CD2 4.39Å; I167-L171 WeakPolarHBondContact O-CB 3.42Å; I167-L171 PolarHBondContact O-N 2.85Å; L168-L171 PolarHBondContact O-N 2.94Å; F169-L171 PolarHBondContact O-N 2.89Å; L171-M174 WeakPolarHBondContact O-CB 3.28Å; L171-M174 PolarHBondContact O-N 3.44Å; L171-I175 HydrophobicContact CD2-CD1 3.75Å; L171-I175 HydrophobicContact CG-CD1 4.42Å; L171-I175 WeakPolarHBondContact O-CG1 3.39Å; L171-I175 PolarHBondContact O-N 3.36Å
172	A	87.8	Confident	87.2	Confident	46 Å²	46	87.8 Å²	87.8	38%	0.38	44%	0.438	S	S	.	.	H	α-helix	trans	-62	-42.9	174.3	0	0	0	0	0	111.7	L168 F169 I175 Y176	L168-A172 WeakPolarHBondContact O-CB 3.39Å; L168-A172 PolarHBondContact O-N 3.49Å; F169-A172 PolarHBondContact O-N 2.88Å; A172-I175 PolarHBondContact O-N 3.43Å; A172-Y176 WeakPolarHBondContact O-CB 3.36Å; A172-Y176 PolarHBondContact O-N 3.34Å
173	L	90.1	Very high	88.2	Confident	109 Å²	109	82.4 Å²	82.4	57%	0.571	41%	0.41	S	S	*	.	H	α-helix	trans	-64.4	-38.5	173.9	-72	172.7	0	0	0	111.9	F169 V170 Y176 T177	F169-L173 WeakPolarHBondContact O-CB 3.48Å; F169-L173 VanDerWaalsContact O-CG 3.26Å; F169-L173 WeakPolarHBondContact O-CG 3.21Å; F169-L173 PolarHBondContact O-N 2.84Å; V170-L173 PolarHBondContact O-N 3.27Å; L173-Y176 PolarHBondContact O-N 2.92Å; L173-T177 WeakPolarHBondContact O-CB 3.24Å; L173-T177 VanDerWaalsContact O-CG2 3.29Å; L173-T177 WeakPolarHBondContact O-CG2 3.31Å; L173-T177 PolarHBondContact O-N 3.17Å; L173-T177 PolarHBondContact O-OG1 3.31Å
174	M	90.8	Very high	88.7	Confident	102 Å²	102	83.2 Å²	83.2	50%	0.502	41%	0.41	S	S	.	.	H	α-helix	trans	-63.2	-44.2	175.1	-77.2	-62.8	-62.7	0	0	111.7	V170 L171 T177 L178	V170-M174 HydrophobicContact CG1-CG 4.41Å; V170-M174 WeakPolarHBondContact O-CB 3.39Å; V170-M174 VanDerWaalsContact O-CG 3.26Å; V170-M174 WeakPolarHBondContact O-CG 3.33Å; V170-M174 PolarHBondContact O-N 2.92Å; L171-M174 WeakPolarHBondContact O-CB 3.28Å; L171-M174 PolarHBondContact O-N 3.44Å; M174-T177 WeakPolarHBondContact CA-OG1 3.41Å; M174-T177 PolarHBondContact O-N 3.35Å; M174-T177 PolarHBondContact O-OG1 2.85Å; M174-L178 WeakPolarHBondContact O-CB 3.19Å; M174-L178 VanDerWaalsContact O-CG 3.25Å; M174-L178 WeakPolarHBondContact O-CG 3.38Å; M174-L178 PolarHBondContact O-N 3.44Å
175	I	88.9	Confident	89.2	Confident	19 Å²	19	80.3 Å²	80.3	10%	0.097	41%	0.411	C	S	.	.	H	α-helix	trans	-64.3	-42.9	175.5	-67.7	170.9	0	0	0	110.8	C16 I20 L171 A172 L178 N179 L255	C16-I175 HydrophobicContact CB-CG2 4.07Å; I20-I175 HydrophobicContact CD1-CD1 3.67Å; I20-I175 HydrophobicContact CG1-CD1 3.64Å; L171-I175 HydrophobicContact CD2-CD1 3.75Å; L171-I175 HydrophobicContact CG-CD1 4.42Å; L171-I175 WeakPolarHBondContact O-CG1 3.39Å; L171-I175 PolarHBondContact O-N 3.36Å; A172-I175 PolarHBondContact O-N 3.43Å; I175-L178 PolarHBondContact O-N 2.85Å; I175-N179 WeakPolarHBondContact O-CB 3.46Å; I175-N179 PolarHBondContact O-N 2.91Å; I175-L255 HydrophobicContact CG2-CD2 4.43Å
176	Y	89.3	Confident	89.5	Confident	112 Å²	112	80.1 Å²	80.1	44%	0.439	41%	0.406	S	S	.	.	H	α-helix	trans	-59.4	-47.4	176.9	178.9	-95.5	0	0	0	112	A172 L173 N179 F180 L255	A172-Y176 WeakPolarHBondContact O-CB 3.36Å; A172-Y176 PolarHBondContact O-N 3.34Å; L173-Y176 PolarHBondContact O-N 2.92Å; Y176-N179 PolarHBondContact O-N 3.44Å; Y176-F180 WeakPolarHBondContact O-CB 3.44Å; Y176-F180 PolarHBondContact O-N 3.42Å; Y176-L255 HydrophobicContact CD2-CB 3.98Å; Y176-L255 HydrophobicContact CE2-CB 4.48Å
177	T	90.1	Very high	89.8	Confident	61 Å²	61	73.8 Å²	73.8	37%	0.374	38%	0.376	S	S	.	.	H	α-helix	trans	-67.7	-42	179.2	51.6	0	0	0	0	112.6	L173 M174 F180 L181	L173-T177 WeakPolarHBondContact O-CB 3.24Å; L173-T177 VanDerWaalsContact O-CG2 3.29Å; L173-T177 WeakPolarHBondContact O-CG2 3.31Å; L173-T177 PolarHBondContact O-N 3.17Å; L173-T177 PolarHBondContact O-OG1 3.31Å; M174-T177 WeakPolarHBondContact CA-OG1 3.41Å; M174-T177 PolarHBondContact O-N 3.35Å; M174-T177 PolarHBondContact O-OG1 2.85Å; T177-F180 WeakPolarHBondContact O-CB 3.49Å; T177-F180 PolarHBondContact O-N 3.11Å; T177-L181 WeakPolarHBondContact O-CG 3.42Å; T177-L181 PolarHBondContact O-N 3.37Å
178	L	90.6	Very high	90	Very high	89 Å²	89	71 Å²	71	47%	0.466	36%	0.364	S	S	.	.	H	α-helix	trans	-62.4	-44.2	174.8	-73.2	170.3	0	0	0	111.7	M174 I175 F180 L181 I182	M174-L178 WeakPolarHBondContact O-CB 3.19Å; M174-L178 VanDerWaalsContact O-CG 3.25Å; M174-L178 WeakPolarHBondContact O-CG 3.38Å; M174-L178 PolarHBondContact O-N 3.44Å; I175-L178 PolarHBondContact O-N 2.85Å; L178-F180 VanDerWaalsContact C-N 3.31Å; L178-F180 PolarHBondContact O-N 2.82Å; L178-L181 PolarHBondContact O-N 2.83Å; L178-I182 WeakPolarHBondContact O-CB 3.43Å; L178-I182 VanDerWaalsContact O-CG1 3.3Å; L178-I182 WeakPolarHBondContact O-CG1 3.45Å; L178-I182 PolarHBondContact O-N 3.22Å
179	N	89.8	Confident	90.1	Very high	26 Å²	26	73.3 Å²	73.3	14%	0.139	37%	0.373	C	S	.	.	H	α-helix	trans	-62.4	-39.7	175.4	-176.4	73	0	0	0	111.6	I175 Y176 G183 R252 Q253 L255	I175-N179 WeakPolarHBondContact O-CB 3.46Å; I175-N179 PolarHBondContact O-N 2.91Å; Y176-N179 PolarHBondContact O-N 3.44Å; N179-G183 WeakPolarHBondContact O-CA 3.26Å; N179-G183 PolarHBondContact O-N 3.39Å; N179-R252 PolarHBondContact ND2-O 2.94Å; N179-Q253 PolarHBondContact ND2-O 2.86Å; N179-L255 HydrophobicContact CB-CD1 4.35Å
180	F	90.3	Very high	90.2	Very high	67 Å²	67	68.6 Å²	68.6	29%	0.294	35%	0.354	S	S	.	.	H	α-helix	trans	-59.9	-48.3	174.7	176.3	-96.3	0	0	0	112	Y176 T177 L178 G183 R184 E227 Q253	Y176-F180 WeakPolarHBondContact O-CB 3.44Å; Y176-F180 PolarHBondContact O-N 3.42Å; T177-F180 WeakPolarHBondContact O-CB 3.49Å; T177-F180 PolarHBondContact O-N 3.11Å; L178-F180 VanDerWaalsContact C-N 3.31Å; L178-F180 PolarHBondContact O-N 2.82Å; F180-G183 PolarHBondContact O-N 3.3Å; F180-R184 VanDerWaalsContact O-CB 3.22Å; F180-R184 WeakPolarHBondContact O-CB 3.19Å; F180-R184 PolarHBondContact O-N 3.04Å; F180-E227 HydrophobicContact CE2-CG 4.31Å; F180-E227 HydrophobicContact CZ-CG 4.43Å; F180-Q253 WeakPolarHBondContact CA-O 3.49Å; F180-Q253 HydrophobicContact CD2-CB 3.71Å; F180-Q253 HydrophobicContact CD2-CG 4Å; F180-Q253 HydrophobicContact CE2-CB 4.15Å; F180-Q253 HydrophobicContact CE2-CG 4.08Å; F180-Q253 HydrophobicContact CG-CB 4.46Å
181	L	90.9	Very high	90.2	Very high	104 Å²	104	65 Å²	65	55%	0.545	33%	0.331	S	S	.	.	H	α-helix	trans	-64	-46.1	179.7	-68.3	174.6	0	0	0	112.2	T177 L178 S185	T177-L181 WeakPolarHBondContact O-CG 3.42Å; T177-L181 PolarHBondContact O-N 3.37Å; L178-L181 PolarHBondContact O-N 2.83Å; L181-S185 WeakPolarHBondContact O-CB 3.4Å; L181-S185 PolarHBondContact O-N 3.03Å
182	I	89.7	Confident	90.2	Very high	64 Å²	64	65.2 Å²	65.2	33%	0.328	33%	0.333	S	S	.	.	H	α-helix	trans	-64.9	-44.5	178	-65.6	167	0	0	0	110.4	V12 L178 S185 K186	V12-I182 HydrophobicContact CG1-CD1 4.25Å; L178-I182 WeakPolarHBondContact O-CB 3.43Å; L178-I182 VanDerWaalsContact O-CG1 3.3Å; L178-I182 WeakPolarHBondContact O-CG1 3.45Å; L178-I182 PolarHBondContact O-N 3.22Å; I182-S185 PolarHBondContact O-N 3.1Å; I182-K186 HydrophobicContact CG2-CD 4.02Å; I182-K186 HydrophobicContact CG2-CG 4.44Å; I182-K186 WeakPolarHBondContact O-CB 3.42Å; I182-K186 VanDerWaalsContact O-CG 3.31Å; I182-K186 WeakPolarHBondContact O-CG 3.25Å; I182-K186 PolarHBondContact O-N 2.82Å
183	G	88.1	Confident	90.2	Very high	2 Å²	2	66.2 Å²	66.2	2%	0.021	34%	0.335	C	S	.	.	H	α-helix	trans	-62.1	-47	178.5	0	0	0	0	0	112.4	N179 F180 K186 N187	N179-G183 WeakPolarHBondContact O-CA 3.26Å; N179-G183 PolarHBondContact O-N 3.39Å; F180-G183 PolarHBondContact O-N 3.3Å; G183-K186 PolarHBondContact O-N 3.43Å; G183-N187 WeakPolarHBondContact O-CB 3.4Å; G183-N187 PolarHBondContact O-N 3.38Å
184	R	90.8	Very high	90.2	Very high	111 Å²	111	61.3 Å²	61.3	42%	0.419	31%	0.309	S	S	.	.	H	α-helix	trans	-59.3	-47.5	174.4	166.9	168.6	173	145.7	-9.9	111.9	F180 N187 T188 E227	F180-R184 VanDerWaalsContact O-CB 3.22Å; F180-R184 WeakPolarHBondContact O-CB 3.19Å; F180-R184 PolarHBondContact O-N 3.04Å; R184-N187 PolarHBondContact O-N 3.06Å; R184-T188 WeakPolarHBondContact O-CB 3.44Å; R184-T188 PolarHBondContact O-N 3.28Å; R184-T188 PolarHBondContact O-OG1 3.24Å; R184-E227 WeakPolarHBondContact CD-OE2 3.19Å; R184-E227 WeakPolarHBondContact CG-OE2 3.44Å; R184-E227 IonicContact CZ-OE1 3.16Å; R184-E227 IonicContact NE-OE1 2.67Å; R184-E227 IonicContact NE-OE2 3.38Å; R184-E227 IonicContact NH1-OE1 2.81Å; R184-E227 PolarHBondContact NH1-OE1 2.76Å
185	S	91.2	Very high	90.1	Very high	77 Å²	77	57.1 Å²	57.1	54%	0.538	29%	0.288	S	S	.	.	H	α-helix	trans	-63.1	-43	179.8	-173.3	0	0	0	0	111.7	L181 I182 Q189	L181-S185 WeakPolarHBondContact O-CB 3.4Å; L181-S185 PolarHBondContact O-N 3.03Å; I182-S185 PolarHBondContact O-N 3.1Å; S185-Q189 WeakPolarHBondContact O-CB 3.44Å; S185-Q189 PolarHBondContact O-N 2.99Å
186	K	90	Very high	90.1	Very high	96 Å²	96	60 Å²	60	42%	0.417	31%	0.31	S	S	.	.	H	α-helix	trans	-64.4	-47.2	177.6	-75.3	178.7	178.8	178.8	0	111.8	I182 G183 T188 Q189 L190	I182-K186 HydrophobicContact CG2-CD 4.02Å; I182-K186 HydrophobicContact CG2-CG 4.44Å; I182-K186 WeakPolarHBondContact O-CB 3.42Å; I182-K186 VanDerWaalsContact O-CG 3.31Å; I182-K186 WeakPolarHBondContact O-CG 3.25Å; I182-K186 PolarHBondContact O-N 2.82Å; G183-K186 PolarHBondContact O-N 3.43Å; K186-T188 VanDerWaalsContact C-N 3.33Å; K186-T188 PolarHBondContact O-N 2.88Å; K186-Q189 PolarHBondContact O-N 3.45Å; K186-L190 WeakPolarHBondContact O-CG 3.37Å; K186-L190 PolarHBondContact O-N 3.01Å
187	N	91.8	Very high	89.9	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-62.1	-42.8	178.6	-78.9	1.1	0	0	0	111.6	G183 R184 Q189 L190 A191 E227 Y230 L249 V250 R252 Q253	G183-N187 WeakPolarHBondContact O-CB 3.4Å; G183-N187 PolarHBondContact O-N 3.38Å; R184-N187 PolarHBondContact O-N 3.06Å; N187-Q189 PolarHBondContact O-N 2.94Å; N187-L190 PolarHBondContact O-N 2.99Å; N187-A191 VanDerWaalsContact O-CB 3.32Å; N187-A191 WeakPolarHBondContact O-CB 3.2Å; N187-A191 PolarHBondContact O-N 3.28Å; N187-E227 WeakPolarHBondContact CB-O 3.42Å; N187-E227 PolarHBondContact ND2-O 3.32Å; N187-Y230 HydrophobicContact CB-CE2 4.46Å; N187-L249 HydrophobicContact CB-CD1 3.82Å; N187-L249 WeakPolarHBondContact O-CD1 3.37Å; N187-V250 PolarHBondContact ND2-O 2.84Å; N187-V250 VanDerWaalsContact ND2-O 3.11Å; N187-R252 WeakPolarHBondContact OD1-CD 3.16Å; N187-R252 PolarHBondContact OD1-NH1 3.27Å; N187-Q253 PolarHBondContact ND2-OE1 3.39Å
188	T	91.4	Very high	89.8	Confident	41 Å²	41	53.6 Å²	53.6	25%	0.252	29%	0.285	S	S	.	.	H	α-helix	trans	-63.1	-42.4	176.1	-55.2	0	0	0	0	111.4	R184 K186 A191 N192 Y230	R184-T188 WeakPolarHBondContact O-CB 3.44Å; R184-T188 PolarHBondContact O-N 3.28Å; R184-T188 PolarHBondContact O-OG1 3.24Å; K186-T188 VanDerWaalsContact C-N 3.33Å; K186-T188 PolarHBondContact O-N 2.88Å; T188-A191 PolarHBondContact O-N 3.43Å; T188-N192 WeakPolarHBondContact O-CB 3.43Å; T188-N192 VanDerWaalsContact O-CG 3.23Å; T188-N192 PolarHBondContact O-N 3.03Å; T188-N192 PolarHBondContact O-ND2 3.21Å; T188-Y230 WeakPolarHBondContact CA-OH 3.48Å; T188-Y230 PolarHBondContact N-OH 2.96Å; T188-Y230 PolarHBondContact OG1-OH 3.38Å; T188-Y230 VanDerWaalsContact OG1-OH 3.05Å
189	Q	91.3	Very high	89.7	Confident	126 Å²	126	52 Å²	52	59%	0.589	28%	0.275	S	S	*	.	H	α-helix	trans	-62.6	-44.1	176.5	-175	-178.4	16.3	0	0	112.1	S185 K186 N187 T193	S185-Q189 WeakPolarHBondContact O-CB 3.44Å; S185-Q189 PolarHBondContact O-N 2.99Å; K186-Q189 PolarHBondContact O-N 3.45Å; N187-Q189 PolarHBondContact O-N 2.94Å; Q189-T193 VanDerWaalsContact O-CB 3.31Å; Q189-T193 WeakPolarHBondContact O-CB 3.29Å; Q189-T193 PolarHBondContact O-N 2.86Å; Q189-T193 PolarHBondContact O-OG1 3.19Å
190	L	89.7	Confident	89.6	Confident	34 Å²	34	54.2 Å²	54.2	18%	0.178	29%	0.291	C	S	.	.	H	α-helix	trans	-62.4	-46.9	177.9	-71.8	175.5	0	0	0	111.5	K186 N187 T193 W194 L249 P392	K186-L190 WeakPolarHBondContact O-CG 3.37Å; K186-L190 PolarHBondContact O-N 3.01Å; N187-L190 PolarHBondContact O-N 2.99Å; L190-T193 PolarHBondContact O-N 3.33Å; L190-W194 WeakPolarHBondContact O-CB 3.36Å; L190-W194 PolarHBondContact O-N 3.06Å; L190-L249 HydrophobicContact CB-CD1 4.48Å; L190-P392 HydrophobicContact CD2-CB 3.51Å; L190-P392 HydrophobicContact CD2-CG 4.5Å
191	A	90.5	Very high	89.6	Confident	1 Å²	1	52.1 Å²	52.1	1%	0.008	28%	0.283	C	S	.	.	H	α-helix	trans	-59.7	-47.6	179	0	0	0	0	0	111.6	N187 T188 W194 F195 L222 Y230 L247 L249	N187-A191 VanDerWaalsContact O-CB 3.32Å; N187-A191 WeakPolarHBondContact O-CB 3.2Å; N187-A191 PolarHBondContact O-N 3.28Å; T188-A191 PolarHBondContact O-N 3.43Å; A191-W194 PolarHBondContact O-N 3.04Å; A191-F195 WeakPolarHBondContact O-CB 3.41Å; A191-F195 PolarHBondContact O-N 2.9Å; A191-L222 HydrophobicContact CB-CD2 3.63Å; A191-Y230 HydrophobicContact CB-CD1 3.76Å; A191-Y230 HydrophobicContact CB-CD2 3.86Å; A191-Y230 HydrophobicContact CB-CE1 3.79Å; A191-Y230 HydrophobicContact CB-CE2 3.94Å; A191-Y230 HydrophobicContact CB-CG 3.79Å; A191-L247 HydrophobicContact CB-CD1 4.22Å; A191-L249 HydrophobicContact CB-CD1 4.36Å
192	N	90.1	Very high	89.6	Confident	82 Å²	82	47.2 Å²	47.2	44%	0.439	26%	0.258	S	S	.	.	H	α-helix	trans	-66.4	-41.2	177.8	-68.7	-12.9	0	0	0	112.3	T188 W194 F195 S196	T188-N192 WeakPolarHBondContact O-CB 3.43Å; T188-N192 VanDerWaalsContact O-CG 3.23Å; T188-N192 PolarHBondContact O-N 3.03Å; T188-N192 PolarHBondContact O-ND2 3.21Å; N192-W194 VanDerWaalsContact C-N 3.33Å; N192-W194 PolarHBondContact O-N 3.35Å; N192-F195 PolarHBondContact O-N 3.48Å; N192-S196 PolarHBondContact O-N 2.9Å; N192-S196 PolarHBondContact O-OG 3.37Å
193	T	89.2	Confident	89.6	Confident	68 Å²	68	49.1 Å²	49.1	42%	0.417	27%	0.265	S	S	.	.	H	α-helix	trans	-62.9	-42.6	177.8	-56	0	0	0	0	111.1	Q189 L190 A197	Q189-T193 VanDerWaalsContact O-CB 3.31Å; Q189-T193 WeakPolarHBondContact O-CB 3.29Å; Q189-T193 PolarHBondContact O-N 2.86Å; Q189-T193 PolarHBondContact O-OG1 3.19Å; L190-T193 PolarHBondContact O-N 3.33Å; T193-A197 PolarHBondContact O-N 3.46Å
194	W	89.3	Confident	89.7	Confident	5 Å²	5	54.6 Å²	54.6	2%	0.019	30%	0.298	C	S	.	.	H	α-helix	trans	-63.1	-45.8	174.8	174.5	87.5	0	0	0	111.2	L190 A191 N192 A197 H198 L222 L232 I245 L247 Y390 F430	L190-W194 WeakPolarHBondContact O-CB 3.36Å; L190-W194 PolarHBondContact O-N 3.06Å; A191-W194 PolarHBondContact O-N 3.04Å; N192-W194 VanDerWaalsContact C-N 3.33Å; N192-W194 PolarHBondContact O-N 3.35Å; W194-A197 PolarHBondContact O-N 3.38Å; W194-H198 AromaticContact CD1-CE1 3.37Å; W194-H198 AromaticContact CD1-ND1 3.44Å; W194-H198 AromaticContact CD2-ND1 3.96Å; W194-H198 AromaticContact CE2-CG 3.9Å; W194-H198 AromaticContact CE2-ND1 3.62Å; W194-H198 AromaticContact CG-ND1 3.86Å; W194-H198 HydrophobicContact CZ2-CB 4.24Å; W194-H198 AromaticContact NE1-CE1 3.22Å; W194-H198 PolarHBondContact NE1-CE1 3.36Å; W194-H198 AromaticContact NE1-CG 3.83Å; W194-H198 AromaticContact NE1-ND1 3.26Å; W194-H198 PolarHBondContact NE1-ND1 3.48Å; W194-H198 AromaticContact NE1-NE2 3.74Å; W194-H198 PolarHBondContact O-N 3.18Å; W194-H198 VanDerWaalsContact O-N 3.13Å; W194-H198 PolarHBondContact O-ND1 2.81Å; W194-L222 HydrophobicContact CZ3-CD1 4.49Å; W194-L232 HydrophobicContact CH2-CD2 4.36Å; W194-L232 HydrophobicContact CZ3-CD2 4.32Å; W194-I245 HydrophobicContact CH2-CB 4.38Å; W194-I245 HydrophobicContact CH2-CD1 4.06Å; W194-I245 HydrophobicContact CH2-CG2 3.62Å; W194-I245 HydrophobicContact CZ2-CG2 3.92Å; W194-L247 HydrophobicContact CD2-CD1 3.96Å; W194-L247 HydrophobicContact CD2-CD2 3.63Å; W194-L247 HydrophobicContact CD2-CG 4.42Å; W194-L247 HydrophobicContact CE3-CD1 3.45Å; W194-L247 VanDerWaalsContact CE3-CD1 3.45Å; W194-L247 HydrophobicContact CE3-CD2 3.73Å; W194-L247 HydrophobicContact CE3-CG 4.09Å; W194-L247 HydrophobicContact CG-CD1 4.46Å; W194-L247 HydrophobicContact CG-CD2 4.24Å; W194-L247 HydrophobicContact CH2-CD2 4.06Å; W194-L247 HydrophobicContact CZ2-CD2 3.96Å; W194-L247 HydrophobicContact CZ3-CD1 3.95Å; W194-L247 HydrophobicContact CZ3-CD2 3.94Å; W194-L247 HydrophobicContact CZ3-CG 4.25Å; W194-Y390 AromaticContact CD1-CE2 3.8Å; W194-F430 AromaticContact CZ2-CE2 3.89Å; W194-F430 HydrophobicContact CZ2-CE2 3.89Å; W194-F430 AromaticContact CZ2-CZ 3.66Å; W194-F430 HydrophobicContact CZ2-CZ 3.66Å
195	F	89	Confident	89.6	Confident	15 Å²	15	51.9 Å²	51.9	7%	0.066	29%	0.292	C	S	.	.	H	α-helix	trans	-61.4	-51.3	-178.4	-179.1	-104.9	0	0	0	111.4	A191 N192 A197 H198 Q199 G220 L222 L232	A191-F195 WeakPolarHBondContact O-CB 3.41Å; A191-F195 PolarHBondContact O-N 2.9Å; N192-F195 PolarHBondContact O-N 3.48Å; F195-A197 PolarHBondContact O-N 3.33Å; F195-A197 VanDerWaalsContact O-N 3.12Å; F195-H198 PolarHBondContact O-N 2.96Å; F195-H198 VanDerWaalsContact O-N 3.09Å; F195-Q199 HydrophobicContact CE1-CB 4.32Å; F195-Q199 HydrophobicContact CE1-CG 4.32Å; F195-Q199 HydrophobicContact CZ-CB 4.2Å; F195-Q199 HydrophobicContact CZ-CG 4.08Å; F195-Q199 VanDerWaalsContact O-CB 3.25Å; F195-Q199 WeakPolarHBondContact O-CB 3.03Å; F195-Q199 PolarHBondContact O-N 3.49Å; F195-G220 WeakPolarHBondContact CE1-O 3.34Å; F195-G220 WeakPolarHBondContact CZ-O 3.27Å; F195-L222 HydrophobicContact CB-CD2 4.39Å; F195-L222 HydrophobicContact CD2-CB 4.25Å; F195-L222 HydrophobicContact CG-CB 4.26Å; F195-L232 HydrophobicContact CD2-CD1 4.45Å; F195-L232 HydrophobicContact CD2-CD2 3.97Å; F195-L232 HydrophobicContact CE2-CD1 3.8Å; F195-L232 HydrophobicContact CE2-CD2 3.73Å; F195-L232 HydrophobicContact CE2-CG 4.44Å
196	S	87.9	Confident	89.6	Confident	80 Å²	80	48.5 Å²	48.5	56%	0.559	27%	0.268	S	S	*	.	H	α-helix	trans	-59.9	-26.9	178.3	-59.1	0	0	0	0	113.6	N192	N192-S196 PolarHBondContact O-N 2.9Å; N192-S196 PolarHBondContact O-OG 3.37Å
197	A	87.1	Confident	89.5	Confident	34 Å²	34	48 Å²	48	28%	0.281	28%	0.281	S	S	.	.	H	α-helix	trans	-79.2	-33.7	176.7	0	0	0	0	0	113.3	T193 W194 F195 I423	T193-A197 PolarHBondContact O-N 3.46Å; W194-A197 PolarHBondContact O-N 3.38Å; F195-A197 PolarHBondContact O-N 3.33Å; F195-A197 VanDerWaalsContact O-N 3.12Å; A197-I423 HydrophobicContact CB-CG2 4.14Å
198	H	87.8	Confident	89.3	Confident	4 Å²	4	49.9 Å²	49.9	2%	0.019	29%	0.292	C	S	.	.	H	α-helix	trans	-101	-19.9	-174.3	-65.2	79.8	0	0	0	113.8	W194 F195 P200 L201 L202 A426 F430	W194-H198 AromaticContact CD1-CE1 3.37Å; W194-H198 AromaticContact CD1-ND1 3.44Å; W194-H198 AromaticContact CD2-ND1 3.96Å; W194-H198 AromaticContact CE2-CG 3.9Å; W194-H198 AromaticContact CE2-ND1 3.62Å; W194-H198 AromaticContact CG-ND1 3.86Å; W194-H198 HydrophobicContact CZ2-CB 4.24Å; W194-H198 AromaticContact NE1-CE1 3.22Å; W194-H198 PolarHBondContact NE1-CE1 3.36Å; W194-H198 AromaticContact NE1-CG 3.83Å; W194-H198 AromaticContact NE1-ND1 3.26Å; W194-H198 PolarHBondContact NE1-ND1 3.48Å; W194-H198 AromaticContact NE1-NE2 3.74Å; W194-H198 PolarHBondContact O-N 3.18Å; W194-H198 VanDerWaalsContact O-N 3.13Å; W194-H198 PolarHBondContact O-ND1 2.81Å; F195-H198 PolarHBondContact O-N 2.96Å; F195-H198 VanDerWaalsContact O-N 3.09Å; H198-P200 VanDerWaalsContact C-CD 3.5Å; H198-L201 WeakPolarHBondContact O-CB 3.4Å; H198-L201 PolarHBondContact O-N 3.28Å; H198-L202 WeakPolarHBondContact O-CG 3.36Å; H198-L202 PolarHBondContact O-N 3.39Å; H198-A426 WeakPolarHBondContact NE2-CB 3.48Å; H198-F430 AromaticContact CD2-CD2 3.38Å; H198-F430 WeakPolarHBondContact CD2-CD2 3.33Å; H198-F430 AromaticContact CD2-CE2 3.69Å; H198-F430 AromaticContact NE2-CD2 3.69Å; H198-F430 AromaticContact NE2-CE2 3.93Å
199	Q	87.7	Confident	89.1	Confident	54 Å²	54	48.4 Å²	48.4	25%	0.252	28%	0.283	S	S	.	.	H	α-helix	trans	-44.8	-52.7	176.4	179.5	177.2	2.4	0	0	113.6	F195 L201 L202 E203	F195-Q199 HydrophobicContact CE1-CB 4.32Å; F195-Q199 HydrophobicContact CE1-CG 4.32Å; F195-Q199 HydrophobicContact CZ-CB 4.2Å; F195-Q199 HydrophobicContact CZ-CG 4.08Å; F195-Q199 VanDerWaalsContact O-CB 3.25Å; F195-Q199 WeakPolarHBondContact O-CB 3.03Å; F195-Q199 PolarHBondContact O-N 3.49Å; Q199-L201 VanDerWaalsContact C-N 3.27Å; Q199-L201 PolarHBondContact O-N 3.24Å; Q199-L202 PolarHBondContact O-N 3.45Å; Q199-L202 VanDerWaalsContact O-N 3.09Å; Q199-E203 HydrophobicContact CG-CG 4.3Å; Q199-E203 WeakPolarHBondContact CG-OE1 3.49Å; Q199-E203 PolarHBondContact NE2-OE1 2.98Å; Q199-E203 WeakPolarHBondContact O-CG 3.22Å; Q199-E203 PolarHBondContact O-N 2.76Å
200	P	88.7	Confident	88.6	Confident	74 Å²	74	42.7 Å²	42.7	48%	0.481	26%	0.258	S	S	.	.	H	α-helix	trans	-64	-31.9	-178	24.7	-35.4	0	0	0	113.3	H198 T204	H198-P200 VanDerWaalsContact C-CD 3.5Å; P200-T204 PolarHBondContact O-N 2.87Å; P200-T204 PolarHBondContact O-OG1 3.33Å
201	L	89.7	Confident	87.7	Confident	23 Å²	23	43.9 Å²	43.9	12%	0.12	27%	0.265	C	S	.	.	H	α-helix	trans	-69.9	-38	176.7	178.5	67	0	0	0	111.2	H198 Q199 N205 F430 H431 F434	H198-L201 WeakPolarHBondContact O-CB 3.4Å; H198-L201 PolarHBondContact O-N 3.28Å; Q199-L201 VanDerWaalsContact C-N 3.27Å; Q199-L201 PolarHBondContact O-N 3.24Å; L201-N205 PolarHBondContact O-ND2 3.3Å; L201-F430 HydrophobicContact CD2-CB 3.49Å; L201-F430 VanDerWaalsContact CD2-CB 3.49Å; L201-F430 HydrophobicContact CD2-CG 4.37Å; L201-H431 WeakPolarHBondContact CD1-CE1 3.46Å; L201-F434 HydrophobicContact CD1-CE2 4.3Å; L201-F434 HydrophobicContact CD2-CE2 4.13Å; L201-F434 HydrophobicContact CG-CE2 3.97Å
202	L	90.3	Very high	86.5	Confident	1 Å²	1	46.3 Å²	46.3	1%	0.005	28%	0.278	C	S	.	.	H	α-helix	trans	-71.5	-46.1	178.7	-65.4	172.7	0	0	0	111.3	H198 Q199 T204 N205 F206 V209 L232 M243 I245 F434	H198-L202 WeakPolarHBondContact O-CG 3.36Å; H198-L202 PolarHBondContact O-N 3.39Å; Q199-L202 PolarHBondContact O-N 3.45Å; Q199-L202 VanDerWaalsContact O-N 3.09Å; L202-T204 PolarHBondContact O-N 2.83Å; L202-N205 PolarHBondContact O-N 2.82Å; L202-F206 HydrophobicContact CD2-CD2 4.41Å; L202-F206 HydrophobicContact CD2-CE2 4.35Å; L202-F206 WeakPolarHBondContact O-CD2 3.28Å; L202-F206 PolarHBondContact O-N 2.93Å; L202-V209 HydrophobicContact CB-CG1 4.22Å; L202-V209 HydrophobicContact CB-CG2 3.97Å; L202-V209 HydrophobicContact CD1-CG1 4.43Å; L202-L232 HydrophobicContact CD1-CD2 3.49Å; L202-L232 VanDerWaalsContact CD1-CD2 3.49Å; L202-M243 HydrophobicContact CD2-CE 3.59Å; L202-I245 HydrophobicContact CD1-CD1 3.99Å; L202-I245 HydrophobicContact CD2-CD1 3.96Å; L202-F434 HydrophobicContact CD2-CZ 4.12Å
203	E	89.5	Confident	85.2	Confident	104 Å²	104	45.7 Å²	45.7	49%	0.486	29%	0.29	S	S	.	.	H	α-helix	trans	-60.7	-27.6	177.3	-71.1	172.7	177.1	0	0	112.7	Q199 V209	Q199-E203 HydrophobicContact CG-CG 4.3Å; Q199-E203 WeakPolarHBondContact CG-OE1 3.49Å; Q199-E203 PolarHBondContact NE2-OE1 2.98Å; Q199-E203 WeakPolarHBondContact O-CG 3.22Å; Q199-E203 PolarHBondContact O-N 2.76Å; E203-V209 HydrophobicContact CG-CG2 4.26Å
204	T	90.7	Very high	83.8	Confident	117 Å²	117	50.1 Å²	50.1	72%	0.718	31%	0.311	S	S	*	.	H	α-helix	trans	-71.8	-29.5	174.9	-57.6	0	0	0	0	112.6	P200 L202	P200-T204 PolarHBondContact O-N 2.87Å; P200-T204 PolarHBondContact O-OG1 3.33Å; L202-T204 PolarHBondContact O-N 2.83Å
205	N	89.3	Confident	82.2	Confident	53 Å²	53	51.5 Å²	51.5	28%	0.283	32%	0.323	S	S	.	.	H	α-helix	trans	-105.4	-19.2	-172.7	-71.5	-75.4	0	0	0	114.2	L201 L202 S237 F434	L201-N205 PolarHBondContact O-ND2 3.3Å; L202-N205 PolarHBondContact O-N 2.82Å; N205-S237 WeakPolarHBondContact O-CB 3.48Å; N205-S237 PolarHBondContact O-OG 3.42Å; N205-F434 HydrophobicContact CB-CZ 4.4Å
206	F	90.8	Very high	80.6	Confident	7 Å²	7	58.8 Å²	58.8	3%	0.031	36%	0.357	C	S	.	.			trans	-126.4	136.2	-175.7	-67.4	-89.9	0	0	0	110.2	L202 V208 V209 C234 C240 M243 F434	L202-F206 HydrophobicContact CD2-CD2 4.41Å; L202-F206 HydrophobicContact CD2-CE2 4.35Å; L202-F206 WeakPolarHBondContact O-CD2 3.28Å; L202-F206 PolarHBondContact O-N 2.93Å; F206-V208 VanDerWaalsContact C-N 3.32Å; F206-V209 HydrophobicContact CB-CG2 3.95Å; F206-C234 HydrophobicContact CB-CB 4.23Å; F206-C234 HydrophobicContact CD1-CB 3.67Å; F206-C234 HydrophobicContact CD2-CB 4.08Å; F206-C234 HydrophobicContact CE1-CB 4.03Å; F206-C234 HydrophobicContact CE2-CB 4.43Å; F206-C234 HydrophobicContact CG-CB 3.72Å; F206-C234 HydrophobicContact CZ-CB 4.42Å; F206-C240 VanDerWaalsContact CE1-SG 3.59Å; F206-M243 HydrophobicContact CD2-CE 4.1Å; F206-M243 HydrophobicContact CE1-CB 3.93Å; F206-M243 HydrophobicContact CE1-CE 4.16Å; F206-M243 HydrophobicContact CE2-CE 3.27Å; F206-M243 HydrophobicContact CE2-SD 4.13Å; F206-M243 HydrophobicContact CZ-CB 3.93Å; F206-M243 HydrophobicContact CZ-CE 3.32Å; F206-M243 HydrophobicContact CZ-CG 4.46Å; F206-M243 HydrophobicContact CZ-SD 3.72Å; F206-F434 AromaticContact CE2-CE1 3.61Å; F206-F434 HydrophobicContact CE2-CE1 3.61Å; F206-F434 AromaticContact CE2-CZ 3.98Å; F206-F434 HydrophobicContact CE2-CZ 3.98Å; F206-F434 HydrophobicContact CZ-CE1 4.1Å
207	A	87.5	Confident	79	Confident	85 Å²	85	60.1 Å²	60.1	70%	0.702	36%	0.364	S	S	*	.	S	Bend	trans	-69.4	-32.1	176.5	0	0	0	0	0	112.6	T235 G236	A207-T235 PolarHBondContact N-O 3.45Å; A207-G236 WeakPolarHBondContact CB-O 3.46Å; A207-G236 PolarHBondContact N-O 3.33Å
208	V	87.7	Confident	77.4	Confident	39 Å²	39	61.3 Å²	61.3	24%	0.236	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	126	-179.7	-170.5	0	0	0	0	109.6	F206 D211 C234 T235	F206-V208 VanDerWaalsContact C-N 3.32Å; V208-D211 HydrophobicContact CG1-CB 3.75Å; V208-C234 CarbonylContact O-C 3.58Å; V208-C234 WeakPolarHBondContact O-CA 3.47Å; V208-T235 PolarHBondContact N-O 3.26Å; V208-T235 PolarHBondContact O-N 3.22Å
209	V	87	Confident	76	Confident	10 Å²	10	65 Å²	65	6%	0.061	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	122	178.1	179.1	0	0	0	0	108	L202 E203 F206 G220 L232	L202-V209 HydrophobicContact CB-CG1 4.22Å; L202-V209 HydrophobicContact CB-CG2 3.97Å; L202-V209 HydrophobicContact CD1-CG1 4.43Å; E203-V209 HydrophobicContact CG-CG2 4.26Å; F206-V209 HydrophobicContact CB-CG2 3.95Å; V209-G220 WeakPolarHBondContact O-CA 3.49Å; V209-L232 HydrophobicContact CG1-CD1 4.15Å; V209-L232 HydrophobicContact CG1-CD2 4.18Å; V209-L232 HydrophobicContact CG1-CG 4.44Å
210	G	81.2	Confident	75	Confident	6 Å²	6	62.9 Å²	62.9	6%	0.062	40%	0.396	C	S	.	.	S	Bend	trans	82.7	38.2	-179.8	0	0	0	0	0	114.7	D212 W233	G210-D212 PolarHBondContact O-N 2.73Å; G210-W233 WeakPolarHBondContact CA-O 3.3Å; G210-W233 PolarHBondContact N-O 3.23Å
211	D	71.6	Confident	74.4	Confident	60 Å²	60	63.3 Å²	63.3	32%	0.321	40%	0.397	S	S	.	.			trans	-79.9	113.1	171.7	-165.3	-5.3	0	0	0	110.2	V208 G213	V208-D211 HydrophobicContact CG1-CB 3.75Å; D211-G213 PolarHBondContact OD1-N 3.07Å
212	D	65.1	Low	74.2	Confident	52 Å²	52	63 Å²	63	28%	0.278	40%	0.396	S	S	.	.			trans	-100.3	5.2	175.9	62.9	-4.4	0	0	0	112.3	G210 L214 A215 M223	G210-D212 PolarHBondContact O-N 2.73Å; D212-L214 PolarHBondContact O-N 2.81Å; D212-L214 PolarHBondContact OD1-N 3.13Å; D212-L214 VanDerWaalsContact OD1-N 3.14Å; D212-A215 WeakPolarHBondContact OD1-CA 3.47Å; D212-A215 WeakPolarHBondContact OD1-CB 3.42Å; D212-A215 PolarHBondContact OD1-N 2.97Å; D212-M223 HydrophobicContact CB-CE 3.67Å; D212-M223 HydrophobicContact CB-CG 4.09Å; D212-M223 HydrophobicContact CB-SD 3.62Å
213	G	61.7	Low	74	Confident	68 Å²	68	66.1 Å²	66.1	70%	0.701	41%	0.411	S	S	*	.	S	Bend	trans	64.7	2.1	-176.9	0	0	0	0	0	114.7	D211	D211-G213 PolarHBondContact OD1-N 3.07Å
214	L	60	Low	74	Confident	162 Å²	162	64.9 Å²	64.9	85%	0.848	40%	0.404	S	S	*	.	S	Bend	trans	-122.2	-29.8	-176.8	-74.1	168	0	0	0	112.3	D212	D212-L214 PolarHBondContact O-N 2.81Å; D212-L214 PolarHBondContact OD1-N 3.13Å; D212-L214 VanDerWaalsContact OD1-N 3.14Å
215	A	55.2	Low	73.8	Confident	34 Å²	34	64.5 Å²	64.5	28%	0.281	39%	0.394	S	S	.	.	S	Bend	trans	-92.9	157.2	176	0	0	0	0	0	111.1	D212 T219	D212-A215 WeakPolarHBondContact OD1-CA 3.47Å; D212-A215 WeakPolarHBondContact OD1-CB 3.42Å; D212-A215 PolarHBondContact OD1-N 2.97Å; A215-T219 WeakPolarHBondContact CB-OG1 3.43Å
216	E	55.5	Low	73.9	Confident	167 Å²	167	64.2 Å²	64.2	78%	0.78	40%	0.396	S	S	*	.	P	Polyproline II helix	trans	-58.6	135.2	172.2	-65.7	-168.9	163.6	0	0	109.7	G218 T219	E216-G218 PolarHBondContact O-N 3.25Å; E216-T219 PolarHBondContact O-N 2.9Å; E216-T219 PolarHBondContact O-OG1 3.27Å
217	P	54	Low	73.9	Confident	108 Å²	108	65.3 Å²	65.3	70%	0.701	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	116.1	-176.2	22.9	-33	0	0	0	109.7
218	G	53.9	Low	74	Confident	60 Å²	60	63.4 Å²	63.4	62%	0.619	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	120.8	1.4	176.4	0	0	0	0	0	116.4	E216 G220	E216-G218 PolarHBondContact O-N 3.25Å; G218-G220 PolarHBondContact O-N 2.96Å; G218-G220 VanDerWaalsContact O-N 3.09Å
219	T	59.6	Low	74.3	Confident	80 Å²	80	63.3 Å²	63.3	49%	0.491	38%	0.376	S	S	.	.			trans	-68.5	-2.4	174.9	33.5	0	0	0	0	114.8	A215 E216 T221	A215-T219 WeakPolarHBondContact CB-OG1 3.43Å; E216-T219 PolarHBondContact O-N 2.9Å; E216-T219 PolarHBondContact O-OG1 3.27Å; T219-T221 PolarHBondContact O-N 3.39Å; T219-T221 PolarHBondContact O-OG1 2.59Å
220	G	66.5	Low	74.6	Confident	11 Å²	11	63 Å²	63	11%	0.113	37%	0.374	C	S	.	.			trans	47.6	39.4	165.1	0	0	0	0	0	113.1	F195 V209 G218	F195-G220 WeakPolarHBondContact CE1-O 3.34Å; F195-G220 WeakPolarHBondContact CZ-O 3.27Å; V209-G220 WeakPolarHBondContact O-CA 3.49Å; G218-G220 PolarHBondContact O-N 2.96Å; G218-G220 VanDerWaalsContact O-N 3.09Å
221	T	75.6	Confident	75.1	Confident	82 Å²	82	62.9 Å²	62.9	50%	0.503	37%	0.371	S	S	.	.			trans	-105.3	133.7	-172.2	-61.6	0	0	0	0	109.4	T219 M223	T219-T221 PolarHBondContact O-N 3.39Å; T219-T221 PolarHBondContact O-OG1 2.59Å; T221-M223 PolarHBondContact O-N 3.4Å
222	L	84.7	Confident	76.1	Confident	17 Å²	17	60 Å²	60	9%	0.089	36%	0.356	C	S	.	.			trans	-70.3	119	173.5	-178.3	68.8	0	0	0	109.7	A191 W194 F195 Y230 L232 L247	A191-L222 HydrophobicContact CB-CD2 3.63Å; W194-L222 HydrophobicContact CZ3-CD1 4.49Å; F195-L222 HydrophobicContact CB-CD2 4.39Å; F195-L222 HydrophobicContact CD2-CB 4.25Å; F195-L222 HydrophobicContact CG-CB 4.26Å; L222-Y230 HydrophobicContact CD2-CD1 3.71Å; L222-Y230 HydrophobicContact CD2-CG 4.03Å; L222-Y230 HydrophobicContact CG-CD1 4.11Å; L222-Y230 HydrophobicContact CG-CG 4.48Å; L222-L232 HydrophobicContact CD1-CB 3.89Å; L222-L247 HydrophobicContact CD1-CD1 4.32Å; L222-L247 HydrophobicContact CD2-CD1 3.99Å
223	M	86.8	Confident	77.4	Confident	66 Å²	66	62 Å²	62	33%	0.325	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	133.2	179.8	-70.2	-66.3	-77.1	0	0	110.7	D212 T221 Y230 S231	D212-M223 HydrophobicContact CB-CE 3.67Å; D212-M223 HydrophobicContact CB-CG 4.09Å; D212-M223 HydrophobicContact CB-SD 3.62Å; T221-M223 PolarHBondContact O-N 3.4Å; M223-Y230 CarbonylContact O-C 3.58Å; M223-Y230 VanDerWaalsContact O-CA 3.28Å; M223-Y230 WeakPolarHBondContact O-CA 3.43Å; M223-S231 WeakPolarHBondContact CA-O 3.39Å; M223-S231 WeakPolarHBondContact CB-O 3.29Å; M223-S231 PolarHBondContact N-O 3.06Å; M223-S231 PolarHBondContact O-N 2.86Å
224	K	89.3	Confident	78.8	Confident	78 Å²	78	58.8 Å²	58.8	34%	0.339	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	95.5	178.5	-174.2	-175.4	-179.5	-175.3	0	109.8	E227 Y230	K224-E227 VanDerWaalsContact CE-OE2 3.22Å; K224-E227 WeakPolarHBondContact CE-OE2 3.45Å; K224-E227 IonicContact NZ-OE1 3.37Å; K224-E227 PolarHBondContact NZ-OE1 3.31Å; K224-E227 IonicContact NZ-OE2 3.48Å; K224-E227 PolarHBondContact NZ-OE2 2.98Å; K224-Y230 HydrophobicContact CB-CD1 4.11Å; K224-Y230 HydrophobicContact CB-CE1 4.08Å; K224-Y230 HydrophobicContact CD-CE1 4.08Å; K224-Y230 HydrophobicContact CG-CD1 4.12Å; K224-Y230 HydrophobicContact CG-CE1 3.75Å
225	E	87.5	Confident	80.2	Confident	110 Å²	110	53 Å²	53	51%	0.514	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	-37.7	174.6	-69.6	178.7	-170.3	0	0	111.8	L229 S231	E225-L229 HydrophobicContact CB-CD2 4.28Å; E225-L229 HydrophobicContact CB-CG 4.31Å; E225-L229 PolarHBondContact N-O 2.92Å; E225-L229 WeakPolarHBondContact OE2-CD2 3.27Å; E225-S231 VanDerWaalsContact CD-OG 3.24Å; E225-S231 WeakPolarHBondContact CG-OG 3.45Å; E225-S231 WeakPolarHBondContact OE1-CB 3.02Å; E225-S231 PolarHBondContact OE1-OG 2.61Å
226	S	91.1	Very high	81.7	Confident	46 Å²	46	53.6 Å²	53.6	32%	0.322	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	170.1	177.2	-165.3	0	0	0	0	110.9	H228 L229	S226-H228 PolarHBondContact O-N 3.27Å; S226-H228 PolarHBondContact OG-CE1 2.86Å; S226-H228 PolarHBondContact OG-ND1 3.44Å; S226-H228 VanDerWaalsContact OG-ND1 3.07Å; S226-L229 PolarHBondContact N-O 3.5Å; S226-L229 PolarHBondContact O-N 3.06Å
227	E	90.2	Very high	83.3	Confident	31 Å²	31	46.7 Å²	46.7	15%	0.145	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-12.4	176.8	-63.4	-61.5	161.2	0	0	114.4	F180 R184 N187 K224 Q253	F180-E227 HydrophobicContact CE2-CG 4.31Å; F180-E227 HydrophobicContact CZ-CG 4.43Å; R184-E227 WeakPolarHBondContact CD-OE2 3.19Å; R184-E227 WeakPolarHBondContact CG-OE2 3.44Å; R184-E227 IonicContact CZ-OE1 3.16Å; R184-E227 IonicContact NE-OE1 2.67Å; R184-E227 IonicContact NE-OE2 3.38Å; R184-E227 IonicContact NH1-OE1 2.81Å; R184-E227 PolarHBondContact NH1-OE1 2.76Å; N187-E227 WeakPolarHBondContact CB-O 3.42Å; N187-E227 PolarHBondContact ND2-O 3.32Å; K224-E227 VanDerWaalsContact CE-OE2 3.22Å; K224-E227 WeakPolarHBondContact CE-OE2 3.45Å; K224-E227 IonicContact NZ-OE1 3.37Å; K224-E227 PolarHBondContact NZ-OE1 3.31Å; K224-E227 IonicContact NZ-OE2 3.48Å; K224-E227 PolarHBondContact NZ-OE2 2.98Å; E227-Q253 HydrophobicContact CB-CG 3.87Å; E227-Q253 HydrophobicContact CG-CG 4.45Å
228	H	90.5	Very high	84.8	Confident	45 Å²	45	47 Å²	47	21%	0.208	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-127.7	-4.4	-178.5	67.6	-69.8	0	0	0	112.9	S226 L249 K251	S226-H228 PolarHBondContact O-N 3.27Å; S226-H228 PolarHBondContact OG-CE1 2.86Å; S226-H228 PolarHBondContact OG-ND1 3.44Å; S226-H228 VanDerWaalsContact OG-ND1 3.07Å; H228-L249 WeakPolarHBondContact CB-O 3.28Å; H228-L249 PolarHBondContact O-N 2.78Å; H228-K251 HydrophobicContact CB-CG 3.92Å; H228-K251 WeakPolarHBondContact NE2-CE 3.5Å
229	L	92.5	Very high	86.4	Confident	36 Å²	36	47 Å²	47	19%	0.188	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	115	-176.6	-176.2	63.4	0	0	0	108.5	E225 S226 E246 L247 R248	E225-L229 HydrophobicContact CB-CD2 4.28Å; E225-L229 HydrophobicContact CB-CG 4.31Å; E225-L229 PolarHBondContact N-O 2.92Å; E225-L229 WeakPolarHBondContact OE2-CD2 3.27Å; S226-L229 PolarHBondContact N-O 3.5Å; S226-L229 PolarHBondContact O-N 3.06Å; L229-E246 HydrophobicContact CD1-CB 4.24Å; L229-L247 WeakPolarHBondContact CA-O 3.21Å; L229-R248 HydrophobicContact CD1-CG 3.82Å
230	Y	93.4	Very high	87.8	Confident	5 Å²	5	43.4 Å²	43.4	2%	0.02	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	137.2	174.7	-62.1	-104.8	0	0	0	107.8	N187 T188 A191 L222 M223 K224 E246 L247 L249	N187-Y230 HydrophobicContact CB-CE2 4.46Å; T188-Y230 WeakPolarHBondContact CA-OH 3.48Å; T188-Y230 PolarHBondContact N-OH 2.96Å; T188-Y230 PolarHBondContact OG1-OH 3.38Å; T188-Y230 VanDerWaalsContact OG1-OH 3.05Å; A191-Y230 HydrophobicContact CB-CD1 3.76Å; A191-Y230 HydrophobicContact CB-CD2 3.86Å; A191-Y230 HydrophobicContact CB-CE1 3.79Å; A191-Y230 HydrophobicContact CB-CE2 3.94Å; A191-Y230 HydrophobicContact CB-CG 3.79Å; L222-Y230 HydrophobicContact CD2-CD1 3.71Å; L222-Y230 HydrophobicContact CD2-CG 4.03Å; L222-Y230 HydrophobicContact CG-CD1 4.11Å; L222-Y230 HydrophobicContact CG-CG 4.48Å; M223-Y230 CarbonylContact O-C 3.58Å; M223-Y230 VanDerWaalsContact O-CA 3.28Å; M223-Y230 WeakPolarHBondContact O-CA 3.43Å; K224-Y230 HydrophobicContact CB-CD1 4.11Å; K224-Y230 HydrophobicContact CB-CE1 4.08Å; K224-Y230 HydrophobicContact CD-CE1 4.08Å; K224-Y230 HydrophobicContact CG-CD1 4.12Å; K224-Y230 HydrophobicContact CG-CE1 3.75Å; Y230-E246 CarbonylContact O-C 3.57Å; Y230-E246 WeakPolarHBondContact O-CA 3.14Å; Y230-L247 PolarHBondContact N-O 3.06Å; Y230-L247 VanDerWaalsContact N-O 3.15Å; Y230-L247 PolarHBondContact O-N 3.17Å; Y230-L249 HydrophobicContact CD2-CD1 3.93Å; Y230-L249 HydrophobicContact CE2-CD1 3.77Å
231	S	92.9	Very high	88.9	Confident	2 Å²	2	48.1 Å²	48.1	1%	0.014	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	145.8	179.5	52.5	0	0	0	0	110.6	M223 E225 I245	M223-S231 WeakPolarHBondContact CA-O 3.39Å; M223-S231 WeakPolarHBondContact CB-O 3.29Å; M223-S231 PolarHBondContact N-O 3.06Å; M223-S231 PolarHBondContact O-N 2.86Å; E225-S231 VanDerWaalsContact CD-OG 3.24Å; E225-S231 WeakPolarHBondContact CG-OG 3.45Å; E225-S231 WeakPolarHBondContact OE1-CB 3.02Å; E225-S231 PolarHBondContact OE1-OG 2.61Å; S231-I245 CarbonylContact C-O 3.5Å; S231-I245 VanDerWaalsContact CA-O 3.32Å; S231-I245 WeakPolarHBondContact CA-O 2.93Å
232	L	92.4	Very high	89.7	Confident	1 Å²	1	44.8 Å²	44.8	1%	0.005	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	122.3	173.8	-178.9	67.6	0	0	0	108.3	W194 F195 L202 V209 L222 L244 I245	W194-L232 HydrophobicContact CH2-CD2 4.36Å; W194-L232 HydrophobicContact CZ3-CD2 4.32Å; F195-L232 HydrophobicContact CD2-CD1 4.45Å; F195-L232 HydrophobicContact CD2-CD2 3.97Å; F195-L232 HydrophobicContact CE2-CD1 3.8Å; F195-L232 HydrophobicContact CE2-CD2 3.73Å; F195-L232 HydrophobicContact CE2-CG 4.44Å; L202-L232 HydrophobicContact CD1-CD2 3.49Å; L202-L232 VanDerWaalsContact CD1-CD2 3.49Å; V209-L232 HydrophobicContact CG1-CD1 4.15Å; V209-L232 HydrophobicContact CG1-CD2 4.18Å; V209-L232 HydrophobicContact CG1-CG 4.44Å; L222-L232 HydrophobicContact CD1-CB 3.89Å; L232-L244 WeakPolarHBondContact O-CA 3.34Å; L232-I245 HydrophobicContact CB-CB 4.35Å; L232-I245 HydrophobicContact CD2-CD1 4.34Å; L232-I245 PolarHBondContact N-O 3.22Å; L232-I245 PolarHBondContact O-N 3.06Å
233	W	91.9	Very high	90.1	Very high	94 Å²	94	44 Å²	44	36%	0.356	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	129.7	174.1	-73.1	94.9	0	0	0	110	G210 L244	G210-W233 WeakPolarHBondContact CA-O 3.3Å; G210-W233 PolarHBondContact N-O 3.23Å; W233-L244 HydrophobicContact CD2-CB 4.27Å; W233-L244 HydrophobicContact CD2-CD1 3.93Å; W233-L244 HydrophobicContact CE3-CB 4Å; W233-L244 HydrophobicContact CG-CD1 4.25Å; W233-L244 HydrophobicContact CH2-CB 4.08Å; W233-L244 HydrophobicContact CH2-CD2 3.92Å; W233-L244 HydrophobicContact CH2-CG 4.41Å; W233-L244 HydrophobicContact CZ2-CB 4.34Å; W233-L244 HydrophobicContact CZ2-CD1 3.99Å; W233-L244 HydrophobicContact CZ2-CD2 3.73Å; W233-L244 HydrophobicContact CZ2-CG 4.23Å; W233-L244 HydrophobicContact CZ3-CB 3.91Å
234	C	91	Very high	90.5	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	131.3	174.5	-53.9	0	0	0	0	108.9	F206 V208 M243	F206-C234 HydrophobicContact CB-CB 4.23Å; F206-C234 HydrophobicContact CD1-CB 3.67Å; F206-C234 HydrophobicContact CD2-CB 4.08Å; F206-C234 HydrophobicContact CE1-CB 4.03Å; F206-C234 HydrophobicContact CE2-CB 4.43Å; F206-C234 HydrophobicContact CG-CB 3.72Å; F206-C234 HydrophobicContact CZ-CB 4.42Å; V208-C234 CarbonylContact O-C 3.58Å; V208-C234 WeakPolarHBondContact O-CA 3.47Å; C234-M243 HydrophobicContact CB-CB 4.36Å; C234-M243 HydrophobicContact CB-CE 3.9Å; C234-M243 PolarHBondContact N-O 3.41Å; C234-M243 PolarHBondContact O-N 3.32Å
235	T	90.7	Very high	90.7	Very high	39 Å²	39	37.9 Å²	37.9	24%	0.239	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	169.3	-178.2	61.6	0	0	0	0	111	A207 V208 A242	A207-T235 PolarHBondContact N-O 3.45Å; V208-T235 PolarHBondContact N-O 3.26Å; V208-T235 PolarHBondContact O-N 3.22Å; T235-A242 HydrophobicContact CG2-CB 4.01Å
236	G	85.7	Confident	91	Very high	48 Å²	48	33.4 Å²	33.4	50%	0.495	19%	0.19	S	C	.	.			trans	76.5	32.2	177.5	0	0	0	0	0	114	A207	A207-G236 WeakPolarHBondContact CB-O 3.46Å; A207-G236 PolarHBondContact N-O 3.33Å
237	S	88.6	Confident	91.1	Very high	21 Å²	21	31.4 Å²	31.4	15%	0.147	18%	0.176	C	C	.	.			trans	-92.5	149.6	164	-163.4	0	0	0	0	110.1	N205 H239	N205-S237 WeakPolarHBondContact O-CB 3.48Å; N205-S237 PolarHBondContact O-OG 3.42Å; S237-H239 PolarHBondContact O-N 2.84Å; S237-H239 PolarHBondContact OG-ND1 3.15Å
238	V	86.7	Confident	91.3	Very high	115 Å²	115	35.1 Å²	35.1	70%	0.697	19%	0.189	S	C	*	.	S	Bend	trans	-72.8	-16.5	174	-177.2	0	0	0	0	111.6
239	H	86.3	Confident	91.3	Very high	60 Å²	60	33.6 Å²	33.6	28%	0.278	18%	0.182	S	C	.	.	S	Bend	trans	-95.4	-16.9	-171.8	-53.1	101.7	0	0	0	114.3	S237 M276 I437	S237-H239 PolarHBondContact O-N 2.84Å; S237-H239 PolarHBondContact OG-ND1 3.15Å; H239-M276 VanDerWaalsContact O-CE 3.26Å; H239-M276 WeakPolarHBondContact O-CE 3.4Å; H239-I437 HydrophobicContact CB-CG2 3.87Å; H239-I437 WeakPolarHBondContact O-CG2 3.32Å
240	C	90	Very high	91.2	Very high	5 Å²	5	32.7 Å²	32.7	3%	0.034	18%	0.178	C	C	.	.			trans	-160	147.9	-176.7	54	0	0	0	0	109.3	F206 V274 M276 I437	F206-C240 VanDerWaalsContact CE1-SG 3.59Å; C240-V274 HydrophobicContact CB-CG1 3.35Å; C240-M276 HydrophobicContact CB-SD 3.67Å; C240-I437 HydrophobicContact CB-CG2 4.34Å
241	D	90.2	Very high	91.1	Very high	109 Å²	109	35.9 Å²	35.9	58%	0.583	19%	0.192	S	C	*	.	S	Bend	trans	-69.1	-52.5	-178.1	-174.3	31.7	0	0	0	111	I275	D241-I275 PolarHBondContact N-O 3.31Å; D241-I275 VanDerWaalsContact N-O 3.08Å
242	A	91.9	Very high	90.8	Very high	12 Å²	12	38.5 Å²	38.5	10%	0.099	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	150.2	176.2	0	0	0	0	0	111.6	T235 I275	T235-A242 HydrophobicContact CG2-CB 4.01Å; A242-I275 HydrophobicContact CB-CB 4.49Å; A242-I275 HydrophobicContact CB-CD1 4.44Å; A242-I275 PolarHBondContact O-N 2.86Å
243	M	93.6	Very high	90.5	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	123.1	173.3	-178.7	179.1	69.5	0	0	109.9	L202 F206 C234 I245 V272 K273 V274 F434	L202-M243 HydrophobicContact CD2-CE 3.59Å; F206-M243 HydrophobicContact CD2-CE 4.1Å; F206-M243 HydrophobicContact CE1-CB 3.93Å; F206-M243 HydrophobicContact CE1-CE 4.16Å; F206-M243 HydrophobicContact CE2-CE 3.27Å; F206-M243 HydrophobicContact CE2-SD 4.13Å; F206-M243 HydrophobicContact CZ-CB 3.93Å; F206-M243 HydrophobicContact CZ-CE 3.32Å; F206-M243 HydrophobicContact CZ-CG 4.46Å; F206-M243 HydrophobicContact CZ-SD 3.72Å; C234-M243 HydrophobicContact CB-CB 4.36Å; C234-M243 HydrophobicContact CB-CE 3.9Å; C234-M243 PolarHBondContact N-O 3.41Å; C234-M243 PolarHBondContact O-N 3.32Å; M243-I245 HydrophobicContact CE-CD1 3.73Å; M243-I245 HydrophobicContact CE-CG1 4.12Å; M243-I245 HydrophobicContact CG-CG1 4.35Å; M243-I245 HydrophobicContact SD-CG1 4.46Å; M243-V272 HydrophobicContact CG-CG1 3.75Å; M243-V272 HydrophobicContact SD-CG1 3.64Å; M243-K273 CarbonylContact C-O 3.55Å; M243-K273 WeakPolarHBondContact CA-O 3.17Å; M243-V274 HydrophobicContact CG-CG2 4.06Å; M243-V274 HydrophobicContact SD-CG2 4.36Å; M243-F434 HydrophobicContact CE-CE1 4.34Å; M243-F434 HydrophobicContact SD-CE1 4.22Å
244	L	93.5	Very high	90.2	Very high	16 Å²	16	36 Å²	36	8%	0.084	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	118.9	174.2	169.5	60.4	0	0	0	109.4	L232 W233 E246 K273	L232-L244 WeakPolarHBondContact O-CA 3.34Å; W233-L244 HydrophobicContact CD2-CB 4.27Å; W233-L244 HydrophobicContact CD2-CD1 3.93Å; W233-L244 HydrophobicContact CE3-CB 4Å; W233-L244 HydrophobicContact CG-CD1 4.25Å; W233-L244 HydrophobicContact CH2-CB 4.08Å; W233-L244 HydrophobicContact CH2-CD2 3.92Å; W233-L244 HydrophobicContact CH2-CG 4.41Å; W233-L244 HydrophobicContact CZ2-CB 4.34Å; W233-L244 HydrophobicContact CZ2-CD1 3.99Å; W233-L244 HydrophobicContact CZ2-CD2 3.73Å; W233-L244 HydrophobicContact CZ2-CG 4.23Å; W233-L244 HydrophobicContact CZ3-CB 3.91Å; L244-E246 HydrophobicContact CD1-CG 4.37Å; L244-E246 HydrophobicContact CD2-CG 4.32Å; L244-E246 HydrophobicContact CG-CG 4.16Å; L244-K273 HydrophobicContact CB-CB 4.32Å; L244-K273 HydrophobicContact CD2-CD 4.18Å; L244-K273 PolarHBondContact N-O 3.24Å; L244-K273 PolarHBondContact O-N 2.86Å
245	I	94.2	Very high	89.7	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	117.3	172.7	-57	166.5	0	0	0	108.6	W194 L202 S231 L232 M243 L247 I270 V272 F430	W194-I245 HydrophobicContact CH2-CB 4.38Å; W194-I245 HydrophobicContact CH2-CD1 4.06Å; W194-I245 HydrophobicContact CH2-CG2 3.62Å; W194-I245 HydrophobicContact CZ2-CG2 3.92Å; L202-I245 HydrophobicContact CD1-CD1 3.99Å; L202-I245 HydrophobicContact CD2-CD1 3.96Å; S231-I245 CarbonylContact C-O 3.5Å; S231-I245 VanDerWaalsContact CA-O 3.32Å; S231-I245 WeakPolarHBondContact CA-O 2.93Å; L232-I245 HydrophobicContact CB-CB 4.35Å; L232-I245 HydrophobicContact CD2-CD1 4.34Å; L232-I245 PolarHBondContact N-O 3.22Å; L232-I245 PolarHBondContact O-N 3.06Å; M243-I245 HydrophobicContact CE-CD1 3.73Å; M243-I245 HydrophobicContact CE-CG1 4.12Å; M243-I245 HydrophobicContact CG-CG1 4.35Å; M243-I245 HydrophobicContact SD-CG1 4.46Å; I245-L247 HydrophobicContact CG2-CD2 4.31Å; I245-I270 HydrophobicContact CG2-CG2 3.81Å; I245-V272 HydrophobicContact CG1-CG1 4.11Å; I245-V272 HydrophobicContact CG1-CG2 4.19Å; I245-V272 HydrophobicContact CG2-CG2 4.28Å; I245-F430 HydrophobicContact CD1-CE1 3.67Å; I245-F430 HydrophobicContact CD1-CZ 4.08Å; I245-F430 HydrophobicContact CG1-CE1 4.31Å; I245-F430 HydrophobicContact CG2-CZ 4.42Å
246	E	94.2	Very high	89.4	Confident	17 Å²	17	43.8 Å²	43.8	8%	0.079	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	116	173.9	-69.9	175.6	-171.7	0	0	110.2	L229 Y230 L244 R248 I270 V271 K273	L229-E246 HydrophobicContact CD1-CB 4.24Å; Y230-E246 CarbonylContact O-C 3.57Å; Y230-E246 WeakPolarHBondContact O-CA 3.14Å; L244-E246 HydrophobicContact CD1-CG 4.37Å; L244-E246 HydrophobicContact CD2-CG 4.32Å; L244-E246 HydrophobicContact CG-CG 4.16Å; E246-R248 PolarHBondContact O-N 2.78Å; E246-R248 IonicContact OE2-CZ 2.69Å; E246-R248 IonicContact OE2-NE 3.88Å; E246-R248 PolarHBondContact OE2-NE 2.9Å; E246-R248 IonicContact OE2-NH2 3.86Å; E246-R248 PolarHBondContact OE2-NH2 3.33Å; E246-I270 CarbonylContact O-C 3.52Å; E246-I270 WeakPolarHBondContact O-CA 3.47Å; E246-V271 HydrophobicContact CB-CB 4.35Å; E246-V271 PolarHBondContact N-O 3.15Å; E246-V271 PolarHBondContact O-N 3.11Å; E246-K273 IonicContact OE1-NZ 3.52Å; E246-K273 PolarHBondContact OE1-NZ 3.07Å; E246-K273 IonicContact OE2-NZ 2.9Å; E246-K273 PolarHBondContact OE2-NZ 2.94Å
247	L	93.3	Very high	89.2	Confident	4 Å²	4	45.4 Å²	45.4	2%	0.021	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	103.6	167	-48.9	177.1	0	0	0	108.6	A191 W194 L222 L229 Y230 I245 L249 I270	A191-L247 HydrophobicContact CB-CD1 4.22Å; W194-L247 HydrophobicContact CD2-CD1 3.96Å; W194-L247 HydrophobicContact CD2-CD2 3.63Å; W194-L247 HydrophobicContact CD2-CG 4.42Å; W194-L247 HydrophobicContact CE3-CD1 3.45Å; W194-L247 VanDerWaalsContact CE3-CD1 3.45Å; W194-L247 HydrophobicContact CE3-CD2 3.73Å; W194-L247 HydrophobicContact CE3-CG 4.09Å; W194-L247 HydrophobicContact CG-CD1 4.46Å; W194-L247 HydrophobicContact CG-CD2 4.24Å; W194-L247 HydrophobicContact CH2-CD2 4.06Å; W194-L247 HydrophobicContact CZ2-CD2 3.96Å; W194-L247 HydrophobicContact CZ3-CD1 3.95Å; W194-L247 HydrophobicContact CZ3-CD2 3.94Å; W194-L247 HydrophobicContact CZ3-CG 4.25Å; L222-L247 HydrophobicContact CD1-CD1 4.32Å; L222-L247 HydrophobicContact CD2-CD1 3.99Å; L229-L247 WeakPolarHBondContact CA-O 3.21Å; Y230-L247 PolarHBondContact N-O 3.06Å; Y230-L247 VanDerWaalsContact N-O 3.15Å; Y230-L247 PolarHBondContact O-N 3.17Å; I245-L247 HydrophobicContact CG2-CD2 4.31Å; L247-L249 PolarHBondContact O-N 2.81Å; L247-I270 HydrophobicContact CD2-CB 4.4Å; L247-I270 HydrophobicContact CD2-CD1 4.1Å; L247-I270 HydrophobicContact CD2-CG1 3.66Å; L247-I270 HydrophobicContact CD2-CG2 4.06Å
248	R	93.1	Very high	88.8	Confident	109 Å²	109	45.9 Å²	45.9	41%	0.411	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	87.3	174.6	-65.7	-177.8	-179.7	-161.6	-3.3	108.9	L229 E246 S269	L229-R248 HydrophobicContact CD1-CG 3.82Å; E246-R248 PolarHBondContact O-N 2.78Å; E246-R248 IonicContact OE2-CZ 2.69Å; E246-R248 IonicContact OE2-NE 3.88Å; E246-R248 PolarHBondContact OE2-NE 2.9Å; E246-R248 IonicContact OE2-NH2 3.86Å; E246-R248 PolarHBondContact OE2-NH2 3.33Å; R248-S269 CarbonylContact C-O 3.44Å; R248-S269 WeakPolarHBondContact CA-O 3.19Å; R248-S269 WeakPolarHBondContact CB-OG 3.28Å; R248-S269 PolarHBondContact N-O 2.74Å; R248-S269 PolarHBondContact O-N 3.32Å
249	L	91.5	Very high	88.7	Confident	12 Å²	12	44.3 Å²	44.3	6%	0.063	22%	0.216	C	C	.	.			trans	-79.5	152.3	174.8	-57.4	179	0	0	0	109.9	N187 L190 A191 H228 Y230 L247 D268	N187-L249 HydrophobicContact CB-CD1 3.82Å; N187-L249 WeakPolarHBondContact O-CD1 3.37Å; L190-L249 HydrophobicContact CB-CD1 4.48Å; A191-L249 HydrophobicContact CB-CD1 4.36Å; H228-L249 WeakPolarHBondContact CB-O 3.28Å; H228-L249 PolarHBondContact O-N 2.78Å; Y230-L249 HydrophobicContact CD2-CD1 3.93Å; Y230-L249 HydrophobicContact CE2-CD1 3.77Å; L247-L249 PolarHBondContact O-N 2.81Å; L249-D268 HydrophobicContact CD2-CB 4.08Å
250	V	90.7	Very high	88.5	Confident	18 Å²	18	43.1 Å²	43.1	11%	0.109	22%	0.216	C	C	.	.			trans	-62.3	142.5	171.3	173.5	0	0	0	0	110.2	N187 R252 N261 V266 D268	N187-V250 PolarHBondContact ND2-O 2.84Å; N187-V250 VanDerWaalsContact ND2-O 3.11Å; V250-R252 HydrophobicContact CB-CG 4.42Å; V250-R252 HydrophobicContact CG1-CG 4.32Å; V250-R252 PolarHBondContact O-N 2.61Å; V250-N261 WeakPolarHBondContact CG1-ND2 3.45Å; V250-V266 HydrophobicContact CG2-CB 4.22Å; V250-V266 HydrophobicContact CG2-CG1 4.04Å; V250-D268 WeakPolarHBondContact CB-OD1 3.4Å; V250-D268 VanDerWaalsContact CG2-OD1 3.3Å; V250-D268 WeakPolarHBondContact CG2-OD1 3.44Å; V250-D268 PolarHBondContact N-OD1 3.27Å
251	K	90.4	Very high	88.1	Confident	72 Å²	72	44.6 Å²	44.6	31%	0.313	22%	0.224	S	C	.	.			trans	-70.4	63.7	177.1	-66.3	-179.6	179.6	-179.5	0	112.6	H228 Q253 C254 F257	H228-K251 HydrophobicContact CB-CG 3.92Å; H228-K251 WeakPolarHBondContact NE2-CE 3.5Å; K251-Q253 VanDerWaalsContact C-OE1 3.25Å; K251-Q253 PolarHBondContact O-N 2.98Å; K251-C254 HydrophobicContact CB-CB 4.47Å; K251-C254 PolarHBondContact O-N 3.29Å; K251-F257 HydrophobicContact CB-CB 3.92Å; K251-F257 HydrophobicContact CB-CD2 4.22Å; K251-F257 HydrophobicContact CB-CG 4.06Å; K251-F257 HydrophobicContact CD-CD1 4.36Å; K251-F257 HydrophobicContact CD-CD2 3.76Å; K251-F257 HydrophobicContact CD-CE1 4.39Å; K251-F257 HydrophobicContact CD-CE2 3.8Å; K251-F257 HydrophobicContact CD-CG 4.06Å; K251-F257 HydrophobicContact CD-CZ 4.13Å
252	R	87.9	Confident	87.4	Confident	57 Å²	57	47.6 Å²	47.6	22%	0.215	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-27.6	-179.1	-63.4	-179.5	-177.1	87.9	4.3	112.7	N179 N187 V250 C254 D268	N179-R252 PolarHBondContact ND2-O 2.94Å; N187-R252 WeakPolarHBondContact OD1-CD 3.16Å; N187-R252 PolarHBondContact OD1-NH1 3.27Å; V250-R252 HydrophobicContact CB-CG 4.42Å; V250-R252 HydrophobicContact CG1-CG 4.32Å; V250-R252 PolarHBondContact O-N 2.61Å; R252-C254 VanDerWaalsContact C-N 3.29Å; R252-C254 PolarHBondContact O-N 3.08Å; R252-D268 IonicContact CZ-OD1 3.2Å; R252-D268 IonicContact CZ-OD2 3.44Å; R252-D268 IonicContact NH1-OD1 2.65Å; R252-D268 PolarHBondContact NH1-OD1 2.9Å; R252-D268 VanDerWaalsContact NH1-OD1 3.16Å; R252-D268 IonicContact NH1-OD2 3.45Å; R252-D268 PolarHBondContact NH1-OD2 3.44Å; R252-D268 IonicContact NH2-OD1 3.83Å; R252-D268 PolarHBondContact NH2-OD1 2.86Å; R252-D268 IonicContact NH2-OD2 2.67Å; R252-D268 PolarHBondContact NH2-OD2 3.44Å
253	Q	85.4	Confident	87.1	Confident	8 Å²	8	53.7 Å²	53.7	4%	0.037	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-21.3	179.9	73.4	-77.3	5.7	0	0	113.6	N179 F180 N187 E227 K251	N179-Q253 PolarHBondContact ND2-O 2.86Å; F180-Q253 WeakPolarHBondContact CA-O 3.49Å; F180-Q253 HydrophobicContact CD2-CB 3.71Å; F180-Q253 HydrophobicContact CD2-CG 4Å; F180-Q253 HydrophobicContact CE2-CB 4.15Å; F180-Q253 HydrophobicContact CE2-CG 4.08Å; F180-Q253 HydrophobicContact CG-CB 4.46Å; N187-Q253 PolarHBondContact ND2-OE1 3.39Å; E227-Q253 HydrophobicContact CB-CG 3.87Å; E227-Q253 HydrophobicContact CG-CG 4.45Å; K251-Q253 VanDerWaalsContact C-OE1 3.25Å; K251-Q253 PolarHBondContact O-N 2.98Å
254	C	85.3	Confident	86.5	Confident	34 Å²	34	63.1 Å²	63.1	23%	0.23	29%	0.292	C	S	.	.			trans	-96.5	117	-179.5	-60.2	0	0	0	0	109.6	K251 R252 F256 F257 A258	K251-C254 HydrophobicContact CB-CB 4.47Å; K251-C254 PolarHBondContact O-N 3.29Å; R252-C254 VanDerWaalsContact C-N 3.29Å; R252-C254 PolarHBondContact O-N 3.08Å; C254-F256 VanDerWaalsContact C-N 3.29Å; C254-F256 PolarHBondContact O-N 3.28Å; C254-F257 HydrophobicContact CB-CB 4.1Å; C254-F257 HydrophobicContact CB-CD2 3.7Å; C254-F257 HydrophobicContact CB-CG 4.38Å; C254-F257 PolarHBondContact O-N 2.81Å; C254-F257 VanDerWaalsContact O-N 3.13Å; C254-A258 PolarHBondContact O-N 2.98Å
255	L	81.1	Confident	86	Confident	50 Å²	50	66.5 Å²	66.5	26%	0.262	32%	0.315	S	S	.	.	H	α-helix	trans	-58.3	-41.1	-178.2	-173.8	63.6	0	0	0	112.3	I175 Y176 N179 F257 A258 I259	I175-L255 HydrophobicContact CG2-CD2 4.43Å; Y176-L255 HydrophobicContact CD2-CB 3.98Å; Y176-L255 HydrophobicContact CE2-CB 4.48Å; N179-L255 HydrophobicContact CB-CD1 4.35Å; L255-F257 PolarHBondContact O-N 2.8Å; L255-A258 WeakPolarHBondContact O-CB 3.38Å; L255-A258 PolarHBondContact O-N 3.47Å; L255-I259 HydrophobicContact CD1-CD1 4.46Å; L255-I259 HydrophobicContact CG-CD1 4.12Å; L255-I259 WeakPolarHBondContact O-CG1 3.47Å; L255-I259 PolarHBondContact O-N 2.68Å
256	F	83.7	Confident	85.5	Confident	153 Å²	153	70.4 Å²	70.4	67%	0.671	34%	0.338	S	S	*	.	H	α-helix	trans	-57.2	-48.2	175.4	178	-98.3	0	0	0	112.4	C254 I259 A260	C254-F256 VanDerWaalsContact C-N 3.29Å; C254-F256 PolarHBondContact O-N 3.28Å; F256-I259 PolarHBondContact O-N 2.65Å; F256-A260 WeakPolarHBondContact O-CB 3.14Å; F256-A260 PolarHBondContact O-N 3.26Å
257	F	81.6	Confident	85.1	Confident	81 Å²	81	73.4 Å²	73.4	36%	0.355	35%	0.352	S	S	.	.	H	α-helix	trans	-69.9	-33.8	178.1	-76.4	-78.3	0	0	0	111.7	K251 C254 L255 I259 A260 N261	K251-F257 HydrophobicContact CB-CB 3.92Å; K251-F257 HydrophobicContact CB-CD2 4.22Å; K251-F257 HydrophobicContact CB-CG 4.06Å; K251-F257 HydrophobicContact CD-CD1 4.36Å; K251-F257 HydrophobicContact CD-CD2 3.76Å; K251-F257 HydrophobicContact CD-CE1 4.39Å; K251-F257 HydrophobicContact CD-CE2 3.8Å; K251-F257 HydrophobicContact CD-CG 4.06Å; K251-F257 HydrophobicContact CD-CZ 4.13Å; C254-F257 HydrophobicContact CB-CB 4.1Å; C254-F257 HydrophobicContact CB-CD2 3.7Å; C254-F257 HydrophobicContact CB-CG 4.38Å; C254-F257 PolarHBondContact O-N 2.81Å; C254-F257 VanDerWaalsContact O-N 3.13Å; L255-F257 PolarHBondContact O-N 2.8Å; F257-I259 VanDerWaalsContact C-N 3.33Å; F257-I259 PolarHBondContact O-N 3.23Å; F257-A260 PolarHBondContact O-N 3.47Å; F257-N261 VanDerWaalsContact O-CB 3.25Å; F257-N261 WeakPolarHBondContact O-CB 3.45Å; F257-N261 PolarHBondContact O-N 3.23Å; F257-N261 PolarHBondContact O-ND2 2.96Å
258	A	80.9	Confident	84.9	Confident	32 Å²	32	73.4 Å²	73.4	26%	0.264	35%	0.352	S	S	.	.	H	α-helix	trans	-60	-43.4	173.4	0	0	0	0	0	111.7	C254 L255 W262	C254-A258 PolarHBondContact O-N 2.98Å; L255-A258 WeakPolarHBondContact O-CB 3.38Å; L255-A258 PolarHBondContact O-N 3.47Å; A258-W262 PolarHBondContact O-N 2.89Å
259	I	83.3	Confident	84.9	Confident	82 Å²	82	69.1 Å²	69.1	42%	0.421	34%	0.339	S	S	.	.	H	α-helix	trans	-69.2	-44.1	175.2	-62.9	165.6	0	0	0	111	L255 F256 F257 N261 W262 I263	L255-I259 HydrophobicContact CD1-CD1 4.46Å; L255-I259 HydrophobicContact CG-CD1 4.12Å; L255-I259 WeakPolarHBondContact O-CG1 3.47Å; L255-I259 PolarHBondContact O-N 2.68Å; F256-I259 PolarHBondContact O-N 2.65Å; F257-I259 VanDerWaalsContact C-N 3.33Å; F257-I259 PolarHBondContact O-N 3.23Å; I259-N261 VanDerWaalsContact C-N 3.29Å; I259-N261 PolarHBondContact O-N 3Å; I259-W262 VanDerWaalsContact O-CB 3.23Å; I259-W262 WeakPolarHBondContact O-CB 3.42Å; I259-W262 PolarHBondContact O-N 2.87Å; I259-I263 PolarHBondContact O-N 3.23Å
260	A	83.8	Confident	85	Confident	35 Å²	35	69 Å²	69	29%	0.289	34%	0.338	S	S	.	.	H	α-helix	trans	-61.7	-38.1	178.1	0	0	0	0	0	112.2	F256 F257 W262 I263 R264	F256-A260 WeakPolarHBondContact O-CB 3.14Å; F256-A260 PolarHBondContact O-N 3.26Å; F257-A260 PolarHBondContact O-N 3.47Å; A260-W262 PolarHBondContact O-N 3.17Å; A260-I263 PolarHBondContact O-N 3.17Å; A260-R264 PolarHBondContact O-N 3.07Å
261	N	80.9	Confident	85.2	Confident	35 Å²	35	68.3 Å²	68.3	19%	0.187	33%	0.334	C	S	.	.	H	α-helix	trans	-67.5	-22.8	176.4	-70.1	-32.7	0	0	0	113	V250 F257 I259 R264 P265 V266	V250-N261 WeakPolarHBondContact CG1-ND2 3.45Å; F257-N261 VanDerWaalsContact O-CB 3.25Å; F257-N261 WeakPolarHBondContact O-CB 3.45Å; F257-N261 PolarHBondContact O-N 3.23Å; F257-N261 PolarHBondContact O-ND2 2.96Å; I259-N261 VanDerWaalsContact C-N 3.29Å; I259-N261 PolarHBondContact O-N 3Å; N261-R264 CarbonylContact C-O 3.45Å; N261-R264 VanDerWaalsContact CA-O 3.32Å; N261-R264 WeakPolarHBondContact CA-O 3.13Å; N261-R264 CarbonylContact O-C 3.53Å; N261-P265 WeakPolarHBondContact O-CA 3.37Å; N261-V266 VanDerWaalsContact OD1-CG2 3.31Å; N261-V266 WeakPolarHBondContact OD1-CG2 3.26Å
262	W	75.4	Confident	85.4	Confident	173 Å²	173	64.9 Å²	64.9	66%	0.655	32%	0.319	S	S	*	.	H	α-helix	trans	-68.6	-37.3	173	-178	57.5	0	0	0	111.6	A258 I259 A260	A258-W262 PolarHBondContact O-N 2.89Å; I259-W262 VanDerWaalsContact O-CB 3.23Å; I259-W262 WeakPolarHBondContact O-CB 3.42Å; I259-W262 PolarHBondContact O-N 2.87Å; A260-W262 PolarHBondContact O-N 3.17Å
263	I	84.4	Confident	85.8	Confident	139 Å²	139	64.2 Å²	64.2	71%	0.713	32%	0.318	S	S	*	.	H	α-helix	trans	-75.1	-43.5	174.7	-58.9	172.2	0	0	0	110.5	I259 A260	I259-I263 PolarHBondContact O-N 3.23Å; A260-I263 PolarHBondContact O-N 3.17Å
264	R	82.3	Confident	86.2	Confident	198 Å²	198	63.9 Å²	63.9	75%	0.747	32%	0.316	S	S	*	.	S	Bend	trans	-127.2	102.3	-178.7	-171.4	175.5	-177	166.7	-0.2	110.2	A260 N261 V266	A260-R264 PolarHBondContact O-N 3.07Å; N261-R264 CarbonylContact C-O 3.45Å; N261-R264 VanDerWaalsContact CA-O 3.32Å; N261-R264 WeakPolarHBondContact CA-O 3.13Å; N261-R264 CarbonylContact O-C 3.53Å; R264-V266 PolarHBondContact O-N 2.87Å; R264-V266 VanDerWaalsContact O-N 3.17Å
265	P	82	Confident	86.6	Confident	87 Å²	87	64.1 Å²	64.1	57%	0.565	32%	0.315	S	S	*	.			trans	-63.3	122.1	-177.8	24.9	-33	0	0	0	110.5	N261	N261-P265 WeakPolarHBondContact O-CA 3.37Å
266	V	84	Confident	87.1	Confident	82 Å²	82	62 Å²	62	50%	0.497	30%	0.304	S	S	.	.			trans	-106.7	140.7	171	-177.1	0	0	0	0	107.9	V250 N261 R264	V250-V266 HydrophobicContact CG2-CB 4.22Å; V250-V266 HydrophobicContact CG2-CG1 4.04Å; N261-V266 VanDerWaalsContact OD1-CG2 3.31Å; N261-V266 WeakPolarHBondContact OD1-CG2 3.26Å; R264-V266 PolarHBondContact O-N 2.87Å; R264-V266 VanDerWaalsContact O-N 3.17Å
267	H	86	Confident	87.4	Confident	80 Å²	80	58 Å²	58	37%	0.37	29%	0.289	S	S	.	.			trans	-104.4	152.2	179.2	-56.9	-59.5	0	0	0	110.4	R389	H267-R389 HydrophobicContact CB-CG 4.01Å; H267-R389 PolarHBondContact CD2-NE 2.67Å; H267-R389 PolarHBondContact CD2-NH1 2.64Å; H267-R389 PolarHBondContact CD2-NH2 2.76Å; H267-R389 PolarHBondContact CE1-NH2 3.5Å; H267-R389 VanDerWaalsContact CG-NE 3.3Å; H267-R389 VanDerWaalsContact CG-NH2 3.31Å; H267-R389 PolarHBondContact ND1-NH2 2.87Å; H267-R389 VanDerWaalsContact ND1-NH2 3.16Å; H267-R389 VanDerWaalsContact NE2-CZ 3.34Å; H267-R389 PolarHBondContact NE2-NH2 2.81Å
268	D	90.4	Very high	87.6	Confident	4 Å²	4	59.2 Å²	59.2	2%	0.021	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.6	145.5	170.2	-62.4	-25	0	0	0	108.7	L249 V250 R252 Y390	L249-D268 HydrophobicContact CD2-CB 4.08Å; V250-D268 WeakPolarHBondContact CB-OD1 3.4Å; V250-D268 VanDerWaalsContact CG2-OD1 3.3Å; V250-D268 WeakPolarHBondContact CG2-OD1 3.44Å; V250-D268 PolarHBondContact N-OD1 3.27Å; R252-D268 IonicContact CZ-OD1 3.2Å; R252-D268 IonicContact CZ-OD2 3.44Å; R252-D268 IonicContact NH1-OD1 2.65Å; R252-D268 PolarHBondContact NH1-OD1 2.9Å; R252-D268 VanDerWaalsContact NH1-OD1 3.16Å; R252-D268 IonicContact NH1-OD2 3.45Å; R252-D268 PolarHBondContact NH1-OD2 3.44Å; R252-D268 IonicContact NH2-OD1 3.83Å; R252-D268 PolarHBondContact NH2-OD1 2.86Å; R252-D268 IonicContact NH2-OD2 2.67Å; R252-D268 PolarHBondContact NH2-OD2 3.44Å; D268-Y390 HydrophobicContact CB-CD1 3.9Å; D268-Y390 HydrophobicContact CB-CG 4.43Å; D268-Y390 PolarHBondContact O-N 2.84Å
269	S	91.7	Very high	87.8	Confident	19 Å²	19	61.9 Å²	61.9	13%	0.133	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	149.6	179.5	54.5	0	0	0	0	110.8	R248 L388	R248-S269 CarbonylContact C-O 3.44Å; R248-S269 WeakPolarHBondContact CA-O 3.19Å; R248-S269 WeakPolarHBondContact CB-OG 3.28Å; R248-S269 PolarHBondContact N-O 2.74Å; R248-S269 PolarHBondContact O-N 3.32Å; S269-L388 CarbonylContact C-O 3.57Å; S269-L388 WeakPolarHBondContact CA-O 3.48Å; S269-L388 WeakPolarHBondContact CB-O 3.33Å
270	I	93.8	Very high	87.9	Confident	9 Å²	9	59.9 Å²	59.9	5%	0.046	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	122.1	175.7	-61.3	168.1	0	0	0	106.1	I245 E246 L247 V272 L388 Y390 F430	I245-I270 HydrophobicContact CG2-CG2 3.81Å; E246-I270 CarbonylContact O-C 3.52Å; E246-I270 WeakPolarHBondContact O-CA 3.47Å; L247-I270 HydrophobicContact CD2-CB 4.4Å; L247-I270 HydrophobicContact CD2-CD1 4.1Å; L247-I270 HydrophobicContact CD2-CG1 3.66Å; L247-I270 HydrophobicContact CD2-CG2 4.06Å; I270-V272 HydrophobicContact CG2-CG2 4.08Å; I270-L388 HydrophobicContact CB-CB 4.42Å; I270-L388 PolarHBondContact N-O 3.43Å; I270-L388 PolarHBondContact O-N 2.92Å; I270-Y390 HydrophobicContact CD1-CD2 3.57Å; I270-Y390 HydrophobicContact CD1-CE2 4.4Å; I270-Y390 HydrophobicContact CD1-CG 3.97Å; I270-Y390 HydrophobicContact CG1-CD2 4.48Å; I270-Y390 HydrophobicContact CG1-CG 4.4Å; I270-F430 HydrophobicContact CG2-CZ 4.45Å
271	V	94.6	Very high	88.2	Confident	4 Å²	4	58.3 Å²	58.3	2%	0.024	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	112.4	178	-176.7	0	0	0	0	107.9	E246 K273 I385 F386 A387	E246-V271 HydrophobicContact CB-CB 4.35Å; E246-V271 PolarHBondContact N-O 3.15Å; E246-V271 PolarHBondContact O-N 3.11Å; V271-K273 HydrophobicContact CG1-CG 4.14Å; V271-I385 HydrophobicContact CG1-CG2 3.8Å; V271-F386 CarbonylContact C-O 3.51Å; V271-F386 WeakPolarHBondContact CA-O 3.45Å; V271-A387 HydrophobicContact CG2-CB 4.46Å
272	V	95.4	Very high	88.6	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	113.8	176.1	-174.8	0	0	0	0	108.1	M243 I245 I270 V274 I385 F386 F430 I433	M243-V272 HydrophobicContact CG-CG1 3.75Å; M243-V272 HydrophobicContact SD-CG1 3.64Å; I245-V272 HydrophobicContact CG1-CG1 4.11Å; I245-V272 HydrophobicContact CG1-CG2 4.19Å; I245-V272 HydrophobicContact CG2-CG2 4.28Å; I270-V272 HydrophobicContact CG2-CG2 4.08Å; V272-V274 HydrophobicContact CG1-CG2 4.14Å; V272-I385 CarbonylContact O-C 3.57Å; V272-I385 WeakPolarHBondContact O-CA 3.46Å; V272-F386 HydrophobicContact CB-CB 4.29Å; V272-F386 PolarHBondContact N-O 2.8Å; V272-F386 PolarHBondContact O-N 2.99Å; V272-F430 HydrophobicContact CG2-CE1 3.96Å; V272-F430 HydrophobicContact CG2-CZ 3.91Å; V272-I433 HydrophobicContact CB-CD1 4.2Å; V272-I433 HydrophobicContact CG1-CG2 4.45Å; V272-I433 HydrophobicContact CG2-CD1 3.86Å
273	K	95.1	Very high	89.3	Confident	44 Å²	44	50 Å²	50	19%	0.191	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	118.5	176.2	-61.2	174.9	-178.8	166.1	0	108.4	M243 L244 E246 V271 L384 I385	M243-K273 CarbonylContact C-O 3.55Å; M243-K273 WeakPolarHBondContact CA-O 3.17Å; L244-K273 HydrophobicContact CB-CB 4.32Å; L244-K273 HydrophobicContact CD2-CD 4.18Å; L244-K273 PolarHBondContact N-O 3.24Å; L244-K273 PolarHBondContact O-N 2.86Å; E246-K273 IonicContact OE1-NZ 3.52Å; E246-K273 PolarHBondContact OE1-NZ 3.07Å; E246-K273 IonicContact OE2-NZ 2.9Å; E246-K273 PolarHBondContact OE2-NZ 2.94Å; V271-K273 HydrophobicContact CG1-CG 4.14Å; K273-L384 CarbonylContact C-O 3.52Å; K273-L384 WeakPolarHBondContact CA-O 3.23Å; K273-I385 HydrophobicContact CG-CD1 4.45Å; K273-I385 HydrophobicContact CG-CG1 4.21Å; K273-I385 HydrophobicContact CG-CG2 4.42Å
274	V	95	Very high	89.8	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	123.4	179.5	-174.3	0	0	0	0	107.4	C240 M243 V272 M276 A383 L384 F386 I437	C240-V274 HydrophobicContact CB-CG1 3.35Å; M243-V274 HydrophobicContact CG-CG2 4.06Å; M243-V274 HydrophobicContact SD-CG2 4.36Å; V272-V274 HydrophobicContact CG1-CG2 4.14Å; V274-M276 HydrophobicContact CG1-SD 4.19Å; V274-A383 CarbonylContact O-C 3.6Å; V274-A383 VanDerWaalsContact O-CA 3.28Å; V274-A383 WeakPolarHBondContact O-CA 3.33Å; V274-L384 HydrophobicContact CB-CB 4.17Å; V274-L384 PolarHBondContact N-O 2.9Å; V274-L384 PolarHBondContact O-N 3.46Å; V274-F386 HydrophobicContact CG2-CD2 4.41Å; V274-F386 HydrophobicContact CG2-CE2 4.17Å; V274-I437 HydrophobicContact CB-CD1 4.46Å; V274-I437 HydrophobicContact CG1-CD1 4.04Å; V274-I437 HydrophobicContact CG1-CG1 4.28Å; V274-I437 HydrophobicContact CG2-CD1 3.68Å; V274-I437 HydrophobicContact CG2-CG1 4.18Å
275	I	93.5	Very high	90.3	Very high	39 Å²	39	34.1 Å²	34.1	20%	0.2	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	123.2	173.8	-57.3	175.3	0	0	0	106.9	D241 A242	D241-I275 PolarHBondContact N-O 3.31Å; D241-I275 VanDerWaalsContact N-O 3.08Å; A242-I275 HydrophobicContact CB-CB 4.49Å; A242-I275 HydrophobicContact CB-CD1 4.44Å; A242-I275 PolarHBondContact O-N 2.86Å
276	M	91.5	Very high	90.9	Very high	5 Å²	5	30 Å²	30	3%	0.025	17%	0.169	C	C	.	.	P	Polyproline II helix	trans	-102.2	150.2	178.1	-70.3	-59.8	-128.1	0	0	110.2	H239 C240 V274 M281 K382 L384 I437 R441	H239-M276 VanDerWaalsContact O-CE 3.26Å; H239-M276 WeakPolarHBondContact O-CE 3.4Å; C240-M276 HydrophobicContact CB-SD 3.67Å; V274-M276 HydrophobicContact CG1-SD 4.19Å; M276-M281 HydrophobicContact CB-CB 4.47Å; M276-K382 HydrophobicContact CB-CB 4.26Å; M276-K382 PolarHBondContact N-O 2.83Å; M276-L384 HydrophobicContact CE-CD1 3.93Å; M276-L384 HydrophobicContact CG-CD1 4.09Å; M276-L384 HydrophobicContact CG-CG 4.19Å; M276-I437 HydrophobicContact CE-CB 4.47Å; M276-I437 HydrophobicContact CE-CG2 3.53Å; M276-I437 HydrophobicContact SD-CG2 4.29Å; M276-R441 HydrophobicContact CE-CB 4.16Å
277	D	89.4	Confident	91.4	Very high	70 Å²	70	26.1 Å²	26.1	37%	0.374	15%	0.145	S	C	.	.	P	Polyproline II helix	trans	-67.4	148.1	173.4	178.8	49.5	0	0	0	111.6	S279 E280	D277-S279 PolarHBondContact O-N 3.14Å; D277-S279 WeakPolarHBondContact OD2-CB 3.28Å; D277-S279 PolarHBondContact OD2-N 3.05Å; D277-S279 PolarHBondContact OD2-OG 3.07Å; D277-E280 HydrophobicContact CB-CG 4.21Å; D277-E280 PolarHBondContact O-N 2.48Å
278	D	86.1	Confident	91.8	Very high	106 Å²	106	22.5 Å²	22.5	57%	0.567	13%	0.128	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-23.9	-178.6	-78.6	-23.7	0	0	0	112.7	K382	D278-K382 PolarHBondContact O-NZ 2.77Å; D278-K382 WeakPolarHBondContact OD1-CE 3.46Å
279	S	86.4	Confident	91.9	Very high	88 Å²	88	22.3 Å²	22.3	62%	0.615	13%	0.128	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.3	-24.8	180	-49.1	0	0	0	0	112.9	D277 R444	D277-S279 PolarHBondContact O-N 3.14Å; D277-S279 WeakPolarHBondContact OD2-CB 3.28Å; D277-S279 PolarHBondContact OD2-N 3.05Å; D277-S279 PolarHBondContact OD2-OG 3.07Å; S279-R444 PolarHBondContact O-NH1 2.69Å; S279-R444 PolarHBondContact O-NH2 2.97Å
280	E	85.1	Confident	91.9	Very high	40 Å²	40	24.8 Å²	24.8	19%	0.187	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.8	-38.1	-168.7	-67.6	-157.8	130.6	0	0	113.4	D277 R441 R444	D277-E280 HydrophobicContact CB-CG 4.21Å; D277-E280 PolarHBondContact O-N 2.48Å; E280-R441 HydrophobicContact CB-CG 4.1Å; E280-R441 HydrophobicContact CG-CG 4.39Å; E280-R441 WeakPolarHBondContact OE1-CD 3.17Å; E280-R441 IonicContact OE1-CZ 2.87Å; E280-R441 IonicContact OE1-NH1 3.07Å; E280-R441 PolarHBondContact OE1-NH1 3.07Å; E280-R441 VanDerWaalsContact OE2-CD 3.29Å; E280-R441 WeakPolarHBondContact OE2-CD 3.3Å; E280-R441 WeakPolarHBondContact OE2-CG 3.34Å; E280-R444 PolarHBondContact O-NH2 2.96Å
281	M	88.6	Confident	91.6	Very high	2 Å²	2	29.9 Å²	29.9	1%	0.01	16%	0.156	C	C	.	.	S	Bend	trans	-104.8	126.1	-175.9	179.7	175	132.2	0	0	111.9	M276 D359 K382 L384 V440	M276-M281 HydrophobicContact CB-CB 4.47Å; M281-D359 HydrophobicContact CE-CB 3.74Å; M281-K382 HydrophobicContact CB-CD 3.9Å; M281-K382 HydrophobicContact CE-CB 4.22Å; M281-K382 HydrophobicContact CG-CD 4.36Å; M281-K382 WeakPolarHBondContact O-CD 3.34Å; M281-K382 PolarHBondContact O-NZ 2.76Å; M281-K382 HydrophobicContact SD-CB 4.24Å; M281-L384 HydrophobicContact SD-CD2 3.93Å; M281-V440 HydrophobicContact CG-CG1 4.29Å; M281-V440 HydrophobicContact SD-CG1 4.08Å
282	D	90.9	Very high	91.3	Very high	18 Å²	18	40.2 Å²	40.2	10%	0.096	20%	0.195	C	C	.	.			trans	-73.2	161.5	172.4	-70.2	-15.4	0	0	0	111.4	W284 R444 L445	D282-W284 PolarHBondContact O-N 2.96Å; D282-W284 PolarHBondContact O-NE1 3.33Å; D282-R444 IonicContact OD1-CZ 2.76Å; D282-R444 IonicContact OD1-NH1 2.73Å; D282-R444 PolarHBondContact OD1-NH1 3.48Å; D282-R444 VanDerWaalsContact OD2-CA 3.3Å; D282-R444 WeakPolarHBondContact OD2-CA 3.26Å; D282-R444 WeakPolarHBondContact OD2-CD 3.43Å; D282-L445 HydrophobicContact CB-CD1 3.48Å; D282-L445 VanDerWaalsContact CB-CD1 3.48Å; D282-L445 PolarHBondContact OD2-N 2.81Å
283	G	90.5	Very high	91.1	Very high	16 Å²	16	46.4 Å²	46.4	17%	0.165	22%	0.218	C	C	.	.	S	Bend	trans	-76.1	113.8	-176	0	0	0	0	0	113.6	D359 S453 R457	G283-D359 VanDerWaalsContact CA-CG 3.45Å; G283-D359 WeakPolarHBondContact CA-OD2 3.44Å; G283-S453 VanDerWaalsContact O-CB 3.27Å; G283-S453 WeakPolarHBondContact O-CB 3.45Å; G283-S453 PolarHBondContact O-OG 3.33Å; G283-R457 PolarHBondContact O-NH2 3.11Å
284	W	93.7	Very high	90.9	Very high	2 Å²	2	44.5 Å²	44.5	1%	0.008	21%	0.21	C	C	.	.			trans	-164.5	153.4	170.7	48.2	-83.7	0	0	0	110.6	D282 L286 V332 I336 F357 D359 V440 F443 L445 R457	D282-W284 PolarHBondContact O-N 2.96Å; D282-W284 PolarHBondContact O-NE1 3.33Å; W284-L286 HydrophobicContact CE3-CB 3.81Å; W284-L286 HydrophobicContact CZ3-CB 3.62Å; W284-L286 HydrophobicContact CZ3-CD2 3.97Å; W284-L286 HydrophobicContact CZ3-CG 4.47Å; W284-V332 HydrophobicContact CB-CG2 4Å; W284-V332 HydrophobicContact CD2-CG1 3.76Å; W284-V332 HydrophobicContact CD2-CG2 4.09Å; W284-V332 HydrophobicContact CE3-CG1 3.62Å; W284-V332 HydrophobicContact CE3-CG2 4.49Å; W284-V332 HydrophobicContact CG-CG1 4.42Å; W284-V332 HydrophobicContact CG-CG2 3.88Å; W284-V332 HydrophobicContact CH2-CG1 4.04Å; W284-V332 HydrophobicContact CZ2-CG1 4.18Å; W284-V332 HydrophobicContact CZ3-CG1 3.75Å; W284-I336 HydrophobicContact CH2-CD1 4.47Å; W284-I336 HydrophobicContact CH2-CG1 4.3Å; W284-F357 HydrophobicContact CE3-CB 4.41Å; W284-F357 HydrophobicContact CH2-CB 3.92Å; W284-F357 AromaticContact CH2-CD2 3.98Å; W284-F357 HydrophobicContact CH2-CD2 3.98Å; W284-F357 HydrophobicContact CH2-CG 4.25Å; W284-F357 HydrophobicContact CZ3-CB 3.49Å; W284-F357 VanDerWaalsContact CZ3-CB 3.49Å; W284-F357 AromaticContact CZ3-CD2 3.86Å; W284-F357 HydrophobicContact CZ3-CD2 3.86Å; W284-F357 HydrophobicContact CZ3-CG 4.11Å; W284-D359 PolarHBondContact N-OD1 3.39Å; W284-D359 PolarHBondContact O-N 2.65Å; W284-V440 HydrophobicContact CH2-CG1 4.31Å; W284-V440 HydrophobicContact CH2-CG2 4.1Å; W284-V440 HydrophobicContact CZ2-CG1 3.93Å; W284-V440 HydrophobicContact CZ2-CG2 4.35Å; W284-F443 HydrophobicContact CZ2-CD1 4.5Å; W284-L445 HydrophobicContact CG-CD1 4.09Å; W284-R457 VanDerWaalsContact N-NH2 3.16Å
285	V	94	Very high	90.6	Very high	2 Å²	2	48.5 Å²	48.5	1%	0.012	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	131.6	176.2	-173.7	0	0	0	0	110.5	L304 Y307 E328 F356 F357 D359	V285-L304 HydrophobicContact CG1-CD2 3.68Å; V285-L304 HydrophobicContact CG1-CG 4.41Å; V285-Y307 HydrophobicContact CG2-CD2 3.96Å; V285-Y307 HydrophobicContact CG2-CG 4.14Å; V285-E328 PolarHBondContact O-N 3.02Å; V285-F356 HydrophobicContact CG1-CE2 4.22Å; V285-F357 WeakPolarHBondContact CA-O 3.35Å; V285-D359 WeakPolarHBondContact CG2-OD1 3.46Å
286	L	93.8	Very high	90.5	Very high	1 Å²	1	48.2 Å²	48.2	1%	0.005	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	131.9	-177.2	-168.5	68.1	0	0	0	110.4	W284 L325 L326 C327 V332 V333 F337 F357	W284-L286 HydrophobicContact CE3-CB 3.81Å; W284-L286 HydrophobicContact CZ3-CB 3.62Å; W284-L286 HydrophobicContact CZ3-CD2 3.97Å; W284-L286 HydrophobicContact CZ3-CG 4.47Å; L286-L325 HydrophobicContact CD1-CD1 3.54Å; L286-L325 HydrophobicContact CG-CD1 4.23Å; L286-L326 CarbonylContact C-O 3.51Å; L286-L326 WeakPolarHBondContact CA-O 3.19Å; L286-C327 HydrophobicContact CD1-CB 3.46Å; L286-C327 VanDerWaalsContact CD1-CB 3.46Å; L286-V332 HydrophobicContact CD2-CG1 4.05Å; L286-V333 HydrophobicContact CD1-CG2 4.17Å; L286-F337 HydrophobicContact CD2-CD2 4.43Å; L286-F337 HydrophobicContact CD2-CE2 3.56Å; L286-F337 HydrophobicContact CD2-CZ 4.16Å; L286-F337 HydrophobicContact CG-CE2 4.22Å; L286-F357 HydrophobicContact CB-CB 4.35Å; L286-F357 HydrophobicContact CB-CD2 4.3Å; L286-F357 HydrophobicContact CD2-CD2 3.91Å; L286-F357 HydrophobicContact CD2-CE2 4.39Å; L286-F357 PolarHBondContact N-O 3.2Å; L286-F357 PolarHBondContact O-N 2.96Å; L286-F357 VanDerWaalsContact O-O 3.09Å
287	A	94.2	Very high	90.5	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	138.2	168.8	0	0	0	0	0	111.4	L294 L297 L304 L325 L326 L355 F356	A287-L294 HydrophobicContact CB-CD1 3.54Å; A287-L297 HydrophobicContact CB-CD2 4.29Å; A287-L304 HydrophobicContact CB-CD1 4.14Å; A287-L304 HydrophobicContact CB-CD2 3.68Å; A287-L325 CarbonylContact O-C 3.59Å; A287-L325 WeakPolarHBondContact O-CA 3.18Å; A287-L326 HydrophobicContact CB-CB 4.37Å; A287-L326 PolarHBondContact N-O 3.03Å; A287-L326 PolarHBondContact O-N 3.41Å; A287-L355 CarbonylContact C-O 3.6Å; A287-L355 VanDerWaalsContact CA-O 3.26Å; A287-L355 WeakPolarHBondContact CA-O 3.44Å; A287-F356 HydrophobicContact CB-CB 4.44Å; A287-F356 HydrophobicContact CB-CD2 3.94Å
288	V	93.7	Very high	90.5	Very high	3 Å²	3	45.7 Å²	45.7	2%	0.018	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	135.8	175.2	174.5	0	0	0	0	109.1	L319 F323 M324 L325 F337 Y354 L355	V288-L319 HydrophobicContact CG1-CD1 4.19Å; V288-L319 HydrophobicContact CG2-CD1 4.32Å; V288-F323 HydrophobicContact CG1-CB 4.15Å; V288-F323 HydrophobicContact CG1-CD2 4.37Å; V288-F323 HydrophobicContact CG1-CG 4.34Å; V288-M324 WeakPolarHBondContact CA-O 3.38Å; V288-L325 HydrophobicContact CG2-CB 4.32Å; V288-L325 HydrophobicContact CG2-CD1 3.22Å; V288-L325 HydrophobicContact CG2-CG 4.36Å; V288-F337 HydrophobicContact CB-CZ 4.04Å; V288-F337 HydrophobicContact CG2-CE1 4.17Å; V288-F337 HydrophobicContact CG2-CE2 3.53Å; V288-F337 HydrophobicContact CG2-CZ 3.29Å; V288-Y354 CarbonylContact O-C 3.56Å; V288-Y354 WeakPolarHBondContact O-CA 3.19Å; V288-Y354 WeakPolarHBondContact O-CB 3.13Å; V288-L355 PolarHBondContact N-O 3.07Å; V288-L355 PolarHBondContact O-N 3.5Å
289	G	93	Very high	90.6	Very high	1 Å²	1	48.6 Å²	48.6	1%	0.01	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	171.7	-174.5	173	0	0	0	0	0	112.4	K291 F323 M324	G289-K291 PolarHBondContact O-N 2.8Å; G289-F323 VanDerWaalsContact C-CD1 3.43Å; G289-F323 WeakPolarHBondContact O-CA 3.46Å; G289-M324 PolarHBondContact N-O 3.12Å; G289-M324 VanDerWaalsContact N-O 3.11Å; G289-M324 PolarHBondContact O-N 3.45Å
290	R	90.8	Very high	90.7	Very high	71 Å²	71	48.5 Å²	48.5	27%	0.268	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.6	137	-179.9	-63.5	-171.4	180	124.8	6.5	110.4	R292 R293 L294 F323 E349 E350 E353	R290-R292 VanDerWaalsContact C-N 3.29Å; R290-R292 PolarHBondContact O-N 2.99Å; R290-R293 PolarHBondContact O-N 3.05Å; R290-L294 WeakPolarHBondContact O-CB 3.47Å; R290-L294 PolarHBondContact O-N 3.3Å; R290-F323 HydrophobicContact CG-CD1 3.98Å; R290-F323 HydrophobicContact CG-CE1 3.79Å; R290-E349 PolarHBondContact NH2-O 2.87Å; R290-E350 PolarHBondContact NH2-O 2.67Å; R290-E350 VanDerWaalsContact NH2-O 3.13Å; R290-E353 PolarHBondContact N-O 3.35Å
291	K	88.3	Confident	90.9	Very high	115 Å²	115	47.4 Å²	47.4	50%	0.5	22%	0.216	S	C	.	.	H	α-helix	trans	-44	-48.3	-175.9	-175.3	176.9	-179.8	178.7	0	114.4	G289 Q295 M324	G289-K291 PolarHBondContact O-N 2.8Å; K291-Q295 WeakPolarHBondContact O-CB 3.31Å; K291-Q295 VanDerWaalsContact O-CG 3.28Å; K291-Q295 WeakPolarHBondContact O-CG 3.47Å; K291-Q295 PolarHBondContact O-N 2.81Å; K291-M324 HydrophobicContact CB-CG 3.8Å; K291-M324 HydrophobicContact CG-CG 4.11Å
292	R	89.1	Confident	90.9	Very high	221 Å²	221	51.7 Å²	51.7	83%	0.834	24%	0.236	S	C	*	.	H	α-helix	trans	-65.5	-40.2	-178.6	-70.9	-176.3	-179.7	167.3	0.3	112.8	R290 A296	R290-R292 VanDerWaalsContact C-N 3.29Å; R290-R292 PolarHBondContact O-N 2.99Å; R292-A296 PolarHBondContact O-N 3.2Å
293	R	89.8	Confident	90.8	Very high	130 Å²	130	51.2 Å²	51.2	49%	0.491	23%	0.233	S	C	.	.	H	α-helix	trans	-76.1	-38.9	-179.4	-64.3	-62.9	-79.1	173.5	-13.4	110.9	R290 Q295 A296 L297 E353	R290-R293 PolarHBondContact O-N 3.05Å; R293-Q295 VanDerWaalsContact C-N 3.32Å; R293-Q295 PolarHBondContact O-N 3.21Å; R293-A296 WeakPolarHBondContact O-CB 3.07Å; R293-A296 PolarHBondContact O-N 3.45Å; R293-A296 VanDerWaalsContact O-N 3.15Å; R293-L297 WeakPolarHBondContact O-CB 3.44Å; R293-L297 PolarHBondContact O-N 2.65Å; R293-E353 HydrophobicContact CG-CG 4.36Å; R293-E353 IonicContact CZ-OE1 3.07Å; R293-E353 IonicContact NE-OE1 3.81Å; R293-E353 PolarHBondContact NE-OE1 3.1Å; R293-E353 IonicContact NH2-OE1 2.81Å; R293-E353 PolarHBondContact NH2-OE1 3.1Å
294	L	91	Very high	90.9	Very high	5 Å²	5	50.5 Å²	50.5	3%	0.026	23%	0.225	C	C	.	.	H	α-helix	trans	-62.8	-37.8	176.2	-164.8	63.4	0	0	0	112.6	A287 R290 L297 A298 M324 L326	A287-L294 HydrophobicContact CB-CD1 3.54Å; R290-L294 WeakPolarHBondContact O-CB 3.47Å; R290-L294 PolarHBondContact O-N 3.3Å; L294-L297 HydrophobicContact CD1-CD2 4.41Å; L294-L297 PolarHBondContact O-N 3.08Å; L294-A298 WeakPolarHBondContact O-CB 3.06Å; L294-A298 PolarHBondContact O-N 2.79Å; L294-M324 VanDerWaalsContact CD2-C 3.49Å; L294-M324 HydrophobicContact CD2-CB 3.62Å; L294-M324 WeakPolarHBondContact CD2-O 3.39Å; L294-L326 HydrophobicContact CD1-CD1 3.82Å; L294-L326 HydrophobicContact CD1-CG 4.13Å; L294-L326 HydrophobicContact CD2-CD1 4.15Å; L294-L326 HydrophobicContact CD2-CG 3.76Å; L294-L326 HydrophobicContact CG-CD1 3.61Å; L294-L326 HydrophobicContact CG-CG 3.81Å
295	Q	89.9	Confident	90.6	Very high	84 Å²	84	52 Å²	52	39%	0.393	24%	0.238	S	C	.	.	H	α-helix	trans	-68.7	-33.1	173.9	-75.4	179.6	-9	0	0	113.6	K291 R293 K299	K291-Q295 WeakPolarHBondContact O-CB 3.31Å; K291-Q295 VanDerWaalsContact O-CG 3.28Å; K291-Q295 WeakPolarHBondContact O-CG 3.47Å; K291-Q295 PolarHBondContact O-N 2.81Å; R293-Q295 VanDerWaalsContact C-N 3.32Å; R293-Q295 PolarHBondContact O-N 3.21Å; Q295-K299 WeakPolarHBondContact O-CG 3.43Å
296	A	90.7	Very high	90.3	Very high	32 Å²	32	55.5 Å²	55.5	26%	0.264	26%	0.259	S	S	.	.	H	α-helix	trans	-69.4	-46.7	171.7	0	0	0	0	0	110.2	R292 R293 A298 K299 D300	R292-A296 PolarHBondContact O-N 3.2Å; R293-A296 WeakPolarHBondContact O-CB 3.07Å; R293-A296 PolarHBondContact O-N 3.45Å; R293-A296 VanDerWaalsContact O-N 3.15Å; A296-A298 VanDerWaalsContact C-N 3.29Å; A296-A298 PolarHBondContact O-N 2.8Å; A296-K299 WeakPolarHBondContact O-CA 3.25Å; A296-K299 WeakPolarHBondContact O-CB 3.18Å; A296-K299 PolarHBondContact O-N 3.48Å; A296-D300 VanDerWaalsContact O-CG 3.23Å; A296-D300 PolarHBondContact O-N 2.97Å
297	L	90.9	Very high	90.2	Very high	8 Å²	8	56.9 Å²	56.9	4%	0.042	27%	0.265	C	S	.	.	H	α-helix	trans	-56.5	-41.6	178.3	-163.4	74.3	0	0	0	112.4	A287 R293 L294 K299 D300 H301 L304 Y354 F356	A287-L297 HydrophobicContact CB-CD2 4.29Å; R293-L297 WeakPolarHBondContact O-CB 3.44Å; R293-L297 PolarHBondContact O-N 2.65Å; L294-L297 HydrophobicContact CD1-CD2 4.41Å; L294-L297 PolarHBondContact O-N 3.08Å; L297-K299 PolarHBondContact O-N 3.35Å; L297-D300 PolarHBondContact O-N 3.21Å; L297-H301 WeakPolarHBondContact CD1-CD2 3.33Å; L297-H301 WeakPolarHBondContact CD1-NE2 3.37Å; L297-H301 PolarHBondContact O-N 2.84Å; L297-L304 HydrophobicContact CB-CD1 4.24Å; L297-L304 HydrophobicContact CD2-CD1 3.69Å; L297-L304 HydrophobicContact CG-CD1 3.65Å; L297-Y354 HydrophobicContact CD1-CD2 4.36Å; L297-Y354 HydrophobicContact CD1-CE2 3.89Å; L297-Y354 HydrophobicContact CD2-CD2 3.82Å; L297-Y354 HydrophobicContact CD2-CE2 4.11Å; L297-Y354 HydrophobicContact CD2-CG 4.34Å; L297-F356 HydrophobicContact CD2-CB 3.98Å; L297-F356 HydrophobicContact CD2-CD1 4.33Å; L297-F356 HydrophobicContact CD2-CD2 4.49Å; L297-F356 HydrophobicContact CD2-CG 4.03Å
298	A	90.2	Very high	90	Very high	14 Å²	14	57.1 Å²	57.1	12%	0.116	27%	0.266	C	S	.	.	H	α-helix	trans	-68.6	-13.2	176.6	0	0	0	0	0	114.7	L294 A296 L304 A305 L326	L294-A298 WeakPolarHBondContact O-CB 3.06Å; L294-A298 PolarHBondContact O-N 2.79Å; A296-A298 VanDerWaalsContact C-N 3.29Å; A296-A298 PolarHBondContact O-N 2.8Å; A298-L304 HydrophobicContact CB-CB 4.28Å; A298-A305 WeakPolarHBondContact O-CB 3.35Å; A298-L326 HydrophobicContact CB-CD1 3.95Å
299	K	88.5	Confident	89.4	Confident	167 Å²	167	62 Å²	62	73%	0.726	30%	0.298	S	S	*	.	H	α-helix	trans	-95	-36.9	171.4	-66.5	177	-178.6	-176	0	111.5	Q295 A296 L297	Q295-K299 WeakPolarHBondContact O-CG 3.43Å; A296-K299 WeakPolarHBondContact O-CA 3.25Å; A296-K299 WeakPolarHBondContact O-CB 3.18Å; A296-K299 PolarHBondContact O-N 3.48Å; L297-K299 PolarHBondContact O-N 3.35Å
300	D	88.6	Confident	88.8	Confident	87 Å²	87	64.6 Å²	64.6	47%	0.465	31%	0.311	S	S	.	.	H	α-helix	trans	-73.7	-32.5	-176.3	-62.3	-13.7	0	0	0	111.8	A296 L297 K365	A296-D300 VanDerWaalsContact O-CG 3.23Å; A296-D300 PolarHBondContact O-N 2.97Å; L297-D300 PolarHBondContact O-N 3.21Å; D300-K365 WeakPolarHBondContact O-CB 3.5Å; D300-K365 PolarHBondContact O-N 3.29Å
301	H	89	Confident	88.1	Confident	17 Å²	17	67.4 Å²	67.4	8%	0.079	33%	0.325	C	S	.	.			trans	-111.3	127.5	179.3	-60.3	-81.1	0	0	0	112.7	L297 D303 A305 F356 Y361 G363	L297-H301 WeakPolarHBondContact CD1-CD2 3.33Å; L297-H301 WeakPolarHBondContact CD1-NE2 3.37Å; L297-H301 PolarHBondContact O-N 2.84Å; H301-D303 VanDerWaalsContact C-N 3.35Å; H301-D303 WeakPolarHBondContact CB-OD1 3.46Å; H301-D303 PolarHBondContact O-N 3.37Å; H301-A305 PolarHBondContact O-N 2.87Å; H301-F356 HydrophobicContact CB-CE1 4.43Å; H301-F356 HydrophobicContact CB-CZ 4.28Å; H301-F356 AromaticContact CG-CE1 3.95Å; H301-Y361 AromaticContact CE1-CE2 3.66Å; H301-Y361 AromaticContact ND1-CE2 3.67Å; H301-G363 PolarHBondContact ND1-O 3.05Å
302	Q	87.5	Confident	87.4	Confident	92 Å²	92	71.9 Å²	71.9	43%	0.43	34%	0.339	S	S	.	.	H	α-helix	trans	-68.6	-32.6	-176.8	179.3	175	-12.5	0	0	112.8	A305 V306	Q302-A305 PolarHBondContact O-N 3.45Å; Q302-V306 HydrophobicContact CG-CG2 3.92Å; Q302-V306 WeakPolarHBondContact O-CB 3.5Å; Q302-V306 WeakPolarHBondContact O-CG2 3.46Å; Q302-V306 PolarHBondContact O-N 2.71Å
303	D	90.7	Very high	86.9	Confident	7 Å²	7	61.8 Å²	61.8	4%	0.037	30%	0.304	C	S	.	.	H	α-helix	trans	-61.2	-50.3	179.1	49.2	10.6	0	0	0	112.1	H301 A305 V306 Y307 F356 S358 Q360	H301-D303 VanDerWaalsContact C-N 3.35Å; H301-D303 WeakPolarHBondContact CB-OD1 3.46Å; H301-D303 PolarHBondContact O-N 3.37Å; D303-A305 VanDerWaalsContact C-N 3.26Å; D303-A305 PolarHBondContact O-N 2.86Å; D303-V306 PolarHBondContact O-N 2.76Å; D303-Y307 HydrophobicContact CB-CD2 4.12Å; D303-Y307 HydrophobicContact CB-CE2 4.4Å; D303-Y307 WeakPolarHBondContact O-CB 3.25Å; D303-Y307 VanDerWaalsContact O-CD2 3.22Å; D303-Y307 WeakPolarHBondContact O-CD2 3.46Å; D303-Y307 PolarHBondContact O-N 2.83Å; D303-F356 WeakPolarHBondContact OD1-CZ 3.46Å; D303-F356 VanDerWaalsContact OD2-CZ 3.28Å; D303-F356 WeakPolarHBondContact OD2-CZ 3.46Å; D303-S358 WeakPolarHBondContact OD2-CB 3.5Å; D303-S358 PolarHBondContact OD2-OG 3.24Å; D303-Q360 HydrophobicContact CB-CB 4.38Å
304	L	91.2	Very high	86.5	Confident	2 Å²	2	59.6 Å²	59.6	1%	0.01	30%	0.3	C	S	.	.	H	α-helix	trans	-60.7	-37.6	174.2	-70.3	173.5	0	0	0	111.7	V285 A287 L297 A298 V306 C308 L326 F356	V285-L304 HydrophobicContact CG1-CD2 3.68Å; V285-L304 HydrophobicContact CG1-CG 4.41Å; A287-L304 HydrophobicContact CB-CD1 4.14Å; A287-L304 HydrophobicContact CB-CD2 3.68Å; L297-L304 HydrophobicContact CB-CD1 4.24Å; L297-L304 HydrophobicContact CD2-CD1 3.69Å; L297-L304 HydrophobicContact CG-CD1 3.65Å; A298-L304 HydrophobicContact CB-CB 4.28Å; L304-V306 VanDerWaalsContact C-N 3.32Å; L304-V306 PolarHBondContact O-N 2.84Å; L304-C308 WeakPolarHBondContact O-CB 2.98Å; L304-C308 PolarHBondContact O-N 3.31Å; L304-L326 HydrophobicContact CD2-CD1 4.44Å; L304-F356 HydrophobicContact CD1-CD2 3.99Å; L304-F356 HydrophobicContact CD1-CE2 3.69Å; L304-F356 HydrophobicContact CD1-CZ 4.05Å; L304-F356 HydrophobicContact CD2-CD2 4.06Å; L304-F356 HydrophobicContact CD2-CE2 3.67Å; L304-F356 HydrophobicContact CG-CD2 4.16Å; L304-F356 HydrophobicContact CG-CE2 3.49Å; L304-F356 VanDerWaalsContact CG-CE2 3.49Å; L304-F356 HydrophobicContact CG-CZ 3.99Å
305	A	87.7	Confident	86	Confident	32 Å²	32	68 Å²	68	26%	0.264	33%	0.331	S	S	.	.	H	α-helix	trans	-68.4	-30	-179.6	0	0	0	0	0	113.7	A298 H301 Q302 D303 K311	A298-A305 WeakPolarHBondContact O-CB 3.35Å; H301-A305 PolarHBondContact O-N 2.87Å; Q302-A305 PolarHBondContact O-N 3.45Å; D303-A305 VanDerWaalsContact C-N 3.26Å; D303-A305 PolarHBondContact O-N 2.86Å; A305-K311 PolarHBondContact O-NZ 2.96Å
306	V	88.7	Confident	85.4	Confident	77 Å²	77	66.6 Å²	66.6	47%	0.467	32%	0.324	S	S	.	.	H	α-helix	trans	-96.1	-46.4	-174.3	171.9	0	0	0	0	112	Q302 D303 L304 A460	Q302-V306 HydrophobicContact CG-CG2 3.92Å; Q302-V306 WeakPolarHBondContact O-CB 3.5Å; Q302-V306 WeakPolarHBondContact O-CG2 3.46Å; Q302-V306 PolarHBondContact O-N 2.71Å; D303-V306 PolarHBondContact O-N 2.76Å; L304-V306 VanDerWaalsContact C-N 3.32Å; L304-V306 PolarHBondContact O-N 2.84Å; V306-A460 HydrophobicContact CG1-CB 3.87Å
307	Y	91.3	Very high	84.7	Confident	30 Å²	30	70.8 Å²	70.8	12%	0.118	35%	0.352	C	S	.	.	H	α-helix	trans	-89.8	-30.4	-171	-64.6	-72.9	0	0	0	113.5	V285 D303 P309 Q360 R457 A460	V285-Y307 HydrophobicContact CG2-CD2 3.96Å; V285-Y307 HydrophobicContact CG2-CG 4.14Å; D303-Y307 HydrophobicContact CB-CD2 4.12Å; D303-Y307 HydrophobicContact CB-CE2 4.4Å; D303-Y307 WeakPolarHBondContact O-CB 3.25Å; D303-Y307 VanDerWaalsContact O-CD2 3.22Å; D303-Y307 WeakPolarHBondContact O-CD2 3.46Å; D303-Y307 PolarHBondContact O-N 2.83Å; Y307-P309 VanDerWaalsContact O-CD 3.29Å; Y307-P309 WeakPolarHBondContact O-CD 3.29Å; Y307-Q360 HydrophobicContact CD2-CB 4.46Å; Y307-Q360 HydrophobicContact CE2-CB 3.68Å; Y307-Q360 HydrophobicContact CE2-CG 3.7Å; Y307-R457 HydrophobicContact CE1-CG 3.99Å; Y307-A460 HydrophobicContact CE1-CB 3.88Å
308	C	89.5	Confident	84	Confident	4 Å²	4	77.4 Å²	77.4	3%	0.027	38%	0.377	C	S	.	.			trans	-83.9	115.1	179.5	-60.9	0	0	0	0	110.7	L304 D310 L326	L304-C308 WeakPolarHBondContact O-CB 2.98Å; L304-C308 PolarHBondContact O-N 3.31Å; C308-D310 PolarHBondContact O-N 3.34Å; C308-L326 HydrophobicContact CB-CB 4.3Å
309	P	80.4	Confident	83.7	Confident	105 Å²	105	77.4 Å²	77.4	68%	0.682	38%	0.375	S	S	*	.	S	Bend	trans	-70.4	-32.7	-177.6	28	-34.5	0	0	0	112.5	Y307	Y307-P309 VanDerWaalsContact O-CD 3.29Å; Y307-P309 WeakPolarHBondContact O-CD 3.29Å
310	D	81.6	Confident	83.5	Confident	56 Å²	56	69.8 Å²	69.8	30%	0.299	34%	0.343	S	S	.	.			trans	-102	96	-177.4	-174.1	1	0	0	0	111.5	C308 R312 G313 L326	C308-D310 PolarHBondContact O-N 3.34Å; D310-R312 PolarHBondContact O-N 3.06Å; D310-R312 WeakPolarHBondContact OD1-CA 3.4Å; D310-R312 WeakPolarHBondContact OD1-CB 3.26Å; D310-R312 PolarHBondContact OD1-N 3.17Å; D310-G313 PolarHBondContact O-N 3.33Å; D310-G313 PolarHBondContact OD1-N 3.35Å; D310-L326 WeakPolarHBondContact O-CD2 3.4Å
311	K	75.8	Confident	83.2	Confident	130 Å²	130	73.7 Å²	73.7	57%	0.565	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-13.9	177.3	-55.5	-168.1	179.8	-155.3	0	113.5	A305 G313	A305-K311 PolarHBondContact O-NZ 2.96Å; K311-G313 VanDerWaalsContact C-N 3.34Å
312	R	73.9	Confident	83.1	Confident	209 Å²	209	74.8 Å²	74.8	79%	0.789	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	-19.4	177.8	-65.3	-178.2	171.2	179.2	-1.6	111.7	D310 M324	D310-R312 PolarHBondContact O-N 3.06Å; D310-R312 WeakPolarHBondContact OD1-CA 3.4Å; D310-R312 WeakPolarHBondContact OD1-CB 3.26Å; D310-R312 PolarHBondContact OD1-N 3.17Å; R312-M324 WeakPolarHBondContact O-CE 3.37Å
313	G	77.5	Confident	83.2	Confident	10 Å²	10	70.7 Å²	70.7	10%	0.103	35%	0.349	C	S	.	.			trans	83.4	146.8	-177.8	0	0	0	0	0	112.3	D310 K311 M324 L325	D310-G313 PolarHBondContact O-N 3.33Å; D310-G313 PolarHBondContact OD1-N 3.35Å; K311-G313 VanDerWaalsContact C-N 3.34Å; G313-M324 WeakPolarHBondContact O-CE 3.34Å; G313-L325 CarbonylContact C-O 3.54Å; G313-L325 VanDerWaalsContact CA-O 3.29Å; G313-L325 WeakPolarHBondContact CA-O 3.23Å
314	Q	82.1	Confident	83.2	Confident	84 Å²	84	71 Å²	71	39%	0.393	35%	0.35	S	S	.	.	B	Isolated β-bridge	trans	-93.5	149.5	173.9	-62.6	-178.8	-2.6	0	0	109.8	L325	Q314-L325 PolarHBondContact N-O 3.49Å; Q314-L325 WeakPolarHBondContact O-CB 3.5Å; Q314-L325 PolarHBondContact O-N 2.86Å
315	R	80	Confident	83.3	Confident	182 Å²	182	71 Å²	71	69%	0.687	35%	0.35	S	S	*	.			trans	-97.1	136.9	168.8	-70.1	-174.6	170.6	-145.5	-8	108.6	M324	R315-M324 HydrophobicContact CG-CE 4.08Å; R315-M324 HydrophobicContact CG-SD 3.82Å
316	H	78.4	Confident	83.5	Confident	53 Å²	53	69.8 Å²	69.8	25%	0.245	34%	0.339	C	S	.	.			trans	-115.7	132.9	175.5	-166.7	-101.1	0	0	0	108.7	Y318 L319 L325	H316-Y318 AromaticContact CE1-CD2 3.59Å; H316-Y318 AromaticContact ND1-CD2 3.87Å; H316-Y318 PolarHBondContact O-N 3.17Å; H316-L319 HydrophobicContact CB-CB 4.49Å; H316-L319 HydrophobicContact CB-CD1 3.93Å; H316-L319 HydrophobicContact CB-CG 4.17Å; H316-L319 PolarHBondContact O-N 3.33Å; H316-L319 VanDerWaalsContact O-N 3.07Å; H316-L325 HydrophobicContact CB-CD2 4.41Å
317	S	75.5	Confident	83.7	Confident	121 Å²	121	66.5 Å²	66.5	85%	0.846	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-18.3	-169.6	-50.1	0	0	0	0	115.1
318	Y	76.7	Confident	83.7	Confident	146 Å²	146	65.5 Å²	65.5	57%	0.573	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.4	-7.9	-177.8	-58.9	-75.2	0	0	0	114.2	H316 C342	H316-Y318 AromaticContact CE1-CD2 3.59Å; H316-Y318 AromaticContact ND1-CD2 3.87Å; H316-Y318 PolarHBondContact O-N 3.17Å; Y318-C342 WeakPolarHBondContact O-CB 3.32Å
319	L	83.7	Confident	83.8	Confident	15 Å²	15	65.5 Å²	65.5	8%	0.079	32%	0.316	C	S	.	.	S	Bend	trans	-88.2	151.1	177.2	-71.3	175.5	0	0	0	110.5	V288 H316 L325 F337 L345	V288-L319 HydrophobicContact CG1-CD1 4.19Å; V288-L319 HydrophobicContact CG2-CD1 4.32Å; H316-L319 HydrophobicContact CB-CB 4.49Å; H316-L319 HydrophobicContact CB-CD1 3.93Å; H316-L319 HydrophobicContact CB-CG 4.17Å; H316-L319 PolarHBondContact O-N 3.33Å; H316-L319 VanDerWaalsContact O-N 3.07Å; L319-L325 HydrophobicContact CD1-CB 4.4Å; L319-F337 HydrophobicContact CD2-CD1 4.23Å; L319-L345 HydrophobicContact CD2-CD1 3.5Å
320	P	83.4	Confident	84.2	Confident	6 Å²	6	64.1 Å²	64.1	4%	0.039	31%	0.307	C	S	.	.			trans	-52	143.9	173	-17.6	19.9	0	0	0	112	S322 F323 N346 E349	P320-S322 PolarHBondContact O-N 2.89Å; P320-F323 HydrophobicContact CB-CD2 4.07Å; P320-F323 HydrophobicContact CG-CD2 3.5Å; P320-F323 HydrophobicContact CG-CE2 3.81Å; P320-F323 HydrophobicContact CG-CG 4.38Å; P320-F323 PolarHBondContact O-N 3.17Å; P320-N346 WeakPolarHBondContact CA-OD1 3.31Å; P320-N346 WeakPolarHBondContact CD-OD1 3.38Å; P320-N346 WeakPolarHBondContact CG-OD1 3.38Å; P320-E349 HydrophobicContact CB-CG 3.97Å; P320-E349 HydrophobicContact CG-CG 4.15Å
321	E	82.8	Confident	84.7	Confident	169 Å²	169	64.8 Å²	64.8	79%	0.79	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-22.2	-177.4	-65.5	-169.7	172.6	0	0	113.9
322	S	86.3	Confident	85.5	Confident	40 Å²	40	58.6 Å²	58.6	28%	0.28	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-21.9	177.7	77.3	0	0	0	0	113.3	P320 E349	P320-S322 PolarHBondContact O-N 2.89Å; S322-E349 WeakPolarHBondContact CB-OE1 3.4Å; S322-E349 PolarHBondContact OG-OE1 2.87Å
323	F	90.3	Very high	86.3	Confident	6 Å²	6	48.9 Å²	48.9	3%	0.026	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	140.7	-178.8	-69	-26.2	0	0	0	111.6	V288 G289 R290 P320 E349 I352	V288-F323 HydrophobicContact CG1-CB 4.15Å; V288-F323 HydrophobicContact CG1-CD2 4.37Å; V288-F323 HydrophobicContact CG1-CG 4.34Å; G289-F323 VanDerWaalsContact C-CD1 3.43Å; G289-F323 WeakPolarHBondContact O-CA 3.46Å; R290-F323 HydrophobicContact CG-CD1 3.98Å; R290-F323 HydrophobicContact CG-CE1 3.79Å; P320-F323 HydrophobicContact CB-CD2 4.07Å; P320-F323 HydrophobicContact CG-CD2 3.5Å; P320-F323 HydrophobicContact CG-CE2 3.81Å; P320-F323 HydrophobicContact CG-CG 4.38Å; P320-F323 PolarHBondContact O-N 3.17Å; F323-E349 HydrophobicContact CE2-CG 4.14Å; F323-E349 HydrophobicContact CZ-CG 3.99Å; F323-I352 HydrophobicContact CZ-CB 4.23Å; F323-I352 HydrophobicContact CZ-CG2 4.31Å
324	M	90.8	Very high	86.9	Confident	15 Å²	15	51.9 Å²	51.9	7%	0.074	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	153.4	171.8	-64.5	-65.5	-57.8	0	0	108.1	V288 G289 K291 L294 R312 G313 R315	V288-M324 WeakPolarHBondContact CA-O 3.38Å; G289-M324 PolarHBondContact N-O 3.12Å; G289-M324 VanDerWaalsContact N-O 3.11Å; G289-M324 PolarHBondContact O-N 3.45Å; K291-M324 HydrophobicContact CB-CG 3.8Å; K291-M324 HydrophobicContact CG-CG 4.11Å; L294-M324 VanDerWaalsContact CD2-C 3.49Å; L294-M324 HydrophobicContact CD2-CB 3.62Å; L294-M324 WeakPolarHBondContact CD2-O 3.39Å; R312-M324 WeakPolarHBondContact O-CE 3.37Å; G313-M324 WeakPolarHBondContact O-CE 3.34Å; R315-M324 HydrophobicContact CG-CE 4.08Å; R315-M324 HydrophobicContact CG-SD 3.82Å
325	L	92.1	Very high	87.3	Confident	2 Å²	2	49 Å²	49	1%	0.01	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	127.1	-177.4	172.2	73.7	0	0	0	109.9	L286 A287 V288 G313 Q314 H316 L319 C327 V333 F337	L286-L325 HydrophobicContact CD1-CD1 3.54Å; L286-L325 HydrophobicContact CG-CD1 4.23Å; A287-L325 CarbonylContact O-C 3.59Å; A287-L325 WeakPolarHBondContact O-CA 3.18Å; V288-L325 HydrophobicContact CG2-CB 4.32Å; V288-L325 HydrophobicContact CG2-CD1 3.22Å; V288-L325 HydrophobicContact CG2-CG 4.36Å; G313-L325 CarbonylContact C-O 3.54Å; G313-L325 VanDerWaalsContact CA-O 3.29Å; G313-L325 WeakPolarHBondContact CA-O 3.23Å; Q314-L325 PolarHBondContact N-O 3.49Å; Q314-L325 WeakPolarHBondContact O-CB 3.5Å; Q314-L325 PolarHBondContact O-N 2.86Å; H316-L325 HydrophobicContact CB-CD2 4.41Å; L319-L325 HydrophobicContact CD1-CB 4.4Å; L325-C327 HydrophobicContact CG-CB 4.43Å; L325-V333 HydrophobicContact CD1-CG2 4.45Å; L325-V333 HydrophobicContact CD2-CB 4.24Å; L325-V333 HydrophobicContact CD2-CG1 3.49Å; L325-V333 VanDerWaalsContact CD2-CG1 3.49Å; L325-V333 HydrophobicContact CD2-CG2 3.67Å; L325-F337 HydrophobicContact CD1-CE2 4.05Å
326	L	92.5	Very high	87.8	Confident	5 Å²	5	40.4 Å²	40.4	3%	0.026	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	119.5	165.7	-61.2	175.9	0	0	0	107.4	L286 A287 L294 A298 L304 C308 D310	L286-L326 CarbonylContact C-O 3.51Å; L286-L326 WeakPolarHBondContact CA-O 3.19Å; A287-L326 HydrophobicContact CB-CB 4.37Å; A287-L326 PolarHBondContact N-O 3.03Å; A287-L326 PolarHBondContact O-N 3.41Å; L294-L326 HydrophobicContact CD1-CD1 3.82Å; L294-L326 HydrophobicContact CD1-CG 4.13Å; L294-L326 HydrophobicContact CD2-CD1 4.15Å; L294-L326 HydrophobicContact CD2-CG 3.76Å; L294-L326 HydrophobicContact CG-CD1 3.61Å; L294-L326 HydrophobicContact CG-CG 3.81Å; A298-L326 HydrophobicContact CB-CD1 3.95Å; L304-L326 HydrophobicContact CD2-CD1 4.44Å; C308-L326 HydrophobicContact CB-CB 4.3Å; D310-L326 WeakPolarHBondContact O-CD2 3.4Å
327	C	92.1	Very high	88.3	Confident	9 Å²	9	38.2 Å²	38.2	6%	0.061	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	141.2	177.3	65.4	0	0	0	0	110.2	L286 L325 V333	L286-C327 HydrophobicContact CD1-CB 3.46Å; L286-C327 VanDerWaalsContact CD1-CB 3.46Å; L325-C327 HydrophobicContact CG-CB 4.43Å; C327-V333 HydrophobicContact CB-CG2 3.93Å
328	E	92.2	Very high	88.9	Confident	8 Å²	8	34.7 Å²	34.7	4%	0.037	18%	0.182	C	C	.	.	S	Bend	trans	-77.5	-48.8	166.9	-177.7	-166.1	165.7	0	0	110.6	V285 N456 R457	V285-E328 PolarHBondContact O-N 3.02Å; E328-N456 WeakPolarHBondContact OE1-CB 3.22Å; E328-N456 PolarHBondContact OE1-ND2 3.3Å; E328-R457 VanDerWaalsContact CD-NH1 3.28Å; E328-R457 IonicContact OE1-CZ 2.76Å; E328-R457 IonicContact OE1-NH1 3.37Å; E328-R457 PolarHBondContact OE1-NH1 3.44Å; E328-R457 IonicContact OE1-NH2 3.48Å; E328-R457 IonicContact OE2-CZ 3.62Å; E328-R457 IonicContact OE2-NH1 3.3Å; E328-R457 PolarHBondContact OE2-NH1 3.05Å; E328-R457 IonicContact OE2-NH2 3.73Å; E328-R457 PolarHBondContact OE2-NH2 3.38Å
329	I	92	Very high	89.4	Confident	5 Å²	5	31.8 Å²	31.8	3%	0.026	18%	0.181	C	C	.	.			trans	-116.6	116.8	-174.9	-62.1	175.6	0	0	0	108.5	E331 V332 L445 G449	I329-E331 HydrophobicContact CG2-CB 3.78Å; I329-E331 PolarHBondContact O-N 3.15Å; I329-V332 HydrophobicContact CB-CG2 4.05Å; I329-V332 HydrophobicContact CG2-CG2 4.19Å; I329-V332 PolarHBondContact O-N 3.37Å; I329-L445 HydrophobicContact CD1-CD2 3.49Å; I329-L445 VanDerWaalsContact CD1-CD2 3.49Å; I329-L445 HydrophobicContact CG2-CD2 4.36Å; I329-G449 WeakPolarHBondContact CD1-O 3.33Å
330	P	89.6	Confident	89.7	Confident	76 Å²	76	36.3 Å²	36.3	49%	0.494	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-20.9	-176.7	27.1	-34.4	0	0	0	113.2	V332 V333 P334	P330-V332 PolarHBondContact O-N 3.35Å; P330-V333 WeakPolarHBondContact O-CB 3.37Å; P330-V333 PolarHBondContact O-N 3.42Å; P330-P334 WeakPolarHBondContact O-CD 3.18Å
331	E	90.9	Very high	90	Very high	69 Å²	69	36.1 Å²	36.1	32%	0.322	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-32.8	176.1	-172	-171	154.6	0	0	113	I329 V333 P334 S446	I329-E331 HydrophobicContact CG2-CB 3.78Å; I329-E331 PolarHBondContact O-N 3.15Å; E331-V333 VanDerWaalsContact C-N 3.27Å; E331-V333 PolarHBondContact O-N 2.97Å; E331-P334 WeakPolarHBondContact O-CD 3.29Å; E331-P334 WeakPolarHBondContact O-CG 3.3Å; E331-S446 VanDerWaalsContact CD-OG 3.29Å; E331-S446 WeakPolarHBondContact OE1-CB 3.19Å; E331-S446 PolarHBondContact OE1-N 3.24Å; E331-S446 PolarHBondContact OE1-OG 2.86Å; E331-S446 WeakPolarHBondContact OE2-CB 3.1Å; E331-S446 PolarHBondContact OE2-OG 3.43Å
332	V	92.2	Very high	90.3	Very high	1 Å²	1	28.3 Å²	28.3	1%	0.006	17%	0.167	C	C	.	.	H	α-helix	trans	-67.7	-32.1	-177.4	-177	0	0	0	0	111.4	W284 L286 I329 P330 A335 I336 F443	W284-V332 HydrophobicContact CB-CG2 4Å; W284-V332 HydrophobicContact CD2-CG1 3.76Å; W284-V332 HydrophobicContact CD2-CG2 4.09Å; W284-V332 HydrophobicContact CE3-CG1 3.62Å; W284-V332 HydrophobicContact CE3-CG2 4.49Å; W284-V332 HydrophobicContact CG-CG1 4.42Å; W284-V332 HydrophobicContact CG-CG2 3.88Å; W284-V332 HydrophobicContact CH2-CG1 4.04Å; W284-V332 HydrophobicContact CZ2-CG1 4.18Å; W284-V332 HydrophobicContact CZ3-CG1 3.75Å; L286-V332 HydrophobicContact CD2-CG1 4.05Å; I329-V332 HydrophobicContact CB-CG2 4.05Å; I329-V332 HydrophobicContact CG2-CG2 4.19Å; I329-V332 PolarHBondContact O-N 3.37Å; P330-V332 PolarHBondContact O-N 3.35Å; V332-A335 PolarHBondContact O-N 3.09Å; V332-I336 HydrophobicContact CG1-CG1 3.74Å; V332-I336 WeakPolarHBondContact O-CG1 3.44Å; V332-I336 PolarHBondContact O-N 3.07Å; V332-F443 HydrophobicContact CB-CE1 4.35Å; V332-F443 HydrophobicContact CG1-CE1 4.12Å; V332-F443 HydrophobicContact CG2-CE1 4.04Å; V332-F443 HydrophobicContact CG2-CZ 4.41Å
333	V	91.1	Very high	90.5	Very high	5 Å²	5	33.1 Å²	33.1	3%	0.03	18%	0.183	C	C	.	.	H	α-helix	trans	-59.7	-57.9	-172.6	-175.8	0	0	0	0	112	L286 L325 C327 P330 E331 A335 F337	L286-V333 HydrophobicContact CD1-CG2 4.17Å; L325-V333 HydrophobicContact CD1-CG2 4.45Å; L325-V333 HydrophobicContact CD2-CB 4.24Å; L325-V333 HydrophobicContact CD2-CG1 3.49Å; L325-V333 VanDerWaalsContact CD2-CG1 3.49Å; L325-V333 HydrophobicContact CD2-CG2 3.67Å; C327-V333 HydrophobicContact CB-CG2 3.93Å; P330-V333 WeakPolarHBondContact O-CB 3.37Å; P330-V333 PolarHBondContact O-N 3.42Å; E331-V333 VanDerWaalsContact C-N 3.27Å; E331-V333 PolarHBondContact O-N 2.97Å; V333-A335 PolarHBondContact O-N 3.21Å; V333-F337 HydrophobicContact CG1-CD2 4.09Å; V333-F337 WeakPolarHBondContact O-CA 3.03Å; V333-F337 VanDerWaalsContact O-CB 3.31Å; V333-F337 WeakPolarHBondContact O-CB 3.26Å; V333-F337 PolarHBondContact O-N 3.45Å
334	P	90.2	Very high	90.4	Very high	73 Å²	73	34.6 Å²	34.6	47%	0.474	19%	0.19	S	C	.	.	H	α-helix	trans	-66.8	-24.3	178.9	27.9	-36.8	0	0	0	113.1	P330 E331 N338	P330-P334 WeakPolarHBondContact O-CD 3.18Å; E331-P334 WeakPolarHBondContact O-CD 3.29Å; E331-P334 WeakPolarHBondContact O-CG 3.3Å; P334-N338 PolarHBondContact O-OD1 3.45Å
335	A	89.9	Confident	90.4	Very high	22 Å²	22	34 Å²	34	18%	0.182	19%	0.187	C	C	.	.	H	α-helix	trans	-76.8	-37.8	-178.4	0	0	0	0	0	113.2	V332 V333 K439 F443	V332-A335 PolarHBondContact O-N 3.09Å; V333-A335 PolarHBondContact O-N 3.21Å; A335-K439 WeakPolarHBondContact O-CE 3.44Å; A335-F443 HydrophobicContact CB-CD2 3.48Å; A335-F443 VanDerWaalsContact CB-CD2 3.48Å; A335-F443 HydrophobicContact CB-CE2 3.15Å; A335-F443 HydrophobicContact CB-CG 4.32Å; A335-F443 HydrophobicContact CB-CZ 3.77Å
336	I	91	Very high	90.2	Very high	2 Å²	2	37.2 Å²	37.2	1%	0.01	20%	0.204	C	C	.	.	H	α-helix	trans	-86.5	-48.4	177.2	-60.5	-57	0	0	0	110.4	W284 V332 N338 F357 K439 V440 F443	W284-I336 HydrophobicContact CH2-CD1 4.47Å; W284-I336 HydrophobicContact CH2-CG1 4.3Å; V332-I336 HydrophobicContact CG1-CG1 3.74Å; V332-I336 WeakPolarHBondContact O-CG1 3.44Å; V332-I336 PolarHBondContact O-N 3.07Å; I336-N338 VanDerWaalsContact C-N 3.27Å; I336-N338 PolarHBondContact O-N 3.13Å; I336-F357 HydrophobicContact CG2-CE2 4.2Å; I336-K439 HydrophobicContact CD1-CG 4.46Å; I336-V440 HydrophobicContact CD1-CG2 3.81Å; I336-F443 HydrophobicContact CD1-CB 4.24Å; I336-F443 HydrophobicContact CD1-CD1 4.32Å; I336-F443 HydrophobicContact CD1-CG 4.33Å
337	F	89.5	Confident	90	Very high	7 Å²	7	43 Å²	43	3%	0.031	24%	0.235	C	C	.	.	S	Bend	trans	-88.9	61.7	-179	-60.3	-68.6	0	0	0	111.8	L286 V288 L319 L325 V333 V341 C342 L345 L355	L286-F337 HydrophobicContact CD2-CD2 4.43Å; L286-F337 HydrophobicContact CD2-CE2 3.56Å; L286-F337 HydrophobicContact CD2-CZ 4.16Å; L286-F337 HydrophobicContact CG-CE2 4.22Å; V288-F337 HydrophobicContact CB-CZ 4.04Å; V288-F337 HydrophobicContact CG2-CE1 4.17Å; V288-F337 HydrophobicContact CG2-CE2 3.53Å; V288-F337 HydrophobicContact CG2-CZ 3.29Å; L319-F337 HydrophobicContact CD2-CD1 4.23Å; L325-F337 HydrophobicContact CD1-CE2 4.05Å; V333-F337 HydrophobicContact CG1-CD2 4.09Å; V333-F337 WeakPolarHBondContact O-CA 3.03Å; V333-F337 VanDerWaalsContact O-CB 3.31Å; V333-F337 WeakPolarHBondContact O-CB 3.26Å; V333-F337 PolarHBondContact O-N 3.45Å; F337-V341 HydrophobicContact CD1-CG1 3.74Å; F337-V341 HydrophobicContact CE1-CG1 4.34Å; F337-C342 PolarHBondContact O-SG 2.89Å; F337-L345 HydrophobicContact CD1-CD1 3.77Å; F337-L345 HydrophobicContact CE1-CD1 3.79Å; F337-L355 HydrophobicContact CE1-CD1 4.32Å
338	N	87	Confident	89.7	Confident	48 Å²	48	44.7 Å²	44.7	26%	0.257	24%	0.241	S	C	.	.			trans	-57.1	160.1	168.5	-84.2	-8.9	0	0	0	111.3	P334 I336 L340 V341 C342 K439	P334-N338 PolarHBondContact O-OD1 3.45Å; I336-N338 VanDerWaalsContact C-N 3.27Å; I336-N338 PolarHBondContact O-N 3.13Å; N338-L340 PolarHBondContact O-N 3.15Å; N338-V341 PolarHBondContact O-N 3.3Å; N338-C342 PolarHBondContact O-N 3.04Å; N338-C342 PolarHBondContact O-SG 2.92Å; N338-K439 PolarHBondContact ND2-NZ 3.06Å
339	P	87.9	Confident	89.5	Confident	85 Å²	85	47.3 Å²	47.3	55%	0.552	25%	0.254	S	S	*	.	H	α-helix	trans	-53.9	-31.5	177.2	-28.2	35.4	0	0	0	114.2	K343	P339-K343 WeakPolarHBondContact O-CB 3.49Å; P339-K343 VanDerWaalsContact O-CG 3.25Å; P339-K343 WeakPolarHBondContact O-CG 3.43Å; P339-K343 PolarHBondContact O-N 3.06Å
340	L	89.1	Confident	89.2	Confident	110 Å²	110	54.7 Å²	54.7	58%	0.576	29%	0.288	S	S	*	.	H	α-helix	trans	-68.9	-44.4	175.9	-176.9	132.9	0	0	0	112.6	N338 K343 F344 Y435	N338-L340 PolarHBondContact O-N 3.15Å; L340-K343 PolarHBondContact O-N 3.28Å; L340-F344 PolarHBondContact O-N 2.81Å; L340-F344 VanDerWaalsContact O-N 3.08Å; L340-Y435 HydrophobicContact CD2-CE1 4.11Å
341	V	90.8	Very high	89.1	Confident	2 Å²	2	52.1 Å²	52.1	1%	0.012	27%	0.272	C	S	.	.	H	α-helix	trans	-63.7	-45.1	174.9	174.3	0	0	0	0	109.5	F337 N338 K343 F344 L345 F432 Y435	F337-V341 HydrophobicContact CD1-CG1 3.74Å; F337-V341 HydrophobicContact CE1-CG1 4.34Å; N338-V341 PolarHBondContact O-N 3.3Å; V341-K343 VanDerWaalsContact C-N 3.34Å; V341-K343 PolarHBondContact O-N 3.49Å; V341-F344 PolarHBondContact O-N 2.99Å; V341-L345 HydrophobicContact CG1-CD1 4.16Å; V341-L345 HydrophobicContact CG1-CG 4.38Å; V341-L345 VanDerWaalsContact O-CG 3.3Å; V341-L345 WeakPolarHBondContact O-CG 3.26Å; V341-L345 PolarHBondContact O-N 2.84Å; V341-F432 HydrophobicContact CB-CE2 4.5Å; V341-F432 HydrophobicContact CG1-CE2 3.85Å; V341-F432 HydrophobicContact CG1-CZ 4.05Å; V341-Y435 HydrophobicContact CG2-CD1 4.25Å; V341-Y435 HydrophobicContact CG2-CE1 3.62Å
342	C	89.5	Confident	89.1	Confident	4 Å²	4	49 Å²	49	3%	0.027	26%	0.257	C	S	.	.	H	α-helix	trans	-59.6	-42.6	177.3	-68.7	0	0	0	0	112.5	Y318 F337 N338 L345 N346	Y318-C342 WeakPolarHBondContact O-CB 3.32Å; F337-C342 PolarHBondContact O-SG 2.89Å; N338-C342 PolarHBondContact O-N 3.04Å; N338-C342 PolarHBondContact O-SG 2.92Å; C342-L345 PolarHBondContact O-N 3.28Å; C342-N346 PolarHBondContact O-N 3.42Å; C342-N346 PolarHBondContact O-ND2 3.47Å
343	K	89.2	Confident	89	Confident	142 Å²	142	50.1 Å²	50.1	62%	0.617	26%	0.262	S	S	*	.	H	α-helix	trans	-58.6	-49.5	173.6	-77.8	176	-179.5	-171.6	0	111.6	P339 L340 V341 L345 N346 D347	P339-K343 WeakPolarHBondContact O-CB 3.49Å; P339-K343 VanDerWaalsContact O-CG 3.25Å; P339-K343 WeakPolarHBondContact O-CG 3.43Å; P339-K343 PolarHBondContact O-N 3.06Å; L340-K343 PolarHBondContact O-N 3.28Å; V341-K343 VanDerWaalsContact C-N 3.34Å; V341-K343 PolarHBondContact O-N 3.49Å; K343-L345 VanDerWaalsContact C-N 3.29Å; K343-L345 PolarHBondContact O-N 3.48Å; K343-N346 WeakPolarHBondContact O-CB 3.42Å; K343-N346 PolarHBondContact O-N 2.97Å; K343-N346 VanDerWaalsContact O-N 3.07Å; K343-D347 VanDerWaalsContact O-CG 3.31Å; K343-D347 PolarHBondContact O-N 2.87Å
344	F	89.9	Confident	89.1	Confident	37 Å²	37	51 Å²	51	16%	0.162	27%	0.266	C	S	.	.	H	α-helix	trans	-59.3	-40.3	177.4	-171.8	-84.4	0	0	0	112.5	L340 V341 N346 D347 F348 I352 L429 F432	L340-F344 PolarHBondContact O-N 2.81Å; L340-F344 VanDerWaalsContact O-N 3.08Å; V341-F344 PolarHBondContact O-N 2.99Å; F344-N346 VanDerWaalsContact C-N 3.3Å; F344-N346 PolarHBondContact O-N 3.27Å; F344-D347 PolarHBondContact O-N 2.77Å; F344-F348 AromaticContact CD1-CD2 3.89Å; F344-F348 HydrophobicContact CD1-CD2 3.89Å; F344-F348 AromaticContact CD2-CD2 3.78Å; F344-F348 HydrophobicContact CD2-CD2 3.78Å; F344-F348 AromaticContact CD2-CE2 3.75Å; F344-F348 HydrophobicContact CD2-CE2 3.75Å; F344-F348 HydrophobicContact CE1-CB 4.23Å; F344-F348 AromaticContact CE1-CD2 3.56Å; F344-F348 HydrophobicContact CE1-CD2 3.56Å; F344-F348 HydrophobicContact CE1-CE2 4.23Å; F344-F348 HydrophobicContact CE1-CG 4.1Å; F344-F348 AromaticContact CE2-CD2 3.46Å; F344-F348 HydrophobicContact CE2-CD2 3.46Å; F344-F348 VanDerWaalsContact CE2-CD2 3.46Å; F344-F348 AromaticContact CE2-CE2 3.26Å; F344-F348 HydrophobicContact CE2-CE2 3.26Å; F344-F348 HydrophobicContact CE2-CZ 4.24Å; F344-F348 AromaticContact CG-CD2 3.99Å; F344-F348 HydrophobicContact CG-CD2 3.99Å; F344-F348 HydrophobicContact CG-CE2 4.42Å; F344-F348 AromaticContact CZ-CD2 3.32Å; F344-F348 HydrophobicContact CZ-CD2 3.32Å; F344-F348 AromaticContact CZ-CE2 3.53Å; F344-F348 HydrophobicContact CZ-CE2 3.53Å; F344-F348 HydrophobicContact CZ-CG 4.04Å; F344-F348 HydrophobicContact CZ-CZ 4.37Å; F344-F348 WeakPolarHBondContact O-CD2 3.38Å; F344-F348 PolarHBondContact O-N 3.3Å; F344-I352 HydrophobicContact CE1-CD1 4.36Å; F344-L429 HydrophobicContact CE1-CD2 3.91Å; F344-L429 HydrophobicContact CZ-CD2 4.1Å; F344-F432 HydrophobicContact CB-CD2 4.21Å; F344-F432 HydrophobicContact CB-CE2 4.28Å; F344-F432 HydrophobicContact CD1-CB 3.98Å; F344-F432 HydrophobicContact CD1-CD1 4.11Å; F344-F432 AromaticContact CD1-CD2 3.23Å; F344-F432 HydrophobicContact CD1-CD2 3.23Å; F344-F432 HydrophobicContact CD1-CE1 4.43Å; F344-F432 AromaticContact CD1-CE2 3.6Å; F344-F432 HydrophobicContact CD1-CE2 3.6Å; F344-F432 AromaticContact CD1-CG 3.51Å; F344-F432 HydrophobicContact CD1-CG 3.51Å; F344-F432 HydrophobicContact CD1-CZ 4.2Å; F344-F432 HydrophobicContact CD2-CD2 4.31Å; F344-F432 HydrophobicContact CE1-CB 3.38Å; F344-F432 AromaticContact CE1-CD1 3.8Å; F344-F432 HydrophobicContact CE1-CD1 3.8Å; F344-F432 AromaticContact CE1-CD2 3.57Å; F344-F432 HydrophobicContact CE1-CD2 3.57Å; F344-F432 HydrophobicContact CE1-CE1 4.46Å; F344-F432 HydrophobicContact CE1-CE2 4.25Å; F344-F432 AromaticContact CE1-CG 3.29Å; F344-F432 HydrophobicContact CE1-CG 3.29Å; F344-F432 HydrophobicContact CE2-CB 3.99Å; F344-F432 AromaticContact CG-CD2 3.66Å; F344-F432 HydrophobicContact CG-CD2 3.66Å; F344-F432 HydrophobicContact CG-CE2 4.12Å; F344-F432 HydrophobicContact CG-CG 4.24Å; F344-F432 HydrophobicContact CZ-CB 3.4Å; F344-F432 HydrophobicContact CZ-CD2 4.25Å; F344-F432 AromaticContact CZ-CG 3.88Å; F344-F432 HydrophobicContact CZ-CG 3.88Å
345	L	89.2	Confident	89.3	Confident	1 Å²	1	47.7 Å²	47.7	1%	0.005	24%	0.244	C	C	.	.	H	α-helix	trans	-65	-32.2	176.4	-68.8	178.8	0	0	0	113.1	L319 F337 V341 C342 K343 E349 I352 L355 F432	L319-L345 HydrophobicContact CD2-CD1 3.5Å; F337-L345 HydrophobicContact CD1-CD1 3.77Å; F337-L345 HydrophobicContact CE1-CD1 3.79Å; V341-L345 HydrophobicContact CG1-CD1 4.16Å; V341-L345 HydrophobicContact CG1-CG 4.38Å; V341-L345 VanDerWaalsContact O-CG 3.3Å; V341-L345 WeakPolarHBondContact O-CG 3.26Å; V341-L345 PolarHBondContact O-N 2.84Å; C342-L345 PolarHBondContact O-N 3.28Å; K343-L345 VanDerWaalsContact C-N 3.29Å; K343-L345 PolarHBondContact O-N 3.48Å; L345-E349 WeakPolarHBondContact O-CA 3.33Å; L345-E349 PolarHBondContact O-N 3.27Å; L345-E349 VanDerWaalsContact O-N 3.15Å; L345-I352 HydrophobicContact CD2-CD1 3.43Å; L345-I352 VanDerWaalsContact CD2-CD1 3.43Å; L345-L355 HydrophobicContact CD2-CD1 4.02Å; L345-F432 HydrophobicContact CD2-CE1 4.36Å; L345-F432 HydrophobicContact CD2-CZ 3.85Å; L345-F432 HydrophobicContact CG-CZ 4.41Å
346	N	88.5	Confident	89.5	Confident	70 Å²	70	46.7 Å²	46.7	37%	0.374	24%	0.235	S	C	.	.	H	α-helix	trans	-71.1	-42.5	172.5	-69.2	-49.8	0	0	0	111.1	P320 C342 K343 F344 F348	P320-N346 WeakPolarHBondContact CA-OD1 3.31Å; P320-N346 WeakPolarHBondContact CD-OD1 3.38Å; P320-N346 WeakPolarHBondContact CG-OD1 3.38Å; C342-N346 PolarHBondContact O-N 3.42Å; C342-N346 PolarHBondContact O-ND2 3.47Å; K343-N346 WeakPolarHBondContact O-CB 3.42Å; K343-N346 PolarHBondContact O-N 2.97Å; K343-N346 VanDerWaalsContact O-N 3.07Å; F344-N346 VanDerWaalsContact C-N 3.3Å; F344-N346 PolarHBondContact O-N 3.27Å; N346-F348 VanDerWaalsContact C-N 3.34Å; N346-F348 PolarHBondContact O-N 3.31Å
347	D	87.5	Confident	89.7	Confident	126 Å²	126	46.7 Å²	46.7	67%	0.674	24%	0.235	S	C	*	.	H	α-helix	trans	-67.4	-34.8	-178.5	-62.4	-21.9	0	0	0	112.3	K343 F344	K343-D347 VanDerWaalsContact O-CG 3.31Å; K343-D347 PolarHBondContact O-N 2.87Å; F344-D347 PolarHBondContact O-N 2.77Å
348	F	87.1	Confident	89.9	Confident	46 Å²	46	46.4 Å²	46.4	20%	0.202	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.6	26.2	-178.1	-64.7	-81.1	0	0	0	113.9	F344 N346 E350 S351 I352 S425 A428 L429	F344-F348 AromaticContact CD1-CD2 3.89Å; F344-F348 HydrophobicContact CD1-CD2 3.89Å; F344-F348 AromaticContact CD2-CD2 3.78Å; F344-F348 HydrophobicContact CD2-CD2 3.78Å; F344-F348 AromaticContact CD2-CE2 3.75Å; F344-F348 HydrophobicContact CD2-CE2 3.75Å; F344-F348 HydrophobicContact CE1-CB 4.23Å; F344-F348 AromaticContact CE1-CD2 3.56Å; F344-F348 HydrophobicContact CE1-CD2 3.56Å; F344-F348 HydrophobicContact CE1-CE2 4.23Å; F344-F348 HydrophobicContact CE1-CG 4.1Å; F344-F348 AromaticContact CE2-CD2 3.46Å; F344-F348 HydrophobicContact CE2-CD2 3.46Å; F344-F348 VanDerWaalsContact CE2-CD2 3.46Å; F344-F348 AromaticContact CE2-CE2 3.26Å; F344-F348 HydrophobicContact CE2-CE2 3.26Å; F344-F348 HydrophobicContact CE2-CZ 4.24Å; F344-F348 AromaticContact CG-CD2 3.99Å; F344-F348 HydrophobicContact CG-CD2 3.99Å; F344-F348 HydrophobicContact CG-CE2 4.42Å; F344-F348 AromaticContact CZ-CD2 3.32Å; F344-F348 HydrophobicContact CZ-CD2 3.32Å; F344-F348 AromaticContact CZ-CE2 3.53Å; F344-F348 HydrophobicContact CZ-CE2 3.53Å; F344-F348 HydrophobicContact CZ-CG 4.04Å; F344-F348 HydrophobicContact CZ-CZ 4.37Å; F344-F348 WeakPolarHBondContact O-CD2 3.38Å; F344-F348 PolarHBondContact O-N 3.3Å; N346-F348 VanDerWaalsContact C-N 3.34Å; N346-F348 PolarHBondContact O-N 3.31Å; F348-E350 PolarHBondContact O-N 2.81Å; F348-E350 VanDerWaalsContact O-N 3.16Å; F348-S351 PolarHBondContact O-N 2.89Å; F348-S351 VanDerWaalsContact O-N 3.09Å; F348-I352 HydrophobicContact CB-CD1 4.2Å; F348-I352 HydrophobicContact CB-CG1 4.46Å; F348-I352 PolarHBondContact O-N 3.31Å; F348-I352 VanDerWaalsContact O-N 3.09Å; F348-S425 WeakPolarHBondContact CE1-OG 3.49Å; F348-A428 HydrophobicContact CZ-CB 4.1Å; F348-L429 HydrophobicContact CB-CD2 4.01Å; F348-L429 HydrophobicContact CD1-CD2 4.32Å; F348-L429 HydrophobicContact CG-CD2 4.15Å
349	E	87.6	Confident	90.2	Very high	63 Å²	63	44.4 Å²	44.4	29%	0.294	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-35.3	-177.8	-171.5	-168.2	152.9	0	0	113	R290 P320 S322 F323 L345	R290-E349 PolarHBondContact NH2-O 2.87Å; P320-E349 HydrophobicContact CB-CG 3.97Å; P320-E349 HydrophobicContact CG-CG 4.15Å; S322-E349 WeakPolarHBondContact CB-OE1 3.4Å; S322-E349 PolarHBondContact OG-OE1 2.87Å; F323-E349 HydrophobicContact CE2-CG 4.14Å; F323-E349 HydrophobicContact CZ-CG 3.99Å; L345-E349 WeakPolarHBondContact O-CA 3.33Å; L345-E349 PolarHBondContact O-N 3.27Å; L345-E349 VanDerWaalsContact O-N 3.15Å
350	E	85.7	Confident	90.3	Very high	159 Å²	159	42.6 Å²	42.6	74%	0.743	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.5	-36.7	-179.5	-66.9	-162	166.6	0	0	112.8	R290 F348	R290-E350 PolarHBondContact NH2-O 2.67Å; R290-E350 VanDerWaalsContact NH2-O 3.13Å; F348-E350 PolarHBondContact O-N 2.81Å; F348-E350 VanDerWaalsContact O-N 3.16Å
351	S	87.3	Confident	90.4	Very high	23 Å²	23	38.3 Å²	38.3	16%	0.161	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-24.6	-175.7	-58.6	0	0	0	0	113.1	F348 L388 R389	F348-S351 PolarHBondContact O-N 2.89Å; F348-S351 VanDerWaalsContact O-N 3.09Å; S351-L388 CarbonylContact O-C 3.58Å; S351-L388 WeakPolarHBondContact O-CA 3.49Å; S351-R389 PolarHBondContact O-N 2.88Å
352	I	90.3	Very high	90	Very high	2 Å²	2	40.7 Å²	40.7	1%	0.01	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	126	179.8	-60.6	172.4	0	0	0	109.5	F323 F344 L345 F348 L355 L388 L429	F323-I352 HydrophobicContact CZ-CB 4.23Å; F323-I352 HydrophobicContact CZ-CG2 4.31Å; F344-I352 HydrophobicContact CE1-CD1 4.36Å; L345-I352 HydrophobicContact CD2-CD1 3.43Å; L345-I352 VanDerWaalsContact CD2-CD1 3.43Å; F348-I352 HydrophobicContact CB-CD1 4.2Å; F348-I352 HydrophobicContact CB-CG1 4.46Å; F348-I352 PolarHBondContact O-N 3.31Å; F348-I352 VanDerWaalsContact O-N 3.09Å; I352-L355 HydrophobicContact CG2-CD2 4.02Å; I352-L355 HydrophobicContact CG2-CG 4.2Å; I352-L388 HydrophobicContact CG1-CD2 3.94Å; I352-L429 HydrophobicContact CD1-CD2 4.26Å; I352-L429 HydrophobicContact CG1-CD2 3.99Å
353	E	90.1	Very high	89.5	Confident	25 Å²	25	41.2 Å²	41.2	12%	0.117	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	-55.7	179.3	-165	-176.1	141.1	0	0	111.6	R290 R293 A387	R290-E353 PolarHBondContact N-O 3.35Å; R293-E353 HydrophobicContact CG-CG 4.36Å; R293-E353 IonicContact CZ-OE1 3.07Å; R293-E353 IonicContact NE-OE1 3.81Å; R293-E353 PolarHBondContact NE-OE1 3.1Å; R293-E353 IonicContact NH2-OE1 2.81Å; R293-E353 PolarHBondContact NH2-OE1 3.1Å; E353-A387 HydrophobicContact CB-CB 4.22Å; E353-A387 WeakPolarHBondContact CB-O 3.5Å; E353-A387 PolarHBondContact N-O 3.45Å
354	Y	93.6	Very high	88.8	Confident	25 Å²	25	38.8 Å²	38.8	10%	0.098	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.3	153.4	171.7	65	-93	0	0	0	111.4	V288 L297 F356 I385 A387	V288-Y354 CarbonylContact O-C 3.56Å; V288-Y354 WeakPolarHBondContact O-CA 3.19Å; V288-Y354 WeakPolarHBondContact O-CB 3.13Å; L297-Y354 HydrophobicContact CD1-CD2 4.36Å; L297-Y354 HydrophobicContact CD1-CE2 3.89Å; L297-Y354 HydrophobicContact CD2-CD2 3.82Å; L297-Y354 HydrophobicContact CD2-CE2 4.11Å; L297-Y354 HydrophobicContact CD2-CG 4.34Å; Y354-F356 HydrophobicContact CD2-CB 4.03Å; Y354-F356 HydrophobicContact CE2-CB 4.23Å; Y354-I385 HydrophobicContact CE2-CG2 4.1Å; Y354-A387 HydrophobicContact CD1-CB 3.51Å; Y354-A387 HydrophobicContact CD2-CB 3.97Å; Y354-A387 HydrophobicContact CE1-CB 3.21Å; Y354-A387 HydrophobicContact CE2-CB 3.71Å; Y354-A387 HydrophobicContact CG-CB 3.87Å; Y354-A387 PolarHBondContact N-O 3.21Å; Y354-A387 PolarHBondContact O-N 2.84Å
355	L	94.9	Very high	87.8	Confident	3 Å²	3	42.3 Å²	42.3	2%	0.016	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	132.1	169.6	-54.7	-173.8	0	0	0	107.5	A287 V288 F337 L345 I352 F357 F386 F432	A287-L355 CarbonylContact C-O 3.6Å; A287-L355 VanDerWaalsContact CA-O 3.26Å; A287-L355 WeakPolarHBondContact CA-O 3.44Å; V288-L355 PolarHBondContact N-O 3.07Å; V288-L355 PolarHBondContact O-N 3.5Å; F337-L355 HydrophobicContact CE1-CD1 4.32Å; L345-L355 HydrophobicContact CD2-CD1 4.02Å; I352-L355 HydrophobicContact CG2-CD2 4.02Å; I352-L355 HydrophobicContact CG2-CG 4.2Å; L355-F357 HydrophobicContact CB-CZ 4.11Å; L355-F386 HydrophobicContact CD2-CB 4.27Å; L355-F386 HydrophobicContact CD2-CD1 3.51Å; L355-F386 HydrophobicContact CD2-CE1 4.28Å; L355-F386 HydrophobicContact CD2-CG 4.27Å; L355-F432 HydrophobicContact CD1-CE1 4.23Å; L355-F432 HydrophobicContact CD1-CZ 4.3Å
356	F	94.5	Very high	86.7	Confident	1 Å²	1	46.6 Å²	46.6	0%	0.004	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	118.5	-175.1	170.8	-139	0	0	0	110.8	V285 A287 L297 H301 D303 L304 Y354 Y361 I385	V285-F356 HydrophobicContact CG1-CE2 4.22Å; A287-F356 HydrophobicContact CB-CB 4.44Å; A287-F356 HydrophobicContact CB-CD2 3.94Å; L297-F356 HydrophobicContact CD2-CB 3.98Å; L297-F356 HydrophobicContact CD2-CD1 4.33Å; L297-F356 HydrophobicContact CD2-CD2 4.49Å; L297-F356 HydrophobicContact CD2-CG 4.03Å; H301-F356 HydrophobicContact CB-CE1 4.43Å; H301-F356 HydrophobicContact CB-CZ 4.28Å; H301-F356 AromaticContact CG-CE1 3.95Å; D303-F356 WeakPolarHBondContact OD1-CZ 3.46Å; D303-F356 VanDerWaalsContact OD2-CZ 3.28Å; D303-F356 WeakPolarHBondContact OD2-CZ 3.46Å; L304-F356 HydrophobicContact CD1-CD2 3.99Å; L304-F356 HydrophobicContact CD1-CE2 3.69Å; L304-F356 HydrophobicContact CD1-CZ 4.05Å; L304-F356 HydrophobicContact CD2-CD2 4.06Å; L304-F356 HydrophobicContact CD2-CE2 3.67Å; L304-F356 HydrophobicContact CG-CD2 4.16Å; L304-F356 HydrophobicContact CG-CE2 3.49Å; L304-F356 VanDerWaalsContact CG-CE2 3.49Å; L304-F356 HydrophobicContact CG-CZ 3.99Å; Y354-F356 HydrophobicContact CD2-CB 4.03Å; Y354-F356 HydrophobicContact CE2-CB 4.23Å; F356-Y361 AromaticContact CE1-CD2 3.84Å; F356-Y361 HydrophobicContact CE1-CD2 3.84Å; F356-Y361 AromaticContact CE1-CE2 3.98Å; F356-Y361 HydrophobicContact CE1-CE2 3.98Å; F356-Y361 HydrophobicContact CZ-CD2 4.29Å; F356-I385 HydrophobicContact CB-CB 4.27Å; F356-I385 HydrophobicContact CD1-CB 4.2Å; F356-I385 HydrophobicContact CD1-CD1 3.88Å; F356-I385 HydrophobicContact CD1-CG1 4.33Å; F356-I385 HydrophobicContact CE1-CD1 4.17Å; F356-I385 PolarHBondContact N-O 3.22Å; F356-I385 PolarHBondContact O-N 3.32Å
357	F	95	Very high	85.4	Confident	2 Å²	2	47.7 Å²	47.7	1%	0.009	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	127.6	-177.3	-50.2	-38.1	0	0	0	108.2	W284 V285 L286 I336 L355 L384 F386 V436	W284-F357 HydrophobicContact CE3-CB 4.41Å; W284-F357 HydrophobicContact CH2-CB 3.92Å; W284-F357 AromaticContact CH2-CD2 3.98Å; W284-F357 HydrophobicContact CH2-CD2 3.98Å; W284-F357 HydrophobicContact CH2-CG 4.25Å; W284-F357 HydrophobicContact CZ3-CB 3.49Å; W284-F357 VanDerWaalsContact CZ3-CB 3.49Å; W284-F357 AromaticContact CZ3-CD2 3.86Å; W284-F357 HydrophobicContact CZ3-CD2 3.86Å; W284-F357 HydrophobicContact CZ3-CG 4.11Å; V285-F357 WeakPolarHBondContact CA-O 3.35Å; L286-F357 HydrophobicContact CB-CB 4.35Å; L286-F357 HydrophobicContact CB-CD2 4.3Å; L286-F357 HydrophobicContact CD2-CD2 3.91Å; L286-F357 HydrophobicContact CD2-CE2 4.39Å; L286-F357 PolarHBondContact N-O 3.2Å; L286-F357 PolarHBondContact O-N 2.96Å; L286-F357 VanDerWaalsContact O-O 3.09Å; I336-F357 HydrophobicContact CG2-CE2 4.2Å; L355-F357 HydrophobicContact CB-CZ 4.11Å; F357-L384 HydrophobicContact CB-CD2 3.66Å; F357-L384 HydrophobicContact CD1-CB 3.69Å; F357-L384 HydrophobicContact CD1-CD2 3.42Å; F357-L384 VanDerWaalsContact CD1-CD2 3.42Å; F357-L384 HydrophobicContact CD1-CG 4.1Å; F357-L384 HydrophobicContact CE1-CB 4.05Å; F357-L384 HydrophobicContact CE1-CD2 4.29Å; F357-L384 HydrophobicContact CG-CD2 3.71Å; F357-F386 HydrophobicContact CE1-CD1 4.42Å; F357-F386 AromaticContact CE1-CE1 3.73Å; F357-F386 HydrophobicContact CE1-CE1 3.73Å; F357-F386 HydrophobicContact CE1-CE2 4.07Å; F357-F386 AromaticContact CE1-CZ 3.53Å; F357-F386 HydrophobicContact CE1-CZ 3.53Å; F357-F386 AromaticContact CZ-CE1 3.84Å; F357-F386 HydrophobicContact CZ-CE1 3.84Å; F357-F386 AromaticContact CZ-CZ 3.97Å; F357-F386 HydrophobicContact CZ-CZ 3.97Å; F357-V436 HydrophobicContact CE1-CG1 4.45Å; F357-V436 HydrophobicContact CE2-CG1 4.3Å; F357-V436 HydrophobicContact CZ-CG1 3.75Å
358	S	93.8	Very high	84	Confident	1 Å²	1	49.7 Å²	49.7	1%	0.007	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	132.1	-177.9	-178.3	0	0	0	0	110.6	D303 Q360 Y361 A383	D303-S358 WeakPolarHBondContact OD2-CB 3.5Å; D303-S358 PolarHBondContact OD2-OG 3.24Å; S358-Q360 VanDerWaalsContact C-N 3.33Å; S358-Q360 PolarHBondContact OG-N 3Å; S358-Y361 PolarHBondContact OG-N 2.94Å; S358-A383 PolarHBondContact N-O 2.8Å; S358-A383 PolarHBondContact O-N 2.79Å
359	D	92.7	Very high	82.5	Confident	6 Å²	6	55.5 Å²	55.5	3%	0.032	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	-15.8	170	70.6	-58	0	0	0	113	M281 G283 W284 V285 K382 R457	M281-D359 HydrophobicContact CE-CB 3.74Å; G283-D359 VanDerWaalsContact CA-CG 3.45Å; G283-D359 WeakPolarHBondContact CA-OD2 3.44Å; W284-D359 PolarHBondContact N-OD1 3.39Å; W284-D359 PolarHBondContact O-N 2.65Å; V285-D359 WeakPolarHBondContact CG2-OD1 3.46Å; D359-K382 HydrophobicContact CB-CG 4.25Å; D359-R457 IonicContact OD1-CZ 3.8Å; D359-R457 IonicContact OD1-NE 2.83Å; D359-R457 IonicContact OD1-NH2 3.78Å; D359-R457 PolarHBondContact OD1-NH2 3.22Å; D359-R457 IonicContact OD2-CZ 3.06Å; D359-R457 IonicContact OD2-NE 3.91Å; D359-R457 PolarHBondContact OD2-NE 3.41Å; D359-R457 IonicContact OD2-NH2 3.03Å; D359-R457 PolarHBondContact OD2-NH2 3.22Å
360	Q	89.7	Confident	80.5	Confident	46 Å²	46	58.1 Å²	58.1	22%	0.215	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	31.5	-175.3	-61.1	-66	-39.1	0	0	111.3	D303 Y307 S358 S362 T380	D303-Q360 HydrophobicContact CB-CB 4.38Å; Y307-Q360 HydrophobicContact CD2-CB 4.46Å; Y307-Q360 HydrophobicContact CE2-CB 3.68Å; Y307-Q360 HydrophobicContact CE2-CG 3.7Å; S358-Q360 VanDerWaalsContact C-N 3.33Å; S358-Q360 PolarHBondContact OG-N 3Å; Q360-S362 PolarHBondContact O-N 3.48Å; Q360-S362 VanDerWaalsContact O-N 3.17Å; Q360-T380 HydrophobicContact CB-CG2 4.32Å
361	Y	91.2	Very high	78.7	Confident	21 Å²	21	57.3 Å²	57.3	8%	0.082	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	117.5	-175.6	-178.8	-100.1	0	0	0	110.3	H301 F356 S358 T380 Q381 A383 I385	H301-Y361 AromaticContact CE1-CE2 3.66Å; H301-Y361 AromaticContact ND1-CE2 3.67Å; F356-Y361 AromaticContact CE1-CD2 3.84Å; F356-Y361 HydrophobicContact CE1-CD2 3.84Å; F356-Y361 AromaticContact CE1-CE2 3.98Å; F356-Y361 HydrophobicContact CE1-CE2 3.98Å; F356-Y361 HydrophobicContact CZ-CD2 4.29Å; S358-Y361 PolarHBondContact OG-N 2.94Å; Y361-T380 WeakPolarHBondContact O-CA 3.42Å; Y361-Q381 VanDerWaalsContact CB-O 3.3Å; Y361-Q381 WeakPolarHBondContact CB-O 3.32Å; Y361-Q381 HydrophobicContact CD1-CG 3.99Å; Y361-Q381 PolarHBondContact N-O 2.89Å; Y361-Q381 PolarHBondContact O-N 3.13Å; Y361-A383 HydrophobicContact CD1-CB 3.93Å; Y361-A383 HydrophobicContact CG-CB 3.91Å; Y361-I385 HydrophobicContact CD2-CD1 4.03Å; Y361-I385 HydrophobicContact CE1-CD1 4.49Å; Y361-I385 HydrophobicContact CE2-CD1 3.42Å; Y361-I385 VanDerWaalsContact CE2-CD1 3.42Å
362	S	83.6	Confident	77.2	Confident	51 Å²	51	61.7 Å²	61.7	36%	0.357	34%	0.34	S	S	.	.			trans	-109.1	6.7	-179.6	171.5	0	0	0	0	112.9	Q360 P378	Q360-S362 PolarHBondContact O-N 3.48Å; Q360-S362 VanDerWaalsContact O-N 3.17Å; S362-P378 WeakPolarHBondContact OG-CB 3.41Å
363	G	79.2	Confident	75.4	Confident	15 Å²	15	66.2 Å²	66.2	16%	0.155	37%	0.368	C	S	.	.			trans	84.8	179.1	-168.6	0	0	0	0	0	113.6	H301	H301-G363 PolarHBondContact ND1-O 3.05Å
364	P	74.2	Confident	73.7	Confident	91 Å²	91	69.2 Å²	69.2	59%	0.591	39%	0.39	S	S	*	.	S	Bend	trans	-66	141.1	173	28.3	-32.4	0	0	0	109.9
365	K	69.1	Low	72	Confident	112 Å²	112	72.7 Å²	72.7	49%	0.487	41%	0.414	S	S	.	.	P	Polyproline II helix	trans	-56.6	126	178.2	-169.6	-175.4	177.3	-168.3	0	109	D300	D300-K365 WeakPolarHBondContact O-CB 3.5Å; D300-K365 PolarHBondContact O-N 3.29Å
366	P	64.5	Low	70.6	Confident	91 Å²	91	80.4 Å²	80.4	59%	0.591	45%	0.447	S	S	*	.	P	Polyproline II helix	trans	-58.4	141.8	173.4	24.5	-32.3	0	0	0	108.8	Q368	P366-Q368 PolarHBondContact O-N 3.44Å
367	P	61.5	Low	69.4	Low	92 Å²	92	84.3 Å²	84.3	60%	0.597	47%	0.473	S	S	*	.	P	Polyproline II helix	trans	-52.5	133.9	173.2	21	-29.2	0	0	0	108.5	E369	P367-E369 PolarHBondContact O-N 3.32Å
368	Q	59.3	Low	68.4	Low	168 Å²	168	86.7 Å²	86.7	79%	0.785	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	7.3	-168.8	-169	165.1	-14.4	0	0	113.8	P366	P366-Q368 PolarHBondContact O-N 3.44Å
369	E	54	Low	67.8	Low	169 Å²	169	93 Å²	93	79%	0.79	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.6	-16.7	-174.2	-70.8	176.3	168.1	0	0	113.4	P367 T371	P367-E369 PolarHBondContact O-N 3.32Å; E369-T371 PolarHBondContact O-N 3.32Å; E369-T371 VanDerWaalsContact O-N 3.1Å
370	D	47.4	Very low	67.4	Low	118 Å²	118	95.5 Å²	95.5	63%	0.631	54%	0.542	S	S	*	.			trans	-80.9	100.4	175.5	-67.4	-33.1	0	0	0	110.7	T372	D370-T372 PolarHBondContact O-N 3.15Å
371	T	46.6	Very low	67.5	Low	142 Å²	142	97.1 Å²	97.1	87%	0.871	55%	0.55	S	S	*	.			trans	-68.7	30.1	-178.2	-59.9	0	0	0	0	113.5	E369	E369-T371 PolarHBondContact O-N 3.32Å; E369-T371 VanDerWaalsContact O-N 3.1Å
372	T	55.1	Low	67.5	Low	115 Å²	115	97.7 Å²	97.7	71%	0.706	55%	0.552	S	S	*	*			trans	-103.6	90.3	165.6	54	0	0	0	0	108.3	D370 P374	D370-T372 PolarHBondContact O-N 3.15Å; T372-P374 WeakPolarHBondContact O-CD 3.41Å
373	T	54.1	Low	68	Low	96 Å²	96	95.4 Å²	95.4	59%	0.589	54%	0.537	S	S	*	.			trans	-52.8	112.9	170.8	50.8	0	0	0	0	108.7	T375	T373-T375 PolarHBondContact O-N 3.36Å
374	P	54.2	Low	68.8	Low	88 Å²	88	94.7 Å²	94.7	57%	0.571	53%	0.53	S	S	*	.			trans	-67.3	111.7	-176	24.7	-30.7	0	0	0	108.2	T372 K376	T372-P374 WeakPolarHBondContact O-CD 3.41Å; P374-K376 PolarHBondContact O-N 2.85Å
375	T	57.6	Low	69.8	Low	98 Å²	98	90.6 Å²	90.6	60%	0.601	50%	0.503	S	S	*	.	S	Bend	trans	-71.7	-11.6	178.4	47.2	0	0	0	0	112.9	T373 R472	T373-T375 PolarHBondContact O-N 3.36Å; T375-R472 PolarHBondContact O-NH2 3.46Å
376	K	66.3	Low	71.1	Confident	165 Å²	165	85.3 Å²	85.3	72%	0.717	48%	0.48	S	S	*	.	S	Bend	trans	-107	139.1	177.2	-66.6	-177.2	-179.5	179.1	0	109.1	P374	P374-K376 PolarHBondContact O-N 2.85Å
377	P	68.2	Low	72.5	Confident	83 Å²	83	81 Å²	81	54%	0.539	45%	0.452	S	S	.	.	P	Polyproline II helix	trans	-58.9	149.1	173	27.4	-34.2	0	0	0	109.8	V379	P377-V379 PolarHBondContact O-N 2.77Å
378	P	73.6	Confident	74	Confident	52 Å²	52	77 Å²	77	34%	0.338	43%	0.425	S	S	.	.	P	Polyproline II helix	trans	-56.7	138.1	175.1	20.3	-29.2	0	0	0	110.7	S362 T380	S362-P378 WeakPolarHBondContact OG-CB 3.41Å; P378-T380 PolarHBondContact O-N 2.81Å
379	V	81.4	Confident	75.4	Confident	133 Å²	133	72.6 Å²	72.6	81%	0.806	40%	0.402	S	S	*	.	P	Polyproline II helix	trans	-71.4	120.4	171.3	-178.4	0	0	0	0	107.5	P377	P377-V379 PolarHBondContact O-N 2.77Å
380	T	85.7	Confident	76.8	Confident	60 Å²	60	65.9 Å²	65.9	37%	0.368	37%	0.369	S	S	.	.	P	Polyproline II helix	trans	-102.5	139.2	-179.7	53.3	0	0	0	0	110.1	Q360 Y361 P378	Q360-T380 HydrophobicContact CB-CG2 4.32Å; Y361-T380 WeakPolarHBondContact O-CA 3.42Å; P378-T380 PolarHBondContact O-N 2.81Å
381	Q	89.9	Confident	78	Confident	79 Å²	79	64.4 Å²	64.4	37%	0.369	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	157.1	173.9	64.8	-177.2	28.2	0	0	110.6	Y361 A383	Y361-Q381 VanDerWaalsContact CB-O 3.3Å; Y361-Q381 WeakPolarHBondContact CB-O 3.32Å; Y361-Q381 HydrophobicContact CD1-CG 3.99Å; Y361-Q381 PolarHBondContact N-O 2.89Å; Y361-Q381 PolarHBondContact O-N 3.13Å; Q381-A383 PolarHBondContact O-N 2.85Å
382	K	93	Very high	78.8	Confident	33 Å²	33	59.3 Å²	59.3	14%	0.143	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	114.1	174.4	-55.5	-171.3	-171.7	179.3	0	109.5	M276 D278 M281 D359	M276-K382 HydrophobicContact CB-CB 4.26Å; M276-K382 PolarHBondContact N-O 2.83Å; D278-K382 PolarHBondContact O-NZ 2.77Å; D278-K382 WeakPolarHBondContact OD1-CE 3.46Å; M281-K382 HydrophobicContact CB-CD 3.9Å; M281-K382 HydrophobicContact CE-CB 4.22Å; M281-K382 HydrophobicContact CG-CD 4.36Å; M281-K382 WeakPolarHBondContact O-CD 3.34Å; M281-K382 PolarHBondContact O-NZ 2.76Å; M281-K382 HydrophobicContact SD-CB 4.24Å; D359-K382 HydrophobicContact CB-CG 4.25Å
383	A	93.8	Very high	78.8	Confident	4 Å²	4	55.4 Å²	55.4	3%	0.033	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	140.2	-174.4	0	0	0	0	0	112.5	V274 S358 Y361 Q381	V274-A383 CarbonylContact O-C 3.6Å; V274-A383 VanDerWaalsContact O-CA 3.28Å; V274-A383 WeakPolarHBondContact O-CA 3.33Å; S358-A383 PolarHBondContact N-O 2.8Å; S358-A383 PolarHBondContact O-N 2.79Å; Y361-A383 HydrophobicContact CD1-CB 3.93Å; Y361-A383 HydrophobicContact CG-CB 3.91Å; Q381-A383 PolarHBondContact O-N 2.85Å
384	L	95.1	Very high	78.5	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	123.7	169.4	-46.6	175.7	0	0	0	108.8	K273 V274 M276 M281 F357 F386 I437 V440	K273-L384 CarbonylContact C-O 3.52Å; K273-L384 WeakPolarHBondContact CA-O 3.23Å; V274-L384 HydrophobicContact CB-CB 4.17Å; V274-L384 PolarHBondContact N-O 2.9Å; V274-L384 PolarHBondContact O-N 3.46Å; M276-L384 HydrophobicContact CE-CD1 3.93Å; M276-L384 HydrophobicContact CG-CD1 4.09Å; M276-L384 HydrophobicContact CG-CG 4.19Å; M281-L384 HydrophobicContact SD-CD2 3.93Å; F357-L384 HydrophobicContact CB-CD2 3.66Å; F357-L384 HydrophobicContact CD1-CB 3.69Å; F357-L384 HydrophobicContact CD1-CD2 3.42Å; F357-L384 VanDerWaalsContact CD1-CD2 3.42Å; F357-L384 HydrophobicContact CD1-CG 4.1Å; F357-L384 HydrophobicContact CE1-CB 4.05Å; F357-L384 HydrophobicContact CE1-CD2 4.29Å; F357-L384 HydrophobicContact CG-CD2 3.71Å; L384-F386 HydrophobicContact CB-CE2 3.74Å; L384-F386 HydrophobicContact CB-CZ 4.34Å; L384-I437 HydrophobicContact CD1-CG1 4.35Å; L384-V440 HydrophobicContact CD1-CB 4.17Å; L384-V440 HydrophobicContact CD1-CG1 4.01Å; L384-V440 HydrophobicContact CD1-CG2 4.26Å; L384-V440 HydrophobicContact CD2-CG1 4.12Å
385	I	95.6	Very high	77.7	Confident	5 Å²	5	55.3 Å²	55.3	3%	0.026	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	119.7	-175.8	-56.3	-176.8	0	0	0	108.6	V271 V272 K273 Y354 F356 Y361	V271-I385 HydrophobicContact CG1-CG2 3.8Å; V272-I385 CarbonylContact O-C 3.57Å; V272-I385 WeakPolarHBondContact O-CA 3.46Å; K273-I385 HydrophobicContact CG-CD1 4.45Å; K273-I385 HydrophobicContact CG-CG1 4.21Å; K273-I385 HydrophobicContact CG-CG2 4.42Å; Y354-I385 HydrophobicContact CE2-CG2 4.1Å; F356-I385 HydrophobicContact CB-CB 4.27Å; F356-I385 HydrophobicContact CD1-CB 4.2Å; F356-I385 HydrophobicContact CD1-CD1 3.88Å; F356-I385 HydrophobicContact CD1-CG1 4.33Å; F356-I385 HydrophobicContact CE1-CD1 4.17Å; F356-I385 PolarHBondContact N-O 3.22Å; F356-I385 PolarHBondContact O-N 3.32Å; Y361-I385 HydrophobicContact CD2-CD1 4.03Å; Y361-I385 HydrophobicContact CE1-CD1 4.49Å; Y361-I385 HydrophobicContact CE2-CD1 3.42Å; Y361-I385 VanDerWaalsContact CE2-CD1 3.42Å
386	F	95.6	Very high	76.9	Confident	1 Å²	1	59.8 Å²	59.8	0%	0.004	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	114.8	175.8	-56.1	-101.6	0	0	0	108.1	V271 V272 V274 L355 F357 L384 I433 V436 I437	V271-F386 CarbonylContact C-O 3.51Å; V271-F386 WeakPolarHBondContact CA-O 3.45Å; V272-F386 HydrophobicContact CB-CB 4.29Å; V272-F386 PolarHBondContact N-O 2.8Å; V272-F386 PolarHBondContact O-N 2.99Å; V274-F386 HydrophobicContact CG2-CD2 4.41Å; V274-F386 HydrophobicContact CG2-CE2 4.17Å; L355-F386 HydrophobicContact CD2-CB 4.27Å; L355-F386 HydrophobicContact CD2-CD1 3.51Å; L355-F386 HydrophobicContact CD2-CE1 4.28Å; L355-F386 HydrophobicContact CD2-CG 4.27Å; F357-F386 HydrophobicContact CE1-CD1 4.42Å; F357-F386 AromaticContact CE1-CE1 3.73Å; F357-F386 HydrophobicContact CE1-CE1 3.73Å; F357-F386 HydrophobicContact CE1-CE2 4.07Å; F357-F386 AromaticContact CE1-CZ 3.53Å; F357-F386 HydrophobicContact CE1-CZ 3.53Å; F357-F386 AromaticContact CZ-CE1 3.84Å; F357-F386 HydrophobicContact CZ-CE1 3.84Å; F357-F386 AromaticContact CZ-CZ 3.97Å; F357-F386 HydrophobicContact CZ-CZ 3.97Å; L384-F386 HydrophobicContact CB-CE2 3.74Å; L384-F386 HydrophobicContact CB-CZ 4.34Å; F386-I433 HydrophobicContact CB-CD1 4.01Å; F386-I433 HydrophobicContact CB-CG1 4.1Å; F386-I433 HydrophobicContact CD1-CG1 3.8Å; F386-I433 HydrophobicContact CD2-CG1 4.37Å; F386-I433 HydrophobicContact CD2-CG2 4.04Å; F386-I433 HydrophobicContact CE1-CG1 4.33Å; F386-I433 HydrophobicContact CE2-CG2 4.02Å; F386-I433 HydrophobicContact CG-CD1 4.25Å; F386-I433 HydrophobicContact CG-CG1 3.85Å; F386-I433 HydrophobicContact CG-CG2 4.37Å; F386-I433 HydrophobicContact CZ-CG2 4.33Å; F386-V436 HydrophobicContact CE1-CB 3.97Å; F386-V436 HydrophobicContact CE1-CG1 3.81Å; F386-V436 HydrophobicContact CE1-CG2 4.48Å; F386-V436 HydrophobicContact CZ-CB 4.06Å; F386-V436 HydrophobicContact CZ-CG1 3.79Å; F386-I437 HydrophobicContact CE2-CG1 4.35Å; F386-I437 HydrophobicContact CZ-CG1 4.46Å
387	A	94.3	Very high	75.4	Confident	1 Å²	1	57.6 Å²	57.6	1%	0.008	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	117.1	174.7	0	0	0	0	0	110	V271 E353 Y354	V271-A387 HydrophobicContact CG2-CB 4.46Å; E353-A387 HydrophobicContact CB-CB 4.22Å; E353-A387 WeakPolarHBondContact CB-O 3.5Å; E353-A387 PolarHBondContact N-O 3.45Å; Y354-A387 HydrophobicContact CD1-CB 3.51Å; Y354-A387 HydrophobicContact CD2-CB 3.97Å; Y354-A387 HydrophobicContact CE1-CB 3.21Å; Y354-A387 HydrophobicContact CE2-CB 3.71Å; Y354-A387 HydrophobicContact CG-CB 3.87Å; Y354-A387 PolarHBondContact N-O 3.21Å; Y354-A387 PolarHBondContact O-N 2.84Å
388	L	92.8	Very high	73.7	Confident	6 Å²	6	62.8 Å²	62.8	3%	0.031	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	143.2	-178.9	-55.1	177	0	0	0	109.3	S269 I270 S351 I352 L429 I433	S269-L388 CarbonylContact C-O 3.57Å; S269-L388 WeakPolarHBondContact CA-O 3.48Å; S269-L388 WeakPolarHBondContact CB-O 3.33Å; I270-L388 HydrophobicContact CB-CB 4.42Å; I270-L388 PolarHBondContact N-O 3.43Å; I270-L388 PolarHBondContact O-N 2.92Å; S351-L388 CarbonylContact O-C 3.58Å; S351-L388 WeakPolarHBondContact O-CA 3.49Å; I352-L388 HydrophobicContact CG1-CD2 3.94Å; L388-L429 HydrophobicContact CD1-CB 3.86Å; L388-L429 HydrophobicContact CD1-CD1 4.11Å; L388-L429 HydrophobicContact CD1-CG 4.48Å; L388-L429 HydrophobicContact CD2-CD1 4.38Å; L388-L429 HydrophobicContact CD2-CD2 4.2Å; L388-I433 HydrophobicContact CD1-CD1 3.89Å
389	R	89.9	Confident	71.7	Confident	77 Å²	77	65.8 Å²	65.8	29%	0.291	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	124.7	169	179.7	176	170.4	173.9	-6.6	108.8	H267 S351	H267-R389 HydrophobicContact CB-CG 4.01Å; H267-R389 PolarHBondContact CD2-NE 2.67Å; H267-R389 PolarHBondContact CD2-NH1 2.64Å; H267-R389 PolarHBondContact CD2-NH2 2.76Å; H267-R389 PolarHBondContact CE1-NH2 3.5Å; H267-R389 VanDerWaalsContact CG-NE 3.3Å; H267-R389 VanDerWaalsContact CG-NH2 3.31Å; H267-R389 PolarHBondContact ND1-NH2 2.87Å; H267-R389 VanDerWaalsContact ND1-NH2 3.16Å; H267-R389 VanDerWaalsContact NE2-CZ 3.34Å; H267-R389 PolarHBondContact NE2-NH2 2.81Å; S351-R389 PolarHBondContact O-N 2.88Å
390	Y	83.2	Confident	69.5	Low	27 Å²	27	69.4 Å²	69.4	11%	0.106	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	125.2	174.8	-176.2	-115.1	0	0	0	110.1	W194 D268 I270 P392	W194-Y390 AromaticContact CD1-CE2 3.8Å; D268-Y390 HydrophobicContact CB-CD1 3.9Å; D268-Y390 HydrophobicContact CB-CG 4.43Å; D268-Y390 PolarHBondContact O-N 2.84Å; I270-Y390 HydrophobicContact CD1-CD2 3.57Å; I270-Y390 HydrophobicContact CD1-CE2 4.4Å; I270-Y390 HydrophobicContact CD1-CG 3.97Å; I270-Y390 HydrophobicContact CG1-CD2 4.48Å; I270-Y390 HydrophobicContact CG1-CG 4.4Å; Y390-P392 HydrophobicContact CD1-CB 4.46Å; Y390-P392 HydrophobicContact CE1-CB 3.84Å
391	V	72.5	Confident	67.1	Low	87 Å²	87	72 Å²	72	53%	0.527	39%	0.386	S	S	.	.			trans	-111.5	104.7	172.3	-176.7	0	0	0	0	107.1	T393	V391-T393 PolarHBondContact O-N 2.69Å
392	P	63.6	Low	64.4	Low	36 Å²	36	74.7 Å²	74.7	23%	0.234	41%	0.408	C	S	.	.			trans	-64.9	128.1	-178.4	25.2	-32.8	0	0	0	110.1	L190 Y390 T394	L190-P392 HydrophobicContact CD2-CB 3.51Å; L190-P392 HydrophobicContact CD2-CG 4.5Å; Y390-P392 HydrophobicContact CD1-CB 4.46Å; Y390-P392 HydrophobicContact CE1-CB 3.84Å; P392-T394 PolarHBondContact O-N 2.8Å
393	T	54.7	Low	61.6	Low	33 Å²	33	78 Å²	78	20%	0.202	44%	0.435	C	S	.	.			trans	-72.9	89.1	172.2	58.7	0	0	0	0	108.9	V391 T395 P422 I423	V391-T393 PolarHBondContact O-N 2.69Å; T393-T395 PolarHBondContact O-N 3.26Å; T393-P422 HydrophobicContact CG2-CB 3.29Å; T393-P422 HydrophobicContact CG2-CG 3.33Å; T393-I423 HydrophobicContact CG2-CG1 3.89Å
394	T	46.6	Very low	59	Low	93 Å²	93	85.9 Å²	85.9	57%	0.571	48%	0.476	S	S	*	.			trans	-70.3	106.2	171.8	59.6	0	0	0	0	108.5	P392 K396	P392-T394 PolarHBondContact O-N 2.8Å; T394-K396 PolarHBondContact O-N 3.47Å
395	T	38.6	Very low	56.4	Low	89 Å²	89	92.6 Å²	92.6	55%	0.546	52%	0.517	S	S	.	.	S	Bend	trans	-71.2	54.4	172.4	53.5	0	0	0	0	111.3	T393 H419	T393-T395 PolarHBondContact O-N 3.26Å; T395-H419 WeakPolarHBondContact CB-NE2 3.41Å; T395-H419 WeakPolarHBondContact CG2-NE2 3.42Å
396	K	40.3	Very low	53.5	Low	191 Å²	191	98.1 Å²	98.1	83%	0.83	56%	0.556	S	S	*	*			trans	-148.9	45.6	174.2	-69.9	-163.8	-179.6	-179.2	0	113.9	T394 K398	T394-K396 PolarHBondContact O-N 3.47Å; K396-K398 VanDerWaalsContact C-N 3.31Å
397	S	34.8	Very low	50.9	Low	119 Å²	119	103.2 Å²	103.2	83%	0.832	59%	0.592	S	S	*	*			trans	-97.8	59.3	153.6	-164.2	0	0	0	0	109.8
398	K	33	Very low	48.5	Very low	193 Å²	193	109.4 Å²	109.4	84%	0.839	63%	0.625	S	S	*	*			trans	-96.6	136.3	151.6	-79.1	-178.2	177	175.7	0	105.2	K396	K396-K398 VanDerWaalsContact C-N 3.31Å
399	S	32	Very low	46.3	Very low	114 Å²	114	115.2 Å²	115.2	80%	0.797	66%	0.656	S	S	*	*			trans	99.2	61.6	173.4	-43.3	0	0	0	0	117.3
400	F	34.1	Very low	44.1	Very low	210 Å²	210	119.3 Å²	119.3	92%	0.921	68%	0.684	S	S	*	*	S	Bend	trans	-160.4	59.6	144.3	-158.1	-103.8	0	0	0	112.6
401	S	35.6	Very low	42.2	Very low	113 Å²	113	122.8 Å²	122.8	79%	0.79	72%	0.718	S	S	*	*	S	Bend	trans	-172.8	49.4	158.3	67.3	0	0	0	0	112.1
402	T	32.7	Very low	40.6	Very low	137 Å²	137	127 Å²	127	84%	0.84	74%	0.738	S	S	*	*			trans	-144.1	67.8	169.2	47.9	0	0	0	0	109.3
403	S	35.4	Very low	39.4	Very low	102 Å²	102	128.5 Å²	128.5	71%	0.713	76%	0.759	S	S	*	*	S	Bend	trans	-159.8	127.5	158.7	57.2	0	0	0	0	104.9
404	L	39.1	Very low	38.6	Very low	169 Å²	169	134.9 Å²	134.9	89%	0.885	79%	0.792	S	S	*	*	S	Bend	trans	91.8	67.6	-171.2	-51.9	143.4	0	0	0	113.5
405	T	40	Very low	38.5	Very low	142 Å²	142	138.4 Å²	138.4	87%	0.871	81%	0.807	S	S	*	*				180	114.2	117.4	45.7	0	0	0	0	108.8
406	S	35.6	Very low	38.8	Very low	120 Å²	120	141.1 Å²	141.1	84%	0.839	82%	0.818	S	S	*	*			trans	-48.3	154.7	161.3	-65.8	0	0	0	0	112.3
407	S	39.5	Very low	38.9	Very low	108 Å²	108	140.3 Å²	140.3	76%	0.755	82%	0.817	S	S	*	*			trans	99.4	109.5	140.5	-149	0	0	0	0	117.4
408	N	44	Very low	39.2	Very low	131 Å²	131	142.9 Å²	142.9	70%	0.701	82%	0.816	S	S	*	*			trans	75.2	117	139.4	-105.8	-1.2	0	0	0	120.8
409	N	47.5	Very low	39.5	Very low	129 Å²	129	138.9 Å²	138.9	69%	0.69	80%	0.8	S	S	*	*			trans	72.7	122.6	134.8	-65.6	-18	0	0	0	120
410	N	42.9	Very low	40	Very low	163 Å²	163	138.5 Å²	138.5	87%	0.872	79%	0.786	S	S	*	*			trans	50.6	104.4	144.5	-84.2	-9.8	0	0	0	117.6
411	A	44	Very low	40.7	Very low	100 Å²	100	134.5 Å²	134.5	83%	0.826	77%	0.77	S	S	*	*				-173.7	125.2	124.5	0	0	0	0	0	110.7	G413	A411-G413 PolarHBondContact O-N 3.38Å
412	N	38.2	Very low	41.6	Very low	175 Å²	175	132 Å²	132	94%	0.936	75%	0.751	S	S	*	*			trans	-52.2	128.6	160.8	-69.6	-33.1	0	0	0	110.4
413	G	38	Very low	42.7	Very low	67 Å²	67	128.5 Å²	128.5	69%	0.691	73%	0.726	S	S	*	*			trans	-173	103.6	174.2	0	0	0	0	0	112.4	A411 L415	A411-G413 PolarHBondContact O-N 3.38Å; G413-L415 PolarHBondContact O-N 2.83Å
414	N	39	Very low	43.9	Very low	167 Å²	167	128.9 Å²	128.9	89%	0.893	72%	0.717	S	S	*	*			trans	-9.4	108.6	168.5	-81.2	-20.6	0	0	0	117.3
415	L	43.5	Very low	45.4	Very low	167 Å²	167	122.1 Å²	122.1	87%	0.874	68%	0.684	S	S	*	*			trans	-125.6	44.9	175	-164.8	64.9	0	0	0	112.7	G413	G413-L415 PolarHBondContact O-N 2.83Å
416	N	44.9	Very low	47	Very low	147 Å²	147	116.1 Å²	116.1	79%	0.786	65%	0.648	S	S	*	*			trans	-122.6	3.1	-176.5	-76.8	-21	0	0	0	116.1
417	Q	43.7	Very low	49.2	Very low	173 Å²	173	112.2 Å²	112.2	81%	0.808	62%	0.62	S	S	*	*	S	Bend	trans	-90.6	-11.2	-169.7	-94.4	177	9	0	0	116.9
418	H	40.7	Very low	51.5	Low	173 Å²	173	108.3 Å²	108.3	80%	0.801	59%	0.594	S	S	*	*	S	Bend	trans	-91.8	-3	-169.1	-141.7	-61.8	0	0	0	115.1
419	H	39.9	Very low	53.7	Low	109 Å²	109	102.5 Å²	102.5	51%	0.505	56%	0.563	S	S	.	*	S	Bend	trans	-98.9	-11.7	-174	-144.8	62.9	0	0	0	115	T395	T395-H419 WeakPolarHBondContact CB-NE2 3.41Å; T395-H419 WeakPolarHBondContact CG2-NE2 3.42Å
420	Q	42.3	Very low	55.7	Low	107 Å²	107	96.4 Å²	96.4	50%	0.5	53%	0.53	S	S	.	.	S	Bend	trans	-96.3	-20.8	-170.7	-137	73.8	3.8	0	0	114.6	P422 I423 E424	Q420-P422 VanDerWaalsContact C-CD 3.49Å; Q420-I423 PolarHBondContact O-N 2.81Å; Q420-E424 WeakPolarHBondContact CB-OE1 3.42Å; Q420-E424 HydrophobicContact CG-CG 4.33Å; Q420-E424 WeakPolarHBondContact CG-OE1 3.44Å; Q420-E424 PolarHBondContact O-N 3.31Å
421	Q	47.7	Very low	58	Low	125 Å²	125	93.7 Å²	93.7	58%	0.584	51%	0.512	S	S	*	.	H	α-helix	trans	-58.4	-37.4	-162.6	-63	-144.8	-25.8	0	0	116.9	S425	Q421-S425 PolarHBondContact O-N 3.49Å; Q421-S425 VanDerWaalsContact O-N 3.15Å
422	P	53.9	Low	60.3	Low	62 Å²	62	89.5 Å²	89.5	40%	0.403	48%	0.475	S	S	.	.	H	α-helix	trans	-88.2	-16.9	-173.4	7.5	9.5	0	0	0	113.7	T393 Q420 A426	T393-P422 HydrophobicContact CG2-CB 3.29Å; T393-P422 HydrophobicContact CG2-CG 3.33Å; Q420-P422 VanDerWaalsContact C-CD 3.49Å; P422-A426 PolarHBondContact O-N 3.46Å
423	I	56.4	Low	62.9	Low	63 Å²	63	81.2 Å²	81.2	32%	0.323	43%	0.431	S	S	.	.	H	α-helix	trans	-73.8	-40.5	169.2	-60.2	174.5	0	0	0	109.4	A197 T393 Q420 S425 A426 T427	A197-I423 HydrophobicContact CB-CG2 4.14Å; T393-I423 HydrophobicContact CG2-CG1 3.89Å; Q420-I423 PolarHBondContact O-N 2.81Å; I423-S425 PolarHBondContact O-N 2.78Å; I423-A426 PolarHBondContact O-N 2.79Å; I423-A426 VanDerWaalsContact O-N 3.16Å; I423-T427 PolarHBondContact O-N 2.92Å; I423-T427 VanDerWaalsContact O-N 3.14Å; I423-T427 PolarHBondContact O-OG1 3.42Å
424	E	60.9	Low	65.5	Low	109 Å²	109	79.4 Å²	79.4	51%	0.509	40%	0.404	S	S	.	.	H	α-helix	trans	-62.1	-32.5	173.4	-67.2	173.1	179.4	0	0	112.3	Q420 T427 A428	Q420-E424 WeakPolarHBondContact CB-OE1 3.42Å; Q420-E424 HydrophobicContact CG-CG 4.33Å; Q420-E424 WeakPolarHBondContact CG-OE1 3.44Å; Q420-E424 PolarHBondContact O-N 3.31Å; E424-T427 WeakPolarHBondContact CA-OG1 3.42Å; E424-T427 PolarHBondContact O-OG1 2.85Å; E424-A428 WeakPolarHBondContact O-CB 3.34Å; E424-A428 PolarHBondContact O-N 2.82Å
425	S	71.5	Confident	68.1	Low	28 Å²	28	75.4 Å²	75.4	20%	0.196	38%	0.377	C	S	.	.	H	α-helix	trans	-65.7	-40.8	173.5	177.9	0	0	0	0	112.3	F348 Q421 I423 A428 L429	F348-S425 WeakPolarHBondContact CE1-OG 3.49Å; Q421-S425 PolarHBondContact O-N 3.49Å; Q421-S425 VanDerWaalsContact O-N 3.15Å; I423-S425 PolarHBondContact O-N 2.78Å; S425-A428 PolarHBondContact O-N 2.86Å; S425-L429 WeakPolarHBondContact O-CG 3.26Å; S425-L429 PolarHBondContact O-N 2.87Å; S425-L429 VanDerWaalsContact O-N 3.14Å
426	A	73.6	Confident	70.4	Confident	15 Å²	15	67.7 Å²	67.7	12%	0.124	34%	0.337	C	S	.	.	H	α-helix	trans	-68.8	-40.9	179.8	0	0	0	0	0	111.8	H198 P422 I423 L429 F430	H198-A426 WeakPolarHBondContact NE2-CB 3.48Å; P422-A426 PolarHBondContact O-N 3.46Å; I423-A426 PolarHBondContact O-N 2.79Å; I423-A426 VanDerWaalsContact O-N 3.16Å; A426-L429 WeakPolarHBondContact O-CB 3.3Å; A426-L429 PolarHBondContact O-N 2.8Å; A426-F430 WeakPolarHBondContact O-CD2 3.3Å; A426-F430 PolarHBondContact O-N 2.81Å
427	T	82	Confident	72.7	Confident	38 Å²	38	60.8 Å²	60.8	23%	0.233	30%	0.3	C	S	.	.	H	α-helix	trans	-65	-39.8	175.4	56.3	0	0	0	0	111.7	I423 E424 L429 F430 H431	I423-T427 PolarHBondContact O-N 2.92Å; I423-T427 VanDerWaalsContact O-N 3.14Å; I423-T427 PolarHBondContact O-OG1 3.42Å; E424-T427 WeakPolarHBondContact CA-OG1 3.42Å; E424-T427 PolarHBondContact O-OG1 2.85Å; T427-L429 VanDerWaalsContact C-N 3.29Å; T427-L429 PolarHBondContact O-N 3.3Å; T427-F430 PolarHBondContact O-N 2.81Å; T427-F430 VanDerWaalsContact O-N 3.13Å; T427-H431 PolarHBondContact O-CD2 3Å; T427-H431 PolarHBondContact O-N 2.9Å
428	A	87.2	Confident	75	Confident	26 Å²	26	55.4 Å²	55.4	22%	0.215	28%	0.275	C	S	.	.	H	α-helix	trans	-58.9	-38.1	173.6	0	0	0	0	0	112.7	F348 E424 S425 H431 F432	F348-A428 HydrophobicContact CZ-CB 4.1Å; E424-A428 WeakPolarHBondContact O-CB 3.34Å; E424-A428 PolarHBondContact O-N 2.82Å; S425-A428 PolarHBondContact O-N 2.86Å; A428-H431 PolarHBondContact O-N 3.43Å; A428-F432 PolarHBondContact O-N 3.4Å
429	L	89.6	Confident	77.4	Confident	9 Å²	9	50.2 Å²	50.2	5%	0.047	25%	0.25	C	C	.	.	H	α-helix	trans	-64.2	-38.7	175.1	-68.4	168	0	0	0	112.2	F344 F348 I352 L388 S425 A426 T427 F432 I433	F344-L429 HydrophobicContact CE1-CD2 3.91Å; F344-L429 HydrophobicContact CZ-CD2 4.1Å; F348-L429 HydrophobicContact CB-CD2 4.01Å; F348-L429 HydrophobicContact CD1-CD2 4.32Å; F348-L429 HydrophobicContact CG-CD2 4.15Å; I352-L429 HydrophobicContact CD1-CD2 4.26Å; I352-L429 HydrophobicContact CG1-CD2 3.99Å; L388-L429 HydrophobicContact CD1-CB 3.86Å; L388-L429 HydrophobicContact CD1-CD1 4.11Å; L388-L429 HydrophobicContact CD1-CG 4.48Å; L388-L429 HydrophobicContact CD2-CD1 4.38Å; L388-L429 HydrophobicContact CD2-CD2 4.2Å; S425-L429 WeakPolarHBondContact O-CG 3.26Å; S425-L429 PolarHBondContact O-N 2.87Å; S425-L429 VanDerWaalsContact O-N 3.14Å; A426-L429 WeakPolarHBondContact O-CB 3.3Å; A426-L429 PolarHBondContact O-N 2.8Å; T427-L429 VanDerWaalsContact C-N 3.29Å; T427-L429 PolarHBondContact O-N 3.3Å; L429-F432 WeakPolarHBondContact O-CB 3.2Å; L429-F432 PolarHBondContact O-N 3.14Å; L429-I433 WeakPolarHBondContact O-CG1 3.49Å; L429-I433 PolarHBondContact O-N 3.4Å
430	F	90.6	Very high	79.9	Confident	2 Å²	2	45.1 Å²	45.1	1%	0.009	23%	0.226	C	C	.	.	H	α-helix	trans	-69	-39.1	175.5	-87.8	-87.3	0	0	0	112.5	W194 H198 L201 I245 I270 V272 A426 T427 F432 I433 F434	W194-F430 AromaticContact CZ2-CE2 3.89Å; W194-F430 HydrophobicContact CZ2-CE2 3.89Å; W194-F430 AromaticContact CZ2-CZ 3.66Å; W194-F430 HydrophobicContact CZ2-CZ 3.66Å; H198-F430 AromaticContact CD2-CD2 3.38Å; H198-F430 WeakPolarHBondContact CD2-CD2 3.33Å; H198-F430 AromaticContact CD2-CE2 3.69Å; H198-F430 AromaticContact NE2-CD2 3.69Å; H198-F430 AromaticContact NE2-CE2 3.93Å; L201-F430 HydrophobicContact CD2-CB 3.49Å; L201-F430 VanDerWaalsContact CD2-CB 3.49Å; L201-F430 HydrophobicContact CD2-CG 4.37Å; I245-F430 HydrophobicContact CD1-CE1 3.67Å; I245-F430 HydrophobicContact CD1-CZ 4.08Å; I245-F430 HydrophobicContact CG1-CE1 4.31Å; I245-F430 HydrophobicContact CG2-CZ 4.42Å; I270-F430 HydrophobicContact CG2-CZ 4.45Å; V272-F430 HydrophobicContact CG2-CE1 3.96Å; V272-F430 HydrophobicContact CG2-CZ 3.91Å; A426-F430 WeakPolarHBondContact O-CD2 3.3Å; A426-F430 PolarHBondContact O-N 2.81Å; T427-F430 PolarHBondContact O-N 2.81Å; T427-F430 VanDerWaalsContact O-N 3.13Å; F430-F432 VanDerWaalsContact C-N 3.26Å; F430-F432 PolarHBondContact O-N 2.75Å; F430-I433 HydrophobicContact CD1-CD1 4.43Å; F430-I433 WeakPolarHBondContact O-CB 3.36Å; F430-I433 PolarHBondContact O-N 2.81Å; F430-I433 VanDerWaalsContact O-N 3.16Å; F430-F434 HydrophobicContact CB-CE2 4.36Å; F430-F434 HydrophobicContact CD1-CZ 4.33Å; F430-F434 WeakPolarHBondContact O-CD2 3.27Å; F430-F434 WeakPolarHBondContact O-CG 3.25Å; F430-F434 PolarHBondContact O-N 3.36Å
431	H	91	Very high	82.2	Confident	106 Å²	106	43.3 Å²	43.3	49%	0.491	22%	0.215	S	C	.	.	H	α-helix	trans	-58.6	-40.1	170.5	-73.3	-65.5	0	0	0	112	L201 T427 A428 F434 Y435	L201-H431 WeakPolarHBondContact CD1-CE1 3.46Å; T427-H431 PolarHBondContact O-CD2 3Å; T427-H431 PolarHBondContact O-N 2.9Å; A428-H431 PolarHBondContact O-N 3.43Å; H431-F434 PolarHBondContact O-N 2.98Å; H431-Y435 WeakPolarHBondContact O-CB 3.27Å; H431-Y435 PolarHBondContact O-N 2.93Å
432	F	91.7	Very high	84.2	Confident	12 Å²	12	45.4 Å²	45.4	5%	0.053	22%	0.217	C	C	.	.	H	α-helix	trans	-63	-43.5	173.4	170.3	-98.5	0	0	0	112.6	V341 F344 L345 L355 A428 L429 F430 F434 Y435 V436	V341-F432 HydrophobicContact CB-CE2 4.5Å; V341-F432 HydrophobicContact CG1-CE2 3.85Å; V341-F432 HydrophobicContact CG1-CZ 4.05Å; F344-F432 HydrophobicContact CB-CD2 4.21Å; F344-F432 HydrophobicContact CB-CE2 4.28Å; F344-F432 HydrophobicContact CD1-CB 3.98Å; F344-F432 HydrophobicContact CD1-CD1 4.11Å; F344-F432 AromaticContact CD1-CD2 3.23Å; F344-F432 HydrophobicContact CD1-CD2 3.23Å; F344-F432 HydrophobicContact CD1-CE1 4.43Å; F344-F432 AromaticContact CD1-CE2 3.6Å; F344-F432 HydrophobicContact CD1-CE2 3.6Å; F344-F432 AromaticContact CD1-CG 3.51Å; F344-F432 HydrophobicContact CD1-CG 3.51Å; F344-F432 HydrophobicContact CD1-CZ 4.2Å; F344-F432 HydrophobicContact CD2-CD2 4.31Å; F344-F432 HydrophobicContact CE1-CB 3.38Å; F344-F432 AromaticContact CE1-CD1 3.8Å; F344-F432 HydrophobicContact CE1-CD1 3.8Å; F344-F432 AromaticContact CE1-CD2 3.57Å; F344-F432 HydrophobicContact CE1-CD2 3.57Å; F344-F432 HydrophobicContact CE1-CE1 4.46Å; F344-F432 HydrophobicContact CE1-CE2 4.25Å; F344-F432 AromaticContact CE1-CG 3.29Å; F344-F432 HydrophobicContact CE1-CG 3.29Å; F344-F432 HydrophobicContact CE2-CB 3.99Å; F344-F432 AromaticContact CG-CD2 3.66Å; F344-F432 HydrophobicContact CG-CD2 3.66Å; F344-F432 HydrophobicContact CG-CE2 4.12Å; F344-F432 HydrophobicContact CG-CG 4.24Å; F344-F432 HydrophobicContact CZ-CB 3.4Å; F344-F432 HydrophobicContact CZ-CD2 4.25Å; F344-F432 AromaticContact CZ-CG 3.88Å; F344-F432 HydrophobicContact CZ-CG 3.88Å; L345-F432 HydrophobicContact CD2-CE1 4.36Å; L345-F432 HydrophobicContact CD2-CZ 3.85Å; L345-F432 HydrophobicContact CG-CZ 4.41Å; L355-F432 HydrophobicContact CD1-CE1 4.23Å; L355-F432 HydrophobicContact CD1-CZ 4.3Å; A428-F432 PolarHBondContact O-N 3.4Å; L429-F432 WeakPolarHBondContact O-CB 3.2Å; L429-F432 PolarHBondContact O-N 3.14Å; F430-F432 VanDerWaalsContact C-N 3.26Å; F430-F432 PolarHBondContact O-N 2.75Å; F432-F434 PolarHBondContact O-N 3.16Å; F432-Y435 WeakPolarHBondContact O-CB 3.4Å; F432-Y435 PolarHBondContact O-N 2.95Å; F432-V436 HydrophobicContact CD1-CG2 4.36Å; F432-V436 HydrophobicContact CD2-CG2 4.23Å; F432-V436 HydrophobicContact CE1-CG2 3.92Å; F432-V436 HydrophobicContact CE2-CG2 3.8Å; F432-V436 HydrophobicContact CZ-CG2 3.62Å; F432-V436 WeakPolarHBondContact O-CG2 3.38Å; F432-V436 PolarHBondContact O-N 3.09Å
433	I	93	Very high	86	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-56.9	-49.8	175.7	-71.5	168.2	0	0	0	110.2	V272 F386 L388 L429 F430 Y435 V436 I437	V272-I433 HydrophobicContact CB-CD1 4.2Å; V272-I433 HydrophobicContact CG1-CG2 4.45Å; V272-I433 HydrophobicContact CG2-CD1 3.86Å; F386-I433 HydrophobicContact CB-CD1 4.01Å; F386-I433 HydrophobicContact CB-CG1 4.1Å; F386-I433 HydrophobicContact CD1-CG1 3.8Å; F386-I433 HydrophobicContact CD2-CG1 4.37Å; F386-I433 HydrophobicContact CD2-CG2 4.04Å; F386-I433 HydrophobicContact CE1-CG1 4.33Å; F386-I433 HydrophobicContact CE2-CG2 4.02Å; F386-I433 HydrophobicContact CG-CD1 4.25Å; F386-I433 HydrophobicContact CG-CG1 3.85Å; F386-I433 HydrophobicContact CG-CG2 4.37Å; F386-I433 HydrophobicContact CZ-CG2 4.33Å; L388-I433 HydrophobicContact CD1-CD1 3.89Å; L429-I433 WeakPolarHBondContact O-CG1 3.49Å; L429-I433 PolarHBondContact O-N 3.4Å; F430-I433 HydrophobicContact CD1-CD1 4.43Å; F430-I433 WeakPolarHBondContact O-CB 3.36Å; F430-I433 PolarHBondContact O-N 2.81Å; F430-I433 VanDerWaalsContact O-N 3.16Å; I433-Y435 VanDerWaalsContact C-N 3.33Å; I433-Y435 PolarHBondContact O-N 2.96Å; I433-V436 PolarHBondContact O-N 2.87Å; I433-V436 VanDerWaalsContact O-N 3.14Å; I433-I437 HydrophobicContact CG2-CD1 3.68Å; I433-I437 HydrophobicContact CG2-CG1 4.26Å; I433-I437 VanDerWaalsContact O-CG1 3.27Å; I433-I437 WeakPolarHBondContact O-CG1 3.47Å; I433-I437 PolarHBondContact O-N 2.89Å
434	F	92.4	Very high	87.7	Confident	29 Å²	29	46.9 Å²	46.9	13%	0.127	21%	0.211	C	C	.	.	H	α-helix	trans	-61.2	-41.1	178.7	-60.2	-41.2	0	0	0	112.8	L201 L202 N205 F206 M243 F430 H431 F432 V436 I437 E438	L201-F434 HydrophobicContact CD1-CE2 4.3Å; L201-F434 HydrophobicContact CD2-CE2 4.13Å; L201-F434 HydrophobicContact CG-CE2 3.97Å; L202-F434 HydrophobicContact CD2-CZ 4.12Å; N205-F434 HydrophobicContact CB-CZ 4.4Å; F206-F434 AromaticContact CE2-CE1 3.61Å; F206-F434 HydrophobicContact CE2-CE1 3.61Å; F206-F434 AromaticContact CE2-CZ 3.98Å; F206-F434 HydrophobicContact CE2-CZ 3.98Å; F206-F434 HydrophobicContact CZ-CE1 4.1Å; M243-F434 HydrophobicContact CE-CE1 4.34Å; M243-F434 HydrophobicContact SD-CE1 4.22Å; F430-F434 HydrophobicContact CB-CE2 4.36Å; F430-F434 HydrophobicContact CD1-CZ 4.33Å; F430-F434 WeakPolarHBondContact O-CD2 3.27Å; F430-F434 WeakPolarHBondContact O-CG 3.25Å; F430-F434 PolarHBondContact O-N 3.36Å; H431-F434 PolarHBondContact O-N 2.98Å; F432-F434 PolarHBondContact O-N 3.16Å; F434-V436 VanDerWaalsContact C-N 3.33Å; F434-V436 PolarHBondContact O-N 2.73Å; F434-I437 HydrophobicContact CD1-CD1 4.18Å; F434-I437 PolarHBondContact O-N 3.33Å; F434-E438 PolarHBondContact O-N 3.09Å
435	Y	92.9	Very high	89.2	Confident	84 Å²	84	42.5 Å²	42.5	33%	0.329	19%	0.192	S	C	.	.	H	α-helix	trans	-59.1	-43.5	174.3	176.7	-94.1	0	0	0	112.2	L340 V341 H431 F432 I433 K439	L340-Y435 HydrophobicContact CD2-CE1 4.11Å; V341-Y435 HydrophobicContact CG2-CD1 4.25Å; V341-Y435 HydrophobicContact CG2-CE1 3.62Å; H431-Y435 WeakPolarHBondContact O-CB 3.27Å; H431-Y435 PolarHBondContact O-N 2.93Å; F432-Y435 WeakPolarHBondContact O-CB 3.4Å; F432-Y435 PolarHBondContact O-N 2.95Å; I433-Y435 VanDerWaalsContact C-N 3.33Å; I433-Y435 PolarHBondContact O-N 2.96Å; Y435-K439 WeakPolarHBondContact O-CB 3.36Å; Y435-K439 PolarHBondContact O-N 3.3Å
436	V	93	Very high	90.3	Very high	4 Å²	4	43.3 Å²	43.3	2%	0.024	20%	0.197	C	C	.	.	H	α-helix	trans	-69.2	-41.3	179	176.2	0	0	0	0	111.5	F357 F386 F432 I433 F434 E438 K439 V440	F357-V436 HydrophobicContact CE1-CG1 4.45Å; F357-V436 HydrophobicContact CE2-CG1 4.3Å; F357-V436 HydrophobicContact CZ-CG1 3.75Å; F386-V436 HydrophobicContact CE1-CB 3.97Å; F386-V436 HydrophobicContact CE1-CG1 3.81Å; F386-V436 HydrophobicContact CE1-CG2 4.48Å; F386-V436 HydrophobicContact CZ-CB 4.06Å; F386-V436 HydrophobicContact CZ-CG1 3.79Å; F432-V436 HydrophobicContact CD1-CG2 4.36Å; F432-V436 HydrophobicContact CD2-CG2 4.23Å; F432-V436 HydrophobicContact CE1-CG2 3.92Å; F432-V436 HydrophobicContact CE2-CG2 3.8Å; F432-V436 HydrophobicContact CZ-CG2 3.62Å; F432-V436 WeakPolarHBondContact O-CG2 3.38Å; F432-V436 PolarHBondContact O-N 3.09Å; I433-V436 PolarHBondContact O-N 2.87Å; I433-V436 VanDerWaalsContact O-N 3.14Å; F434-V436 VanDerWaalsContact C-N 3.33Å; F434-V436 PolarHBondContact O-N 2.73Å; V436-E438 VanDerWaalsContact C-N 3.33Å; V436-E438 PolarHBondContact O-N 3.16Å; V436-K439 PolarHBondContact O-N 3.45Å; V436-V440 HydrophobicContact CG1-CG2 4.21Å; V436-V440 WeakPolarHBondContact O-CB 3.36Å; V436-V440 WeakPolarHBondContact O-CG2 3.48Å; V436-V440 PolarHBondContact O-N 2.97Å
437	I	93	Very high	91.2	Very high	2 Å²	2	52 Å²	52	1%	0.01	23%	0.232	C	C	.	.	H	α-helix	trans	-55.9	-50.2	174.8	-67.6	167	0	0	0	109.8	H239 C240 V274 M276 L384 F386 I433 F434 K439 V440 R441	H239-I437 HydrophobicContact CB-CG2 3.87Å; H239-I437 WeakPolarHBondContact O-CG2 3.32Å; C240-I437 HydrophobicContact CB-CG2 4.34Å; V274-I437 HydrophobicContact CB-CD1 4.46Å; V274-I437 HydrophobicContact CG1-CD1 4.04Å; V274-I437 HydrophobicContact CG1-CG1 4.28Å; V274-I437 HydrophobicContact CG2-CD1 3.68Å; V274-I437 HydrophobicContact CG2-CG1 4.18Å; M276-I437 HydrophobicContact CE-CB 4.47Å; M276-I437 HydrophobicContact CE-CG2 3.53Å; M276-I437 HydrophobicContact SD-CG2 4.29Å; L384-I437 HydrophobicContact CD1-CG1 4.35Å; F386-I437 HydrophobicContact CE2-CG1 4.35Å; F386-I437 HydrophobicContact CZ-CG1 4.46Å; I433-I437 HydrophobicContact CG2-CD1 3.68Å; I433-I437 HydrophobicContact CG2-CG1 4.26Å; I433-I437 VanDerWaalsContact O-CG1 3.27Å; I433-I437 WeakPolarHBondContact O-CG1 3.47Å; I433-I437 PolarHBondContact O-N 2.89Å; F434-I437 HydrophobicContact CD1-CD1 4.18Å; F434-I437 PolarHBondContact O-N 3.33Å; I437-K439 VanDerWaalsContact C-N 3.31Å; I437-K439 PolarHBondContact O-N 3.26Å; I437-V440 PolarHBondContact O-N 3.43Å; I437-R441 WeakPolarHBondContact O-CB 3.25Å; I437-R441 PolarHBondContact O-N 3Å
438	E	91.6	Very high	91.8	Very high	61 Å²	61	57.9 Å²	57.9	29%	0.285	26%	0.257	S	S	.	.	H	α-helix	trans	-61.6	-41	178	-169	-171.8	171.2	0	0	111.8	F434 V436 R441 R442	F434-E438 PolarHBondContact O-N 3.09Å; V436-E438 VanDerWaalsContact C-N 3.33Å; V436-E438 PolarHBondContact O-N 3.16Å; E438-R441 PolarHBondContact O-N 2.97Å; E438-R442 WeakPolarHBondContact O-CG 3.41Å; E438-R442 PolarHBondContact O-N 3.08Å; E438-R442 VanDerWaalsContact O-N 3.07Å; E438-R442 IonicContact OE1-CZ 2.67Å; E438-R442 IonicContact OE1-NE 2.64Å; E438-R442 PolarHBondContact OE1-NE 2.97Å; E438-R442 IonicContact OE1-NH2 3.87Å; E438-R442 PolarHBondContact OE1-NH2 3.14Å
439	K	91.5	Very high	92	Very high	64 Å²	64	56.8 Å²	56.8	28%	0.278	25%	0.249	S	C	.	.	H	α-helix	trans	-64.4	-43.4	179.3	-171	65.7	176.7	176	0	112.2	A335 I336 N338 Y435 V436 I437 R442 F443	A335-K439 WeakPolarHBondContact O-CE 3.44Å; I336-K439 HydrophobicContact CD1-CG 4.46Å; N338-K439 PolarHBondContact ND2-NZ 3.06Å; Y435-K439 WeakPolarHBondContact O-CB 3.36Å; Y435-K439 PolarHBondContact O-N 3.3Å; V436-K439 PolarHBondContact O-N 3.45Å; I437-K439 VanDerWaalsContact C-N 3.31Å; I437-K439 PolarHBondContact O-N 3.26Å; K439-R442 PolarHBondContact O-N 3.38Å; K439-F443 WeakPolarHBondContact O-CB 3.48Å; K439-F443 PolarHBondContact O-N 3.05Å; K439-F443 VanDerWaalsContact O-N 3.09Å
440	V	92.3	Very high	92.2	Very high	1 Å²	1	62.4 Å²	62.4	1%	0.006	27%	0.272	C	S	.	.	H	α-helix	trans	-62.2	-45.6	176.5	166.3	0	0	0	0	110.5	M281 W284 I336 L384 V436 I437 R442 F443	M281-V440 HydrophobicContact CG-CG1 4.29Å; M281-V440 HydrophobicContact SD-CG1 4.08Å; W284-V440 HydrophobicContact CH2-CG1 4.31Å; W284-V440 HydrophobicContact CH2-CG2 4.1Å; W284-V440 HydrophobicContact CZ2-CG1 3.93Å; W284-V440 HydrophobicContact CZ2-CG2 4.35Å; I336-V440 HydrophobicContact CD1-CG2 3.81Å; L384-V440 HydrophobicContact CD1-CB 4.17Å; L384-V440 HydrophobicContact CD1-CG1 4.01Å; L384-V440 HydrophobicContact CD1-CG2 4.26Å; L384-V440 HydrophobicContact CD2-CG1 4.12Å; V436-V440 HydrophobicContact CG1-CG2 4.21Å; V436-V440 WeakPolarHBondContact O-CB 3.36Å; V436-V440 WeakPolarHBondContact O-CG2 3.48Å; V436-V440 PolarHBondContact O-N 2.97Å; I437-V440 PolarHBondContact O-N 3.43Å; V440-R442 VanDerWaalsContact C-N 3.31Å; V440-R442 PolarHBondContact O-N 3.2Å; V440-F443 PolarHBondContact O-N 3.41Å; V440-F443 VanDerWaalsContact O-N 3.15Å
441	R	91	Very high	92.4	Very high	69 Å²	69	65.2 Å²	65.2	26%	0.26	30%	0.296	S	S	.	.	H	α-helix	trans	-61.1	-37.1	178.8	-161.9	-175.2	78	95.7	-4.5	113.4	M276 E280 I437 E438	M276-R441 HydrophobicContact CE-CB 4.16Å; E280-R441 HydrophobicContact CB-CG 4.1Å; E280-R441 HydrophobicContact CG-CG 4.39Å; E280-R441 WeakPolarHBondContact OE1-CD 3.17Å; E280-R441 IonicContact OE1-CZ 2.87Å; E280-R441 IonicContact OE1-NH1 3.07Å; E280-R441 PolarHBondContact OE1-NH1 3.07Å; E280-R441 VanDerWaalsContact OE2-CD 3.29Å; E280-R441 WeakPolarHBondContact OE2-CD 3.3Å; E280-R441 WeakPolarHBondContact OE2-CG 3.34Å; I437-R441 WeakPolarHBondContact O-CB 3.25Å; I437-R441 PolarHBondContact O-N 3Å; E438-R441 PolarHBondContact O-N 2.97Å
442	R	90.1	Very high	92.5	Very high	169 Å²	169	64.9 Å²	64.9	64%	0.638	29%	0.293	S	S	*	.	H	α-helix	trans	-78.7	-21.4	177.8	-70.6	175.7	-178.7	-103.8	6.3	113.1	E438 K439 V440	E438-R442 WeakPolarHBondContact O-CG 3.41Å; E438-R442 PolarHBondContact O-N 3.08Å; E438-R442 VanDerWaalsContact O-N 3.07Å; E438-R442 IonicContact OE1-CZ 2.67Å; E438-R442 IonicContact OE1-NE 2.64Å; E438-R442 PolarHBondContact OE1-NE 2.97Å; E438-R442 IonicContact OE1-NH2 3.87Å; E438-R442 PolarHBondContact OE1-NH2 3.14Å; K439-R442 PolarHBondContact O-N 3.38Å; V440-R442 VanDerWaalsContact C-N 3.31Å; V440-R442 PolarHBondContact O-N 3.2Å
443	F	91.5	Very high	92.6	Very high	28 Å²	28	64.6 Å²	64.6	12%	0.123	29%	0.292	C	S	.	.			trans	-79.8	131.2	-176.7	176.2	-109.5	0	0	0	110.9	W284 V332 A335 I336 K439 V440 L445	W284-F443 HydrophobicContact CZ2-CD1 4.5Å; V332-F443 HydrophobicContact CB-CE1 4.35Å; V332-F443 HydrophobicContact CG1-CE1 4.12Å; V332-F443 HydrophobicContact CG2-CE1 4.04Å; V332-F443 HydrophobicContact CG2-CZ 4.41Å; A335-F443 HydrophobicContact CB-CD2 3.48Å; A335-F443 VanDerWaalsContact CB-CD2 3.48Å; A335-F443 HydrophobicContact CB-CE2 3.15Å; A335-F443 HydrophobicContact CB-CG 4.32Å; A335-F443 HydrophobicContact CB-CZ 3.77Å; I336-F443 HydrophobicContact CD1-CB 4.24Å; I336-F443 HydrophobicContact CD1-CD1 4.32Å; I336-F443 HydrophobicContact CD1-CG 4.33Å; K439-F443 WeakPolarHBondContact O-CB 3.48Å; K439-F443 PolarHBondContact O-N 3.05Å; K439-F443 VanDerWaalsContact O-N 3.09Å; V440-F443 PolarHBondContact O-N 3.41Å; V440-F443 VanDerWaalsContact O-N 3.15Å; F443-L445 HydrophobicContact CD1-CD1 4.46Å; F443-L445 HydrophobicContact CE1-CD1 3.76Å; F443-L445 HydrophobicContact CE1-CG 4.21Å; F443-L445 HydrophobicContact CZ-CD1 4.44Å; F443-L445 HydrophobicContact CZ-CG 4.44Å
444	R	91.8	Very high	92.7	Very high	128 Å²	128	70.1 Å²	70.1	48%	0.483	32%	0.318	S	S	.	.			trans	-125.9	140.5	173.2	-65.8	-64.9	-177.1	158.5	-1.9	109	S279 E280 D282	S279-R444 PolarHBondContact O-NH1 2.69Å; S279-R444 PolarHBondContact O-NH2 2.97Å; E280-R444 PolarHBondContact O-NH2 2.96Å; D282-R444 IonicContact OD1-CZ 2.76Å; D282-R444 IonicContact OD1-NH1 2.73Å; D282-R444 PolarHBondContact OD1-NH1 3.48Å; D282-R444 VanDerWaalsContact OD2-CA 3.3Å; D282-R444 WeakPolarHBondContact OD2-CA 3.26Å; D282-R444 WeakPolarHBondContact OD2-CD 3.43Å
445	L	91.8	Very high	92.7	Very high	18 Å²	18	76.2 Å²	76.2	9%	0.094	34%	0.341	C	S	.	.			trans	-70.7	149.7	179.3	-86.4	82.6	0	0	0	110.7	D282 W284 I329 F443 K450	D282-L445 HydrophobicContact CB-CD1 3.48Å; D282-L445 VanDerWaalsContact CB-CD1 3.48Å; D282-L445 PolarHBondContact OD2-N 2.81Å; W284-L445 HydrophobicContact CG-CD1 4.09Å; I329-L445 HydrophobicContact CD1-CD2 3.49Å; I329-L445 VanDerWaalsContact CD1-CD2 3.49Å; I329-L445 HydrophobicContact CG2-CD2 4.36Å; F443-L445 HydrophobicContact CD1-CD1 4.46Å; F443-L445 HydrophobicContact CE1-CD1 3.76Å; F443-L445 HydrophobicContact CE1-CG 4.21Å; F443-L445 HydrophobicContact CZ-CD1 4.44Å; F443-L445 HydrophobicContact CZ-CG 4.44Å; L445-K450 HydrophobicContact CB-CB 4.39Å
446	S	93.8	Very high	92.8	Very high	44 Å²	44	73.9 Å²	73.9	31%	0.308	33%	0.334	S	S	.	.			trans	-55.6	159.3	164.3	73.5	0	0	0	0	111.4	E331 E448 G449 K450	E331-S446 VanDerWaalsContact CD-OG 3.29Å; E331-S446 WeakPolarHBondContact OE1-CB 3.19Å; E331-S446 PolarHBondContact OE1-N 3.24Å; E331-S446 PolarHBondContact OE1-OG 2.86Å; E331-S446 WeakPolarHBondContact OE2-CB 3.1Å; E331-S446 PolarHBondContact OE2-OG 3.43Å; S446-E448 PolarHBondContact O-N 2.91Å; S446-G449 PolarHBondContact O-N 2.89Å; S446-G449 VanDerWaalsContact O-N 3.15Å; S446-G449 PolarHBondContact OG-N 3.34Å; S446-K450 WeakPolarHBondContact O-CB 3.48Å; S446-K450 PolarHBondContact O-N 2.95Å
447	K	93.8	Very high	92.7	Very high	199 Å²	199	74.6 Å²	74.6	87%	0.865	34%	0.336	S	S	*	.	H	α-helix	trans	-55.3	-37.7	175.6	-66.9	-176.8	179.8	-179.9	0	111.9	A451	K447-A451 WeakPolarHBondContact O-CB 3.36Å; K447-A451 PolarHBondContact O-N 2.69Å
448	E	93.4	Very high	92.7	Very high	160 Å²	160	78.9 Å²	78.9	75%	0.748	36%	0.356	S	S	*	.	H	α-helix	trans	-69.8	-46.6	177.2	-173.2	-178.9	169.9	0	0	111.6	S446 K450 A451 K452	S446-E448 PolarHBondContact O-N 2.91Å; E448-K450 VanDerWaalsContact C-N 3.33Å; E448-K450 PolarHBondContact O-N 3.25Å; E448-A451 PolarHBondContact O-N 2.9Å; E448-K452 WeakPolarHBondContact O-CB 3.29Å; E448-K452 PolarHBondContact O-N 2.9Å
449	G	92.5	Very high	92.8	Very high	4 Å²	4	82.3 Å²	82.3	4%	0.041	37%	0.366	C	S	.	.	H	α-helix	trans	-58.4	-44.6	176.2	0	0	0	0	0	112.1	I329 S446 K452 S453	I329-G449 WeakPolarHBondContact CD1-O 3.33Å; S446-G449 PolarHBondContact O-N 2.89Å; S446-G449 VanDerWaalsContact O-N 3.15Å; S446-G449 PolarHBondContact OG-N 3.34Å; G449-K452 PolarHBondContact O-N 2.85Å; G449-S453 VanDerWaalsContact O-CB 3.27Å; G449-S453 WeakPolarHBondContact O-CB 3.44Å; G449-S453 PolarHBondContact O-N 2.74Å
450	K	93.8	Very high	92.7	Very high	126 Å²	126	80.2 Å²	80.2	55%	0.548	36%	0.361	S	S	.	.	H	α-helix	trans	-63.7	-44	176.3	-172.8	170.6	-178.2	167.9	0	112.4	L445 S446 E448 K452 S453 E454	L445-K450 HydrophobicContact CB-CB 4.39Å; S446-K450 WeakPolarHBondContact O-CB 3.48Å; S446-K450 PolarHBondContact O-N 2.95Å; E448-K450 VanDerWaalsContact C-N 3.33Å; E448-K450 PolarHBondContact O-N 3.25Å; K450-K452 VanDerWaalsContact C-N 3.35Å; K450-K452 PolarHBondContact O-N 3.36Å; K450-S453 WeakPolarHBondContact O-CB 3.45Å; K450-S453 PolarHBondContact O-N 3.06Å; K450-E454 WeakPolarHBondContact O-CB 3.33Å; K450-E454 PolarHBondContact O-N 2.88Å
451	A	94.5	Very high	92.6	Very high	61 Å²	61	84.5 Å²	84.5	50%	0.504	38%	0.381	S	S	.	.	H	α-helix	trans	-64.3	-39.3	176.8	0	0	0	0	0	112.3	K447 E448 R455	K447-A451 WeakPolarHBondContact O-CB 3.36Å; K447-A451 PolarHBondContact O-N 2.69Å; E448-A451 PolarHBondContact O-N 2.9Å; A451-R455 WeakPolarHBondContact O-CB 3.19Å; A451-R455 PolarHBondContact O-N 2.93Å
452	K	94.1	Very high	92.7	Very high	100 Å²	100	84.1 Å²	84.1	44%	0.435	38%	0.384	S	S	.	.	H	α-helix	trans	-66.1	-45.1	176.1	-175.5	177.3	-179.5	-178.6	0	111.7	E448 G449 K450 R455 N456	E448-K452 WeakPolarHBondContact O-CB 3.29Å; E448-K452 PolarHBondContact O-N 2.9Å; G449-K452 PolarHBondContact O-N 2.85Å; K450-K452 VanDerWaalsContact C-N 3.35Å; K450-K452 PolarHBondContact O-N 3.36Å; K452-R455 PolarHBondContact O-N 3.47Å; K452-N456 PolarHBondContact O-N 3.49Å
453	S	93.3	Very high	92.7	Very high	5 Å²	5	79.8 Å²	79.8	4%	0.035	38%	0.379	C	S	.	.	H	α-helix	trans	-53.3	-55.7	174.1	170.6	0	0	0	0	110.8	G283 G449 K450 R455 N456 R457	G283-S453 VanDerWaalsContact O-CB 3.27Å; G283-S453 WeakPolarHBondContact O-CB 3.45Å; G283-S453 PolarHBondContact O-OG 3.33Å; G449-S453 VanDerWaalsContact O-CB 3.27Å; G449-S453 WeakPolarHBondContact O-CB 3.44Å; G449-S453 PolarHBondContact O-N 2.74Å; K450-S453 WeakPolarHBondContact O-CB 3.45Å; K450-S453 PolarHBondContact O-N 3.06Å; S453-R455 VanDerWaalsContact C-N 3.33Å; S453-R455 PolarHBondContact O-N 2.94Å; S453-N456 WeakPolarHBondContact O-CB 3.36Å; S453-N456 PolarHBondContact O-N 2.92Å; S453-R457 VanDerWaalsContact C-NH1 3.29Å; S453-R457 VanDerWaalsContact O-CD 3.28Å; S453-R457 WeakPolarHBondContact O-CD 3.32Å; S453-R457 PolarHBondContact O-N 3.44Å; S453-R457 PolarHBondContact O-NH1 3.35Å; S453-R457 PolarHBondContact OG-NE 2.95Å; S453-R457 VanDerWaalsContact OG-NE 3.13Å; S453-R457 PolarHBondContact OG-NH1 2.93Å
454	E	93.8	Very high	92.4	Very high	116 Å²	116	80.3 Å²	80.3	54%	0.542	38%	0.382	S	S	.	.	H	α-helix	trans	-59.5	-43.3	-178.7	-170.7	57.4	-146.8	0	0	111.9	K450 N456 R457 Q458	K450-E454 WeakPolarHBondContact O-CB 3.33Å; K450-E454 PolarHBondContact O-N 2.88Å; E454-N456 VanDerWaalsContact C-N 3.29Å; E454-N456 PolarHBondContact O-N 2.96Å; E454-R457 PolarHBondContact O-N 2.83Å; E454-Q458 PolarHBondContact O-N 2.82Å
455	R	94.3	Very high	92.3	Very high	158 Å²	158	78.5 Å²	78.5	60%	0.596	38%	0.382	S	S	*	.	H	α-helix	trans	-60.4	-38.4	176.4	-170.2	178.2	-171.4	-173.1	1.1	112.4	A451 K452 S453 R459	A451-R455 WeakPolarHBondContact O-CB 3.19Å; A451-R455 PolarHBondContact O-N 2.93Å; K452-R455 PolarHBondContact O-N 3.47Å; S453-R455 VanDerWaalsContact C-N 3.33Å; S453-R455 PolarHBondContact O-N 2.94Å; R455-R459 WeakPolarHBondContact O-CB 3.45Å; R455-R459 WeakPolarHBondContact O-CD 3.22Å; R455-R459 WeakPolarHBondContact O-CG 3.28Å; R455-R459 PolarHBondContact O-N 3.5Å
456	N	93	Very high	92.3	Very high	34 Å²	34	84.9 Å²	84.9	18%	0.182	41%	0.408	C	S	.	.	H	α-helix	trans	-69.8	-39.4	177.2	-72.9	-17.4	0	0	0	111.8	E328 K452 S453 E454 R459 A460	E328-N456 WeakPolarHBondContact OE1-CB 3.22Å; E328-N456 PolarHBondContact OE1-ND2 3.3Å; K452-N456 PolarHBondContact O-N 3.49Å; S453-N456 WeakPolarHBondContact O-CB 3.36Å; S453-N456 PolarHBondContact O-N 2.92Å; E454-N456 VanDerWaalsContact C-N 3.29Å; E454-N456 PolarHBondContact O-N 2.96Å; N456-R459 PolarHBondContact O-N 3.27Å; N456-A460 WeakPolarHBondContact O-CB 3.45Å; N456-A460 PolarHBondContact O-N 3.38Å
457	R	92.8	Very high	92.1	Very high	20 Å²	20	87 Å²	87	8%	0.075	42%	0.416	C	S	.	.	H	α-helix	trans	-63.3	-46.3	174.4	-75.9	137.6	-169.4	75.8	8.3	111.8	G283 W284 Y307 E328 D359 S453 E454 R459 A460 H461	G283-R457 PolarHBondContact O-NH2 3.11Å; W284-R457 VanDerWaalsContact N-NH2 3.16Å; Y307-R457 HydrophobicContact CE1-CG 3.99Å; E328-R457 VanDerWaalsContact CD-NH1 3.28Å; E328-R457 IonicContact OE1-CZ 2.76Å; E328-R457 IonicContact OE1-NH1 3.37Å; E328-R457 PolarHBondContact OE1-NH1 3.44Å; E328-R457 IonicContact OE1-NH2 3.48Å; E328-R457 IonicContact OE2-CZ 3.62Å; E328-R457 IonicContact OE2-NH1 3.3Å; E328-R457 PolarHBondContact OE2-NH1 3.05Å; E328-R457 IonicContact OE2-NH2 3.73Å; E328-R457 PolarHBondContact OE2-NH2 3.38Å; D359-R457 IonicContact OD1-CZ 3.8Å; D359-R457 IonicContact OD1-NE 2.83Å; D359-R457 IonicContact OD1-NH2 3.78Å; D359-R457 PolarHBondContact OD1-NH2 3.22Å; D359-R457 IonicContact OD2-CZ 3.06Å; D359-R457 IonicContact OD2-NE 3.91Å; D359-R457 PolarHBondContact OD2-NE 3.41Å; D359-R457 IonicContact OD2-NH2 3.03Å; D359-R457 PolarHBondContact OD2-NH2 3.22Å; S453-R457 VanDerWaalsContact C-NH1 3.29Å; S453-R457 VanDerWaalsContact O-CD 3.28Å; S453-R457 WeakPolarHBondContact O-CD 3.32Å; S453-R457 PolarHBondContact O-N 3.44Å; S453-R457 PolarHBondContact O-NH1 3.35Å; S453-R457 PolarHBondContact OG-NE 2.95Å; S453-R457 VanDerWaalsContact OG-NE 3.13Å; S453-R457 PolarHBondContact OG-NH1 2.93Å; E454-R457 PolarHBondContact O-N 2.83Å; R457-R459 PolarHBondContact O-N 2.96Å; R457-A460 PolarHBondContact O-N 2.86Å; R457-H461 WeakPolarHBondContact O-CB 3.4Å; R457-H461 PolarHBondContact O-N 3.03Å
458	Q	92.8	Very high	91.7	Very high	92 Å²	92	78.6 Å²	78.6	43%	0.43	38%	0.38	S	S	.	.	H	α-helix	trans	-59.8	-44.7	174.3	-171.5	62.6	39.2	0	0	111.9	E454 A460 H461 D462	E454-Q458 PolarHBondContact O-N 2.82Å; Q458-A460 VanDerWaalsContact C-N 3.35Å; Q458-A460 PolarHBondContact O-N 3.42Å; Q458-H461 PolarHBondContact O-N 2.88Å; Q458-D462 PolarHBondContact NE2-OD1 3.37Å; Q458-D462 WeakPolarHBondContact O-CB 3.37Å; Q458-D462 PolarHBondContact O-N 2.8Å
459	R	93.2	Very high	91.6	Very high	132 Å²	132	76.8 Å²	76.8	50%	0.498	37%	0.371	S	S	.	.	H	α-helix	trans	-60.9	-41.8	176.2	-75.8	167.4	174.7	179.3	-5.7	112.6	R455 N456 R457 S463	R455-R459 WeakPolarHBondContact O-CB 3.45Å; R455-R459 WeakPolarHBondContact O-CD 3.22Å; R455-R459 WeakPolarHBondContact O-CG 3.28Å; R455-R459 PolarHBondContact O-N 3.5Å; N456-R459 PolarHBondContact O-N 3.27Å; R457-R459 PolarHBondContact O-N 2.96Å; R459-S463 VanDerWaalsContact O-CB 3.25Å; R459-S463 WeakPolarHBondContact O-CB 3.25Å; R459-S463 PolarHBondContact O-N 3.16Å
460	A	90.3	Very high	91.6	Very high	20 Å²	20	79.7 Å²	79.7	17%	0.165	39%	0.391	C	S	.	.	H	α-helix	trans	-65.1	-44.4	177.2	0	0	0	0	0	111.1	V306 Y307 N456 R457 Q458 S463 H464	V306-A460 HydrophobicContact CG1-CB 3.87Å; Y307-A460 HydrophobicContact CE1-CB 3.88Å; N456-A460 WeakPolarHBondContact O-CB 3.45Å; N456-A460 PolarHBondContact O-N 3.38Å; R457-A460 PolarHBondContact O-N 2.86Å; Q458-A460 VanDerWaalsContact C-N 3.35Å; Q458-A460 PolarHBondContact O-N 3.42Å; A460-S463 PolarHBondContact O-N 3.22Å; A460-H464 WeakPolarHBondContact O-CB 3.36Å; A460-H464 PolarHBondContact O-N 3.44Å
461	H	89.2	Confident	91.4	Very high	92 Å²	92	76.8 Å²	76.8	43%	0.426	38%	0.379	S	S	.	.	H	α-helix	trans	-61.5	-47.1	175.4	178.7	-96.9	0	0	0	112	R457 Q458 S463 H464 L465	R457-H461 WeakPolarHBondContact O-CB 3.4Å; R457-H461 PolarHBondContact O-N 3.03Å; Q458-H461 PolarHBondContact O-N 2.88Å; H461-S463 VanDerWaalsContact C-N 3.35Å; H461-S463 PolarHBondContact O-N 3.26Å; H461-H464 WeakPolarHBondContact O-CB 3.49Å; H461-H464 PolarHBondContact O-N 2.91Å; H461-L465 WeakPolarHBondContact CE1-CD1 3.5Å; H461-L465 WeakPolarHBondContact O-CG 3.3Å; H461-L465 PolarHBondContact O-N 2.75Å
462	D	92.4	Very high	91.1	Very high	60 Å²	60	80.8 Å²	80.8	32%	0.321	38%	0.381	S	S	.	.	H	α-helix	trans	-63.3	-40.4	177.3	-67.9	-14.5	0	0	0	112	Q458 L465 K466	Q458-D462 PolarHBondContact NE2-OD1 3.37Å; Q458-D462 WeakPolarHBondContact O-CB 3.37Å; Q458-D462 PolarHBondContact O-N 2.8Å; D462-L465 PolarHBondContact O-N 2.79Å; D462-K466 WeakPolarHBondContact O-CB 3.45Å; D462-K466 VanDerWaalsContact O-CG 3.24Å; D462-K466 WeakPolarHBondContact O-CG 3.32Å; D462-K466 PolarHBondContact O-N 2.77Å
463	S	89.9	Confident	91	Very high	78 Å²	78	80.7 Å²	80.7	55%	0.545	38%	0.382	S	S	.	.	H	α-helix	trans	-62.7	-43.6	174.8	-173.7	0	0	0	0	111.2	R459 A460 H461 K466 L467	R459-S463 VanDerWaalsContact O-CB 3.25Å; R459-S463 WeakPolarHBondContact O-CB 3.25Å; R459-S463 PolarHBondContact O-N 3.16Å; A460-S463 PolarHBondContact O-N 3.22Å; H461-S463 VanDerWaalsContact C-N 3.35Å; H461-S463 PolarHBondContact O-N 3.26Å; S463-K466 PolarHBondContact O-N 2.87Å; S463-L467 WeakPolarHBondContact O-CB 3.43Å; S463-L467 PolarHBondContact O-N 3.46Å
464	H	86.4	Confident	90.9	Very high	40 Å²	40	85.6 Å²	85.6	19%	0.185	41%	0.405	C	S	.	.	H	α-helix	trans	-63.5	-44.9	175.7	-176.6	76.4	0	0	0	111.9	A460 H461 K466 L467 M468	A460-H464 WeakPolarHBondContact O-CB 3.36Å; A460-H464 PolarHBondContact O-N 3.44Å; H461-H464 WeakPolarHBondContact O-CB 3.49Å; H461-H464 PolarHBondContact O-N 2.91Å; H464-K466 VanDerWaalsContact C-N 3.34Å; H464-K466 PolarHBondContact O-N 3.47Å; H464-L467 PolarHBondContact O-N 3.16Å; H464-M468 WeakPolarHBondContact O-CB 3.38Å; H464-M468 VanDerWaalsContact O-CG 3.31Å; H464-M468 WeakPolarHBondContact O-CG 3.45Å; H464-M468 PolarHBondContact O-N 3.1Å
465	L	88.8	Confident	90.8	Very high	90 Å²	90	82.3 Å²	82.3	47%	0.471	40%	0.398	S	S	.	.	H	α-helix	trans	-60.9	-41.5	175.4	-76.4	178.7	0	0	0	112.3	H461 D462 M468 H469	H461-L465 WeakPolarHBondContact CE1-CD1 3.5Å; H461-L465 WeakPolarHBondContact O-CG 3.3Å; H461-L465 PolarHBondContact O-N 2.75Å; D462-L465 PolarHBondContact O-N 2.79Å; L465-M468 PolarHBondContact O-N 3.41Å; L465-H469 WeakPolarHBondContact O-CB 3.29Å; L465-H469 PolarHBondContact O-N 2.67Å
466	K	92	Very high	90.7	Very high	151 Å²	151	76.9 Å²	76.9	66%	0.657	39%	0.386	S	S	*	.	H	α-helix	trans	-63.7	-43.8	175.4	-75.1	170.7	-176	177.2	0	111.7	D462 S463 H464 H469 S470	D462-K466 WeakPolarHBondContact O-CB 3.45Å; D462-K466 VanDerWaalsContact O-CG 3.24Å; D462-K466 WeakPolarHBondContact O-CG 3.32Å; D462-K466 PolarHBondContact O-N 2.77Å; S463-K466 PolarHBondContact O-N 2.87Å; H464-K466 VanDerWaalsContact C-N 3.34Å; H464-K466 PolarHBondContact O-N 3.47Å; K466-H469 PolarHBondContact O-N 3.02Å; K466-S470 WeakPolarHBondContact O-CB 3.26Å; K466-S470 PolarHBondContact O-N 3.16Å
467	L	89	Confident	90.7	Very high	90 Å²	90	80.4 Å²	80.4	47%	0.471	40%	0.402	S	S	.	.	H	α-helix	trans	-61.2	-47.6	175.4	-179.6	63.2	0	0	0	111.1	S463 H464 H469 S470 Q471	S463-L467 WeakPolarHBondContact O-CB 3.43Å; S463-L467 PolarHBondContact O-N 3.46Å; H464-L467 PolarHBondContact O-N 3.16Å; L467-H469 VanDerWaalsContact C-N 3.34Å; L467-H469 PolarHBondContact O-N 3.38Å; L467-S470 PolarHBondContact O-N 3.01Å; L467-Q471 HydrophobicContact CD1-CG 4.4Å; L467-Q471 WeakPolarHBondContact O-CB 3.27Å; L467-Q471 WeakPolarHBondContact O-CG 3.32Å; L467-Q471 PolarHBondContact O-N 3.01Å
468	M	87.2	Confident	90.7	Very high	21 Å²	21	83.5 Å²	83.5	10%	0.103	42%	0.42	C	S	.	.	H	α-helix	trans	-60.7	-41	176.2	-73.9	-63.9	109.9	0	0	112.2	H464 L465 R472	H464-M468 WeakPolarHBondContact O-CB 3.38Å; H464-M468 VanDerWaalsContact O-CG 3.31Å; H464-M468 WeakPolarHBondContact O-CG 3.45Å; H464-M468 PolarHBondContact O-N 3.1Å; L465-M468 PolarHBondContact O-N 3.41Å; M468-R472 WeakPolarHBondContact O-CB 3.36Å; M468-R472 WeakPolarHBondContact O-CG 3.16Å; M468-R472 PolarHBondContact O-N 3.27Å
469	H	90.5	Very high	90.6	Very high	123 Å²	123	87.2 Å²	87.2	57%	0.569	43%	0.43	S	S	*	.	H	α-helix	trans	-65.5	-45.3	176.3	-174.1	69.6	0	0	0	111.8	L465 K466 L467 Q471 R472 Q473	L465-H469 WeakPolarHBondContact O-CB 3.29Å; L465-H469 PolarHBondContact O-N 2.67Å; K466-H469 PolarHBondContact O-N 3.02Å; L467-H469 VanDerWaalsContact C-N 3.34Å; L467-H469 PolarHBondContact O-N 3.38Å; H469-Q471 PolarHBondContact O-N 3.38Å; H469-R472 PolarHBondContact O-N 3.44Å; H469-Q473 WeakPolarHBondContact O-CB 3.28Å; H469-Q473 PolarHBondContact O-N 2.67Å
470	S	92.1	Very high	90.5	Very high	64 Å²	64	89.8 Å²	89.8	45%	0.448	44%	0.44	S	S	.	.	H	α-helix	trans	-59.1	-46.7	176.1	-171.2	0	0	0	0	111.4	K466 L467 R472 Q473 E474	K466-S470 WeakPolarHBondContact O-CB 3.26Å; K466-S470 PolarHBondContact O-N 3.16Å; L467-S470 PolarHBondContact O-N 3.01Å; S470-R472 PolarHBondContact O-N 3.13Å; S470-Q473 PolarHBondContact O-N 3.23Å; S470-E474 WeakPolarHBondContact O-CB 3.08Å; S470-E474 PolarHBondContact O-N 3.41Å
471	Q	90	Very high	90.6	Very high	66 Å²	66	90.3 Å²	90.3	31%	0.308	45%	0.447	S	S	.	.	H	α-helix	trans	-63.6	-41	177.1	-73.7	177.7	-5.9	0	0	112.1	L467 H469 Q473 E474 A475	L467-Q471 HydrophobicContact CD1-CG 4.4Å; L467-Q471 WeakPolarHBondContact O-CB 3.27Å; L467-Q471 WeakPolarHBondContact O-CG 3.32Å; L467-Q471 PolarHBondContact O-N 3.01Å; H469-Q471 PolarHBondContact O-N 3.38Å; Q471-Q473 VanDerWaalsContact C-N 3.33Å; Q471-Q473 PolarHBondContact O-N 3.07Å; Q471-E474 PolarHBondContact O-N 3.33Å; Q471-A475 VanDerWaalsContact O-CB 3.28Å; Q471-A475 WeakPolarHBondContact O-CB 3.48Å; Q471-A475 PolarHBondContact O-N 3.4Å
472	R	89.1	Confident	90.7	Very high	144 Å²	144	91.7 Å²	91.7	54%	0.543	45%	0.454	S	S	.	.	H	α-helix	trans	-64.2	-38.6	174.4	-73.8	173	-169.3	-175	4.7	111.8	T375 M468 H469 S470 A476	T375-R472 PolarHBondContact O-NH2 3.46Å; M468-R472 WeakPolarHBondContact O-CB 3.36Å; M468-R472 WeakPolarHBondContact O-CG 3.16Å; M468-R472 PolarHBondContact O-N 3.27Å; H469-R472 PolarHBondContact O-N 3.44Å; S470-R472 PolarHBondContact O-N 3.13Å; R472-A476 WeakPolarHBondContact O-CB 3.28Å; R472-A476 PolarHBondContact O-N 3.3Å
473	Q	92.1	Very high	90.6	Very high	98 Å²	98	98 Å²	98	46%	0.458	47%	0.473	S	S	.	.	H	α-helix	trans	-68.2	-43.8	177.4	-176.9	175	-4.8	0	0	111.4	H469 S470 Q471 A476 Q477	H469-Q473 WeakPolarHBondContact O-CB 3.28Å; H469-Q473 PolarHBondContact O-N 2.67Å; S470-Q473 PolarHBondContact O-N 3.23Å; Q471-Q473 VanDerWaalsContact C-N 3.33Å; Q471-Q473 PolarHBondContact O-N 3.07Å; Q473-A476 PolarHBondContact O-N 3.23Å; Q473-Q477 WeakPolarHBondContact O-CB 3.38Å; Q473-Q477 VanDerWaalsContact O-CG 3.26Å; Q473-Q477 WeakPolarHBondContact O-CG 3.18Å; Q473-Q477 PolarHBondContact O-N 3.36Å
474	E	91.1	Very high	90.5	Very high	108 Å²	108	98.4 Å²	98.4	51%	0.505	47%	0.469	S	S	.	.	H	α-helix	trans	-63	-48.1	175.5	-173.6	-179.1	170.1	0	0	111.2	S470 Q471 A476 Q477 N478	S470-E474 WeakPolarHBondContact O-CB 3.08Å; S470-E474 PolarHBondContact O-N 3.41Å; Q471-E474 PolarHBondContact O-N 3.33Å; E474-A476 VanDerWaalsContact C-N 3.3Å; E474-A476 PolarHBondContact O-N 3.14Å; E474-Q477 CarbonylContact O-C 3.52Å; E474-Q477 PolarHBondContact O-N 3.46Å; E474-Q477 VanDerWaalsContact O-N 3.07Å; E474-N478 WeakPolarHBondContact O-CB 3.43Å; E474-N478 PolarHBondContact O-N 3.29Å
475	A	90.9	Very high	90.7	Very high	48 Å²	48	104.9 Å²	104.9	40%	0.397	49%	0.492	S	S	.	.	H	α-helix	trans	-60.7	-38.9	175.2	0	0	0	0	0	112.2	Q471 R479	Q471-A475 VanDerWaalsContact O-CB 3.28Å; Q471-A475 WeakPolarHBondContact O-CB 3.48Å; Q471-A475 PolarHBondContact O-N 3.4Å; A475-R479 WeakPolarHBondContact O-CB 3.5Å; A475-R479 VanDerWaalsContact O-CG 3.26Å; A475-R479 WeakPolarHBondContact O-CG 3.13Å; A475-R479 PolarHBondContact O-N 2.98Å
476	A	91.9	Very high	90.8	Very high	43 Å²	43	103.2 Å²	103.2	36%	0.355	49%	0.491	S	S	.	.	H	α-helix	trans	-69.1	-33.9	174.6	0	0	0	0	0	112.6	R472 Q473 E474 R480	R472-A476 WeakPolarHBondContact O-CB 3.28Å; R472-A476 PolarHBondContact O-N 3.3Å; Q473-A476 PolarHBondContact O-N 3.23Å; E474-A476 VanDerWaalsContact C-N 3.3Å; E474-A476 PolarHBondContact O-N 3.14Å; A476-R480 WeakPolarHBondContact O-CB 3.25Å; A476-R480 WeakPolarHBondContact O-CD 3.43Å; A476-R480 WeakPolarHBondContact O-CG 3.33Å; A476-R480 PolarHBondContact O-N 3Å; A476-R480 VanDerWaalsContact O-N 3.09Å
477	Q	92.3	Very high	90.7	Very high	108 Å²	108	97.3 Å²	97.3	51%	0.505	47%	0.47	S	S	.	.	H	α-helix	trans	-71.6	-42.8	174.7	-77.3	177.3	-3.9	0	0	111.6	Q473 E474 R480 G481	Q473-Q477 WeakPolarHBondContact O-CB 3.38Å; Q473-Q477 VanDerWaalsContact O-CG 3.26Å; Q473-Q477 WeakPolarHBondContact O-CG 3.18Å; Q473-Q477 PolarHBondContact O-N 3.36Å; E474-Q477 CarbonylContact O-C 3.52Å; E474-Q477 PolarHBondContact O-N 3.46Å; E474-Q477 VanDerWaalsContact O-N 3.07Å; Q477-R480 CarbonylContact O-C 3.55Å; Q477-R480 WeakPolarHBondContact O-CB 3.48Å; Q477-R480 PolarHBondContact O-N 3.42Å; Q477-R480 VanDerWaalsContact O-N 3.12Å; Q477-G481 PolarHBondContact O-N 3.44Å
478	N	92.5	Very high	90.7	Very high	86 Å²	86	99.9 Å²	99.9	46%	0.46	48%	0.477	S	S	.	.	H	α-helix	trans	-61	-48	175	-72.3	-5.7	0	0	0	110.7	E474 R480 G481 E482	E474-N478 WeakPolarHBondContact O-CB 3.43Å; E474-N478 PolarHBondContact O-N 3.29Å; N478-R480 VanDerWaalsContact C-N 3.26Å; N478-R480 PolarHBondContact O-N 2.86Å; N478-G481 PolarHBondContact O-N 3.4Å; N478-E482 WeakPolarHBondContact O-CB 3.38Å; N478-E482 WeakPolarHBondContact O-CG 3.5Å; N478-E482 PolarHBondContact O-N 2.91Å
479	R	92.1	Very high	90.8	Very high	169 Å²	169	105.3 Å²	105.3	64%	0.638	50%	0.503	S	S	*	.	H	α-helix	trans	-59.5	-33.9	173.4	-72.9	176.5	179.3	-166.9	-0	113.2	A475 R483	A475-R479 WeakPolarHBondContact O-CB 3.5Å; A475-R479 VanDerWaalsContact O-CG 3.26Å; A475-R479 WeakPolarHBondContact O-CG 3.13Å; A475-R479 PolarHBondContact O-N 2.98Å; R479-R483 WeakPolarHBondContact O-CB 3.34Å; R479-R483 WeakPolarHBondContact O-CD 3.39Å; R479-R483 WeakPolarHBondContact O-CG 3.37Å; R479-R483 PolarHBondContact O-N 3.45Å
480	R	91.5	Very high	90.7	Very high	186 Å²	186	108.5 Å²	108.5	70%	0.702	51%	0.51	S	S	*	.	H	α-helix	trans	-72.9	-39.5	174.5	-76.4	170.9	-176.6	-172.1	4.1	111.7	A476 Q477 N478 L484	A476-R480 WeakPolarHBondContact O-CB 3.25Å; A476-R480 WeakPolarHBondContact O-CD 3.43Å; A476-R480 WeakPolarHBondContact O-CG 3.33Å; A476-R480 PolarHBondContact O-N 3Å; A476-R480 VanDerWaalsContact O-N 3.09Å; Q477-R480 CarbonylContact O-C 3.55Å; Q477-R480 WeakPolarHBondContact O-CB 3.48Å; Q477-R480 PolarHBondContact O-N 3.42Å; Q477-R480 VanDerWaalsContact O-N 3.12Å; N478-R480 VanDerWaalsContact C-N 3.26Å; N478-R480 PolarHBondContact O-N 2.86Å; R480-L484 WeakPolarHBondContact O-CB 3.33Å; R480-L484 PolarHBondContact O-N 2.73Å
481	G	91	Very high	90.2	Very high	32 Å²	32	106.8 Å²	106.8	33%	0.33	50%	0.495	S	S	.	.	H	α-helix	trans	-67.1	-43.6	177.7	0	0	0	0	0	112.5	Q477 N478 L484 R485	Q477-G481 PolarHBondContact O-N 3.44Å; N478-G481 PolarHBondContact O-N 3.4Å; G481-L484 PolarHBondContact O-N 3.34Å; G481-R485 WeakPolarHBondContact O-CB 3.47Å; G481-R485 PolarHBondContact O-N 3.02Å
482	E	91.4	Very high	89.8	Confident	120 Å²	120	111.1 Å²	111.1	56%	0.561	52%	0.517	S	S	*	.	H	α-helix	trans	-59.9	-47.2	173	-74.5	165	-167.7	0	0	111.3	N478 L484 R485 A486	N478-E482 WeakPolarHBondContact O-CB 3.38Å; N478-E482 WeakPolarHBondContact O-CG 3.5Å; N478-E482 PolarHBondContact O-N 2.91Å; E482-L484 VanDerWaalsContact C-N 3.31Å; E482-L484 PolarHBondContact O-N 3.21Å; E482-R485 PolarHBondContact O-N 3.42Å; E482-A486 WeakPolarHBondContact O-CB 3.35Å; E482-A486 PolarHBondContact O-N 2.91Å
483	R	90.9	Very high	89.7	Confident	192 Å²	192	107.8 Å²	107.8	73%	0.725	52%	0.521	S	S	*	.	H	α-helix	trans	-60.8	-38.2	175.3	-74.5	173.4	-176.7	-169.9	0	112.9	R479 A487	R479-R483 WeakPolarHBondContact O-CB 3.34Å; R479-R483 WeakPolarHBondContact O-CD 3.39Å; R479-R483 WeakPolarHBondContact O-CG 3.37Å; R479-R483 PolarHBondContact O-N 3.45Å; R483-A487 VanDerWaalsContact O-CB 3.31Å; R483-A487 WeakPolarHBondContact O-CB 3.49Å; R483-A487 PolarHBondContact O-N 2.94Å
484	L	88.1	Confident	89.4	Confident	87 Å²	87	105.7 Å²	105.7	46%	0.455	51%	0.511	S	S	.	.	H	α-helix	trans	-71.7	-40.4	177.6	-174.6	64.5	0	0	0	111.6	R480 G481 E482 A487 K488	R480-L484 WeakPolarHBondContact O-CB 3.33Å; R480-L484 PolarHBondContact O-N 2.73Å; G481-L484 PolarHBondContact O-N 3.34Å; E482-L484 VanDerWaalsContact C-N 3.31Å; E482-L484 PolarHBondContact O-N 3.21Å; L484-A487 PolarHBondContact O-N 3.41Å; L484-K488 PolarHBondContact O-N 3.49Å
485	R	90.4	Very high	89	Confident	177 Å²	177	108.1 Å²	108.1	67%	0.668	53%	0.527	S	S	*	.	H	α-helix	trans	-63.8	-47.6	176.2	-177.4	178.4	-80.6	117.6	-6.7	111	G481 E482 A487 K488 E489	G481-R485 WeakPolarHBondContact O-CB 3.47Å; G481-R485 PolarHBondContact O-N 3.02Å; E482-R485 PolarHBondContact O-N 3.42Å; R485-A487 VanDerWaalsContact C-N 3.3Å; R485-A487 PolarHBondContact O-N 2.94Å; R485-K488 PolarHBondContact O-N 2.93Å; R485-E489 WeakPolarHBondContact O-CB 3.45Å; R485-E489 PolarHBondContact O-N 2.78Å
486	A	91.6	Very high	88.7	Confident	55 Å²	55	109.5 Å²	109.5	46%	0.455	53%	0.528	S	S	.	.	H	α-helix	trans	-61.5	-37.2	175.9	0	0	0	0	0	112.4	E482 R490	E482-A486 WeakPolarHBondContact O-CB 3.35Å; E482-A486 PolarHBondContact O-N 2.91Å; A486-R490 WeakPolarHBondContact O-CB 3.36Å; A486-R490 PolarHBondContact O-N 2.95Å
487	A	88.1	Confident	88.3	Confident	26 Å²	26	112.4 Å²	112.4	22%	0.215	54%	0.543	C	S	.	.	H	α-helix	trans	-66.9	-41.8	174.9	0	0	0	0	0	112.4	R483 L484 R485 R490 I491 E507	R483-A487 VanDerWaalsContact O-CB 3.31Å; R483-A487 WeakPolarHBondContact O-CB 3.49Å; R483-A487 PolarHBondContact O-N 2.94Å; L484-A487 PolarHBondContact O-N 3.41Å; R485-A487 VanDerWaalsContact C-N 3.3Å; R485-A487 PolarHBondContact O-N 2.94Å; A487-R490 WeakPolarHBondContact O-CB 3.31Å; A487-R490 PolarHBondContact O-N 3.47Å; A487-I491 WeakPolarHBondContact O-CG1 3.42Å; A487-I491 PolarHBondContact O-N 3.34Å; A487-I491 VanDerWaalsContact O-N 3.15Å; A487-E507 WeakPolarHBondContact CB-OE1 3.37Å
488	K	89.1	Confident	87.8	Confident	144 Å²	144	113.7 Å²	113.7	63%	0.626	55%	0.549	S	S	*	.	H	α-helix	trans	-65.9	-41.5	176.2	-175.3	178.7	179	-177.5	0	112.4	L484 R485 R490 I491 M492	L484-K488 PolarHBondContact O-N 3.49Å; R485-K488 PolarHBondContact O-N 2.93Å; K488-R490 VanDerWaalsContact C-N 3.31Å; K488-I491 PolarHBondContact O-N 3.27Å; K488-I491 VanDerWaalsContact O-N 3.16Å; K488-M492 PolarHBondContact O-N 3.47Å
489	E	90.4	Very high	87.5	Confident	135 Å²	135	114.4 Å²	114.4	63%	0.631	55%	0.548	S	S	*	.	H	α-helix	trans	-61.1	-42	175.2	-173.8	172	-178.2	0	0	111.1	R485 I491 M492 A493	R485-E489 WeakPolarHBondContact O-CB 3.45Å; R485-E489 PolarHBondContact O-N 2.78Å; E489-I491 VanDerWaalsContact C-N 3.29Å; E489-I491 PolarHBondContact O-N 2.96Å; E489-M492 PolarHBondContact O-N 2.98Å; E489-A493 WeakPolarHBondContact O-CB 3.37Å; E489-A493 PolarHBondContact O-N 3.43Å
490	R	87.4	Confident	87	Confident	191 Å²	191	107.4 Å²	107.4	72%	0.721	53%	0.526	S	S	*	.	H	α-helix	trans	-61.5	-32.2	173.2	-173.5	179.4	177.9	172.8	5.5	113.8	A486 A487 K488	A486-R490 WeakPolarHBondContact O-CB 3.36Å; A486-R490 PolarHBondContact O-N 2.95Å; A487-R490 WeakPolarHBondContact O-CB 3.31Å; A487-R490 PolarHBondContact O-N 3.47Å; K488-R490 VanDerWaalsContact C-N 3.31Å
491	I	82.6	Confident	86.7	Confident	27 Å²	27	106.2 Å²	106.2	14%	0.138	52%	0.522	C	S	.	.	H	α-helix	trans	-74.8	-39.1	176.1	-66.8	173.2	0	0	0	111.1	A487 K488 E489 A493 E494 L503 E504 E507	A487-I491 WeakPolarHBondContact O-CG1 3.42Å; A487-I491 PolarHBondContact O-N 3.34Å; A487-I491 VanDerWaalsContact O-N 3.15Å; K488-I491 PolarHBondContact O-N 3.27Å; K488-I491 VanDerWaalsContact O-N 3.16Å; E489-I491 VanDerWaalsContact C-N 3.29Å; E489-I491 PolarHBondContact O-N 2.96Å; I491-A493 VanDerWaalsContact C-N 3.35Å; I491-E494 PolarHBondContact O-N 3.45Å; I491-L503 HydrophobicContact CD1-CB 4.3Å; I491-L503 HydrophobicContact CG1-CB 4Å; I491-E504 HydrophobicContact CG2-CB 4.39Å; I491-E507 HydrophobicContact CD1-CB 4.36Å; I491-E507 HydrophobicContact CD1-CG 3.72Å; I491-E507 WeakPolarHBondContact CD1-OE2 3.34Å
492	M	81.4	Confident	86.5	Confident	158 Å²	158	112.2 Å²	112.2	78%	0.778	54%	0.539	S	S	*	.	H	α-helix	trans	-70.5	-31.1	179.8	-178.6	173.1	-81.6	0	0	112.6	K488 E489 E494	K488-M492 PolarHBondContact O-N 3.47Å; E489-M492 PolarHBondContact O-N 2.98Å; M492-E494 VanDerWaalsContact C-N 3.3Å; M492-E494 PolarHBondContact O-N 2.94Å
493	A	87.8	Confident	86.2	Confident	74 Å²	74	109.2 Å²	109.2	61%	0.612	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.4	-0.7	177.9	0	0	0	0	0	114.3	E489 I491	E489-A493 WeakPolarHBondContact O-CB 3.37Å; E489-A493 PolarHBondContact O-N 3.43Å; I491-A493 VanDerWaalsContact C-N 3.35Å
494	E	85.3	Confident	86	Confident	54 Å²	54	104.7 Å²	104.7	25%	0.252	51%	0.514	S	S	.	.			trans	-84.3	116.3	-179.9	-173.6	78.3	-120.7	0	0	110.7	I491 M492 D496 K499 L503	I491-E494 PolarHBondContact O-N 3.45Å; M492-E494 VanDerWaalsContact C-N 3.3Å; M492-E494 PolarHBondContact O-N 2.94Å; E494-D496 PolarHBondContact O-N 2.9Å; E494-K499 VanDerWaalsContact CD-CE 3.49Å; E494-K499 HydrophobicContact CG-CB 4.17Å; E494-K499 HydrophobicContact CG-CD 4.14Å; E494-K499 HydrophobicContact CG-CG 4.09Å; E494-K499 WeakPolarHBondContact OE1-CD 3.41Å; E494-K499 WeakPolarHBondContact OE1-CE 3.37Å; E494-K499 IonicContact OE1-NZ 2.72Å; E494-K499 PolarHBondContact OE1-NZ 2.92Å; E494-K499 WeakPolarHBondContact OE2-CE 3.32Å; E494-K499 IonicContact OE2-NZ 3.03Å; E494-K499 PolarHBondContact OE2-NZ 3.26Å; E494-L503 HydrophobicContact CG-CD1 4.41Å
495	D	83.3	Confident	86.1	Confident	159 Å²	159	106.9 Å²	106.9	85%	0.85	52%	0.521	S	S	*	.			trans	-70.7	-27.5	-172.9	-64.9	-43.8	0	0	0	114.9	P497	D495-P497 WeakPolarHBondContact O-CD 3.32Å
496	D	83.7	Confident	86.1	Confident	77 Å²	77	104.6 Å²	104.6	41%	0.412	52%	0.516	S	S	.	.			trans	-84.1	116.3	-176.5	-179.9	-3.9	0	0	0	111.2	E494 E498 K499 A500	E494-D496 PolarHBondContact O-N 2.9Å; D496-E498 VanDerWaalsContact C-N 3.27Å; D496-E498 PolarHBondContact O-N 3.35Å; D496-E498 PolarHBondContact OD1-N 2.92Å; D496-E498 VanDerWaalsContact OD1-N 3.1Å; D496-K499 HydrophobicContact CB-CB 3.91Å; D496-K499 PolarHBondContact O-N 2.9Å; D496-K499 VanDerWaalsContact O-N 3.12Å; D496-A500 WeakPolarHBondContact O-CB 3.41Å; D496-A500 PolarHBondContact O-N 3.23Å
497	P	83.1	Confident	85.8	Confident	103 Å²	103	104.6 Å²	104.6	67%	0.669	51%	0.507	S	S	*	.	H	α-helix	trans	-61.8	-31.3	-175.2	25.3	-35.3	0	0	0	113.3	D495 R501	D495-P497 WeakPolarHBondContact O-CD 3.32Å; P497-R501 WeakPolarHBondContact O-CB 3.41Å; P497-R501 PolarHBondContact O-N 2.94Å
498	E	82.9	Confident	85.9	Confident	136 Å²	136	107.1 Å²	107.1	64%	0.636	51%	0.514	S	S	*	.	H	α-helix	trans	-73.8	-37.2	178.3	-66.7	-156.2	150	0	0	111.8	D496 K502	D496-E498 VanDerWaalsContact C-N 3.27Å; D496-E498 PolarHBondContact O-N 3.35Å; D496-E498 PolarHBondContact OD1-N 2.92Å; D496-E498 VanDerWaalsContact OD1-N 3.1Å; E498-K502 WeakPolarHBondContact O-CB 3.29Å; E498-K502 PolarHBondContact O-N 2.68Å; E498-K502 VanDerWaalsContact O-N 3.1Å
499	K	84.7	Confident	86	Confident	100 Å²	100	109.9 Å²	109.9	44%	0.435	52%	0.521	S	S	.	.	H	α-helix	trans	-73.3	-41.7	-179.6	-167.4	173	166.8	-151.4	0	111.5	E494 D496 R501 K502 L503	E494-K499 VanDerWaalsContact CD-CE 3.49Å; E494-K499 HydrophobicContact CG-CB 4.17Å; E494-K499 HydrophobicContact CG-CD 4.14Å; E494-K499 HydrophobicContact CG-CG 4.09Å; E494-K499 WeakPolarHBondContact OE1-CD 3.41Å; E494-K499 WeakPolarHBondContact OE1-CE 3.37Å; E494-K499 IonicContact OE1-NZ 2.72Å; E494-K499 PolarHBondContact OE1-NZ 2.92Å; E494-K499 WeakPolarHBondContact OE2-CE 3.32Å; E494-K499 IonicContact OE2-NZ 3.03Å; E494-K499 PolarHBondContact OE2-NZ 3.26Å; D496-K499 HydrophobicContact CB-CB 3.91Å; D496-K499 PolarHBondContact O-N 2.9Å; D496-K499 VanDerWaalsContact O-N 3.12Å; K499-R501 PolarHBondContact O-N 2.86Å; K499-K502 PolarHBondContact O-N 3.42Å; K499-L503 WeakPolarHBondContact O-CG 3.36Å; K499-L503 PolarHBondContact O-N 2.82Å
500	A	82.9	Confident	85.9	Confident	22 Å²	22	108.6 Å²	108.6	18%	0.182	51%	0.513	C	S	.	.	H	α-helix	trans	-56.6	-48.7	172	0	0	0	0	0	111	D496 K502 L503 E504	D496-A500 WeakPolarHBondContact O-CB 3.41Å; D496-A500 PolarHBondContact O-N 3.23Å; A500-K502 VanDerWaalsContact C-N 3.32Å; A500-K502 PolarHBondContact O-N 3.47Å; A500-L503 PolarHBondContact O-N 3.06Å; A500-E504 WeakPolarHBondContact O-CB 3.31Å; A500-E504 PolarHBondContact O-N 3.09Å
501	R	84.2	Confident	85.9	Confident	162 Å²	162	103.1 Å²	103.1	61%	0.611	50%	0.495	S	S	*	.	H	α-helix	trans	-59	-41.8	177.4	-168	-177.1	71.7	-165	-4.6	112.4	P497 K499 E505	P497-R501 WeakPolarHBondContact O-CB 3.41Å; P497-R501 PolarHBondContact O-N 2.94Å; K499-R501 PolarHBondContact O-N 2.86Å; R501-E505 WeakPolarHBondContact O-CB 3.45Å; R501-E505 PolarHBondContact O-N 3.13Å
502	K	87.9	Confident	86.2	Confident	158 Å²	158	108.2 Å²	108.2	69%	0.687	52%	0.517	S	S	*	.	H	α-helix	trans	-68.7	-36.5	179.3	-169.3	175.2	-176.8	176.2	0	112.6	E498 K499 A500 K506	E498-K502 WeakPolarHBondContact O-CB 3.29Å; E498-K502 PolarHBondContact O-N 2.68Å; E498-K502 VanDerWaalsContact O-N 3.1Å; K499-K502 PolarHBondContact O-N 3.42Å; A500-K502 VanDerWaalsContact C-N 3.32Å; A500-K502 PolarHBondContact O-N 3.47Å; K502-K506 WeakPolarHBondContact O-CB 3.49Å; K502-K506 PolarHBondContact O-N 3.21Å
503	L	84	Confident	86.5	Confident	56 Å²	56	104 Å²	104	29%	0.293	50%	0.503	S	S	.	.	H	α-helix	trans	-68.7	-44.9	175	-74.6	171.2	0	0	0	111.2	I491 E494 K499 A500 K506 E507	I491-L503 HydrophobicContact CD1-CB 4.3Å; I491-L503 HydrophobicContact CG1-CB 4Å; E494-L503 HydrophobicContact CG-CD1 4.41Å; K499-L503 WeakPolarHBondContact O-CG 3.36Å; K499-L503 PolarHBondContact O-N 2.82Å; A500-L503 PolarHBondContact O-N 3.06Å; L503-K506 WeakPolarHBondContact O-CB 3.33Å; L503-K506 PolarHBondContact O-N 2.97Å; L503-E507 PolarHBondContact O-N 3.05Å
504	E	87.5	Confident	86.4	Confident	98 Å²	98	108.7 Å²	108.7	46%	0.458	51%	0.509	S	S	.	.	H	α-helix	trans	-61.7	-47.3	177.7	-167	-173.8	174.5	0	0	111.6	I491 A500 K506 E507 Q508	I491-E504 HydrophobicContact CG2-CB 4.39Å; A500-E504 WeakPolarHBondContact O-CB 3.31Å; A500-E504 PolarHBondContact O-N 3.09Å; E504-K506 VanDerWaalsContact C-N 3.27Å; E504-K506 PolarHBondContact O-N 2.97Å; E504-E507 PolarHBondContact O-N 3.09Å; E504-E507 VanDerWaalsContact O-N 3.16Å; E504-Q508 HydrophobicContact CG-CG 4.48Å; E504-Q508 WeakPolarHBondContact O-CG 3.03Å; E504-Q508 PolarHBondContact O-N 3.36Å; E504-Q508 PolarHBondContact OE1-NE2 2.82Å; E504-Q508 VanDerWaalsContact OE1-NE2 3.11Å
505	E	89.1	Confident	86.5	Confident	133 Å²	133	113.9 Å²	113.9	62%	0.621	53%	0.531	S	S	*	.	H	α-helix	trans	-60.7	-38	177.7	-169.5	-178.2	178.3	0	0	111.8	R501 R509	R501-E505 WeakPolarHBondContact O-CB 3.45Å; R501-E505 PolarHBondContact O-N 3.13Å; E505-R509 WeakPolarHBondContact O-CB 3.26Å; E505-R509 PolarHBondContact O-N 2.99Å
506	K	90.4	Very high	86.5	Confident	129 Å²	129	112.4 Å²	112.4	56%	0.561	52%	0.52	S	S	*	.	H	α-helix	trans	-66.7	-39.4	176.5	-171.4	177.6	-176.1	179.1	0	111.9	K502 L503 E504 K510	K502-K506 WeakPolarHBondContact O-CB 3.49Å; K502-K506 PolarHBondContact O-N 3.21Å; L503-K506 WeakPolarHBondContact O-CB 3.33Å; L503-K506 PolarHBondContact O-N 2.97Å; E504-K506 VanDerWaalsContact C-N 3.27Å; E504-K506 PolarHBondContact O-N 2.97Å; K506-K510 WeakPolarHBondContact O-CG 3.23Å; K506-K510 PolarHBondContact O-N 3.16Å; K506-K510 VanDerWaalsContact O-N 3.14Å
507	E	87	Confident	86.3	Confident	54 Å²	54	114.3 Å²	114.3	25%	0.252	54%	0.537	S	S	.	.	H	α-helix	trans	-69.7	-44.6	174.8	-71.7	-146.3	144.8	0	0	112.3	A487 I491 L503 E504 R509 K510 E511	A487-E507 WeakPolarHBondContact CB-OE1 3.37Å; I491-E507 HydrophobicContact CD1-CB 4.36Å; I491-E507 HydrophobicContact CD1-CG 3.72Å; I491-E507 WeakPolarHBondContact CD1-OE2 3.34Å; L503-E507 PolarHBondContact O-N 3.05Å; E504-E507 PolarHBondContact O-N 3.09Å; E504-E507 VanDerWaalsContact O-N 3.16Å; E507-R509 VanDerWaalsContact C-N 3.27Å; E507-R509 PolarHBondContact O-N 2.96Å; E507-K510 CarbonylContact O-C 3.2Å; E507-K510 WeakPolarHBondContact O-CA 3.2Å; E507-K510 WeakPolarHBondContact O-CB 3.43Å; E507-K510 PolarHBondContact O-N 3.37Å; E507-E511 PolarHBondContact O-N 3.38Å
508	Q	88.8	Confident	86.2	Confident	80 Å²	80	119.2 Å²	119.2	37%	0.374	55%	0.548	S	S	.	.	H	α-helix	trans	-58.6	-39.6	175.1	-71.4	-173.8	22.1	0	0	111.8	E504 E511 K512	E504-Q508 HydrophobicContact CG-CG 4.48Å; E504-Q508 WeakPolarHBondContact O-CG 3.03Å; E504-Q508 PolarHBondContact O-N 3.36Å; E504-Q508 PolarHBondContact OE1-NE2 2.82Å; E504-Q508 VanDerWaalsContact OE1-NE2 3.11Å; Q508-E511 PolarHBondContact O-N 3.38Å; Q508-K512 WeakPolarHBondContact O-CB 3.34Å; Q508-K512 VanDerWaalsContact O-CG 3.25Å; Q508-K512 WeakPolarHBondContact O-CG 3.46Å; Q508-K512 PolarHBondContact O-N 3.03Å
509	R	91	Very high	85.7	Confident	201 Å²	201	121.1 Å²	121.1	76%	0.758	56%	0.559	S	S	*	*	H	α-helix	trans	-65.4	-39.9	175	-170.4	174	178.8	-179.2	-0.1	112	E505 E507 S513	E505-R509 WeakPolarHBondContact O-CB 3.26Å; E505-R509 PolarHBondContact O-N 2.99Å; E507-R509 VanDerWaalsContact C-N 3.27Å; E507-R509 PolarHBondContact O-N 2.96Å; R509-S513 WeakPolarHBondContact O-CB 2.9Å; R509-S513 PolarHBondContact O-N 3.47Å; R509-S513 PolarHBondContact O-OG 3.14Å
510	K	89.6	Confident	85.1	Confident	108 Å²	108	125.6 Å²	125.6	47%	0.47	58%	0.578	S	S	.	*	H	α-helix	trans	-63.9	-44.1	174.1	-74.9	174.5	179.3	179.8	0	111.4	K506 E507 S513 K514	K506-K510 WeakPolarHBondContact O-CG 3.23Å; K506-K510 PolarHBondContact O-N 3.16Å; K506-K510 VanDerWaalsContact O-N 3.14Å; E507-K510 CarbonylContact O-C 3.2Å; E507-K510 WeakPolarHBondContact O-CA 3.2Å; E507-K510 WeakPolarHBondContact O-CB 3.43Å; E507-K510 PolarHBondContact O-N 3.37Å; K510-S513 WeakPolarHBondContact CA-OG 3.25Å; K510-S513 PolarHBondContact O-N 3.15Å; K510-S513 PolarHBondContact O-OG 3.13Å; K510-K514 WeakPolarHBondContact O-CG 3.35Å; K510-K514 PolarHBondContact O-N 2.79Å
511	E	86	Confident	84.3	Confident	76 Å²	76	132.7 Å²	132.7	36%	0.355	61%	0.61	S	S	.	*	H	α-helix	trans	-64.6	-45.1	176.9	-71.3	-160.9	163	0	0	112.7	E507 Q508 S513 K514 K515	E507-E511 PolarHBondContact O-N 3.38Å; Q508-E511 PolarHBondContact O-N 3.38Å; E511-S513 VanDerWaalsContact C-N 3.28Å; E511-S513 PolarHBondContact O-N 3.14Å; E511-K514 PolarHBondContact O-N 3.09Å; E511-K514 VanDerWaalsContact O-N 3.12Å; E511-K515 WeakPolarHBondContact O-CG 3.47Å; E511-K515 PolarHBondContact O-N 2.79Å; E511-K515 IonicContact OE2-NZ 2.87Å
512	K	89	Confident	82.9	Confident	135 Å²	135	132.5 Å²	132.5	59%	0.587	62%	0.62	S	S	*	*	H	α-helix	trans	-58.8	-41.6	174.1	-72.8	171.6	-177.5	173	0	110.8	Q508 K514 K515 M516	Q508-K512 WeakPolarHBondContact O-CB 3.34Å; Q508-K512 VanDerWaalsContact O-CG 3.25Å; Q508-K512 WeakPolarHBondContact O-CG 3.46Å; Q508-K512 PolarHBondContact O-N 3.03Å; K512-K514 VanDerWaalsContact C-N 3.33Å; K512-K514 PolarHBondContact O-N 3.31Å; K512-K515 PolarHBondContact O-N 3.12Å; K512-M516 WeakPolarHBondContact O-CG 3.2Å; K512-M516 PolarHBondContact O-N 2.92Å; K512-M516 VanDerWaalsContact O-N 3.13Å
513	S	88.6	Confident	81.3	Confident	69 Å²	69	134.3 Å²	134.3	48%	0.483	63%	0.628	S	S	.	*	H	α-helix	trans	-65.2	-32.1	175.9	77.5	0	0	0	0	114.1	R509 K510 E511	R509-S513 WeakPolarHBondContact O-CB 2.9Å; R509-S513 PolarHBondContact O-N 3.47Å; R509-S513 PolarHBondContact O-OG 3.14Å; K510-S513 WeakPolarHBondContact CA-OG 3.25Å; K510-S513 PolarHBondContact O-N 3.15Å; K510-S513 PolarHBondContact O-OG 3.13Å; E511-S513 VanDerWaalsContact C-N 3.28Å; E511-S513 PolarHBondContact O-N 3.14Å
514	K	84.9	Confident	79.9	Confident	173 Å²	173	140.2 Å²	140.2	75%	0.752	66%	0.656	S	S	*	*	H	α-helix	trans	-76.3	-32.1	175.9	-72.2	173.4	-178.4	177.5	0	112.6	K510 E511 K512	K510-K514 WeakPolarHBondContact O-CG 3.35Å; K510-K514 PolarHBondContact O-N 2.79Å; E511-K514 PolarHBondContact O-N 3.09Å; E511-K514 VanDerWaalsContact O-N 3.12Å; K512-K514 VanDerWaalsContact C-N 3.33Å; K512-K514 PolarHBondContact O-N 3.31Å
515	K	87.1	Confident	78.3	Confident	163 Å²	163	148.6 Å²	148.6	71%	0.709	69%	0.691	S	S	*	*	H	α-helix	trans	-81.1	-17.3	179.6	-71.7	175.4	179.6	169.1	0	113.4	E511 K512	E511-K515 WeakPolarHBondContact O-CG 3.47Å; E511-K515 PolarHBondContact O-N 2.79Å; E511-K515 IonicContact OE2-NZ 2.87Å; K512-K515 PolarHBondContact O-N 3.12Å
516	M	84	Confident	77.7	Confident	127 Å²	127	149.4 Å²	149.4	63%	0.626	70%	0.695	S	S	*	*	S	Bend	trans	-69	126	177.8	-80.1	-171.4	-70.8	0	0	111.6	K512 K518	K512-M516 WeakPolarHBondContact O-CG 3.2Å; K512-M516 PolarHBondContact O-N 2.92Å; K512-M516 VanDerWaalsContact O-N 3.13Å; M516-K518 PolarHBondContact O-N 3.25Å
517	P	80	Confident	77.1	Confident	117 Å²	117	150.5 Å²	150.5	76%	0.76	70%	0.702	S	S	*	*			trans	-65.9	131.2	178.8	25.6	-32.4	0	0	0	111	M519	P517-M519 PolarHBondContact O-N 3.26Å
518	K	81.4	Confident	76.5	Confident	206 Å²	206	155.8 Å²	155.8	90%	0.896	73%	0.727	S	S	*	*			trans	-78.1	94.8	171.6	-67.6	-177.6	179.6	179.2	0	109.1	M516 K520	M516-K518 PolarHBondContact O-N 3.25Å; K518-K520 PolarHBondContact O-N 2.79Å; K518-K520 VanDerWaalsContact O-N 3.08Å
519	M	72.2	Confident	75.8	Confident	177 Å²	177	160.3 Å²	160.3	87%	0.872	75%	0.748	S	S	*	*			trans	-63.8	107.1	169.8	-94.1	166.7	65.4	0	0	109.7	P517 M521	P517-M519 PolarHBondContact O-N 3.26Å; M519-M521 PolarHBondContact O-N 2.84Å
520	K	70.7	Confident	74.9	Confident	193 Å²	193	157.8 Å²	157.8	84%	0.839	75%	0.747	S	S	*	*			trans	-77.5	109.1	164.4	-69.9	-176.2	179.5	-179.5	0	107.4	K518 L522	K518-K520 PolarHBondContact O-N 2.79Å; K518-K520 VanDerWaalsContact O-N 3.08Å; K520-L522 PolarHBondContact O-N 3.01Å
521	M	67.1	Low	73.9	Confident	172 Å²	172	161.1 Å²	161.1	85%	0.847	77%	0.765	S	S	*	*			trans	-66.7	101.2	166.2	-77.4	179.9	69.8	0	0	108.4	M519 K523	M519-M521 PolarHBondContact O-N 2.84Å; M521-K523 PolarHBondContact O-N 3.39Å
522	L	54.6	Low	73	Confident	157 Å²	157	167.1 Å²	167.1	82%	0.822	80%	0.795	S	S	*	*			trans	-74.1	106.8	164	-137.1	93.3	0	0	0	106.9	K520 M524	K520-L522 PolarHBondContact O-N 3.01Å; L522-M524 PolarHBondContact O-N 3.46Å
523	K	55.2	Low	71.8	Confident	196 Å²	196	169.6 Å²	169.6	85%	0.852	81%	0.811	S	S	*	*			trans	-79.4	93.5	175.1	-148.2	171.2	-172.8	173.4	0	106.7	M521	M521-K523 PolarHBondContact O-N 3.39Å
524	M	54.6	Low	70.4	Confident	181 Å²	181	178 Å²	178	89%	0.892	84%	0.838	S	S	*	*			trans	-65.8	132.7	163.3	-93.9	-178	167.3	0	0	107.7	L522	L522-M524 PolarHBondContact O-N 3.46Å
525	K	52.7	Low	69.1	Low	274 Å²	274	178.5 Å²	178.5	100%	1.191	85%	0.846	S	S	*	*			trans	-113.6	0	178.6	-157.7	-179.9	-176.7	-176.4	0	108.5

Retrieved 525 of 525 residues in 636.9 ms (Link to these results)

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