A0A077ZGJ3_TRITR Loading...

RNA binding protein 26

AlphaFold DB , UniProt , Accession A0A077ZGJ3, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 690 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	54.2	Low	71.6	Confident	79 Å²	79	77.3 Å²	77.3	39%	0.389	40%	0.403	S	S	.	.				0	130.6	0	-72.2	-178.8	173.7	0	0	110.4	V3 E39 D42 V72 K73	M1-V3 PolarHBondContact O-N 2.96Å; M1-E39 WeakPolarHBondContact CA-OE1 3.22Å; M1-E39 PolarHBondContact N-OE1 3.27Å; M1-D42 WeakPolarHBondContact CE-OD1 3.34Å; M1-V72 HydrophobicContact SD-CG1 3.55Å; M1-V72 VanDerWaalsContact SD-CG1 3.55Å; M1-K73 HydrophobicContact CE-CG 4.24Å
2	L	51.8	Low	72.8	Confident	170 Å²	170	73.1 Å²	73.1	89%	0.89	38%	0.378	S	S	*	.			trans	-77	103.3	174	-68.8	172.1	0	0	0	111.7	A4	L2-A4 PolarHBondContact O-N 3.37Å
3	V	63.1	Low	73.8	Confident	36 Å²	36	67.5 Å²	67.5	22%	0.218	35%	0.349	C	S	.	.			trans	-77.5	105.8	173.8	178.5	0	0	0	0	109.8	M1 H5 L9	M1-V3 PolarHBondContact O-N 2.96Å; V3-H5 VanDerWaalsContact C-N 3.34Å; V3-H5 PolarHBondContact O-N 3.24Å; V3-L9 HydrophobicContact CB-CD2 4.44Å; V3-L9 HydrophobicContact CG1-CB 4.15Å; V3-L9 HydrophobicContact CG1-CD2 3.65Å; V3-L9 HydrophobicContact CG2-CD2 3.9Å
4	A	63.5	Low	74.7	Confident	72 Å²	72	65.1 Å²	65.1	60%	0.595	34%	0.34	S	S	*	.	S	Bend	trans	-63	-33.9	-175.1	0	0	0	0	0	114.4	L2	L2-A4 PolarHBondContact O-N 3.37Å
5	H	70.4	Confident	75.4	Confident	101 Å²	101	65.5 Å²	65.5	47%	0.468	36%	0.357	S	S	.	.			trans	-134	88.8	179.5	-64	-52.4	0	0	0	110.6	V3 E7 L8 L9	V3-H5 VanDerWaalsContact C-N 3.34Å; V3-H5 PolarHBondContact O-N 3.24Å; H5-E7 VanDerWaalsContact C-N 3.27Å; H5-E7 PolarHBondContact O-N 2.94Å; H5-L8 HydrophobicContact CB-CB 4.16Å; H5-L8 HydrophobicContact CB-CD1 3.91Å; H5-L8 HydrophobicContact CB-CG 4.14Å; H5-L8 PolarHBondContact O-N 3.25Å; H5-L9 PolarHBondContact O-N 2.67Å
6	P	76.9	Confident	75.8	Confident	48 Å²	48	62.8 Å²	62.8	31%	0.312	34%	0.342	S	S	.	.	H	α-helix	trans	-64.3	-30.1	-176.7	25.2	-34.2	0	0	0	112.9	L9 R10	P6-L9 PolarHBondContact O-N 2.69Å; P6-R10 WeakPolarHBondContact O-CG 3.37Å; P6-R10 PolarHBondContact O-N 2.95Å
7	E	76.9	Confident	76.3	Confident	100 Å²	100	59.1 Å²	59.1	47%	0.467	32%	0.322	S	S	.	.	H	α-helix	trans	-70.7	-42.8	-179.7	-51.9	-49.3	136	0	0	112.2	H5 L9 R10 E11	H5-E7 VanDerWaalsContact C-N 3.27Å; H5-E7 PolarHBondContact O-N 2.94Å; E7-L9 VanDerWaalsContact C-N 3.25Å; E7-L9 PolarHBondContact O-N 2.99Å; E7-R10 WeakPolarHBondContact O-CB 3.37Å; E7-R10 PolarHBondContact O-N 3.38Å; E7-R10 VanDerWaalsContact O-N 3.08Å; E7-R10 IonicContact OE1-CZ 2.71Å; E7-R10 IonicContact OE1-NH1 3.86Å; E7-R10 PolarHBondContact OE1-NH1 2.93Å; E7-R10 IonicContact OE1-NH2 2.67Å; E7-R10 WeakPolarHBondContact OE2-CD 3.27Å; E7-R10 IonicContact OE2-CZ 3.83Å; E7-R10 IonicContact OE2-NE 3.53Å; E7-R10 IonicContact OE2-NH1 3.65Å; E7-R10 PolarHBondContact OE2-NH1 3.43Å; E7-E11 PolarHBondContact O-N 3.49Å
8	L	79	Confident	76.4	Confident	39 Å²	39	60.5 Å²	60.5	20%	0.204	34%	0.337	C	S	.	.	H	α-helix	trans	-63	-33.9	172.1	-65.7	178.8	0	0	0	111.8	H5 W12 Y77 L78	H5-L8 HydrophobicContact CB-CB 4.16Å; H5-L8 HydrophobicContact CB-CD1 3.91Å; H5-L8 HydrophobicContact CB-CG 4.14Å; H5-L8 PolarHBondContact O-N 3.25Å; L8-W12 WeakPolarHBondContact O-CB 3.47Å; L8-W12 PolarHBondContact O-N 2.91Å; L8-Y77 HydrophobicContact CB-CD2 4.2Å; L8-L78 HydrophobicContact CD1-CD2 4.05Å
9	L	83.3	Confident	76.4	Confident	0 Å²	0	62.9 Å²	62.9	0%	0	36%	0.356	C	S	.	.	H	α-helix	trans	-69.6	-35.9	172.7	-173.6	61.8	0	0	0	111.9	V3 H5 P6 E7 W12 I13 I33 L36 L68 V72 Y77	V3-L9 HydrophobicContact CB-CD2 4.44Å; V3-L9 HydrophobicContact CG1-CB 4.15Å; V3-L9 HydrophobicContact CG1-CD2 3.65Å; V3-L9 HydrophobicContact CG2-CD2 3.9Å; H5-L9 PolarHBondContact O-N 2.67Å; P6-L9 PolarHBondContact O-N 2.69Å; E7-L9 VanDerWaalsContact C-N 3.25Å; E7-L9 PolarHBondContact O-N 2.99Å; L9-W12 HydrophobicContact CD1-CE3 4.4Å; L9-W12 PolarHBondContact O-N 3.39Å; L9-I13 HydrophobicContact CD1-CD1 4.18Å; L9-I13 HydrophobicContact CD1-CG1 4.26Å; L9-I13 HydrophobicContact CD2-CD1 4.39Å; L9-I13 HydrophobicContact CG-CD1 3.79Å; L9-I13 HydrophobicContact CG-CG1 4.33Å; L9-I13 WeakPolarHBondContact O-CB 3.31Å; L9-I13 WeakPolarHBondContact O-CG1 3.47Å; L9-I13 PolarHBondContact O-N 3.13Å; L9-I33 HydrophobicContact CD2-CG1 4.21Å; L9-I33 HydrophobicContact CG-CD1 4.49Å; L9-L36 HydrophobicContact CD2-CD1 3.92Å; L9-L68 HydrophobicContact CD1-CD1 4.37Å; L9-V72 HydrophobicContact CD1-CG2 4.23Å; L9-V72 HydrophobicContact CD2-CG2 4.38Å; L9-Y77 HydrophobicContact CD1-CD1 4.16Å; L9-Y77 HydrophobicContact CD1-CG 4.21Å
10	R	83.7	Confident	76.4	Confident	78 Å²	78	62.3 Å²	62.3	29%	0.294	35%	0.351	S	S	.	.	H	α-helix	trans	-60.8	-48.2	171.4	-73.4	-179.7	-176	144.7	7.5	111.5	P6 E7 W12 I13 C14 A29 I33	P6-R10 WeakPolarHBondContact O-CG 3.37Å; P6-R10 PolarHBondContact O-N 2.95Å; E7-R10 WeakPolarHBondContact O-CB 3.37Å; E7-R10 PolarHBondContact O-N 3.38Å; E7-R10 VanDerWaalsContact O-N 3.08Å; E7-R10 IonicContact OE1-CZ 2.71Å; E7-R10 IonicContact OE1-NH1 3.86Å; E7-R10 PolarHBondContact OE1-NH1 2.93Å; E7-R10 IonicContact OE1-NH2 2.67Å; E7-R10 WeakPolarHBondContact OE2-CD 3.27Å; E7-R10 IonicContact OE2-CZ 3.83Å; E7-R10 IonicContact OE2-NE 3.53Å; E7-R10 IonicContact OE2-NH1 3.65Å; E7-R10 PolarHBondContact OE2-NH1 3.43Å; R10-W12 VanDerWaalsContact C-N 3.34Å; R10-W12 PolarHBondContact O-N 3.34Å; R10-I13 PolarHBondContact O-N 3.24Å; R10-C14 WeakPolarHBondContact O-CB 3.39Å; R10-C14 PolarHBondContact O-N 3.02Å; R10-C14 PolarHBondContact O-SG 3.15Å; R10-A29 HydrophobicContact CG-CB 4.4Å; R10-I33 HydrophobicContact CB-CD1 4.44Å; R10-I33 HydrophobicContact CG-CD1 3.36Å
11	E	84.8	Confident	76.4	Confident	127 Å²	127	60.1 Å²	60.1	59%	0.593	34%	0.339	S	S	*	.	H	α-helix	trans	-59.1	-45.6	178.2	-70.2	-178.7	-176.2	0	0	111.6	E7 C14 A15	E7-E11 PolarHBondContact O-N 3.49Å; E11-C14 PolarHBondContact O-N 2.99Å; E11-A15 WeakPolarHBondContact O-CB 3.33Å; E11-A15 PolarHBondContact O-N 3.48Å
12	W	86.4	Confident	77.4	Confident	27 Å²	27	64.8 Å²	64.8	10%	0.102	37%	0.366	C	S	.	.	H	α-helix	trans	-62.9	-43.8	176	-174.1	93.9	0	0	0	112.2	L8 L9 R10 A15 N16 K67 L68 A71	L8-W12 WeakPolarHBondContact O-CB 3.47Å; L8-W12 PolarHBondContact O-N 2.91Å; L9-W12 HydrophobicContact CD1-CE3 4.4Å; L9-W12 PolarHBondContact O-N 3.39Å; R10-W12 VanDerWaalsContact C-N 3.34Å; R10-W12 PolarHBondContact O-N 3.34Å; W12-A15 PolarHBondContact O-N 3.25Å; W12-N16 WeakPolarHBondContact CZ2-ND2 2.92Å; W12-N16 PolarHBondContact O-N 3.04Å; W12-N16 VanDerWaalsContact O-N 3.13Å; W12-N16 PolarHBondContact O-ND2 3.32Å; W12-K67 HydrophobicContact CH2-CG 4.14Å; W12-K67 HydrophobicContact CZ2-CG 4.32Å; W12-L68 HydrophobicContact CE3-CD1 4.45Å; W12-L68 HydrophobicContact CZ3-CB 4.44Å; W12-L68 HydrophobicContact CZ3-CD1 3.86Å; W12-A71 HydrophobicContact CD2-CB 4.33Å; W12-A71 HydrophobicContact CE3-CB 4.41Å; W12-A71 HydrophobicContact CH2-CB 3.44Å; W12-A71 VanDerWaalsContact CH2-CB 3.44Å; W12-A71 HydrophobicContact CZ2-CB 3.29Å; W12-A71 HydrophobicContact CZ3-CB 4.01Å
13	I	86	Confident	78.5	Confident	0 Å²	0	59 Å²	59	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-62.5	-50.2	176.7	-73.2	167.4	0	0	0	110.3	L9 R10 A15 N16 L17 A29 V32 I33 F64 L68	L9-I13 HydrophobicContact CD1-CD1 4.18Å; L9-I13 HydrophobicContact CD1-CG1 4.26Å; L9-I13 HydrophobicContact CD2-CD1 4.39Å; L9-I13 HydrophobicContact CG-CD1 3.79Å; L9-I13 HydrophobicContact CG-CG1 4.33Å; L9-I13 WeakPolarHBondContact O-CB 3.31Å; L9-I13 WeakPolarHBondContact O-CG1 3.47Å; L9-I13 PolarHBondContact O-N 3.13Å; R10-I13 PolarHBondContact O-N 3.24Å; I13-A15 VanDerWaalsContact C-N 3.31Å; I13-A15 PolarHBondContact O-N 2.93Å; I13-N16 CarbonylContact O-C 3.51Å; I13-N16 PolarHBondContact O-N 2.7Å; I13-L17 HydrophobicContact CG2-CD1 3.38Å; I13-L17 HydrophobicContact CG2-CG 3.92Å; I13-L17 WeakPolarHBondContact O-CB 3.41Å; I13-L17 WeakPolarHBondContact O-CG 3.42Å; I13-L17 PolarHBondContact O-N 3.3Å; I13-A29 HydrophobicContact CB-CB 4.16Å; I13-A29 HydrophobicContact CG2-CB 3.65Å; I13-V32 HydrophobicContact CD1-CB 4.23Å; I13-V32 HydrophobicContact CD1-CG1 3.73Å; I13-I33 HydrophobicContact CD1-CD1 4.46Å; I13-I33 HydrophobicContact CD1-CG1 4.13Å; I13-F64 HydrophobicContact CG2-CZ 4.16Å; I13-L68 HydrophobicContact CD1-CD1 4.14Å; I13-L68 HydrophobicContact CG1-CD1 4.02Å
14	C	85.9	Confident	79.5	Confident	34 Å²	34	63.3 Å²	63.3	23%	0.23	37%	0.365	C	S	.	.	H	α-helix	trans	-56.3	-44	178.2	-72.6	0	0	0	0	112.3	R10 E11 N16 L17 S18	R10-C14 WeakPolarHBondContact O-CB 3.39Å; R10-C14 PolarHBondContact O-N 3.02Å; R10-C14 PolarHBondContact O-SG 3.15Å; E11-C14 PolarHBondContact O-N 2.99Å; C14-N16 VanDerWaalsContact C-N 3.28Å; C14-N16 PolarHBondContact O-N 3.5Å; C14-L17 PolarHBondContact O-N 2.91Å; C14-S18 WeakPolarHBondContact O-CB 3.5Å; C14-S18 PolarHBondContact O-N 3.03Å
15	A	84.5	Confident	80.4	Confident	72 Å²	72	61.8 Å²	61.8	60%	0.595	35%	0.349	S	S	*	.	H	α-helix	trans	-65.1	-28.4	177.3	0	0	0	0	0	113.5	E11 W12 I13	E11-A15 WeakPolarHBondContact O-CB 3.33Å; E11-A15 PolarHBondContact O-N 3.48Å; W12-A15 PolarHBondContact O-N 3.25Å; I13-A15 VanDerWaalsContact C-N 3.31Å; I13-A15 PolarHBondContact O-N 2.93Å
16	N	83.2	Confident	81	Confident	22 Å²	22	60.2 Å²	60.2	12%	0.118	35%	0.349	C	S	.	.	H	α-helix	trans	-89.7	-23.2	176.8	-76.9	-88.4	0	0	0	113.6	W12 I13 C14 I20 F64 K67	W12-N16 WeakPolarHBondContact CZ2-ND2 2.92Å; W12-N16 PolarHBondContact O-N 3.04Å; W12-N16 VanDerWaalsContact O-N 3.13Å; W12-N16 PolarHBondContact O-ND2 3.32Å; I13-N16 CarbonylContact O-C 3.51Å; I13-N16 PolarHBondContact O-N 2.7Å; C14-N16 VanDerWaalsContact C-N 3.28Å; C14-N16 PolarHBondContact O-N 3.5Å; N16-I20 WeakPolarHBondContact O-CD1 3.28Å; N16-I20 WeakPolarHBondContact O-CG1 3.46Å; N16-F64 HydrophobicContact CB-CD2 4.48Å; N16-F64 HydrophobicContact CB-CE2 4.02Å; N16-K67 VanDerWaalsContact OD1-CE 3.29Å; N16-K67 WeakPolarHBondContact OD1-CE 3.37Å; N16-K67 PolarHBondContact OD1-NZ 3Å
17	L	82.8	Confident	81.5	Confident	0 Å²	0	60.6 Å²	60.6	0%	0	36%	0.356	C	S	.	.	H	α-helix	trans	-83	-34.9	175.3	-71.3	173.8	0	0	0	113.1	I13 C14 P19 I20 C21 P25 L28 L57 F64	I13-L17 HydrophobicContact CG2-CD1 3.38Å; I13-L17 HydrophobicContact CG2-CG 3.92Å; I13-L17 WeakPolarHBondContact O-CB 3.41Å; I13-L17 WeakPolarHBondContact O-CG 3.42Å; I13-L17 PolarHBondContact O-N 3.3Å; C14-L17 PolarHBondContact O-N 2.91Å; L17-P19 VanDerWaalsContact C-N 3.28Å; L17-P19 VanDerWaalsContact O-N 3.11Å; L17-I20 PolarHBondContact O-N 3.4Å; L17-C21 HydrophobicContact CB-CB 4.4Å; L17-C21 WeakPolarHBondContact O-CB 3.47Å; L17-C21 PolarHBondContact O-N 2.99Å; L17-P25 HydrophobicContact CB-CB 3.89Å; L17-P25 HydrophobicContact CD1-CB 4.24Å; L17-L28 HydrophobicContact CD1-CB 4.14Å; L17-L28 HydrophobicContact CD1-CD2 3.44Å; L17-L28 VanDerWaalsContact CD1-CD2 3.44Å; L17-L28 HydrophobicContact CD1-CG 4.4Å; L17-L28 HydrophobicContact CD2-CD2 3.8Å; L17-L28 HydrophobicContact CG-CD2 4.28Å; L17-L57 HydrophobicContact CD2-CD1 4.03Å; L17-L57 HydrophobicContact CD2-CD2 4.05Å; L17-F64 HydrophobicContact CD2-CD2 4.06Å; L17-F64 HydrophobicContact CD2-CE1 4.13Å; L17-F64 HydrophobicContact CD2-CE2 3.58Å; L17-F64 HydrophobicContact CD2-CZ 3.63Å; L17-F64 HydrophobicContact CG-CE2 3.88Å; L17-F64 HydrophobicContact CG-CZ 3.97Å
18	S	78.1	Confident	82	Confident	84 Å²	84	56.2 Å²	56.2	59%	0.587	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.2	-28.7	-174.8	-174.4	0	0	0	0	116.2	C14	C14-S18 WeakPolarHBondContact O-CB 3.5Å; C14-S18 PolarHBondContact O-N 3.03Å
19	P	77.5	Confident	82.5	Confident	107 Å²	107	54.4 Å²	54.4	70%	0.695	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.4	6.7	173.8	35.8	-33.2	0	0	0	114.3	L17	L17-P19 VanDerWaalsContact C-N 3.28Å; L17-P19 VanDerWaalsContact O-N 3.11Å
20	I	75.8	Confident	82.7	Confident	50 Å²	50	60 Å²	60	26%	0.256	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-127.2	-27.1	-172.1	-41.7	-175.4	0	0	0	112.6	N16 L17 L57 N60	N16-I20 WeakPolarHBondContact O-CD1 3.28Å; N16-I20 WeakPolarHBondContact O-CG1 3.46Å; L17-I20 PolarHBondContact O-N 3.4Å; I20-L57 HydrophobicContact CB-CD2 4.03Å; I20-L57 HydrophobicContact CG2-CD2 3.65Å; I20-N60 HydrophobicContact CG2-CB 3.37Å; I20-N60 WeakPolarHBondContact CG2-ND2 3.5Å
21	C	76.4	Confident	82.9	Confident	16 Å²	16	60.2 Å²	60.2	11%	0.108	35%	0.352	C	S	.	.			trans	-120.2	129.9	-171.2	-177.7	0	0	0	0	111.3	L17 A23 L57	L17-C21 HydrophobicContact CB-CB 4.4Å; L17-C21 WeakPolarHBondContact O-CB 3.47Å; L17-C21 PolarHBondContact O-N 2.99Å; C21-A23 PolarHBondContact SG-N 2.91Å; C21-A23 VanDerWaalsContact SG-N 3.43Å; C21-A23 PolarHBondContact SG-O 3.2Å; C21-L57 HydrophobicContact CB-CD2 3.98Å
22	D	74.8	Confident	83	Confident	178 Å²	178	54.1 Å²	54.1	95%	0.952	32%	0.324	S	S	*	.	S	Bend	trans	-84.2	-16	176.4	-159.3	41.8	0	0	0	112.5
23	A	75.3	Confident	82.9	Confident	49 Å²	49	53.4 Å²	53.4	41%	0.405	32%	0.322	S	S	.	.	S	Bend	trans	-92	156	175.9	0	0	0	0	0	112.7	C21 P25	C21-A23 PolarHBondContact SG-N 2.91Å; C21-A23 VanDerWaalsContact SG-N 3.43Å; C21-A23 PolarHBondContact SG-O 3.2Å; A23-P25 VanDerWaalsContact O-CD 3.3Å; A23-P25 WeakPolarHBondContact O-CD 3.47Å
24	D	84.2	Confident	82.9	Confident	126 Å²	126	55.8 Å²	55.8	67%	0.674	34%	0.341	S	S	*	.			trans	-46.1	106.4	-174.8	-86.2	-48.8	0	0	0	114.5	S26 A27 L28	D24-S26 PolarHBondContact O-N 3.15Å; D24-A27 HydrophobicContact CB-CB 3.89Å; D24-A27 PolarHBondContact O-N 3.16Å; D24-L28 PolarHBondContact O-N 3.49Å; D24-L28 VanDerWaalsContact O-N 3.08Å
25	P	83.5	Confident	82.9	Confident	40 Å²	40	54.2 Å²	54.2	26%	0.26	33%	0.331	S	S	.	.	H	α-helix	trans	-66.1	-27.4	-176.2	25	-33.6	0	0	0	112.2	L17 A23 A29	L17-P25 HydrophobicContact CB-CB 3.89Å; L17-P25 HydrophobicContact CD1-CB 4.24Å; A23-P25 VanDerWaalsContact O-CD 3.3Å; A23-P25 WeakPolarHBondContact O-CD 3.47Å; P25-A29 WeakPolarHBondContact O-CB 3.41Å; P25-A29 PolarHBondContact O-N 3.36Å
26	S	83	Confident	82.7	Confident	68 Å²	68	51.2 Å²	51.2	48%	0.476	31%	0.305	S	S	.	.	H	α-helix	trans	-70.5	-30.3	175.6	-176	0	0	0	0	113.2	D24 K30	D24-S26 PolarHBondContact O-N 3.15Å; S26-K30 WeakPolarHBondContact O-CD 3.37Å; S26-K30 WeakPolarHBondContact O-CE 3.29Å; S26-K30 WeakPolarHBondContact O-CG 3.41Å
27	A	86.9	Confident	82.5	Confident	56 Å²	56	57.9 Å²	57.9	46%	0.463	33%	0.333	S	S	.	.	H	α-helix	trans	-74.9	-48.5	172.5	0	0	0	0	0	110.2	D24 A29 K30 Y31	D24-A27 HydrophobicContact CB-CB 3.89Å; D24-A27 PolarHBondContact O-N 3.16Å; A27-A29 VanDerWaalsContact C-N 3.35Å; A27-A29 PolarHBondContact O-N 2.99Å; A27-K30 WeakPolarHBondContact O-CB 3.47Å; A27-K30 PolarHBondContact O-N 3.39Å; A27-K30 VanDerWaalsContact O-N 3.13Å; A27-Y31 PolarHBondContact O-N 3.37Å
28	L	87.4	Confident	82.2	Confident	8 Å²	8	63.8 Å²	63.8	4%	0.042	36%	0.358	C	S	.	.	H	α-helix	trans	-65.8	-35.2	-178.1	-161	137.6	0	0	0	112.4	L17 D24 K30 Y31 V32 L53 F56	L17-L28 HydrophobicContact CD1-CB 4.14Å; L17-L28 HydrophobicContact CD1-CD2 3.44Å; L17-L28 VanDerWaalsContact CD1-CD2 3.44Å; L17-L28 HydrophobicContact CD1-CG 4.4Å; L17-L28 HydrophobicContact CD2-CD2 3.8Å; L17-L28 HydrophobicContact CG-CD2 4.28Å; D24-L28 PolarHBondContact O-N 3.49Å; D24-L28 VanDerWaalsContact O-N 3.08Å; L28-K30 VanDerWaalsContact C-N 3.29Å; L28-K30 PolarHBondContact O-N 3.31Å; L28-Y31 WeakPolarHBondContact O-CB 3.4Å; L28-Y31 PolarHBondContact O-N 3.05Å; L28-Y31 VanDerWaalsContact O-N 3.13Å; L28-V32 HydrophobicContact CD2-CG2 3.73Å; L28-V32 WeakPolarHBondContact O-CG2 3.4Å; L28-V32 PolarHBondContact O-N 3.25Å; L28-L53 HydrophobicContact CD2-CD2 4.1Å; L28-F56 HydrophobicContact CD1-CB 3.57Å; L28-F56 HydrophobicContact CD1-CD1 3.63Å; L28-F56 HydrophobicContact CD1-CD2 3.76Å; L28-F56 HydrophobicContact CD1-CE1 4.21Å; L28-F56 HydrophobicContact CD1-CE2 4.32Å; L28-F56 HydrophobicContact CD1-CG 3.38Å
29	A	88.5	Confident	81.3	Confident	1 Å²	1	66 Å²	66	1%	0.008	36%	0.359	C	S	.	.	H	α-helix	trans	-60	-34.7	173	0	0	0	0	0	113.7	R10 I13 P25 A27 I33	R10-A29 HydrophobicContact CG-CB 4.4Å; I13-A29 HydrophobicContact CB-CB 4.16Å; I13-A29 HydrophobicContact CG2-CB 3.65Å; P25-A29 WeakPolarHBondContact O-CB 3.41Å; P25-A29 PolarHBondContact O-N 3.36Å; A27-A29 VanDerWaalsContact C-N 3.35Å; A27-A29 PolarHBondContact O-N 2.99Å; A29-I33 WeakPolarHBondContact O-CG1 3.47Å; A29-I33 PolarHBondContact O-N 3.17Å
30	K	87.5	Confident	81.1	Confident	118 Å²	118	65.1 Å²	65.1	51%	0.513	35%	0.345	S	S	.	.	H	α-helix	trans	-68.9	-39.9	175	-65.9	165.2	-172.4	172.1	0	111	S26 A27 L28 A34	S26-K30 WeakPolarHBondContact O-CD 3.37Å; S26-K30 WeakPolarHBondContact O-CE 3.29Å; S26-K30 WeakPolarHBondContact O-CG 3.41Å; A27-K30 WeakPolarHBondContact O-CB 3.47Å; A27-K30 PolarHBondContact O-N 3.39Å; A27-K30 VanDerWaalsContact O-N 3.13Å; L28-K30 VanDerWaalsContact C-N 3.29Å; L28-K30 PolarHBondContact O-N 3.31Å; K30-A34 PolarHBondContact O-N 3.38Å; K30-A34 VanDerWaalsContact O-N 3.12Å
31	Y	88.3	Confident	81.1	Confident	81 Å²	81	69 Å²	69	32%	0.318	36%	0.362	S	S	.	.	H	α-helix	trans	-67.1	-47.1	177.1	176.3	-114.5	0	0	0	112.3	A27 L28 I33 A34 L35 Q52 L53 F56	A27-Y31 PolarHBondContact O-N 3.37Å; L28-Y31 WeakPolarHBondContact O-CB 3.4Å; L28-Y31 PolarHBondContact O-N 3.05Å; L28-Y31 VanDerWaalsContact O-N 3.13Å; Y31-I33 VanDerWaalsContact C-N 3.28Å; Y31-I33 PolarHBondContact O-N 3.15Å; Y31-A34 CarbonylContact O-C 3.58Å; Y31-A34 WeakPolarHBondContact O-CA 3.3Å; Y31-A34 WeakPolarHBondContact O-CB 3.33Å; Y31-A34 PolarHBondContact O-N 2.92Å; Y31-L35 HydrophobicContact CD1-CD1 4.22Å; Y31-L35 HydrophobicContact CE1-CD1 3.73Å; Y31-L35 HydrophobicContact CE1-CG 4.36Å; Y31-L35 HydrophobicContact CE2-CD2 4.17Å; Y31-L35 HydrophobicContact CE2-CG 4.35Å; Y31-L35 PolarHBondContact O-N 3.41Å; Y31-Q52 HydrophobicContact CE1-CB 4.45Å; Y31-Q52 WeakPolarHBondContact OH-CB 3.45Å; Y31-Q52 PolarHBondContact OH-OE1 3.5Å; Y31-L53 HydrophobicContact CD1-CD2 4.26Å; Y31-L53 HydrophobicContact CE1-CD2 4.19Å; Y31-F56 HydrophobicContact CE1-CE2 4.36Å
32	V	86.4	Confident	80.9	Confident	0 Å²	0	70.5 Å²	70.5	0%	0	37%	0.368	C	S	.	.	H	α-helix	trans	-55.4	-42.9	175.1	172.3	0	0	0	0	111.5	I13 L28 A34 L35 L36 L53 L68	I13-V32 HydrophobicContact CD1-CB 4.23Å; I13-V32 HydrophobicContact CD1-CG1 3.73Å; L28-V32 HydrophobicContact CD2-CG2 3.73Å; L28-V32 WeakPolarHBondContact O-CG2 3.4Å; L28-V32 PolarHBondContact O-N 3.25Å; V32-A34 VanDerWaalsContact C-N 3.31Å; V32-A34 PolarHBondContact O-N 2.95Å; V32-L35 PolarHBondContact O-N 2.98Å; V32-L36 HydrophobicContact CG1-CD1 4.19Å; V32-L36 WeakPolarHBondContact O-CG 3.41Å; V32-L36 PolarHBondContact O-N 3.31Å; V32-L53 HydrophobicContact CG2-CD1 4.18Å; V32-L53 HydrophobicContact CG2-CD2 3.95Å; V32-L68 HydrophobicContact CG1-CD2 3.54Å
33	I	86	Confident	80.8	Confident	11 Å²	11	67.2 Å²	67.2	6%	0.056	35%	0.351	C	S	.	.	H	α-helix	trans	-68.4	-29.1	176.5	-69.8	172.2	0	0	0	112.3	L9 R10 I13 A29 Y31 K37	L9-I33 HydrophobicContact CD2-CG1 4.21Å; L9-I33 HydrophobicContact CG-CD1 4.49Å; R10-I33 HydrophobicContact CB-CD1 4.44Å; R10-I33 HydrophobicContact CG-CD1 3.36Å; I13-I33 HydrophobicContact CD1-CD1 4.46Å; I13-I33 HydrophobicContact CD1-CG1 4.13Å; A29-I33 WeakPolarHBondContact O-CG1 3.47Å; A29-I33 PolarHBondContact O-N 3.17Å; Y31-I33 VanDerWaalsContact C-N 3.28Å; Y31-I33 PolarHBondContact O-N 3.15Å; I33-K37 WeakPolarHBondContact O-CG 3.19Å; I33-K37 PolarHBondContact O-N 3.35Å
34	A	85.8	Confident	81.2	Confident	50 Å²	50	70.3 Å²	70.3	41%	0.413	36%	0.357	S	S	.	.	H	α-helix	trans	-72.1	-30	171.7	0	0	0	0	0	112.7	K30 Y31 V32	K30-A34 PolarHBondContact O-N 3.38Å; K30-A34 VanDerWaalsContact O-N 3.12Å; Y31-A34 CarbonylContact O-C 3.58Å; Y31-A34 WeakPolarHBondContact O-CA 3.3Å; Y31-A34 WeakPolarHBondContact O-CB 3.33Å; Y31-A34 PolarHBondContact O-N 2.92Å; V32-A34 VanDerWaalsContact C-N 3.31Å; V32-A34 PolarHBondContact O-N 2.95Å
35	L	84.7	Confident	81.1	Confident	2 Å²	2	64.7 Å²	64.7	1%	0.01	33%	0.327	C	S	.	.	H	α-helix	trans	-72.1	-45.4	172	-62.3	179	0	0	0	111.8	Y31 V32 K37 K38 F48 L49 Q52	Y31-L35 HydrophobicContact CD1-CD1 4.22Å; Y31-L35 HydrophobicContact CE1-CD1 3.73Å; Y31-L35 HydrophobicContact CE1-CG 4.36Å; Y31-L35 HydrophobicContact CE2-CD2 4.17Å; Y31-L35 HydrophobicContact CE2-CG 4.35Å; Y31-L35 PolarHBondContact O-N 3.41Å; V32-L35 PolarHBondContact O-N 2.98Å; L35-K37 PolarHBondContact O-N 2.89Å; L35-K37 VanDerWaalsContact O-N 3.09Å; L35-K38 WeakPolarHBondContact O-CB 3.43Å; L35-K38 PolarHBondContact O-N 3.46Å; L35-F48 HydrophobicContact CD2-CE1 3.92Å; L35-F48 HydrophobicContact CD2-CZ 4.03Å; L35-L49 HydrophobicContact CB-CD2 3.68Å; L35-L49 HydrophobicContact CD1-CD2 3.8Å; L35-L49 HydrophobicContact CG-CD2 4.41Å; L35-Q52 HydrophobicContact CD1-CB 3.69Å; L35-Q52 HydrophobicContact CD1-CG 4.26Å; L35-Q52 HydrophobicContact CD2-CG 4.29Å
36	L	81.7	Confident	81.1	Confident	9 Å²	9	65.1 Å²	65.1	5%	0.047	33%	0.328	C	S	.	.	H	α-helix	trans	-60	-20.9	178	-71.3	172	0	0	0	114	L9 V32 K38 L45 L49 L68	L9-L36 HydrophobicContact CD2-CD1 3.92Å; V32-L36 HydrophobicContact CG1-CD1 4.19Å; V32-L36 WeakPolarHBondContact O-CG 3.41Å; V32-L36 PolarHBondContact O-N 3.31Å; L36-K38 VanDerWaalsContact C-N 3.33Å; L36-L45 HydrophobicContact CD2-CD2 4.22Å; L36-L49 HydrophobicContact CD2-CD1 4.17Å; L36-L68 HydrophobicContact CD1-CD1 4.48Å; L36-L68 HydrophobicContact CD1-CD2 4.49Å
37	K	79.1	Confident	81.1	Confident	161 Å²	161	65.3 Å²	65.3	70%	0.7	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.2	-8.6	173.9	-78.5	-179	175.2	-167.9	0	114.8	I33 L35 E39	I33-K37 WeakPolarHBondContact O-CG 3.19Å; I33-K37 PolarHBondContact O-N 3.35Å; L35-K37 PolarHBondContact O-N 2.89Å; L35-K37 VanDerWaalsContact O-N 3.09Å; K37-E39 VanDerWaalsContact C-N 3.3Å; K37-E39 PolarHBondContact O-N 3.37Å
38	K	75.2	Confident	81	Confident	124 Å²	124	64 Å²	64	54%	0.539	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.6	12	-176.2	-62.9	-174.8	176.6	-179.8	0	114.9	L35 L36 K40 F48	L35-K38 WeakPolarHBondContact O-CB 3.43Å; L35-K38 PolarHBondContact O-N 3.46Å; L36-K38 VanDerWaalsContact C-N 3.33Å; K38-K40 PolarHBondContact O-N 3.32Å; K38-F48 HydrophobicContact CD-CE1 3.94Å; K38-F48 HydrophobicContact CD-CZ 3.98Å
39	E	60.3	Low	81	Confident	130 Å²	130	63.6 Å²	63.6	61%	0.607	31%	0.312	S	S	*	.			trans	33.8	65	168.6	-52.9	-139	118	0	0	116.5	M1 K37	M1-E39 WeakPolarHBondContact CA-OE1 3.22Å; M1-E39 PolarHBondContact N-OE1 3.27Å; K37-E39 VanDerWaalsContact C-N 3.3Å; K37-E39 PolarHBondContact O-N 3.37Å
40	K	72.8	Confident	80.9	Confident	90 Å²	90	64.7 Å²	64.7	39%	0.391	32%	0.319	S	S	.	.			trans	-93.8	167	166.9	-65.8	-170.3	173.5	-173.6	0	111.7	K38 E44 L45 F48	K38-K40 PolarHBondContact O-N 3.32Å; K40-E44 HydrophobicContact CB-CB 4.05Å; K40-E44 HydrophobicContact CD-CB 4.2Å; K40-L45 HydrophobicContact CB-CB 4.42Å; K40-F48 HydrophobicContact CD-CB 4.11Å; K40-F48 HydrophobicContact CD-CD1 4.13Å; K40-F48 HydrophobicContact CD-CG 4.13Å
41	H	74.7	Confident	80.8	Confident	132 Å²	132	65 Å²	65	61%	0.611	32%	0.323	S	S	*	.			trans	-62.2	154.3	169.2	-145.9	-100.2	0	0	0	110.6	D43 E44 L45	H41-D43 VanDerWaalsContact C-N 3.25Å; H41-D43 IonicContact CE1-OD2 2.65Å; H41-D43 IonicContact ND1-OD2 2.7Å; H41-D43 PolarHBondContact ND1-OD2 2.89Å; H41-D43 PolarHBondContact O-N 3.2Å; H41-E44 HydrophobicContact CB-CG 4.25Å; H41-E44 PolarHBondContact O-N 3.49Å; H41-L45 VanDerWaalsContact O-CB 3.22Å; H41-L45 WeakPolarHBondContact O-CB 3.47Å; H41-L45 PolarHBondContact O-N 2.91Å
42	D	72.6	Confident	80.7	Confident	46 Å²	46	64 Å²	64	25%	0.246	32%	0.321	C	S	.	.	H	α-helix	trans	-54.2	-41.1	-174.2	-83.6	-36.5	0	0	0	113.1	M1 L45 V46 K73	M1-D42 WeakPolarHBondContact CE-OD1 3.34Å; D42-L45 WeakPolarHBondContact O-CB 3.37Å; D42-L45 PolarHBondContact O-N 3.43Å; D42-V46 WeakPolarHBondContact O-CG2 3.31Å; D42-V46 PolarHBondContact O-N 3.45Å; D42-K73 VanDerWaalsContact CG-CE 3.43Å; D42-K73 WeakPolarHBondContact OD1-CE 3.45Å; D42-K73 IonicContact OD1-NZ 2.93Å; D42-K73 WeakPolarHBondContact OD2-CE 3.49Å; D42-K73 IonicContact OD2-NZ 3.1Å; D42-K73 PolarHBondContact OD2-NZ 2.96Å
43	D	74.1	Confident	80.6	Confident	110 Å²	110	64 Å²	64	59%	0.588	32%	0.321	S	S	*	.	H	α-helix	trans	-75.4	-37.2	-174.4	-37.2	-84.2	0	0	0	111.8	H41 L45 S47	H41-D43 VanDerWaalsContact C-N 3.25Å; H41-D43 IonicContact CE1-OD2 2.65Å; H41-D43 IonicContact ND1-OD2 2.7Å; H41-D43 PolarHBondContact ND1-OD2 2.89Å; H41-D43 PolarHBondContact O-N 3.2Å; D43-L45 VanDerWaalsContact C-N 3.32Å; D43-S47 PolarHBondContact O-N 3.41Å; D43-S47 PolarHBondContact O-OG 3.41Å
44	E	81.8	Confident	80.6	Confident	114 Å²	114	69.2 Å²	69.2	53%	0.533	35%	0.345	S	S	.	.	H	α-helix	trans	-69.1	-32.8	169.6	-62.3	-177.1	165.2	0	0	111.7	K40 H41 S47 F48	K40-E44 HydrophobicContact CB-CB 4.05Å; K40-E44 HydrophobicContact CD-CB 4.2Å; H41-E44 HydrophobicContact CB-CG 4.25Å; H41-E44 PolarHBondContact O-N 3.49Å; E44-S47 PolarHBondContact O-N 3.36Å; E44-F48 WeakPolarHBondContact O-CB 3.35Å; E44-F48 PolarHBondContact O-N 3.28Å
45	L	82.6	Confident	80.6	Confident	8 Å²	8	72.5 Å²	72.5	4%	0.042	36%	0.359	C	S	.	.	H	α-helix	trans	-71.2	-36.7	179.9	-174.2	67.4	0	0	0	111.1	L36 K40 H41 D42 D43 L49	L36-L45 HydrophobicContact CD2-CD2 4.22Å; K40-L45 HydrophobicContact CB-CB 4.42Å; H41-L45 VanDerWaalsContact O-CB 3.22Å; H41-L45 WeakPolarHBondContact O-CB 3.47Å; H41-L45 PolarHBondContact O-N 2.91Å; D42-L45 WeakPolarHBondContact O-CB 3.37Å; D42-L45 PolarHBondContact O-N 3.43Å; D43-L45 VanDerWaalsContact C-N 3.32Å; L45-L49 HydrophobicContact CD1-CD1 4.11Å; L45-L49 HydrophobicContact CD1-CG 4.12Å; L45-L49 HydrophobicContact CG-CD1 3.86Å; L45-L49 HydrophobicContact CG-CG 4.28Å; L45-L49 WeakPolarHBondContact O-CB 3.41Å; L45-L49 WeakPolarHBondContact O-CG 3.41Å; L45-L49 PolarHBondContact O-N 3.22Å
46	V	83.6	Confident	80.6	Confident	48 Å²	48	76.9 Å²	76.9	29%	0.291	38%	0.379	S	S	.	.	H	α-helix	trans	-55	-57.9	168.5	174.8	0	0	0	0	109.7	D42 F48 L49 S50 V65 I69	D42-V46 WeakPolarHBondContact O-CG2 3.31Å; D42-V46 PolarHBondContact O-N 3.45Å; V46-F48 PolarHBondContact O-N 2.87Å; V46-L49 PolarHBondContact O-N 3.15Å; V46-S50 PolarHBondContact O-N 2.91Å; V46-S50 PolarHBondContact O-OG 3.44Å; V46-V65 HydrophobicContact CB-CG1 4.46Å; V46-V65 HydrophobicContact CG1-CG1 4.22Å; V46-I69 HydrophobicContact CB-CD1 4.32Å; V46-I69 HydrophobicContact CG2-CD1 3.46Å; V46-I69 VanDerWaalsContact CG2-CD1 3.46Å
47	S	83.8	Confident	80.5	Confident	73 Å²	73	76.7 Å²	76.7	51%	0.51	38%	0.378	S	S	.	.	H	α-helix	trans	-59.5	-44	-175.9	-55.2	0	0	0	0	112.6	D43 E44 S50 E51	D43-S47 PolarHBondContact O-N 3.41Å; D43-S47 PolarHBondContact O-OG 3.41Å; E44-S47 PolarHBondContact O-N 3.36Å; S47-S50 WeakPolarHBondContact CA-OG 3.37Å; S47-S50 PolarHBondContact O-N 3.34Å; S47-S50 PolarHBondContact O-OG 2.89Å; S47-E51 PolarHBondContact O-N 2.93Å; S47-E51 VanDerWaalsContact O-N 3.1Å
48	F	85.4	Confident	80.7	Confident	28 Å²	28	75.6 Å²	75.6	12%	0.123	38%	0.375	C	S	.	.	H	α-helix	trans	-72.2	-33.1	179.7	179.7	-115.9	0	0	0	113	L35 K38 K40 E44 V46 Q52	L35-F48 HydrophobicContact CD2-CE1 3.92Å; L35-F48 HydrophobicContact CD2-CZ 4.03Å; K38-F48 HydrophobicContact CD-CE1 3.94Å; K38-F48 HydrophobicContact CD-CZ 3.98Å; K40-F48 HydrophobicContact CD-CB 4.11Å; K40-F48 HydrophobicContact CD-CD1 4.13Å; K40-F48 HydrophobicContact CD-CG 4.13Å; E44-F48 WeakPolarHBondContact O-CB 3.35Å; E44-F48 PolarHBondContact O-N 3.28Å; V46-F48 PolarHBondContact O-N 2.87Å; F48-Q52 HydrophobicContact CD2-CG 4.27Å; F48-Q52 HydrophobicContact CE2-CG 3.98Å; F48-Q52 HydrophobicContact CZ-CG 4.26Å; F48-Q52 WeakPolarHBondContact O-CB 3.47Å; F48-Q52 WeakPolarHBondContact O-CG 3.49Å; F48-Q52 PolarHBondContact O-N 2.9Å
49	L	85.4	Confident	80.9	Confident	0 Å²	0	79 Å²	79	0%	0	39%	0.39	C	S	.	.	H	α-helix	trans	-73.1	-35.7	172.1	-73.1	172.7	0	0	0	111.5	L35 L36 L45 V46 L53 V65 L68 I69	L35-L49 HydrophobicContact CB-CD2 3.68Å; L35-L49 HydrophobicContact CD1-CD2 3.8Å; L35-L49 HydrophobicContact CG-CD2 4.41Å; L36-L49 HydrophobicContact CD2-CD1 4.17Å; L45-L49 HydrophobicContact CD1-CD1 4.11Å; L45-L49 HydrophobicContact CD1-CG 4.12Å; L45-L49 HydrophobicContact CG-CD1 3.86Å; L45-L49 HydrophobicContact CG-CG 4.28Å; L45-L49 WeakPolarHBondContact O-CB 3.41Å; L45-L49 WeakPolarHBondContact O-CG 3.41Å; L45-L49 PolarHBondContact O-N 3.22Å; V46-L49 PolarHBondContact O-N 3.15Å; L49-L53 WeakPolarHBondContact O-CB 3.23Å; L49-L53 WeakPolarHBondContact O-CG 3.41Å; L49-L53 PolarHBondContact O-N 2.79Å; L49-L53 VanDerWaalsContact O-N 3.1Å; L49-V65 HydrophobicContact CB-CB 4.49Å; L49-V65 HydrophobicContact CB-CG1 3.78Å; L49-V65 HydrophobicContact CB-CG2 3.81Å; L49-V65 HydrophobicContact CD1-CG1 4.17Å; L49-L68 HydrophobicContact CD1-CD2 4.27Å; L49-I69 HydrophobicContact CD1-CD1 4.29Å; L49-I69 HydrophobicContact CD1-CG1 4.41Å
50	S	86.8	Confident	81.8	Confident	24 Å²	24	76.9 Å²	76.9	17%	0.168	38%	0.383	C	S	.	.	H	α-helix	trans	-66.2	-49	177.9	55	0	0	0	0	111.9	V46 S47 Q52 L53 E54	V46-S50 PolarHBondContact O-N 2.91Å; V46-S50 PolarHBondContact O-OG 3.44Å; S47-S50 WeakPolarHBondContact CA-OG 3.37Å; S47-S50 PolarHBondContact O-N 3.34Å; S47-S50 PolarHBondContact O-OG 2.89Å; S50-Q52 VanDerWaalsContact C-N 3.32Å; S50-Q52 PolarHBondContact O-N 2.91Å; S50-L53 PolarHBondContact O-N 2.89Å; S50-L53 VanDerWaalsContact O-N 3.17Å; S50-E54 WeakPolarHBondContact O-CB 3.19Å; S50-E54 PolarHBondContact O-N 3.33Å
51	E	87	Confident	82.4	Confident	125 Å²	125	72.8 Å²	72.8	58%	0.584	37%	0.365	S	S	*	.	H	α-helix	trans	-56.2	-44.9	177.6	-179.9	-172.8	-152.6	0	0	112.1	S47 L53	S47-E51 PolarHBondContact O-N 2.93Å; S47-E51 VanDerWaalsContact O-N 3.1Å; E51-L53 VanDerWaalsContact C-N 3.34Å; E51-L53 PolarHBondContact O-N 3.36Å
52	Q	84.7	Confident	82.8	Confident	59 Å²	59	71.3 Å²	71.3	28%	0.276	36%	0.361	S	S	.	.	H	α-helix	trans	-76.7	-16	-178	-65.8	-66.9	-90.6	0	0	114.1	Y31 L35 F48 S50	Y31-Q52 HydrophobicContact CE1-CB 4.45Å; Y31-Q52 WeakPolarHBondContact OH-CB 3.45Å; Y31-Q52 PolarHBondContact OH-OE1 3.5Å; L35-Q52 HydrophobicContact CD1-CB 3.69Å; L35-Q52 HydrophobicContact CD1-CG 4.26Å; L35-Q52 HydrophobicContact CD2-CG 4.29Å; F48-Q52 HydrophobicContact CD2-CG 4.27Å; F48-Q52 HydrophobicContact CE2-CG 3.98Å; F48-Q52 HydrophobicContact CZ-CG 4.26Å; F48-Q52 WeakPolarHBondContact O-CB 3.47Å; F48-Q52 WeakPolarHBondContact O-CG 3.49Å; F48-Q52 PolarHBondContact O-N 2.9Å; S50-Q52 VanDerWaalsContact C-N 3.32Å; S50-Q52 PolarHBondContact O-N 2.91Å
53	L	85.3	Confident	83.3	Confident	0 Å²	0	75.5 Å²	75.5	0%	0	38%	0.377	C	S	.	.	H	α-helix	trans	-111.8	-14.1	-177.9	-64.2	177.3	0	0	0	114	L28 Y31 V32 L49 S50 E51 V55 F56 L57 T61 F64 V65	L28-L53 HydrophobicContact CD2-CD2 4.1Å; Y31-L53 HydrophobicContact CD1-CD2 4.26Å; Y31-L53 HydrophobicContact CE1-CD2 4.19Å; V32-L53 HydrophobicContact CG2-CD1 4.18Å; V32-L53 HydrophobicContact CG2-CD2 3.95Å; L49-L53 WeakPolarHBondContact O-CB 3.23Å; L49-L53 WeakPolarHBondContact O-CG 3.41Å; L49-L53 PolarHBondContact O-N 2.79Å; L49-L53 VanDerWaalsContact O-N 3.1Å; S50-L53 PolarHBondContact O-N 2.89Å; S50-L53 VanDerWaalsContact O-N 3.17Å; E51-L53 VanDerWaalsContact C-N 3.34Å; E51-L53 PolarHBondContact O-N 3.36Å; L53-V55 PolarHBondContact O-N 3.35Å; L53-F56 PolarHBondContact O-N 2.93Å; L53-L57 HydrophobicContact CB-CD1 4.39Å; L53-L57 PolarHBondContact O-N 2.82Å; L53-T61 HydrophobicContact CB-CG2 3.6Å; L53-F64 HydrophobicContact CD1-CD1 4.23Å; L53-F64 HydrophobicContact CD1-CE1 4.19Å; L53-V65 HydrophobicContact CD1-CG2 4.05Å
54	E	86.4	Confident	84	Confident	121 Å²	121	70.3 Å²	70.3	57%	0.565	35%	0.35	S	S	*	.	H	α-helix	trans	-57.8	-36.1	177.7	-178.6	167.6	-162.9	0	0	112.3	S50 F56 Q58 T61	S50-E54 WeakPolarHBondContact O-CB 3.19Å; S50-E54 PolarHBondContact O-N 3.33Å; E54-F56 PolarHBondContact O-N 3.22Å; E54-F56 VanDerWaalsContact O-N 3.15Å; E54-Q58 VanDerWaalsContact O-CA 3.26Å; E54-Q58 WeakPolarHBondContact O-CA 3.22Å; E54-Q58 PolarHBondContact O-N 2.88Å; E54-T61 WeakPolarHBondContact CA-OG1 3.43Å
55	V	85	Confident	84.3	Confident	118 Å²	118	64.9 Å²	64.9	72%	0.715	32%	0.324	S	S	*	.	H	α-helix	trans	-56.3	-29.6	174.3	-175.9	0	0	0	0	112.6	L53	L53-V55 PolarHBondContact O-N 3.35Å
56	F	83.8	Confident	84.5	Confident	95 Å²	95	69.9 Å²	69.9	42%	0.417	35%	0.347	S	S	.	.	H	α-helix	trans	-104.5	-37.9	-177	-60.2	-81.3	0	0	0	113.8	L28 Y31 L53 E54	L28-F56 HydrophobicContact CD1-CB 3.57Å; L28-F56 HydrophobicContact CD1-CD1 3.63Å; L28-F56 HydrophobicContact CD1-CD2 3.76Å; L28-F56 HydrophobicContact CD1-CE1 4.21Å; L28-F56 HydrophobicContact CD1-CE2 4.32Å; L28-F56 HydrophobicContact CD1-CG 3.38Å; Y31-F56 HydrophobicContact CE1-CE2 4.36Å; L53-F56 PolarHBondContact O-N 2.93Å; E54-F56 PolarHBondContact O-N 3.22Å; E54-F56 VanDerWaalsContact O-N 3.15Å
57	L	80.4	Confident	84.7	Confident	5 Å²	5	71.7 Å²	71.7	3%	0.026	35%	0.352	C	S	.	.	H	α-helix	trans	-110.5	-9.3	-170.4	-70.3	169.7	0	0	0	113.5	L17 I20 C21 L53 K59 N60 T61 F64	L17-L57 HydrophobicContact CD2-CD1 4.03Å; L17-L57 HydrophobicContact CD2-CD2 4.05Å; I20-L57 HydrophobicContact CB-CD2 4.03Å; I20-L57 HydrophobicContact CG2-CD2 3.65Å; C21-L57 HydrophobicContact CB-CD2 3.98Å; L53-L57 HydrophobicContact CB-CD1 4.39Å; L53-L57 PolarHBondContact O-N 2.82Å; L57-K59 PolarHBondContact O-N 3.28Å; L57-N60 WeakPolarHBondContact O-CB 3.42Å; L57-N60 PolarHBondContact O-N 2.82Å; L57-T61 VanDerWaalsContact C-OG1 3.27Å; L57-T61 HydrophobicContact CB-CG2 4.45Å; L57-T61 VanDerWaalsContact CB-OG1 3.26Å; L57-T61 WeakPolarHBondContact CB-OG1 3.49Å; L57-F64 HydrophobicContact CD1-CB 4.01Å; L57-F64 HydrophobicContact CD1-CD1 3.65Å; L57-F64 HydrophobicContact CD1-CE1 4.32Å; L57-F64 HydrophobicContact CD1-CG 3.82Å
58	Q	82.9	Confident	84.8	Confident	138 Å²	138	68.2 Å²	68.2	65%	0.645	33%	0.327	S	S	*	.	G	3₁₀ helix	trans	45.4	-119.1	177.7	-57.4	-179.4	4.9	0	0	112.1	E54 N60 T61	E54-Q58 VanDerWaalsContact O-CA 3.26Å; E54-Q58 WeakPolarHBondContact O-CA 3.22Å; E54-Q58 PolarHBondContact O-N 2.88Å; Q58-N60 PolarHBondContact O-N 3.25Å; Q58-T61 PolarHBondContact N-OG1 3.24Å; Q58-T61 WeakPolarHBondContact O-CB 3.19Å; Q58-T61 PolarHBondContact O-N 3.45Å; Q58-T61 PolarHBondContact O-OG1 3.46Å
59	K	78.9	Confident	84.8	Confident	196 Å²	196	67.5 Å²	67.5	85%	0.852	33%	0.325	S	S	*	.	G	3₁₀ helix	trans	-65.7	-19.2	-177.8	-59.6	-178.7	-178.2	-179.9	0	114.1	L57	L57-K59 PolarHBondContact O-N 3.28Å
60	N	79.9	Confident	84.8	Confident	84 Å²	84	70.4 Å²	70.4	45%	0.449	35%	0.345	S	S	.	.	G	3₁₀ helix	trans	-90.5	-4.1	-178.6	-58.9	-35.4	0	0	0	112.8	I20 L57 Q58 F64	I20-N60 HydrophobicContact CG2-CB 3.37Å; I20-N60 WeakPolarHBondContact CG2-ND2 3.5Å; L57-N60 WeakPolarHBondContact O-CB 3.42Å; L57-N60 PolarHBondContact O-N 2.82Å; Q58-N60 PolarHBondContact O-N 3.25Å; N60-F64 PolarHBondContact O-N 3.23Å; N60-F64 VanDerWaalsContact O-N 3.13Å
61	T	85.2	Confident	84.7	Confident	4 Å²	4	69.4 Å²	69.4	3%	0.025	34%	0.338	C	S	.	.	H	α-helix	trans	-62	-50.3	-171.4	-50.4	0	0	0	0	112.9	L53 E54 L57 Q58 F63 F64 V65	L53-T61 HydrophobicContact CB-CG2 3.6Å; E54-T61 WeakPolarHBondContact CA-OG1 3.43Å; L57-T61 VanDerWaalsContact C-OG1 3.27Å; L57-T61 HydrophobicContact CB-CG2 4.45Å; L57-T61 VanDerWaalsContact CB-OG1 3.26Å; L57-T61 WeakPolarHBondContact CB-OG1 3.49Å; Q58-T61 PolarHBondContact N-OG1 3.24Å; Q58-T61 WeakPolarHBondContact O-CB 3.19Å; Q58-T61 PolarHBondContact O-N 3.45Å; Q58-T61 PolarHBondContact O-OG1 3.46Å; T61-F63 PolarHBondContact O-N 3.39Å; T61-F64 PolarHBondContact O-N 3.42Å; T61-F64 VanDerWaalsContact O-N 3.11Å; T61-V65 HydrophobicContact CG2-CG2 4.19Å; T61-V65 WeakPolarHBondContact O-CG2 3.49Å; T61-V65 PolarHBondContact O-N 2.9Å
62	L	82.9	Confident	84.5	Confident	102 Å²	102	64.2 Å²	64.2	53%	0.534	32%	0.315	S	S	.	.	H	α-helix	trans	-58.4	-48.8	-177.4	-61.7	176.7	0	0	0	111.3	F64 V65 E66	L62-F64 VanDerWaalsContact C-N 3.29Å; L62-F64 PolarHBondContact O-N 3.17Å; L62-V65 PolarHBondContact O-N 3.1Å; L62-V65 VanDerWaalsContact O-N 3.11Å; L62-E66 WeakPolarHBondContact O-CB 3.24Å; L62-E66 WeakPolarHBondContact O-CG 3.49Å; L62-E66 PolarHBondContact O-N 2.9Å
63	F	84.4	Confident	84.3	Confident	133 Å²	133	66.3 Å²	66.3	58%	0.583	32%	0.323	S	S	*	.	H	α-helix	trans	-60.2	-36.1	176.9	-176.8	-102.3	0	0	0	113	T61 K67	T61-F63 PolarHBondContact O-N 3.39Å; F63-K67 WeakPolarHBondContact O-CB 3.45Å; F63-K67 PolarHBondContact O-N 3.41Å
64	F	88	Confident	83.9	Confident	2 Å²	2	72 Å²	72	1%	0.009	35%	0.353	C	S	.	.	H	α-helix	trans	-70.1	-41.7	173.8	177.9	-95.2	0	0	0	112.2	I13 N16 L17 L53 L57 N60 T61 L62 K67 L68	I13-F64 HydrophobicContact CG2-CZ 4.16Å; N16-F64 HydrophobicContact CB-CD2 4.48Å; N16-F64 HydrophobicContact CB-CE2 4.02Å; L17-F64 HydrophobicContact CD2-CD2 4.06Å; L17-F64 HydrophobicContact CD2-CE1 4.13Å; L17-F64 HydrophobicContact CD2-CE2 3.58Å; L17-F64 HydrophobicContact CD2-CZ 3.63Å; L17-F64 HydrophobicContact CG-CE2 3.88Å; L17-F64 HydrophobicContact CG-CZ 3.97Å; L53-F64 HydrophobicContact CD1-CD1 4.23Å; L53-F64 HydrophobicContact CD1-CE1 4.19Å; L57-F64 HydrophobicContact CD1-CB 4.01Å; L57-F64 HydrophobicContact CD1-CD1 3.65Å; L57-F64 HydrophobicContact CD1-CE1 4.32Å; L57-F64 HydrophobicContact CD1-CG 3.82Å; N60-F64 PolarHBondContact O-N 3.23Å; N60-F64 VanDerWaalsContact O-N 3.13Å; T61-F64 PolarHBondContact O-N 3.42Å; T61-F64 VanDerWaalsContact O-N 3.11Å; L62-F64 VanDerWaalsContact C-N 3.29Å; L62-F64 PolarHBondContact O-N 3.17Å; F64-K67 PolarHBondContact O-N 3.11Å; F64-L68 HydrophobicContact CE1-CD2 4.18Å; F64-L68 VanDerWaalsContact O-CB 3.23Å; F64-L68 WeakPolarHBondContact O-CB 3.41Å; F64-L68 PolarHBondContact O-N 3.46Å
65	V	87.9	Confident	83.5	Confident	0 Å²	0	72.3 Å²	72.3	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-68.1	-46	-179.1	170.1	0	0	0	0	111.8	V46 L49 L53 T61 L62 K67 L68 I69	V46-V65 HydrophobicContact CB-CG1 4.46Å; V46-V65 HydrophobicContact CG1-CG1 4.22Å; L49-V65 HydrophobicContact CB-CB 4.49Å; L49-V65 HydrophobicContact CB-CG1 3.78Å; L49-V65 HydrophobicContact CB-CG2 3.81Å; L49-V65 HydrophobicContact CD1-CG1 4.17Å; L53-V65 HydrophobicContact CD1-CG2 4.05Å; T61-V65 HydrophobicContact CG2-CG2 4.19Å; T61-V65 WeakPolarHBondContact O-CG2 3.49Å; T61-V65 PolarHBondContact O-N 2.9Å; L62-V65 PolarHBondContact O-N 3.1Å; L62-V65 VanDerWaalsContact O-N 3.11Å; V65-K67 PolarHBondContact O-N 2.91Å; V65-L68 PolarHBondContact O-N 2.97Å; V65-I69 HydrophobicContact CG1-CD1 3.88Å; V65-I69 WeakPolarHBondContact O-CG1 3.01Å; V65-I69 PolarHBondContact O-N 3.08Å
66	E	87.7	Confident	82.8	Confident	112 Å²	112	69.3 Å²	69.3	52%	0.523	34%	0.335	S	S	.	.	H	α-helix	trans	-55.2	-52.8	172.5	-72.1	171.2	178.1	0	0	110.6	L62 L68 I69 S70	L62-E66 WeakPolarHBondContact O-CB 3.24Å; L62-E66 WeakPolarHBondContact O-CG 3.49Å; L62-E66 PolarHBondContact O-N 2.9Å; E66-L68 VanDerWaalsContact C-N 3.3Å; E66-L68 PolarHBondContact O-N 3.29Å; E66-I69 PolarHBondContact O-N 3.22Å; E66-S70 PolarHBondContact O-N 3.27Å; E66-S70 PolarHBondContact O-OG 2.92Å
67	K	86.4	Confident	82.1	Confident	87 Å²	87	65.3 Å²	65.3	38%	0.378	32%	0.317	S	S	.	.	H	α-helix	trans	-61.9	-35.5	180	-167.6	-174.6	-169.8	-172.6	0	112.7	W12 N16 F63 F64 V65 A71	W12-K67 HydrophobicContact CH2-CG 4.14Å; W12-K67 HydrophobicContact CZ2-CG 4.32Å; N16-K67 VanDerWaalsContact OD1-CE 3.29Å; N16-K67 WeakPolarHBondContact OD1-CE 3.37Å; N16-K67 PolarHBondContact OD1-NZ 3Å; F63-K67 WeakPolarHBondContact O-CB 3.45Å; F63-K67 PolarHBondContact O-N 3.41Å; F64-K67 PolarHBondContact O-N 3.11Å; V65-K67 PolarHBondContact O-N 2.91Å; K67-A71 WeakPolarHBondContact O-CB 3.42Å; K67-A71 PolarHBondContact O-N 3.2Å
68	L	87.1	Confident	81.2	Confident	0 Å²	0	68.8 Å²	68.8	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-66.4	-46.9	174.7	174.4	65.6	0	0	0	111.3	L9 W12 I13 V32 L36 L49 F64 V65 E66 A71 V72	L9-L68 HydrophobicContact CD1-CD1 4.37Å; W12-L68 HydrophobicContact CE3-CD1 4.45Å; W12-L68 HydrophobicContact CZ3-CB 4.44Å; W12-L68 HydrophobicContact CZ3-CD1 3.86Å; I13-L68 HydrophobicContact CD1-CD1 4.14Å; I13-L68 HydrophobicContact CG1-CD1 4.02Å; V32-L68 HydrophobicContact CG1-CD2 3.54Å; L36-L68 HydrophobicContact CD1-CD1 4.48Å; L36-L68 HydrophobicContact CD1-CD2 4.49Å; L49-L68 HydrophobicContact CD1-CD2 4.27Å; F64-L68 HydrophobicContact CE1-CD2 4.18Å; F64-L68 VanDerWaalsContact O-CB 3.23Å; F64-L68 WeakPolarHBondContact O-CB 3.41Å; F64-L68 PolarHBondContact O-N 3.46Å; V65-L68 PolarHBondContact O-N 2.97Å; E66-L68 VanDerWaalsContact C-N 3.3Å; E66-L68 PolarHBondContact O-N 3.29Å; L68-A71 PolarHBondContact O-N 3.2Å; L68-V72 HydrophobicContact CD1-CG2 4.33Å; L68-V72 WeakPolarHBondContact O-CG2 3.36Å; L68-V72 PolarHBondContact O-N 2.91Å
69	I	85.2	Confident	80.3	Confident	13 Å²	13	71.1 Å²	71.1	7%	0.067	34%	0.343	C	S	.	.	H	α-helix	trans	-66.3	-44.3	-179.7	-69.9	166.7	0	0	0	110.4	V46 L49 V65 E66 A71 V72 K73	V46-I69 HydrophobicContact CB-CD1 4.32Å; V46-I69 HydrophobicContact CG2-CD1 3.46Å; V46-I69 VanDerWaalsContact CG2-CD1 3.46Å; L49-I69 HydrophobicContact CD1-CD1 4.29Å; L49-I69 HydrophobicContact CD1-CG1 4.41Å; V65-I69 HydrophobicContact CG1-CD1 3.88Å; V65-I69 WeakPolarHBondContact O-CG1 3.01Å; V65-I69 PolarHBondContact O-N 3.08Å; E66-I69 PolarHBondContact O-N 3.22Å; I69-A71 VanDerWaalsContact C-N 3.35Å; I69-A71 PolarHBondContact O-N 3.18Å; I69-V72 PolarHBondContact O-N 2.67Å; I69-K73 HydrophobicContact CG2-CD 4.07Å; I69-K73 WeakPolarHBondContact O-CB 3.05Å; I69-K73 WeakPolarHBondContact O-CG 3.34Å; I69-K73 PolarHBondContact O-N 2.86Å
70	S	84.7	Confident	79	Confident	61 Å²	61	65 Å²	65	43%	0.427	33%	0.325	S	S	.	.	H	α-helix	trans	-56	-47.7	169.7	-62.5	0	0	0	0	111.6	E66 V72 K73 D74	E66-S70 PolarHBondContact O-N 3.27Å; E66-S70 PolarHBondContact O-OG 2.92Å; S70-V72 VanDerWaalsContact C-N 3.3Å; S70-V72 PolarHBondContact O-N 3.24Å; S70-K73 PolarHBondContact O-N 3.39Å; S70-D74 VanDerWaalsContact O-CB 3.3Å; S70-D74 WeakPolarHBondContact O-CB 3.26Å; S70-D74 PolarHBondContact O-N 3Å
71	A	84.5	Confident	77.4	Confident	3 Å²	3	64.1 Å²	64.1	3%	0.025	33%	0.326	C	S	.	.	H	α-helix	trans	-65.2	-29.9	-178.6	0	0	0	0	0	114.3	W12 K67 L68 I69 K75 T76 Y77	W12-A71 HydrophobicContact CD2-CB 4.33Å; W12-A71 HydrophobicContact CE3-CB 4.41Å; W12-A71 HydrophobicContact CH2-CB 3.44Å; W12-A71 VanDerWaalsContact CH2-CB 3.44Å; W12-A71 HydrophobicContact CZ2-CB 3.29Å; W12-A71 HydrophobicContact CZ3-CB 4.01Å; K67-A71 WeakPolarHBondContact O-CB 3.42Å; K67-A71 PolarHBondContact O-N 3.2Å; L68-A71 PolarHBondContact O-N 3.2Å; I69-A71 VanDerWaalsContact C-N 3.35Å; I69-A71 PolarHBondContact O-N 3.18Å; A71-K75 CarbonylContact O-C 3.57Å; A71-K75 VanDerWaalsContact O-CA 3.28Å; A71-K75 WeakPolarHBondContact O-CA 3.41Å; A71-K75 PolarHBondContact O-N 3.23Å; A71-K75 VanDerWaalsContact O-N 3.12Å; A71-T76 VanDerWaalsContact CA-OG1 3.26Å; A71-T76 WeakPolarHBondContact CA-OG1 3.32Å; A71-T76 VanDerWaalsContact CB-OG1 3.25Å; A71-T76 WeakPolarHBondContact CB-OG1 3.26Å; A71-T76 PolarHBondContact O-N 3.22Å; A71-Y77 WeakPolarHBondContact O-CD1 3.18Å
72	V	83	Confident	75.2	Confident	16 Å²	16	73.4 Å²	73.4	10%	0.097	37%	0.366	C	S	.	.	H	α-helix	trans	-75.4	-42.4	173.7	174.4	0	0	0	0	110.9	M1 L9 L68 I69 S70 K75	M1-V72 HydrophobicContact SD-CG1 3.55Å; M1-V72 VanDerWaalsContact SD-CG1 3.55Å; L9-V72 HydrophobicContact CD1-CG2 4.23Å; L9-V72 HydrophobicContact CD2-CG2 4.38Å; L68-V72 HydrophobicContact CD1-CG2 4.33Å; L68-V72 WeakPolarHBondContact O-CG2 3.36Å; L68-V72 PolarHBondContact O-N 2.91Å; I69-V72 PolarHBondContact O-N 2.67Å; S70-V72 VanDerWaalsContact C-N 3.3Å; S70-V72 PolarHBondContact O-N 3.24Å; V72-K75 PolarHBondContact O-N 2.84Å
73	K	81.4	Confident	73.1	Confident	103 Å²	103	79 Å²	79	45%	0.448	38%	0.38	S	S	.	.	H	α-helix	trans	-63.6	-53.4	176.2	-73.3	177.6	174.9	-172.4	0	112.2	M1 D42 I69 S70 K75	M1-K73 HydrophobicContact CE-CG 4.24Å; D42-K73 VanDerWaalsContact CG-CE 3.43Å; D42-K73 WeakPolarHBondContact OD1-CE 3.45Å; D42-K73 IonicContact OD1-NZ 2.93Å; D42-K73 WeakPolarHBondContact OD2-CE 3.49Å; D42-K73 IonicContact OD2-NZ 3.1Å; D42-K73 PolarHBondContact OD2-NZ 2.96Å; I69-K73 HydrophobicContact CG2-CD 4.07Å; I69-K73 WeakPolarHBondContact O-CB 3.05Å; I69-K73 WeakPolarHBondContact O-CG 3.34Å; I69-K73 PolarHBondContact O-N 2.86Å; S70-K73 PolarHBondContact O-N 3.39Å; K73-K75 PolarHBondContact O-N 3.17Å
74	D	76.2	Confident	70.7	Confident	119 Å²	119	78.8 Å²	78.8	64%	0.636	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.3	-6.3	-179.6	-61.9	-19.2	0	0	0	112.9	S70 T76	S70-D74 VanDerWaalsContact O-CB 3.3Å; S70-D74 WeakPolarHBondContact O-CB 3.26Å; S70-D74 PolarHBondContact O-N 3Å; D74-T76 HydrophobicContact CB-CG2 3.8Å; D74-T76 PolarHBondContact O-N 2.64Å; D74-T76 VanDerWaalsContact O-N 3.16Å
75	K	77.5	Confident	68	Low	128 Å²	128	84.3 Å²	84.3	56%	0.557	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.6	29.1	-177.2	-54.4	172	-172.7	171.6	0	113.3	A71 V72 K73 Y77 L78	A71-K75 CarbonylContact O-C 3.57Å; A71-K75 VanDerWaalsContact O-CA 3.28Å; A71-K75 WeakPolarHBondContact O-CA 3.41Å; A71-K75 PolarHBondContact O-N 3.23Å; A71-K75 VanDerWaalsContact O-N 3.12Å; V72-K75 PolarHBondContact O-N 2.84Å; K73-K75 PolarHBondContact O-N 3.17Å; K75-Y77 HydrophobicContact CB-CE1 4.22Å; K75-Y77 PolarHBondContact O-N 3.1Å; K75-Y77 VanDerWaalsContact O-N 3.08Å; K75-L78 HydrophobicContact CB-CD1 3.92Å; K75-L78 HydrophobicContact CB-CG 4.32Å; K75-L78 WeakPolarHBondContact O-CB 3.2Å; K75-L78 WeakPolarHBondContact O-CG 3.2Å; K75-L78 PolarHBondContact O-N 3.25Å
76	T	70.1	Confident	65.7	Low	55 Å²	55	89.5 Å²	89.5	34%	0.337	47%	0.467	S	S	.	.	G	3₁₀ helix	trans	-63.3	-20.2	-174.7	54.4	0	0	0	0	113.5	A71 D74 L78 K79	A71-T76 VanDerWaalsContact CA-OG1 3.26Å; A71-T76 WeakPolarHBondContact CA-OG1 3.32Å; A71-T76 VanDerWaalsContact CB-OG1 3.25Å; A71-T76 WeakPolarHBondContact CB-OG1 3.26Å; A71-T76 PolarHBondContact O-N 3.22Å; D74-T76 HydrophobicContact CB-CG2 3.8Å; D74-T76 PolarHBondContact O-N 2.64Å; D74-T76 VanDerWaalsContact O-N 3.16Å; T76-L78 PolarHBondContact O-N 2.88Å; T76-K79 WeakPolarHBondContact O-CB 3.2Å; T76-K79 PolarHBondContact O-N 3.33Å
77	Y	69.6	Low	63.4	Low	10 Å²	10	90 Å²	90	4%	0.039	48%	0.483	C	S	.	.	G	3₁₀ helix	trans	-59.3	-22.4	171.9	64.2	-93.7	0	0	0	113.3	L8 L9 A71 K75 S80	L8-Y77 HydrophobicContact CB-CD2 4.2Å; L9-Y77 HydrophobicContact CD1-CD1 4.16Å; L9-Y77 HydrophobicContact CD1-CG 4.21Å; A71-Y77 WeakPolarHBondContact O-CD1 3.18Å; K75-Y77 HydrophobicContact CB-CE1 4.22Å; K75-Y77 PolarHBondContact O-N 3.1Å; K75-Y77 VanDerWaalsContact O-N 3.08Å; Y77-S80 PolarHBondContact O-OG 2.66Å
78	L	62.3	Low	60.9	Low	79 Å²	79	91.5 Å²	91.5	41%	0.414	50%	0.504	S	S	.	.	G	3₁₀ helix	trans	-71.6	-30.3	171.3	-58	178.5	0	0	0	112.3	L8 K75 T76 S81	L8-L78 HydrophobicContact CD1-CD2 4.05Å; K75-L78 HydrophobicContact CB-CD1 3.92Å; K75-L78 HydrophobicContact CB-CG 4.32Å; K75-L78 WeakPolarHBondContact O-CB 3.2Å; K75-L78 WeakPolarHBondContact O-CG 3.2Å; K75-L78 PolarHBondContact O-N 3.25Å; T76-L78 PolarHBondContact O-N 2.88Å; L78-S81 WeakPolarHBondContact O-CB 3.48Å; L78-S81 PolarHBondContact O-N 3.15Å
79	K	62.7	Low	58.8	Low	187 Å²	187	96.7 Å²	96.7	81%	0.813	54%	0.541	S	S	*	.	G	3₁₀ helix	trans	-78.3	-20.4	-175.2	-157.7	169.2	-175.4	174.6	0	112.9	T76 S81	T76-K79 WeakPolarHBondContact O-CB 3.2Å; T76-K79 PolarHBondContact O-N 3.33Å; K79-S81 VanDerWaalsContact C-N 3.29Å; K79-S81 PolarHBondContact O-N 2.95Å
80	S	52.1	Low	56.6	Low	66 Å²	66	104.9 Å²	104.9	46%	0.462	58%	0.576	S	S	.	*	G	3₁₀ helix	trans	-71.8	-15.8	172.1	22.8	0	0	0	0	114.4	Y77 K82	Y77-S80 PolarHBondContact O-OG 2.66Å; S80-K82 PolarHBondContact O-N 3.26Å
81	S	47.3	Very low	54.3	Low	67 Å²	67	109.2 Å²	109.2	47%	0.469	59%	0.589	S	S	.	*	G	3₁₀ helix	trans	-65.5	-4.5	-172.8	-171.2	0	0	0	0	115.6	L78 K79 R83	L78-S81 WeakPolarHBondContact O-CB 3.48Å; L78-S81 PolarHBondContact O-N 3.15Å; K79-S81 VanDerWaalsContact C-N 3.29Å; K79-S81 PolarHBondContact O-N 2.95Å; S81-R83 PolarHBondContact O-N 2.89Å
82	K	39.3	Very low	51.9	Low	199 Å²	199	117.6 Å²	117.6	87%	0.865	63%	0.626	S	S	*	*			trans	-93.2	62.5	-169.4	-156	168.8	-173.7	173.8	0	114.3	S80	S80-K82 PolarHBondContact O-N 3.26Å
83	R	37.1	Very low	49.9	Very low	218 Å²	218	121.3 Å²	121.3	82%	0.823	65%	0.652	S	S	*	*	S	Bend	trans	-69.8	157.9	145.9	-97.2	-172.4	170.3	-152	-1	109.3	S81 S85	S81-R83 PolarHBondContact O-N 2.89Å; R83-S85 PolarHBondContact O-N 2.97Å
84	P	34.9	Very low	47.7	Very low	129 Å²	129	127.7 Å²	127.7	84%	0.838	67%	0.674	S	S	*	*			trans	-76.5	88	-177.6	30.6	-34.9	0	0	0	112
85	S	32	Very low	45.9	Very low	118 Å²	118	127.2 Å²	127.2	83%	0.825	68%	0.68	S	S	*	*			trans	-101.6	93	166.6	59.8	0	0	0	0	110.7	R83	R83-S85 PolarHBondContact O-N 2.97Å
86	S	38.6	Very low	44.1	Very low	110 Å²	110	125.7 Å²	125.7	77%	0.769	69%	0.69	S	S	*	*			trans	-149.2	125	169.4	55.1	0	0	0	0	106.9
87	S	39.1	Very low	42.7	Very low	122 Å²	122	134.2 Å²	134.2	85%	0.853	72%	0.717	S	S	*	*			cis	-120.2	160.7	40.4	47.8	0	0	0	0	116
88	S	35	Very low	41.2	Very low	118 Å²	118	140.2 Å²	140.2	83%	0.825	75%	0.749	S	S	*	*			trans	-147.4	125.2	167.8	60	0	0	0	0	110.1
89	S	41.9	Very low	40.3	Very low	110 Å²	110	141.2 Å²	141.2	77%	0.769	76%	0.763	S	S	*	*			trans	-163.7	115.5	170.5	54.6	0	0	0	0	112.1
90	K	38.7	Very low	39.4	Very low	185 Å²	185	136.2 Å²	136.2	80%	0.804	75%	0.752	S	S	*	*			trans	42.8	118.9	144.6	-68.9	-170.4	172.9	-173.9	0	119.6
91	E	36.2	Very low	38.9	Very low	151 Å²	151	141.9 Å²	141.9	71%	0.706	77%	0.771	S	S	*	*				87.6	140.1	68	-99.7	-173.2	135.2	0	0	115.1
92	F	35.6	Very low	38.5	Very low	180 Å²	180	141.8 Å²	141.8	79%	0.789	78%	0.781	S	S	*	*			trans	78.2	127.6	161.5	-91.2	-94.4	0	0	0	123
93	S	39.8	Very low	38.7	Very low	94 Å²	94	138.3 Å²	138.3	66%	0.657	78%	0.781	S	S	*	*			trans	71	100.2	147.3	43.9	0	0	0	0	123.7
94	R	36.6	Very low	38.9	Very low	237 Å²	237	132.3 Å²	132.3	89%	0.894	77%	0.773	S	S	*	*				69.2	114.3	114.7	-70.1	178.2	179.3	165.9	-0.1	122.1
95	S	38.4	Very low	39.2	Very low	109 Å²	109	137 Å²	137	76%	0.762	77%	0.773	S	S	*	*				77	108.6	125.2	67.1	0	0	0	0	123.5
96	A	38.1	Very low	39.8	Very low	95 Å²	95	139.1 Å²	139.1	79%	0.785	77%	0.77	S	S	*	*				88.8	156	119.9	0	0	0	0	0	121.6
97	R	41.7	Very low	39.9	Very low	235 Å²	235	138.6 Å²	138.6	89%	0.887	77%	0.767	S	S	*	*			trans	79.4	146.5	173.5	-71	-177.4	173.8	163.2	-0.9	117.9
98	D	37.4	Very low	40	Very low	135 Å²	135	143.2 Å²	143.2	72%	0.722	77%	0.766	S	S	*	*			cis	-165.6	164.6	-27.8	-144.1	-20.8	0	0	0	110.3
99	S	43.8	Very low	40.2	Very low	100 Å²	100	141.5 Å²	141.5	70%	0.699	75%	0.754	S	S	*	*			trans	58.9	157.6	158	-60.5	0	0	0	0	121
100	S	43.7	Very low	40.2	Very low	83 Å²	83	143 Å²	143	58%	0.58	75%	0.748	S	S	*	*			cis	-164.3	158.4	-33.4	61.6	0	0	0	0	109.8
101	E	42.4	Very low	40.5	Very low	184 Å²	184	140.8 Å²	140.8	86%	0.86	74%	0.741	S	S	*	*			trans	59.5	154.6	154.6	-65.7	152	118.7	0	0	120.3
102	G	39.2	Very low	40.8	Very low	66 Å²	66	141 Å²	141	68%	0.68	74%	0.742	S	S	*	*			cis	167.4	147.4	-10.3	0	0	0	0	0	113.1
103	S	43.5	Very low	40.8	Very low	125 Å²	125	138.8 Å²	138.8	87%	0.874	74%	0.738	S	S	*	*			trans	64.2	155.9	170.9	-77.4	0	0	0	0	118.1
104	S	40.8	Very low	40.7	Very low	92 Å²	92	139 Å²	139	64%	0.643	74%	0.739	S	S	*	*			cis	-170.6	144.5	-18.4	54	0	0	0	0	111.6
105	R	41.7	Very low	40.8	Very low	227 Å²	227	134.7 Å²	134.7	86%	0.857	73%	0.73	S	S	*	*			trans	57.6	155.2	148.7	-62	173.6	-179.3	166.5	1.4	117.1
106	Q	43	Very low	40.9	Very low	163 Å²	163	136.4 Å²	136.4	76%	0.762	72%	0.723	S	S	*	*			cis	-163.3	153.6	24.2	-151.8	160.9	-75.3	0	0	114.6
107	S	42.1	Very low	40.8	Very low	99 Å²	99	138.3 Å²	138.3	69%	0.692	72%	0.72	S	S	*	*			trans	70.6	139.6	145	50.7	0	0	0	0	125.1
108	R	39.7	Very low	40.5	Very low	219 Å²	219	133.8 Å²	133.8	83%	0.826	71%	0.714	S	S	*	*			trans	78.8	120	156.4	-87.6	175.9	168	144.2	-0.1	119.6
109	S	41	Very low	40.8	Very low	83 Å²	83	133.3 Å²	133.3	58%	0.58	72%	0.721	S	S	*	*			cis	67.2	144.8	21.2	83.7	0	0	0	0	115
110	E	41.1	Very low	40.7	Very low	140 Å²	140	135.2 Å²	135.2	65%	0.654	73%	0.728	S	S	*	*			cis	-117.4	-171.3	3.4	-77.7	78	-141.4	0	0	111.6
111	H	45	Very low	40.8	Very low	140 Å²	140	136 Å²	136	65%	0.648	73%	0.731	S	S	*	*			cis	-157	155.5	-4.6	-126.7	32.5	0	0	0	108.9
112	Q	41.9	Very low	40.6	Very low	154 Å²	154	138.2 Å²	138.2	72%	0.72	73%	0.732	S	S	*	*				50.5	152.9	98.7	-63.4	-167.5	19.5	0	0	119.5
113	N	36.2	Very low	40.3	Very low	135 Å²	135	144.8 Å²	144.8	72%	0.722	74%	0.736	S	S	*	*			cis	-176.8	174.7	-23.8	-174.2	22.2	0	0	0	108
114	S	38.1	Very low	40.3	Very low	97 Å²	97	151 Å²	151	68%	0.678	74%	0.74	S	S	*	*			trans	64.7	156.6	162.9	61.4	0	0	0	0	117.6
115	E	38.8	Very low	40.1	Very low	148 Å²	148	154.7 Å²	154.7	69%	0.692	75%	0.745	S	S	*	*			cis	171.8	164.8	-30.7	-111	-158.5	99.2	0	0	106.1
116	K	39	Very low	40.2	Very low	145 Å²	145	149.5 Å²	149.5	63%	0.63	74%	0.743	S	S	*	*			trans	65	118.7	154.7	-72.4	-179.8	-178.5	72.3	0	121.8
117	N	35.9	Very low	40.1	Very low	135 Å²	135	147.1 Å²	147.1	72%	0.722	74%	0.744	S	S	*	*				82.6	135.4	124.8	-60.9	15.3	0	0	0	122.8
118	D	36.8	Very low	40.3	Very low	140 Å²	140	147.3 Å²	147.3	75%	0.749	74%	0.744	S	S	*	*			trans	12.6	121.2	145.2	-56.4	-88.9	0	0	0	120.9
119	S	42.8	Very low	40	Very low	125 Å²	125	144.5 Å²	144.5	87%	0.874	75%	0.745	S	S	*	*				-168.8	121.8	121.2	-85.6	0	0	0	0	114.1
120	V	43	Very low	39.8	Very low	139 Å²	139	152 Å²	152	84%	0.842	76%	0.761	S	S	*	*			trans	-96.9	158.8	165.7	177.4	0	0	0	0	108
121	P	45.1	Very low	39.7	Very low	100 Å²	100	150.3 Å²	150.3	65%	0.649	76%	0.762	S	S	*	*			cis	-119.1	-173.4	-31	37.1	-22.8	0	0	0	111.9
122	R	37.3	Very low	39.3	Very low	230 Å²	230	153 Å²	153	87%	0.868	77%	0.771	S	S	*	*				177	122.5	126.2	-95	152	-166.9	-153.4	4.5	116.9
123	R	34.5	Very low	39.1	Very low	204 Å²	204	152.2 Å²	152.2	77%	0.77	78%	0.778	S	S	*	*			trans	27	116	136.9	-61.5	178.4	177.1	-179.9	1.1	120.8	K125	R123-K125 HydrophobicContact CB-CB 4.42Å
124	R	43.6	Very low	39	Very low	255 Å²	255	154.8 Å²	154.8	96%	0.962	78%	0.782	S	S	*	*				-146.9	113.6	117.5	-59.9	-174.6	-177.3	174.3	0.4	106
125	K	36.4	Very low	38.9	Very low	170 Å²	170	161.1 Å²	161.1	74%	0.739	79%	0.791	S	S	*	*			cis	75.1	76.3	13.1	-157.3	172.7	-175.3	176.3	0	117.4	R123	R123-K125 HydrophobicContact CB-CB 4.42Å
126	S	42.4	Very low	39	Very low	119 Å²	119	163.5 Å²	163.5	83%	0.832	80%	0.8	S	S	*	*			trans	-172.1	141.1	144.6	-90.8	0	0	0	0	108.2
127	S	42.1	Very low	38.7	Very low	112 Å²	112	162.9 Å²	162.9	78%	0.783	81%	0.808	S	S	*	*			cis	-158.9	152.4	-20.2	-133.9	0	0	0	0	109.5
128	P	45.7	Very low	38.8	Very low	104 Å²	104	160 Å²	160	68%	0.675	81%	0.81	S	S	*	*			trans	-90.4	173.8	-179.2	37	-36	0	0	0	113.7
129	N	33.2	Very low	38.7	Very low	160 Å²	160	158.5 Å²	158.5	86%	0.856	81%	0.811	S	S	*	*			trans	67.4	126.1	172.8	-60.4	-35.4	0	0	0	117.6
130	R	37.3	Very low	38.4	Very low	240 Å²	240	162.6 Å²	162.6	91%	0.906	81%	0.807	S	S	*	*				-176.8	144.4	98.5	-163.6	166.6	-175.4	175	0.9	111
131	P	39.1	Very low	37.9	Very low	104 Å²	104	160.6 Å²	160.6	68%	0.675	80%	0.8	S	S	*	*			trans	-103.5	174	-174.3	40.3	-36.9	0	0	0	114.7
132	K	35.5	Very low	37.6	Very low	197 Å²	197	166.5 Å²	166.5	86%	0.857	81%	0.809	S	S	*	*			trans	65	110.7	167.6	-57.7	177.7	-179.5	178.5	0	117.2
133	T	38.3	Very low	37.5	Very low	138 Å²	138	160.4 Å²	160.4	85%	0.847	80%	0.802	S	S	*	*				-168.9	124.6	121.9	24.7	0	0	0	0	113.6
134	F	33.7	Very low	37.8	Very low	188 Å²	188	161.9 Å²	161.9	83%	0.825	81%	0.807	S	S	*	*			trans	26.8	141.5	134.4	-94.6	-89.6	0	0	0	123.4
135	R	37.3	Very low	37.5	Very low	230 Å²	230	154.2 Å²	154.2	87%	0.868	79%	0.793	S	S	*	*			trans	82.3	146.2	165.6	-56	153.2	-177.5	-178.4	0.4	113.7
136	K	39.5	Very low	37.7	Very low	199 Å²	199	156.1 Å²	156.1	87%	0.865	80%	0.795	S	S	*	*			cis	-140.1	138.2	10.5	-150.2	170.6	-173.7	176.9	0	111.4
137	T	33.5	Very low	37.6	Very low	131 Å²	131	158.2 Å²	158.2	80%	0.804	79%	0.792	S	S	*	*			trans	-66.8	136.2	173.1	36	0	0	0	0	111.2
138	G	38	Very low	37.2	Very low	74 Å²	74	164.2 Å²	164.2	76%	0.763	80%	0.797	S	S	*	*			trans	-108.1	22.2	-172.6	0	0	0	0	0	115.4	R140	G138-R140 PolarHBondContact O-N 3.17Å; G138-R140 VanDerWaalsContact O-N 3.08Å
139	S	34.4	Very low	36.9	Very low	110 Å²	110	166.5 Å²	166.5	77%	0.769	80%	0.804	S	S	*	*			trans	-58.2	111.4	-177.9	-50.6	0	0	0	0	111.5
140	R	36	Very low	36.9	Very low	210 Å²	210	168.4 Å²	168.4	79%	0.792	80%	0.804	S	S	*	*			trans	-115.3	57.1	179.3	-153.2	169.4	-161.1	160.6	6.7	113.6	G138	G138-R140 PolarHBondContact O-N 3.17Å; G138-R140 VanDerWaalsContact O-N 3.08Å
141	S	32.9	Very low	36.8	Very low	98 Å²	98	159.8 Å²	159.8	69%	0.685	79%	0.79	S	S	*	*			trans	-51.3	136.9	160.9	-41.2	0	0	0	0	110.4
142	R	39.5	Very low	36.6	Very low	223 Å²	223	161.1 Å²	161.1	84%	0.842	80%	0.797	S	S	*	*			trans	-130.2	96.7	161	-103.2	-176.4	170.5	156.7	-3.8	110.3
143	S	34.8	Very low	36.8	Very low	103 Å²	103	156.9 Å²	156.9	72%	0.72	79%	0.792	S	S	*	*			trans	-73.5	150.5	-177.9	-38.5	0	0	0	0	112.9
144	R	40.6	Very low	36.8	Very low	235 Å²	235	155.9 Å²	155.9	89%	0.887	79%	0.79	S	S	*	*			trans	-163.5	108.3	141.1	-95.2	140.9	-174.5	-171	0.3	105.5
145	S	36.6	Very low	36.9	Very low	94 Å²	94	150.1 Å²	150.1	66%	0.657	78%	0.784	S	S	*	*				47	115.6	76.4	74.8	0	0	0	0	110.3
146	R	40.7	Very low	37	Very low	209 Å²	209	145.3 Å²	145.3	79%	0.789	79%	0.786	S	S	*	*			cis	-158.5	170.3	43.2	-70.6	-178.2	166	117.5	-1.9	109.4
147	E	41.5	Very low	37	Very low	163 Å²	163	140.5 Å²	140.5	76%	0.762	78%	0.783	S	S	*	*			cis	-160	167.3	-16.2	-107.8	150.3	-158.7	0	0	107.5
148	R	33.3	Very low	37.1	Very low	239 Å²	239	137.5 Å²	137.5	90%	0.902	78%	0.778	S	S	*	*			trans	-101.4	130.9	168.3	-80.5	177.3	168.9	169.5	-5.4	109.7
149	N	40.2	Very low	37.3	Very low	151 Å²	151	139.1 Å²	139.1	81%	0.807	78%	0.778	S	S	*	*			trans	-172	134.9	140.2	-90.3	-35.3	0	0	0	107.2
150	K	33.2	Very low	37.5	Very low	200 Å²	200	144.5 Å²	144.5	87%	0.87	78%	0.781	S	S	*	*			cis	87.8	98.3	46.4	-170.5	-175.3	176.9	-175.6	0	111.7
151	G	35.3	Very low	37.8	Very low	59 Å²	59	139 Å²	139	61%	0.608	78%	0.775	S	S	*	*			trans	155.2	104.2	173.7	0	0	0	0	0	108
152	T	33.5	Very low	38	Very low	132 Å²	132	138.7 Å²	138.7	81%	0.81	77%	0.773	S	S	*	*				81.8	145	60.6	61.7	0	0	0	0	113.5
153	S	40.2	Very low	38	Very low	109 Å²	109	135.2 Å²	135.2	76%	0.762	77%	0.77	S	S	*	*			trans	71.7	110.2	-172.8	94.9	0	0	0	0	112.2
154	S	38.9	Very low	38.2	Very low	116 Å²	116	136.1 Å²	136.1	81%	0.811	77%	0.771	S	S	*	*				84.9	129.8	67.6	71.6	0	0	0	0	112.7
155	G	35.8	Very low	38	Very low	68 Å²	68	129.9 Å²	129.9	70%	0.701	76%	0.764	S	S	*	*			cis	162.5	178.2	-1	0	0	0	0	0	111
156	S	38.7	Very low	38	Very low	129 Å²	129	130.3 Å²	130.3	90%	0.902	77%	0.767	S	S	*	*			trans	63.3	163.4	174	-70	0	0	0	0	116.9
157	A	39.8	Very low	37.9	Very low	98 Å²	98	131.8 Å²	131.8	81%	0.81	77%	0.772	S	S	*	*			cis	-165.1	163.1	-32.6	0	0	0	0	0	109.1
158	G	36.6	Very low	37.8	Very low	67 Å²	67	131.9 Å²	131.9	69%	0.691	77%	0.773	S	S	*	*			trans	102.3	128.7	175.9	0	0	0	0	0	112.6
159	S	41.1	Very low	38	Very low	108 Å²	108	132.4 Å²	132.4	76%	0.755	78%	0.775	S	S	*	*			cis	67.1	132.2	44.2	-59.6	0	0	0	0	113
160	R	39.3	Very low	38	Very low	224 Å²	224	134.1 Å²	134.1	85%	0.845	78%	0.778	S	S	*	*			cis	-159.1	170	9.1	-123.1	164.6	-166.3	166.7	0.5	111.9
161	S	40.7	Very low	38.5	Very low	95 Å²	95	134.5 Å²	134.5	66%	0.664	78%	0.78	S	S	*	*			trans	-9.7	152.8	147.6	57	0	0	0	0	118.6
162	S	37.3	Very low	38.7	Very low	91 Å²	91	140 Å²	140	64%	0.636	79%	0.789	S	S	*	*			cis	173.7	-178.4	2.4	44.5	0	0	0	0	110
163	L	40.4	Very low	38.9	Very low	150 Å²	150	140.2 Å²	140.2	79%	0.785	79%	0.786	S	S	*	*			trans	72	159	165.8	-48.6	172.1	0	0	0	115.2
164	T	38.6	Very low	39	Very low	121 Å²	121	145.5 Å²	145.5	74%	0.742	79%	0.789	S	S	*	*			cis	-167.5	175.2	-27.7	29.5	0	0	0	0	107.6
165	S	36	Very low	39.1	Very low	104 Å²	104	145.8 Å²	145.8	73%	0.727	78%	0.781	S	S	*	*			trans	93.1	99.9	151.5	-151.8	0	0	0	0	119
166	S	37.5	Very low	39.2	Very low	103 Å²	103	146.5 Å²	146.5	72%	0.72	78%	0.781	S	S	*	*				40.9	125.4	123.1	-48.6	0	0	0	0	122.1
167	R	39.2	Very low	39.3	Very low	241 Å²	241	150.6 Å²	150.6	91%	0.909	78%	0.782	S	S	*	*				-167.1	146.1	109.4	-105.5	163	176.5	151.3	-0.2	112.7
168	E	37.7	Very low	39.1	Very low	165 Å²	165	149.3 Å²	149.3	77%	0.771	78%	0.778	S	S	*	*			trans	-82.1	166.1	178.4	-48.2	95.6	135.1	0	0	112.9
169	R	39.1	Very low	39.2	Very low	249 Å²	249	152 Å²	152	94%	0.94	78%	0.781	S	S	*	*			trans	-160.9	110.3	141.7	-118.3	170.2	-174.3	150.5	3.5	112.3
170	E	39.5	Very low	39.3	Very low	187 Å²	187	155.8 Å²	155.8	87%	0.874	79%	0.787	S	S	*	*			trans	-83.4	162.8	161.8	-59.9	178.5	115.7	0	0	110.4
171	K	42.6	Very low	39.2	Very low	209 Å²	209	150.6 Å²	150.6	91%	0.909	79%	0.785	S	S	*	*			trans	-155.6	143	148.8	-148.7	171.4	-176	-178.9	0	111.8
172	E	40.7	Very low	39.4	Very low	173 Å²	173	151.7 Å²	151.7	81%	0.808	79%	0.79	S	S	*	*			trans	-82.4	155.1	-165.4	-64.7	166.4	85.5	0	0	116.5
173	N	37.6	Very low	39.6	Very low	138 Å²	138	155.1 Å²	155.1	74%	0.738	80%	0.8	S	S	*	*			trans	-33.4	140.7	143.7	172.5	35.3	0	0	0	115.8
174	R	43.2	Very low	39.4	Very low	220 Å²	220	155.5 Å²	155.5	83%	0.83	80%	0.803	S	S	*	*			trans	-155.4	119.4	142.4	-80.2	-146.3	179.7	162	2.3	114
175	D	40.7	Very low	39.5	Very low	121 Å²	121	154.6 Å²	154.6	65%	0.647	81%	0.808	S	S	*	*				52.6	104.2	127.9	-55.4	-63.1	0	0	0	123.3
176	A	38.1	Very low	39.4	Very low	83 Å²	83	152.6 Å²	152.6	69%	0.686	80%	0.804	S	S	*	*				67.2	133.1	110.1	0	0	0	0	0	124.4
177	K	39.5	Very low	39.7	Very low	216 Å²	216	157.8 Å²	157.8	94%	0.939	81%	0.813	S	S	*	*			trans	75.4	152.8	153.9	-65.7	171.1	-180	174.4	0	119.3
178	G	36	Very low	39.7	Very low	70 Å²	70	153.4 Å²	153.4	72%	0.722	80%	0.803	S	S	*	*			trans	98	101.6	178.3	0	0	0	0	0	112.7
179	V	38.4	Very low	40.2	Very low	125 Å²	125	151.8 Å²	151.8	76%	0.758	81%	0.806	S	S	*	*			cis	91.2	128.9	45.8	176.9	0	0	0	0	113.4
180	Q	42.3	Very low	40.2	Very low	187 Å²	187	150 Å²	150	87%	0.874	80%	0.8	S	S	*	*			trans	72.6	140.8	168.2	-76.4	157.9	-2.5	0	0	120
181	S	38.1	Very low	40.2	Very low	115 Å²	115	150.9 Å²	150.9	80%	0.804	80%	0.801	S	S	*	*			trans	-118.7	147.9	175	-43.4	0	0	0	0	110.3
182	P	44.9	Very low	40	Very low	117 Å²	117	145.9 Å²	145.9	76%	0.76	79%	0.792	S	S	*	*			trans	-118	130.9	144.3	-2.7	24.4	0	0	0	111.3
183	L	42	Very low	40	Very low	164 Å²	164	141.3 Å²	141.3	86%	0.859	78%	0.784	S	S	*	*				79.9	80.5	85.1	-67.7	178.1	0	0	0	116.5
184	N	35.8	Very low	40.3	Very low	158 Å²	158	143.1 Å²	143.1	85%	0.845	79%	0.788	S	S	*	*				41.5	103.3	120.8	-169.2	27.9	0	0	0	121.1
185	A	39.8	Very low	40.4	Very low	102 Å²	102	140.1 Å²	140.1	84%	0.843	78%	0.783	S	S	*	*			trans	-162.4	149.6	142	0	0	0	0	0	109.9
186	G	35.8	Very low	40.2	Very low	62 Å²	62	140.2 Å²	140.2	64%	0.639	78%	0.784	S	S	*	*			cis	141.9	80.6	-11.9	0	0	0	0	0	114.9
187	K	42.5	Very low	40.4	Very low	211 Å²	211	142.7 Å²	142.7	92%	0.917	79%	0.791	S	S	*	*			trans	177.4	132.6	154.4	-101	151.4	-173.6	176.6	0	113.4
188	E	39.8	Very low	40.6	Very low	150 Å²	150	137 Å²	137	70%	0.701	78%	0.778	S	S	*	*			trans	-94.8	167.2	149.8	-73.8	-163.7	145.1	0	0	109.4	R190	E188-R190 IonicContact OE2-NE 3.64Å
189	P	48.9	Very low	41	Very low	130 Å²	130	139.5 Å²	139.5	84%	0.844	78%	0.779	S	S	*	*			trans	-124.8	144.2	137.7	35.8	-27.1	0	0	0	112.8
190	R	37.3	Very low	41.1	Very low	212 Å²	212	140.7 Å²	140.7	80%	0.8	78%	0.781	S	S	*	*			trans	-111.9	147.8	172.1	-59	176.1	-179.4	179.6	-3.3	110.8	E188	E188-R190 IonicContact OE2-NE 3.64Å
191	K	40.6	Very low	41.2	Very low	205 Å²	205	137.1 Å²	137.1	89%	0.891	77%	0.772	S	S	*	*			trans	172.9	167.2	147.5	-98.9	178.5	175.9	-172.3	0	108.7
192	S	37.6	Very low	41.3	Very low	104 Å²	104	137 Å²	137	73%	0.727	77%	0.767	S	S	*	*			cis	161.5	135.1	-45.5	-85.8	0	0	0	0	107.5
193	A	41.9	Very low	40.9	Very low	77 Å²	77	137.6 Å²	137.6	64%	0.636	77%	0.768	S	S	*	*			trans	64.2	159.5	172.3	0	0	0	0	0	116.2
194	E	42.5	Very low	40.9	Very low	176 Å²	176	135.5 Å²	135.5	82%	0.822	77%	0.768	S	S	*	*			cis	-158.4	-168.8	-33.6	-120.1	94.5	-108.9	0	0	105.1
195	Q	45.3	Very low	41.1	Very low	157 Å²	157	134.4 Å²	134.4	73%	0.734	77%	0.767	S	S	*	*			cis	-157	147	8.7	-145.3	-169.3	-45.8	0	0	111.5
196	D	38	Very low	41	Very low	124 Å²	124	136.2 Å²	136.2	66%	0.663	76%	0.762	S	S	*	*			trans	45.6	158.8	144.5	-72.9	-31.4	0	0	0	127.4
197	T	42.5	Very low	41.2	Very low	135 Å²	135	137.5 Å²	137.5	83%	0.828	76%	0.761	S	S	*	*			trans	78.1	144.3	164.8	70.3	0	0	0	0	119.9
198	S	42.2	Very low	41.3	Very low	96 Å²	96	132.6 Å²	132.6	67%	0.671	75%	0.749	S	S	*	*			cis	-172.7	169.1	-43	42.5	0	0	0	0	110.6
199	T	45.5	Very low	41.5	Very low	122 Å²	122	130.6 Å²	130.6	75%	0.748	75%	0.752	S	S	*	*			trans	67.7	120.5	175.1	61.3	0	0	0	0	115.7
200	D	40.4	Very low	41.4	Very low	150 Å²	150	130.4 Å²	130.4	80%	0.802	74%	0.744	S	S	*	*				89.2	136.7	57.5	-77.2	-43.4	0	0	0	112.7
201	V	44.6	Very low	42	Very low	113 Å²	113	129.9 Å²	129.9	69%	0.685	74%	0.742	S	S	*	*			cis	-155.5	161.9	5.8	85.8	0	0	0	0	114
202	T	39.7	Very low	42.5	Very low	113 Å²	113	122.8 Å²	122.8	69%	0.693	73%	0.726	S	S	*	*			trans	72	126.7	160.4	50.4	0	0	0	0	124.3
203	T	36.4	Very low	43.3	Very low	128 Å²	128	121.1 Å²	121.1	79%	0.785	71%	0.709	S	S	*	*			trans	60.8	90.6	138.8	59.5	0	0	0	0	121.9
204	S	41.4	Very low	43.8	Very low	121 Å²	121	124.7 Å²	124.7	85%	0.846	71%	0.711	S	S	*	*				-171.6	125.1	107.4	38.7	0	0	0	0	111.3	D206	S204-D206 PolarHBondContact O-N 2.96Å
205	V	41.6	Very low	44.6	Very low	135 Å²	135	120.7 Å²	120.7	82%	0.818	70%	0.695	S	S	*	*			trans	-103	73.5	-170.3	-74	0	0	0	0	113.2	S207	V205-S207 PolarHBondContact O-N 3.43Å; V205-S207 PolarHBondContact O-OG 3.09Å
206	D	36.1	Very low	45.2	Very low	139 Å²	139	119 Å²	119	74%	0.743	69%	0.685	S	S	*	*			trans	-73.1	86.8	178.5	-163	3.6	0	0	0	112.4	S204 T208	S204-D206 PolarHBondContact O-N 2.96Å; D206-T208 VanDerWaalsContact C-N 3.32Å; D206-T208 PolarHBondContact O-N 3.41Å; D206-T208 PolarHBondContact O-OG1 2.94Å; D206-T208 WeakPolarHBondContact OD1-CG2 3.43Å
207	S	40.3	Very low	46	Very low	90 Å²	90	120.2 Å²	120.2	63%	0.629	68%	0.68	S	S	*	*			trans	-82.4	66.6	-167.9	-62.1	0	0	0	0	113.2	V205 S209	V205-S207 PolarHBondContact O-N 3.43Å; V205-S207 PolarHBondContact O-OG 3.09Å; S207-S209 PolarHBondContact O-N 3.12Å
208	T	44.1	Very low	46.7	Very low	107 Å²	107	120.3 Å²	120.3	66%	0.656	67%	0.669	S	S	*	*			trans	-90.1	11.7	-172.9	45.7	0	0	0	0	115.7	D206	D206-T208 VanDerWaalsContact C-N 3.32Å; D206-T208 PolarHBondContact O-N 3.41Å; D206-T208 PolarHBondContact O-OG1 2.94Å; D206-T208 WeakPolarHBondContact OD1-CG2 3.43Å
209	S	44.2	Very low	47.7	Very low	109 Å²	109	124 Å²	124	76%	0.762	67%	0.673	S	S	*	*	S	Bend	trans	-119.1	16.9	-166.9	58	0	0	0	0	117.1	S207	S207-S209 PolarHBondContact O-N 3.12Å
210	N	48.1	Very low	48.9	Very low	126 Å²	126	123.2 Å²	123.2	67%	0.674	66%	0.664	S	S	*	*	S	Bend	trans	-144	16.3	-175.2	-127.3	-27.6	0	0	0	117.7
211	R	49.3	Very low	50.4	Low	201 Å²	201	121.6 Å²	121.6	76%	0.758	65%	0.646	S	S	*	*	H	α-helix	trans	-74.9	-44.6	-178.5	-68.4	-177.3	179.6	166.4	2.3	113.2	D213 K214	R211-D213 PolarHBondContact O-N 2.88Å; R211-K214 PolarHBondContact O-N 3.29Å
212	G	50.6	Low	51.8	Low	55 Å²	55	116.2 Å²	116.2	57%	0.567	61%	0.614	S	S	*	*	H	α-helix	trans	-70.9	7.5	-170.2	0	0	0	0	0	118.2	K216	G212-K216 WeakPolarHBondContact O-CE 3.49Å; G212-K216 PolarHBondContact O-NZ 2.84Å; G212-K216 VanDerWaalsContact O-NZ 3.12Å
213	D	54.2	Low	53.3	Low	69 Å²	69	121.3 Å²	121.3	37%	0.369	62%	0.62	S	S	.	*	H	α-helix	trans	-113.3	-27.3	172.2	-149.6	58.7	0	0	0	113.6	R211 D215 K216 R217	R211-D213 PolarHBondContact O-N 2.88Å; D213-D215 VanDerWaalsContact C-N 3.25Å; D213-D215 PolarHBondContact O-N 3.01Å; D213-K216 PolarHBondContact O-N 3.46Å; D213-K216 VanDerWaalsContact O-N 3.12Å; D213-K216 IonicContact OD1-NZ 3.62Å; D213-K216 PolarHBondContact OD1-NZ 3.26Å; D213-R217 PolarHBondContact O-N 3.02Å
214	K	54	Low	54.8	Low	153 Å²	153	119.4 Å²	119.4	67%	0.665	61%	0.605	S	S	*	*	H	α-helix	trans	-59.3	-38.6	171.6	-75	-171.4	171.5	-173.6	0	111.5	R211 K216 R217 K218	R211-K214 PolarHBondContact O-N 3.29Å; K214-K216 PolarHBondContact O-N 3.46Å; K214-R217 PolarHBondContact O-N 2.71Å; K214-K218 PolarHBondContact O-N 3.17Å
215	D	58.2	Low	55.9	Low	92 Å²	92	114.6 Å²	114.6	49%	0.492	57%	0.569	S	S	.	*	H	α-helix	trans	-71.9	-5.7	179.7	-57.9	-34.8	0	0	0	114.3	D213	D213-D215 VanDerWaalsContact C-N 3.25Å; D213-D215 PolarHBondContact O-N 3.01Å
216	K	57.4	Low	56.9	Low	121 Å²	121	110 Å²	110	53%	0.526	54%	0.54	S	S	.	.	H	α-helix	trans	-95.5	-36.5	173	-56.9	-176.4	-157.7	127.3	0	112.4	G212 D213 K214 K218 K219	G212-K216 WeakPolarHBondContact O-CE 3.49Å; G212-K216 PolarHBondContact O-NZ 2.84Å; G212-K216 VanDerWaalsContact O-NZ 3.12Å; D213-K216 PolarHBondContact O-N 3.46Å; D213-K216 VanDerWaalsContact O-N 3.12Å; D213-K216 IonicContact OD1-NZ 3.62Å; D213-K216 PolarHBondContact OD1-NZ 3.26Å; K214-K216 PolarHBondContact O-N 3.46Å; K216-K218 VanDerWaalsContact C-N 3.34Å; K216-K219 PolarHBondContact O-N 3.01Å; K216-K219 VanDerWaalsContact O-N 3.14Å
217	R	54.6	Low	58	Low	149 Å²	149	104 Å²	104	56%	0.562	51%	0.511	S	S	*	.	H	α-helix	trans	-65.7	-39.1	176.9	-65.4	-172.1	-172.2	-168.6	0.6	111.6	D213 K214 K219 L220 P256	D213-R217 PolarHBondContact O-N 3.02Å; K214-R217 PolarHBondContact O-N 2.71Å; R217-K219 PolarHBondContact O-N 3.39Å; R217-L220 PolarHBondContact O-N 3.16Å; R217-P256 CarbonylContact C-O 3.46Å
218	K	58.6	Low	58.7	Low	138 Å²	138	104.7 Å²	104.7	60%	0.6	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	2	169.4	-67.8	-176.6	171.8	-169.7	0	115.9	K214 K216	K214-K218 PolarHBondContact O-N 3.17Å; K216-K218 VanDerWaalsContact C-N 3.34Å
219	K	63.2	Low	59.4	Low	173 Å²	173	103.1 Å²	103.1	75%	0.752	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.8	5.9	176.8	-66.2	-177.7	178.6	-180	0	113.2	K216 R217	K216-K219 PolarHBondContact O-N 3.01Å; K216-K219 VanDerWaalsContact O-N 3.14Å; R217-K219 PolarHBondContact O-N 3.39Å
220	L	69.8	Low	60	Low	106 Å²	106	100.6 Å²	100.6	56%	0.555	48%	0.477	S	S	*	.	S	Bend	trans	-101.4	132.4	164.6	-86.9	66.5	0	0	0	107.9	R217 F257 D258	R217-L220 PolarHBondContact O-N 3.16Å; L220-F257 HydrophobicContact CB-CD1 3.89Å; L220-F257 HydrophobicContact CB-CE1 4.19Å; L220-F257 WeakPolarHBondContact O-CB 3.45Å; L220-D258 PolarHBondContact O-N 3Å
221	R	72.3	Confident	60.5	Low	115 Å²	115	97.2 Å²	97.2	43%	0.434	47%	0.467	S	S	.	.	B	Isolated β-bridge	trans	-75.9	145.7	174.9	-164	164.5	138.5	140.6	-1.3	109.6	R223 D226 E245 D258	R221-R223 PolarHBondContact O-N 2.88Å; R221-D226 WeakPolarHBondContact CG-OD2 3.46Å; R221-D226 IonicContact CZ-OD1 3.15Å; R221-D226 VanDerWaalsContact NE-CG 3.34Å; R221-D226 IonicContact NE-OD1 2.76Å; R221-D226 PolarHBondContact NE-OD1 3.31Å; R221-D226 IonicContact NE-OD2 2.65Å; R221-D226 PolarHBondContact NE-OD2 2.87Å; R221-D226 IonicContact NH2-OD1 2.69Å; R221-D226 PolarHBondContact NH2-OD1 3.11Å; R221-E245 IonicContact NH2-OE1 3.23Å; R221-D258 WeakPolarHBondContact CA-O 3.39Å
222	C	74.3	Confident	61.2	Low	1 Å²	1	91.2 Å²	91.2	1%	0.007	45%	0.449	C	S	.	.	P	Polyproline II helix	trans	-70.6	125.7	-171.6	-174.8	0	0	0	0	112.3	D224 F225 D226 F257 D258 H259	C222-D224 VanDerWaalsContact C-N 3.26Å; C222-D224 PolarHBondContact O-N 3.11Å; C222-F225 HydrophobicContact CB-CB 3.78Å; C222-F225 WeakPolarHBondContact O-CB 3.41Å; C222-F225 PolarHBondContact O-N 3.14Å; C222-F225 VanDerWaalsContact O-N 3.12Å; C222-D226 PolarHBondContact O-N 3.42Å; C222-D226 VanDerWaalsContact O-N 3.08Å; C222-F257 HydrophobicContact CB-CB 3.85Å; C222-D258 PolarHBondContact N-O 3.06Å; C222-H259 WeakPolarHBondContact CB-CD2 3.35Å; C222-H259 WeakPolarHBondContact CB-NE2 3.4Å
223	R	70.6	Confident	61.1	Low	219 Å²	219	93.1 Å²	93.1	83%	0.826	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-27	179.5	-59	-173.8	80.8	139	4	113.1	R221 F225	R221-R223 PolarHBondContact O-N 2.88Å; R223-F225 VanDerWaalsContact C-N 3.33Å
224	D	67.4	Low	61.5	Low	88 Å²	88	92.6 Å²	92.6	47%	0.471	45%	0.449	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-20.4	175.6	-64	-70	0	0	0	112.6	C222 K246	C222-D224 VanDerWaalsContact C-N 3.26Å; C222-D224 PolarHBondContact O-N 3.11Å; D224-K246 WeakPolarHBondContact O-CB 3.23Å; D224-K246 VanDerWaalsContact O-CD 3.23Å; D224-K246 WeakPolarHBondContact O-CD 3.38Å
225	F	64.3	Low	61.4	Low	20 Å²	20	93 Å²	93	9%	0.088	45%	0.451	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.7	-43.3	174.5	-171.1	-91.3	0	0	0	111	C222 R223 G227 K246 G247 H259	C222-F225 HydrophobicContact CB-CB 3.78Å; C222-F225 WeakPolarHBondContact O-CB 3.41Å; C222-F225 PolarHBondContact O-N 3.14Å; C222-F225 VanDerWaalsContact O-N 3.12Å; R223-F225 VanDerWaalsContact C-N 3.33Å; F225-G227 PolarHBondContact O-N 3.33Å; F225-G227 VanDerWaalsContact O-N 3.11Å; F225-K246 PolarHBondContact O-N 3.43Å; F225-K246 VanDerWaalsContact O-N 3.15Å; F225-G247 WeakPolarHBondContact CE2-O 3.34Å; F225-H259 HydrophobicContact CD2-CB 4.08Å; F225-H259 AromaticContact CD2-CD2 3.84Å; F225-H259 VanDerWaalsContact CE1-O 3.31Å; F225-H259 WeakPolarHBondContact CE1-O 3.29Å; F225-H259 HydrophobicContact CE2-CB 3.98Å; F225-H259 HydrophobicContact CZ-CB 4.38Å; F225-H259 WeakPolarHBondContact CZ-O 3.46Å
226	D	62.6	Low	61.5	Low	39 Å²	39	92.3 Å²	92.3	21%	0.209	47%	0.465	C	S	.	.	S	Bend	trans	-73.9	7.1	-176.2	-77.7	-19.5	0	0	0	116.1	R221 C222 F242	R221-D226 WeakPolarHBondContact CG-OD2 3.46Å; R221-D226 IonicContact CZ-OD1 3.15Å; R221-D226 VanDerWaalsContact NE-CG 3.34Å; R221-D226 IonicContact NE-OD1 2.76Å; R221-D226 PolarHBondContact NE-OD1 3.31Å; R221-D226 IonicContact NE-OD2 2.65Å; R221-D226 PolarHBondContact NE-OD2 2.87Å; R221-D226 IonicContact NH2-OD1 2.69Å; R221-D226 PolarHBondContact NH2-OD1 3.11Å; C222-D226 PolarHBondContact O-N 3.42Å; C222-D226 VanDerWaalsContact O-N 3.08Å; D226-F242 WeakPolarHBondContact O-CZ 3.36Å
227	G	59.3	Low	61.7	Low	13 Å²	13	91.6 Å²	91.6	13%	0.134	47%	0.467	C	S	.	.			trans	69.3	-169	178.1	0	0	0	0	0	113.8	F225 A244	F225-G227 PolarHBondContact O-N 3.33Å; F225-G227 VanDerWaalsContact O-N 3.11Å; G227-A244 WeakPolarHBondContact CA-O 3.46Å
228	I	56.5	Low	62	Low	104 Å²	104	89.5 Å²	89.5	53%	0.533	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	108.2	-176.6	-56.6	-179.1	0	0	0	109.7	V230 L243	I228-V230 HydrophobicContact CG2-CG2 3.86Å; I228-V230 PolarHBondContact O-N 3.24Å; I228-L243 PolarHBondContact N-O 3.3Å; I228-L243 VanDerWaalsContact N-O 3.08Å; I228-L243 WeakPolarHBondContact O-CB 3.4Å; I228-L243 PolarHBondContact O-N 2.88Å
229	T	57.2	Low	62.5	Low	74 Å²	74	85 Å²	85	45%	0.454	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	110.6	166.3	-47.7	0	0	0	0	109.9	N240 Y241	T229-N240 HydrophobicContact CG2-CB 3.76Å; T229-Y241 CarbonylContact C-O 3.59Å; T229-Y241 WeakPolarHBondContact CA-O 3.48Å
230	V	57	Low	62.6	Low	57 Å²	57	81.3 Å²	81.3	35%	0.345	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	109.6	173.1	179	0	0	0	0	108.9	I228 I232 Y241 L243	I228-V230 HydrophobicContact CG2-CG2 3.86Å; I228-V230 PolarHBondContact O-N 3.24Å; V230-I232 HydrophobicContact CG1-CD1 4.34Å; V230-I232 HydrophobicContact CG1-CG1 3.89Å; V230-I232 PolarHBondContact O-N 3.2Å; V230-Y241 PolarHBondContact N-O 2.91Å; V230-Y241 WeakPolarHBondContact O-CB 3.43Å; V230-Y241 PolarHBondContact O-N 3.11Å; V230-L243 HydrophobicContact CB-CD1 3.95Å; V230-L243 HydrophobicContact CG2-CD1 3.41Å; V230-L243 VanDerWaalsContact CG2-CD1 3.41Å
231	A	59.3	Low	61.8	Low	55 Å²	55	81.6 Å²	81.6	46%	0.455	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	113	175.4	0	0	0	0	0	110.5	L238	A231-L238 HydrophobicContact CB-CD1 3.82Å; A231-L238 HydrophobicContact CB-CG 4.12Å
232	I	63.4	Low	61	Low	75 Å²	75	81.7 Å²	81.7	39%	0.385	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	122.8	177	-51.1	-174.4	0	0	0	108.6	V230 I234 V239 Y241	V230-I232 HydrophobicContact CG1-CD1 4.34Å; V230-I232 HydrophobicContact CG1-CG1 3.89Å; V230-I232 PolarHBondContact O-N 3.2Å; I232-I234 HydrophobicContact CB-CG1 4.3Å; I232-I234 HydrophobicContact CG2-CD1 4.1Å; I232-I234 HydrophobicContact CG2-CG1 3.69Å; I232-I234 PolarHBondContact O-N 3.49Å; I232-V239 PolarHBondContact N-O 2.73Å; I232-V239 WeakPolarHBondContact O-CB 3.5Å; I232-V239 PolarHBondContact O-N 3.05Å; I232-Y241 HydrophobicContact CB-CD2 4.1Å; I232-Y241 HydrophobicContact CB-CE2 4.08Å; I232-Y241 HydrophobicContact CD1-CD2 3.61Å; I232-Y241 HydrophobicContact CD1-CE2 3.77Å; I232-Y241 HydrophobicContact CD1-CG 4.26Å; I232-Y241 HydrophobicContact CG1-CD2 3.76Å; I232-Y241 HydrophobicContact CG1-CE2 4.11Å
233	C	49.7	Very low	59.9	Low	95 Å²	95	86.6 Å²	86.6	64%	0.642	46%	0.462	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.6	109.4	171.8	-72.4	0	0	0	0	110.1	I237	C233-I237 WeakPolarHBondContact CA-O 3.37Å
234	I	62	Low	59	Low	57 Å²	57	79.8 Å²	79.8	29%	0.292	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	127.4	175.7	-45.3	-178.2	0	0	0	107.8	I232 G236 I237 V239 Y241	I232-I234 HydrophobicContact CB-CG1 4.3Å; I232-I234 HydrophobicContact CG2-CD1 4.1Å; I232-I234 HydrophobicContact CG2-CG1 3.69Å; I232-I234 PolarHBondContact O-N 3.49Å; I234-G236 PolarHBondContact O-N 2.95Å; I234-G236 VanDerWaalsContact O-N 3.1Å; I234-I237 PolarHBondContact N-O 2.98Å; I234-I237 WeakPolarHBondContact O-CB 3.45Å; I234-I237 PolarHBondContact O-N 3.45Å; I234-V239 HydrophobicContact CB-CG2 4.18Å; I234-V239 HydrophobicContact CD1-CG2 4.32Å; I234-V239 HydrophobicContact CG1-CG2 4.21Å; I234-Y241 HydrophobicContact CD1-CE2 4.05Å
235	F	52.2	Low	58.6	Low	162 Å²	162	81.4 Å²	81.4	71%	0.711	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.3	28.6	-174.1	-52.1	-62.3	0	0	0	114.9	I237 F630	F235-I237 PolarHBondContact O-N 3.28Å; F235-F630 AromaticContact CD1-CD2 3.98Å; F235-F630 HydrophobicContact CD1-CD2 3.98Å; F235-F630 AromaticContact CD1-CE2 3.41Å; F235-F630 HydrophobicContact CD1-CE2 3.41Å; F235-F630 VanDerWaalsContact CD1-CE2 3.41Å; F235-F630 HydrophobicContact CD1-CZ 4.03Å; F235-F630 HydrophobicContact CE1-CD2 4.4Å; F235-F630 AromaticContact CE1-CE2 3.73Å; F235-F630 HydrophobicContact CE1-CE2 3.73Å; F235-F630 HydrophobicContact CG-CE2 4.41Å
236	G	60	Low	58.4	Low	77 Å²	77	85.1 Å²	85.1	79%	0.794	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.3	-2.5	-175.3	0	0	0	0	0	114.8	I234	I234-G236 PolarHBondContact O-N 2.95Å; I234-G236 VanDerWaalsContact O-N 3.1Å
237	I	61.9	Low	58.5	Low	107 Å²	107	84.5 Å²	84.5	55%	0.549	48%	0.476	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	133.8	173.4	-57.6	175.1	0	0	0	108.8	C233 I234 F235 V239	C233-I237 WeakPolarHBondContact CA-O 3.37Å; I234-I237 PolarHBondContact N-O 2.98Å; I234-I237 WeakPolarHBondContact O-CB 3.45Å; I234-I237 PolarHBondContact O-N 3.45Å; F235-I237 PolarHBondContact O-N 3.28Å; I237-V239 HydrophobicContact CG2-CG2 4.3Å; I237-V239 PolarHBondContact O-N 3.31Å; I237-V239 VanDerWaalsContact O-N 3.17Å
238	L	61	Low	59	Low	104 Å²	104	89 Å²	89	55%	0.545	49%	0.49	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	91	174.9	-169.4	75.7	0	0	0	109.9	A231 N240	A231-L238 HydrophobicContact CB-CD1 3.82Å; A231-L238 HydrophobicContact CB-CG 4.12Å; L238-N240 PolarHBondContact O-N 2.94Å
239	V	67.8	Low	59.9	Low	44 Å²	44	84.7 Å²	84.7	27%	0.267	47%	0.469	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	112.1	179.7	-172.9	0	0	0	0	109.3	I232 I234 I237 Y241	I232-V239 PolarHBondContact N-O 2.73Å; I232-V239 WeakPolarHBondContact O-CB 3.5Å; I232-V239 PolarHBondContact O-N 3.05Å; I234-V239 HydrophobicContact CB-CG2 4.18Å; I234-V239 HydrophobicContact CD1-CG2 4.32Å; I234-V239 HydrophobicContact CG1-CG2 4.21Å; I237-V239 HydrophobicContact CG2-CG2 4.3Å; I237-V239 PolarHBondContact O-N 3.31Å; I237-V239 VanDerWaalsContact O-N 3.17Å; V239-Y241 HydrophobicContact CB-CD2 4.36Å; V239-Y241 HydrophobicContact CB-CE2 3.96Å; V239-Y241 HydrophobicContact CG1-CD2 3.87Å; V239-Y241 HydrophobicContact CG1-CE2 3.45Å; V239-Y241 VanDerWaalsContact CG1-CE2 3.45Å; V239-Y241 PolarHBondContact O-N 2.82Å
240	N	66	Low	60.7	Low	95 Å²	95	88.5 Å²	88.5	51%	0.508	48%	0.484	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	102.3	176.3	-71.7	-73.2	0	0	0	110	T229 L238	T229-N240 HydrophobicContact CG2-CB 3.76Å; L238-N240 PolarHBondContact O-N 2.94Å
241	Y	54.3	Low	61.4	Low	112 Å²	112	90 Å²	90	44%	0.439	49%	0.489	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	121.9	170.3	-75.8	-99.5	0	0	0	109.5	T229 V230 I232 I234 V239 L243	T229-Y241 CarbonylContact C-O 3.59Å; T229-Y241 WeakPolarHBondContact CA-O 3.48Å; V230-Y241 PolarHBondContact N-O 2.91Å; V230-Y241 WeakPolarHBondContact O-CB 3.43Å; V230-Y241 PolarHBondContact O-N 3.11Å; I232-Y241 HydrophobicContact CB-CD2 4.1Å; I232-Y241 HydrophobicContact CB-CE2 4.08Å; I232-Y241 HydrophobicContact CD1-CD2 3.61Å; I232-Y241 HydrophobicContact CD1-CE2 3.77Å; I232-Y241 HydrophobicContact CD1-CG 4.26Å; I232-Y241 HydrophobicContact CG1-CD2 3.76Å; I232-Y241 HydrophobicContact CG1-CE2 4.11Å; I234-Y241 HydrophobicContact CD1-CE2 4.05Å; V239-Y241 HydrophobicContact CB-CD2 4.36Å; V239-Y241 HydrophobicContact CB-CE2 3.96Å; V239-Y241 HydrophobicContact CG1-CD2 3.87Å; V239-Y241 HydrophobicContact CG1-CE2 3.45Å; V239-Y241 VanDerWaalsContact CG1-CE2 3.45Å; V239-Y241 PolarHBondContact O-N 2.82Å; Y241-L243 PolarHBondContact O-N 2.86Å
242	F	54.9	Low	62.1	Low	118 Å²	118	88.8 Å²	88.8	52%	0.518	48%	0.481	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	94	178.3	-153.5	-89.4	0	0	0	109	D226 A244 E245	D226-F242 WeakPolarHBondContact O-CZ 3.36Å; F242-A244 PolarHBondContact O-N 3.13Å; F242-E245 HydrophobicContact CE1-CG 3.76Å; F242-E245 HydrophobicContact CZ-CG 4.48Å
243	L	50.6	Low	62.6	Low	103 Å²	103	91.7 Å²	91.7	54%	0.539	50%	0.498	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	103.4	172.2	-79.1	109.2	0	0	0	109.3	I228 V230 Y241	I228-L243 PolarHBondContact N-O 3.3Å; I228-L243 VanDerWaalsContact N-O 3.08Å; I228-L243 WeakPolarHBondContact O-CB 3.4Å; I228-L243 PolarHBondContact O-N 2.88Å; V230-L243 HydrophobicContact CB-CD1 3.95Å; V230-L243 HydrophobicContact CG2-CD1 3.41Å; V230-L243 VanDerWaalsContact CG2-CD1 3.41Å; Y241-L243 PolarHBondContact O-N 2.86Å
244	A	51.9	Low	63.9	Low	76 Å²	76	94.2 Å²	94.2	63%	0.628	51%	0.505	S	S	*	.			trans	36	116.2	164.2	0	0	0	0	0	116.7	G227 F242 K246	G227-A244 WeakPolarHBondContact CA-O 3.46Å; F242-A244 PolarHBondContact O-N 3.13Å; A244-K246 PolarHBondContact O-N 3.36Å; A244-K246 VanDerWaalsContact O-N 3.15Å
245	E	58.3	Low	64.7	Low	123 Å²	123	92.4 Å²	92.4	58%	0.575	50%	0.497	S	S	*	.			trans	-50.6	123.7	162.2	-64.9	-173.8	134	0	0	108.6	R221 F242 G247	R221-E245 IonicContact NH2-OE1 3.23Å; F242-E245 HydrophobicContact CE1-CG 3.76Å; F242-E245 HydrophobicContact CZ-CG 4.48Å; E245-G247 VanDerWaalsContact C-N 3.27Å
246	K	61.6	Low	65.9	Low	97 Å²	97	87.7 Å²	87.7	42%	0.422	48%	0.483	S	S	.	.			trans	-71.5	-28.3	177.8	-83.4	178.8	169.8	178.2	0	111	D224 F225 A244 Y248	D224-K246 WeakPolarHBondContact O-CB 3.23Å; D224-K246 VanDerWaalsContact O-CD 3.23Å; D224-K246 WeakPolarHBondContact O-CD 3.38Å; F225-K246 PolarHBondContact O-N 3.43Å; F225-K246 VanDerWaalsContact O-N 3.15Å; A244-K246 PolarHBondContact O-N 3.36Å; A244-K246 VanDerWaalsContact O-N 3.15Å; K246-Y248 HydrophobicContact CB-CE1 4.46Å; K246-Y248 WeakPolarHBondContact O-CD1 3.36Å; K246-Y248 PolarHBondContact O-N 3.2Å
247	G	64.9	Low	66.8	Low	26 Å²	26	87.9 Å²	87.9	27%	0.268	46%	0.462	S	S	.	.			trans	70.9	-12.2	179.3	0	0	0	0	0	115.3	F225 E245	F225-G247 WeakPolarHBondContact CE2-O 3.34Å; E245-G247 VanDerWaalsContact C-N 3.27Å
248	Y	69.5	Low	67.5	Low	109 Å²	109	86.7 Å²	86.7	43%	0.427	46%	0.456	S	S	.	.			trans	-131.8	153.3	173.4	68.6	-86.4	0	0	0	110.8	K246 M250	K246-Y248 HydrophobicContact CB-CE1 4.46Å; K246-Y248 WeakPolarHBondContact O-CD1 3.36Å; K246-Y248 PolarHBondContact O-N 3.2Å; Y248-M250 HydrophobicContact CD2-CG 4.41Å; Y248-M250 HydrophobicContact CE2-CG 4.11Å
249	C	75.5	Confident	68.3	Low	13 Å²	13	82.9 Å²	82.9	9%	0.088	44%	0.436	C	S	.	.			trans	-121.2	134	169.7	177.1	0	0	0	0	108.5	L251 G252 H259	C249-L251 PolarHBondContact O-N 2.87Å; C249-G252 PolarHBondContact O-N 3.4Å; C249-H259 VanDerWaalsContact CB-NE2 3.26Å; C249-H259 WeakPolarHBondContact CB-NE2 3.34Å
250	M	73.6	Confident	68.5	Low	154 Å²	154	82.1 Å²	82.1	76%	0.759	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	8.7	-178.8	-48.3	-160.9	-22.6	0	0	114.4	Y248	Y248-M250 HydrophobicContact CD2-CG 4.41Å; Y248-M250 HydrophobicContact CE2-CG 4.11Å
251	L	72.1	Confident	68.8	Low	89 Å²	89	84 Å²	84	47%	0.466	45%	0.454	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100	-9.6	165.4	-71.8	87.3	0	0	0	112.3	C249 D253 N254 C255	C249-L251 PolarHBondContact O-N 2.87Å; L251-D253 PolarHBondContact O-N 3.08Å; L251-N254 WeakPolarHBondContact O-CA 3.36Å; L251-N254 VanDerWaalsContact O-CB 3.27Å; L251-N254 WeakPolarHBondContact O-CB 3.45Å; L251-N254 PolarHBondContact O-N 3.3Å; L251-C255 HydrophobicContact CB-CB 3.89Å; L251-C255 PolarHBondContact O-N 3.13Å
252	G	72.8	Confident	69.1	Low	28 Å²	28	85.2 Å²	85.2	29%	0.289	47%	0.468	S	S	.	.	G	3₁₀ helix	trans	49	-132.7	-177.1	0	0	0	0	0	112.5	C249 N254 C255 H259	C249-G252 PolarHBondContact O-N 3.4Å; G252-N254 PolarHBondContact O-N 3.13Å; G252-C255 WeakPolarHBondContact O-CB 3.47Å; G252-C255 PolarHBondContact O-N 3.33Å; G252-C255 VanDerWaalsContact O-N 3.14Å; G252-H259 PolarHBondContact O-CE1 3.34Å
253	D	74.3	Confident	69.5	Low	137 Å²	137	82.2 Å²	82.2	73%	0.733	46%	0.461	S	S	*	.	G	3₁₀ helix	trans	-68.5	-14.4	176.1	-64	-30.1	0	0	0	114.1	L251 C255	L251-D253 PolarHBondContact O-N 3.08Å; D253-C255 PolarHBondContact O-N 3.24Å
254	N	77.8	Confident	70.1	Confident	148 Å²	148	81.8 Å²	81.8	79%	0.791	46%	0.462	S	S	*	.	G	3₁₀ helix	trans	-80.4	-2.2	172.9	-60.4	-60.1	0	0	0	112.6	L251 G252	L251-N254 WeakPolarHBondContact O-CA 3.36Å; L251-N254 VanDerWaalsContact O-CB 3.27Å; L251-N254 WeakPolarHBondContact O-CB 3.45Å; L251-N254 PolarHBondContact O-N 3.3Å; G252-N254 PolarHBondContact O-N 3.13Å
255	C	77.6	Confident	70.4	Confident	18 Å²	18	82.2 Å²	82.2	12%	0.122	46%	0.457	C	S	.	.			trans	-66.7	130.6	177	-169.5	0	0	0	0	111.6	L251 G252 D253 F257 H259	L251-C255 HydrophobicContact CB-CB 3.89Å; L251-C255 PolarHBondContact O-N 3.13Å; G252-C255 WeakPolarHBondContact O-CB 3.47Å; G252-C255 PolarHBondContact O-N 3.33Å; G252-C255 VanDerWaalsContact O-N 3.14Å; D253-C255 PolarHBondContact O-N 3.24Å; C255-F257 PolarHBondContact O-N 3.19Å; C255-H259 WeakPolarHBondContact CB-CE1 3.42Å; C255-H259 PolarHBondContact SG-NE2 3.03Å; C255-H259 VanDerWaalsContact SG-NE2 3.37Å
256	P	77.9	Confident	70.4	Confident	63 Å²	63	81 Å²	81	41%	0.409	46%	0.458	S	S	.	.	S	Bend	trans	-81.6	7.1	177.3	34.2	-36.4	0	0	0	114	R217	R217-P256 CarbonylContact C-O 3.46Å
257	F	78.9	Confident	70	Confident	82 Å²	82	84.7 Å²	84.7	36%	0.36	48%	0.477	S	S	.	.	S	Bend	trans	-119.3	162.1	-176	-60.6	-67.3	0	0	0	111.2	L220 C222 C255	L220-F257 HydrophobicContact CB-CD1 3.89Å; L220-F257 HydrophobicContact CB-CE1 4.19Å; L220-F257 WeakPolarHBondContact O-CB 3.45Å; C222-F257 HydrophobicContact CB-CB 3.85Å; C255-F257 PolarHBondContact O-N 3.19Å
258	D	76.7	Confident	69.3	Low	81 Å²	81	91.8 Å²	91.8	43%	0.433	50%	0.503	S	S	.	.	B	Isolated β-bridge	trans	-80.7	141	-179.4	-168.5	6.2	0	0	0	111.9	L220 R221 C222 G260	L220-D258 PolarHBondContact O-N 3Å; R221-D258 WeakPolarHBondContact CA-O 3.39Å; C222-D258 PolarHBondContact N-O 3.06Å; D258-G260 PolarHBondContact OD1-N 2.96Å
259	H	76.5	Confident	68	Low	24 Å²	24	95.3 Å²	95.3	11%	0.111	52%	0.52	C	S	.	.			trans	-112.1	-3.3	175.1	-62.7	148.9	0	0	0	112.6	C222 F225 C249 G252 C255 P263	C222-H259 WeakPolarHBondContact CB-CD2 3.35Å; C222-H259 WeakPolarHBondContact CB-NE2 3.4Å; F225-H259 HydrophobicContact CD2-CB 4.08Å; F225-H259 AromaticContact CD2-CD2 3.84Å; F225-H259 VanDerWaalsContact CE1-O 3.31Å; F225-H259 WeakPolarHBondContact CE1-O 3.29Å; F225-H259 HydrophobicContact CE2-CB 3.98Å; F225-H259 HydrophobicContact CZ-CB 4.38Å; F225-H259 WeakPolarHBondContact CZ-O 3.46Å; C249-H259 VanDerWaalsContact CB-NE2 3.26Å; C249-H259 WeakPolarHBondContact CB-NE2 3.34Å; G252-H259 PolarHBondContact O-CE1 3.34Å; C255-H259 WeakPolarHBondContact CB-CE1 3.42Å; C255-H259 PolarHBondContact SG-NE2 3.03Å; C255-H259 VanDerWaalsContact SG-NE2 3.37Å; H259-P263 HydrophobicContact CB-CB 4.03Å
260	G	73.1	Confident	66.5	Low	28 Å²	28	100.8 Å²	100.8	29%	0.289	56%	0.556	S	S	.	*			trans	79.9	-161.8	-179.2	0	0	0	0	0	113.8	D258 D262	D258-G260 PolarHBondContact OD1-N 2.96Å; G260-D262 PolarHBondContact O-N 3.36Å
261	P	72.4	Confident	64.9	Low	135 Å²	135	100.9 Å²	100.9	88%	0.877	56%	0.559	S	S	*	*	S	Bend	trans	-83.4	-8.6	-162.2	33	-37.2	0	0	0	115.7
262	D	60.6	Low	63.4	Low	137 Å²	137	101.6 Å²	101.6	73%	0.733	57%	0.568	S	S	*	*			trans	-146.7	69.7	-173.1	-160	12.6	0	0	0	111.5	G260	G260-D262 PolarHBondContact O-N 3.36Å
263	P	62.7	Low	61.7	Low	55 Å²	55	107.6 Å²	107.6	36%	0.357	59%	0.594	S	S	.	*			trans	-78.8	123.3	-179.2	31.1	-33.3	0	0	0	111.6	H259 V265	H259-P263 HydrophobicContact CB-CB 4.03Å; P263-V265 PolarHBondContact O-N 3.34Å
264	V	63.1	Low	60	Low	95 Å²	95	109.3 Å²	109.3	58%	0.576	60%	0.6	S	S	*	*			trans	-74.4	99.3	172.8	-177.6	0	0	0	0	109.5	V266	V264-V266 PolarHBondContact O-N 3.18Å
265	V	58.9	Low	58.3	Low	85 Å²	85	109.6 Å²	109.6	52%	0.515	60%	0.598	S	S	.	*			trans	-77.1	115.8	173.5	-176.8	0	0	0	0	109.1	P263	P263-V265 PolarHBondContact O-N 3.34Å
266	V	57.8	Low	56.8	Low	98 Å²	98	114.1 Å²	114.1	59%	0.594	63%	0.627	S	S	*	*			trans	-93.3	118.3	170.5	-177.6	0	0	0	0	107.7	V264 E268	V264-V266 PolarHBondContact O-N 3.18Å; V266-E268 PolarHBondContact O-N 3.29Å
267	E	52.7	Low	54.7	Low	174 Å²	174	118 Å²	118	81%	0.813	64%	0.64	S	S	*	*			trans	-68	116.6	172.9	-70.7	-172.6	125	0	0	110	F269	E267-F269 PolarHBondContact O-N 2.94Å
268	E	51.8	Low	52.5	Low	174 Å²	174	124.4 Å²	124.4	81%	0.813	67%	0.667	S	S	*	*			trans	-72.5	113.1	174.1	-67.7	-170.5	126.6	0	0	110.1	V266	V266-E268 PolarHBondContact O-N 3.29Å
269	F	41.8	Very low	50.3	Low	183 Å²	183	125.3 Å²	125.3	80%	0.803	68%	0.679	S	S	*	*			trans	-56.8	138	166	-84.9	-102.7	0	0	0	109.7	E267 L271	E267-F269 PolarHBondContact O-N 2.94Å; F269-L271 PolarHBondContact O-N 3.23Å
270	P	42.4	Very low	48.2	Very low	128 Å²	128	130 Å²	130	83%	0.831	71%	0.714	S	S	*	*			trans	-71.7	91.7	-169.1	28	-35.7	0	0	0	112.4
271	L	41.6	Very low	46.3	Very low	157 Å²	157	137.1 Å²	137.1	82%	0.822	74%	0.738	S	S	*	*			trans	-91.3	130.2	172.5	-67.2	178.3	0	0	0	110.9	F269 N273	F269-L271 PolarHBondContact O-N 3.23Å; L271-N273 PolarHBondContact O-N 2.94Å
272	P	40.6	Very low	44.3	Very low	103 Å²	103	139.6 Å²	139.6	67%	0.669	74%	0.735	S	S	*	*			trans	-78.4	111.9	-170.6	29.2	-34.6	0	0	0	113.6
273	N	37.3	Very low	43.1	Very low	155 Å²	155	142.5 Å²	142.5	83%	0.829	74%	0.742	S	S	*	*			trans	51.9	71.1	134.9	-160.9	93.2	0	0	0	117	L271	L271-N273 PolarHBondContact O-N 2.94Å
274	M	36.9	Very low	41.8	Very low	173 Å²	173	145 Å²	145	85%	0.852	76%	0.758	S	S	*	*			trans	-132.3	99.4	166	37.2	-171.5	69.8	0	0	112.6
275	M	43.6	Very low	40.4	Very low	153 Å²	153	147.9 Å²	147.9	75%	0.754	77%	0.769	S	S	*	*			trans	-66.1	152.7	166.3	-137.8	93	69.4	0	0	109.6
276	P	46.5	Very low	39.5	Very low	113 Å²	113	150.3 Å²	150.3	73%	0.734	79%	0.786	S	S	*	*				-147.1	138.4	106	34.7	-18.4	0	0	0	117
277	H	33.3	Very low	38.5	Very low	144 Å²	144	153 Å²	153	67%	0.667	80%	0.795	S	S	*	*			trans	4.3	128.9	140.2	-38.3	-67.9	0	0	0	120.4	C279	H277-C279 PolarHBondContact O-N 2.98Å
278	K	33.1	Very low	37.8	Very low	217 Å²	217	156.5 Å²	156.5	94%	0.943	80%	0.8	S	S	*	*			trans	9.3	93.1	145.8	-59.5	176.1	-176.9	174.1	0	117.1
279	C	29.3	Very low	37	Very low	100 Å²	100	152 Å²	152	68%	0.676	80%	0.801	S	S	*	*			trans	-122.5	111.5	163.7	-75.7	0	0	0	0	111.9	H277 F281	H277-C279 PolarHBondContact O-N 2.98Å; C279-F281 HydrophobicContact CB-CD2 3.85Å; C279-F281 HydrophobicContact CB-CE2 3.71Å; C279-F281 PolarHBondContact O-N 3.19Å
280	S	33.7	Very low	36.6	Very low	122 Å²	122	149.1 Å²	149.1	85%	0.853	80%	0.803	S	S	*	*			trans	-76.2	115.3	168	-57	0	0	0	0	109.4
281	F	32.7	Very low	36.3	Very low	178 Å²	178	149 Å²	149	78%	0.781	80%	0.8	S	S	*	*			trans	-115.5	119.9	174.5	-88.4	-73.8	0	0	0	113.1	C279	C279-F281 HydrophobicContact CB-CD2 3.85Å; C279-F281 HydrophobicContact CB-CE2 3.71Å; C279-F281 PolarHBondContact O-N 3.19Å
282	F	30.9	Very low	35.9	Very low	188 Å²	188	147.9 Å²	147.9	83%	0.825	80%	0.8	S	S	*	*			trans	-62.1	144.1	169.1	-93.2	-133.7	0	0	0	111.1
283	F	33.5	Very low	35.8	Very low	198 Å²	198	148.7 Å²	148.7	87%	0.868	81%	0.807	S	S	*	*			trans	-107.7	118.1	149.6	-91.8	-89.2	0	0	0	108.5
284	P	36.7	Very low	35.4	Very low	108 Å²	108	150.4 Å²	150.4	70%	0.701	81%	0.807	S	S	*	*			trans	-83.3	140	-177.5	32.1	-33.7	0	0	0	112.2
285	L	33.1	Very low	35.7	Very low	155 Å²	155	148.6 Å²	148.6	81%	0.812	81%	0.805	S	S	*	*			trans	-85	131.9	162.7	-65.7	93.7	0	0	0	109.8	M287	L285-M287 PolarHBondContact O-N 3.08Å
286	P	40.1	Very low	35.2	Very low	135 Å²	135	148 Å²	148	88%	0.877	81%	0.806	S	S	*	*			trans	-82.8	103.8	164.3	31.6	-29.8	0	0	0	109.8
287	M	37.7	Very low	34.9	Very low	156 Å²	156	147.2 Å²	147.2	77%	0.768	80%	0.802	S	S	*	*			trans	-121	124.1	173.2	-109.3	-69.5	166.8	0	0	110.7	L285	L285-M287 PolarHBondContact O-N 3.08Å
288	R	36.9	Very low	35.4	Very low	246 Å²	246	147.8 Å²	147.8	93%	0.928	81%	0.81	S	S	*	*			trans	56.5	121.7	166.8	-89.6	176.2	163.3	-177.6	-5.5	118.2
289	G	36.3	Very low	35.7	Very low	80 Å²	80	143.4 Å²	143.4	83%	0.825	80%	0.804	S	S	*	*			trans	-176.4	105.8	161.3	0	0	0	0	0	111.3
290	S	31.7	Very low	36.4	Very low	122 Å²	122	147.5 Å²	147.5	85%	0.853	81%	0.813	S	S	*	*			trans	-82.5	140.9	176.1	-48.7	0	0	0	0	111
291	T	36.4	Very low	36.7	Very low	125 Å²	125	149.4 Å²	149.4	77%	0.767	81%	0.811	S	S	*	*			trans	-153.5	136.8	142.4	-74	0	0	0	0	108
292	V	33.3	Very low	37	Very low	134 Å²	134	144.8 Å²	144.8	81%	0.812	81%	0.805	S	S	*	*			trans	-97.3	137.8	167.2	-73.7	0	0	0	0	109.1
293	C	39.9	Very low	37.6	Very low	121 Å²	121	141.6 Å²	141.6	82%	0.818	80%	0.802	S	S	*	*			trans	-119.2	98	173.1	-59.7	0	0	0	0	108.2
294	F	28.8	Very low	38.3	Very low	191 Å²	191	143.2 Å²	143.2	84%	0.838	80%	0.802	S	S	*	*			trans	-77.1	150.9	163.4	-110.7	-102.5	0	0	0	109.3
295	V	41.4	Very low	38.4	Very low	134 Å²	134	144.1 Å²	144.1	81%	0.812	81%	0.808	S	S	*	*			trans	-139	136.1	154.8	-75.5	0	0	0	0	108.2
296	D	34.7	Very low	39.2	Very low	142 Å²	142	143.9 Å²	143.9	76%	0.759	81%	0.812	S	S	*	*			trans	-61.5	166	174.8	-67	-99.8	0	0	0	111.7
297	S	40	Very low	39.2	Very low	95 Å²	95	146.5 Å²	146.5	66%	0.664	81%	0.81	S	S	*	*			cis	-156	-176.4	40.9	-56.2	0	0	0	0	115.6
298	D	42.5	Very low	39.4	Very low	157 Å²	157	144.2 Å²	144.2	84%	0.84	81%	0.807	S	S	*	*			trans	80.3	89.7	154.5	-52.1	-32.9	0	0	0	119.7
299	P	41	Very low	39.6	Very low	125 Å²	125	139 Å²	139	81%	0.812	80%	0.802	S	S	*	*			trans	-120.4	135.4	159.8	36.4	-23.4	0	0	0	113.2
300	E	42.8	Very low	39.8	Very low	185 Å²	185	141.7 Å²	141.7	86%	0.864	80%	0.802	S	S	*	*			trans	-147.4	156.7	158	-133.4	-163.9	117.2	0	0	115.2
301	M	41.1	Very low	40.7	Very low	162 Å²	162	142.3 Å²	142.3	80%	0.798	80%	0.801	S	S	*	*			trans	61	99.7	166.6	-129	56.5	175.5	0	0	120.8
302	A	38.8	Very low	41.4	Very low	81 Å²	81	140.2 Å²	140.2	67%	0.669	80%	0.796	S	S	*	*			trans	-69.2	170.6	157.9	0	0	0	0	0	110.6
303	T	43.7	Very low	43	Very low	122 Å²	122	139.7 Å²	139.7	75%	0.748	80%	0.796	S	S	*	*				-179.4	160.4	62.2	-42.6	0	0	0	0	111.4
304	R	47.4	Very low	44.1	Very low	232 Å²	232	139.3 Å²	139.3	88%	0.875	79%	0.792	S	S	*	*			trans	92.6	123.5	160.8	-57	-174	174.3	-117.4	-5.5	117.7
305	P	38.5	Very low	45.8	Very low	126 Å²	126	135.8 Å²	135.8	82%	0.818	79%	0.788	S	S	*	*			trans	-101.3	147.9	173.4	37.7	-32	0	0	0	113.4
306	V	50.1	Low	46.7	Very low	150 Å²	150	134.4 Å²	134.4	91%	0.909	78%	0.782	S	S	*	*			trans	-139.3	154.2	165	-174.7	0	0	0	0	108.9
307	K	39.3	Very low	47.2	Very low	190 Å²	190	134.2 Å²	134.2	83%	0.826	78%	0.781	S	S	*	*			trans	-153.6	156.5	-168.9	-176.6	-172.2	-178.2	-170.9	0	108.8
308	P	42	Very low	47.4	Very low	109 Å²	109	139 Å²	139	71%	0.708	79%	0.79	S	S	*	*			cis	-118.2	-175.6	-38.5	38.9	-24.8	0	0	0	111.1
309	T	42.5	Very low	47.4	Very low	135 Å²	135	135.5 Å²	135.5	83%	0.828	78%	0.778	S	S	*	*			trans	-162.4	153.4	147.6	-82.3	0	0	0	0	110.2
310	V	39.9	Very low	48	Very low	137 Å²	137	137.3 Å²	137.3	83%	0.83	78%	0.779	S	S	*	*			trans	-101.7	124	-178.3	175.6	0	0	0	0	110.8
311	V	51.4	Low	49	Very low	135 Å²	135	133.9 Å²	133.9	82%	0.818	77%	0.773	S	S	*	*			trans	-146.6	138.9	155.9	-174.9	0	0	0	0	108
312	A	50.3	Low	49.9	Very low	82 Å²	82	132.1 Å²	132.1	68%	0.678	77%	0.773	S	S	*	*			trans	-106	141.1	171.2	0	0	0	0	0	110.3
313	P	66.5	Low	50.2	Low	123 Å²	123	134.7 Å²	134.7	80%	0.799	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-77.9	142.8	176.9	31.6	-33.9	0	0	0	111.8
314	P	62.5	Low	50	Low	112 Å²	112	132.1 Å²	132.1	73%	0.727	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-77.8	160.5	175.1	33	-35.6	0	0	0	112.5
315	P	64.9	Low	49.8	Very low	118 Å²	118	132.7 Å²	132.7	77%	0.766	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-70.6	148.3	176.2	30	-35.3	0	0	0	112.4
316	P	61.6	Low	50.3	Low	105 Å²	105	131 Å²	131	68%	0.682	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-73.8	132.1	179.3	30.1	-34.4	0	0	0	112.1	F318	P316-F318 HydrophobicContact CB-CD2 4.3Å; P316-F318 HydrophobicContact CB-CE2 3.99Å; P316-F318 HydrophobicContact CG-CE2 4.21Å
317	N	43.4	Very low	50	Low	138 Å²	138	129.6 Å²	129.6	74%	0.738	78%	0.776	S	S	*	*			trans	-92.2	105.7	178.7	-177	-9.7	0	0	0	110.7	S319	N317-S319 PolarHBondContact O-N 2.81Å; N317-S319 PolarHBondContact OD1-OG 3.18Å
318	F	44.4	Very low	50.4	Low	194 Å²	194	128.6 Å²	128.6	85%	0.851	78%	0.777	S	S	*	*			trans	-96.9	77.7	175.3	-81	-82	0	0	0	111.6	P316	P316-F318 HydrophobicContact CB-CD2 4.3Å; P316-F318 HydrophobicContact CB-CE2 3.99Å; P316-F318 HydrophobicContact CG-CE2 4.21Å
319	S	43	Very low	50.6	Low	85 Å²	85	131.4 Å²	131.4	59%	0.594	78%	0.781	S	S	*	*			trans	-103.5	158.1	158.6	-60.7	0	0	0	0	109.4	N317	N317-S319 PolarHBondContact O-N 2.81Å; N317-S319 PolarHBondContact OD1-OG 3.18Å
320	I	52.9	Low	50.7	Low	162 Å²	162	130.3 Å²	130.3	83%	0.831	78%	0.776	S	S	*	*			trans	82.2	96.8	-178.2	-48	160.2	0	0	0	114.9
321	P	65.5	Low	50.8	Low	113 Å²	113	128.5 Å²	128.5	73%	0.734	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-89.2	145.5	157.5	34.9	-31	0	0	0	111.6
322	P	59.1	Low	50.5	Low	125 Å²	125	128.3 Å²	128.3	81%	0.812	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-79.5	155	173.2	32.6	-34.1	0	0	0	112.3
323	P	45.1	Very low	50	Low	135 Å²	135	128.9 Å²	128.9	88%	0.877	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-101.2	151.6	-162.8	2.3	19.7	0	0	0	114.7
324	G	40.4	Very low	49	Very low	68 Å²	68	130 Å²	130	70%	0.701	78%	0.776	S	S	*	*			trans	119.3	96.8	146.7	0	0	0	0	0	117.5
325	Y	43.2	Very low	47.8	Very low	245 Å²	245	132.6 Å²	132.6	96%	0.961	78%	0.778	S	S	*	*			trans	-152	137.3	132.4	-112.2	-78.7	0	0	0	108.4
326	A	49.2	Very low	46.5	Very low	90 Å²	90	132.6 Å²	132.6	74%	0.744	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-95.7	144.3	-166.9	0	0	0	0	0	113.4
327	P	42.5	Very low	45.6	Very low	121 Å²	121	136.1 Å²	136.1	79%	0.786	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-82	147.4	173.6	33.8	-34.2	0	0	0	112.1
328	I	48.8	Very low	45.4	Very low	168 Å²	168	140.2 Å²	140.2	86%	0.862	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-103.7	135.2	172.7	-61.7	173.4	0	0	0	109.6
329	Q	45.2	Very low	45.4	Very low	168 Å²	168	137.5 Å²	137.5	79%	0.785	78%	0.782	S	S	*	*			trans	-135.6	-178.8	161.6	-54.8	-172.6	5.8	0	0	106.5
330	P	45.7	Very low	45.8	Very low	112 Å²	112	139.5 Å²	139.5	73%	0.727	79%	0.793	S	S	*	*			cis	-121.5	-146.3	-7.3	34.3	-10	0	0	0	108.3
331	P	41.9	Very low	45.6	Very low	99 Å²	99	139.6 Å²	139.6	64%	0.643	79%	0.79	S	S	*	*			cis	-140.9	155.7	-3.3	42.6	-23.6	0	0	0	119.3
332	T	43.3	Very low	45.1	Very low	131 Å²	131	138.4 Å²	138.4	80%	0.804	79%	0.79	S	S	*	*			trans	53.9	129.9	140.3	59.9	0	0	0	0	123.3
333	A	41.4	Very low	44.7	Very low	94 Å²	94	142.3 Å²	142.3	78%	0.777	79%	0.79	S	S	*	*			trans	74	98.5	139.5	0	0	0	0	0	120.2
334	V	45	Very low	45.7	Very low	147 Å²	147	141 Å²	141	89%	0.891	78%	0.775	S	S	*	*				-149.3	148.7	108	-95.6	0	0	0	0	110.4
335	E	36.3	Very low	47.1	Very low	166 Å²	166	142.2 Å²	142.2	78%	0.776	77%	0.771	S	S	*	*			trans	-70.6	133.7	-178.3	-170.6	77.6	-177.6	0	0	111.3
336	S	39.5	Very low	47.5	Very low	119 Å²	119	138.6 Å²	138.6	83%	0.832	76%	0.763	S	S	*	*			trans	-157.4	92.4	167.1	-80.1	0	0	0	0	111.4
337	K	41.1	Very low	47.6	Very low	178 Å²	178	139 Å²	139	77%	0.774	76%	0.76	S	S	*	*			trans	-86	117.6	-176.6	-178.6	177.4	-179.4	176.7	0	110.9
338	Y	40.5	Very low	47.6	Very low	224 Å²	224	139 Å²	139	88%	0.878	76%	0.76	S	S	*	*			trans	-132.8	120.3	172.2	-148.6	-90.2	0	0	0	110.2
339	Q	44.9	Very low	47.1	Very low	137 Å²	137	136.4 Å²	136.4	64%	0.64	76%	0.757	S	S	*	*			trans	-97.3	154.8	170	-99.6	-175	-60.2	0	0	110.1	E341	Q339-E341 PolarHBondContact O-N 3.46Å
340	P	50.5	Low	47	Very low	127 Å²	127	136.3 Å²	136.3	83%	0.825	76%	0.761	S	S	*	*			trans	-77.1	87.2	175.3	32.3	-33.4	0	0	0	110.3
341	E	49	Very low	46.7	Very low	165 Å²	165	136.9 Å²	136.9	77%	0.771	76%	0.763	S	S	*	*			trans	-70.9	148.9	174.5	-82.7	-62.8	166.1	0	0	112.9	Q339	Q339-E341 PolarHBondContact O-N 3.46Å
342	A	54.4	Low	46.5	Very low	87 Å²	87	137.3 Å²	137.3	72%	0.719	77%	0.768	S	S	*	*			trans	-78.4	150	-171.7	0	0	0	0	0	113.3	N344	A342-N344 PolarHBondContact O-N 3.32Å; A342-N344 VanDerWaalsContact O-N 3.15Å
343	Y	50.2	Low	46.5	Very low	208 Å²	208	135.8 Å²	135.8	82%	0.816	77%	0.768	S	S	*	*			trans	-65.2	110.5	-180	176.9	-99.8	0	0	0	112.3	P345	Y343-P345 HydrophobicContact CE1-CB 4.03Å
344	N	67.4	Low	46.7	Very low	106 Å²	106	137 Å²	137	57%	0.567	77%	0.768	S	S	*	*			trans	-98.8	120.8	170.5	-179.9	-3.6	0	0	0	110	A342 E346	A342-N344 PolarHBondContact O-N 3.32Å; A342-N344 VanDerWaalsContact O-N 3.15Å; N344-E346 PolarHBondContact O-N 3.43Å; N344-E346 PolarHBondContact OD1-N 3.06Å; N344-E346 VanDerWaalsContact OD1-N 3.16Å
345	P	69.5	Low	46.5	Very low	95 Å²	95	136 Å²	136	62%	0.617	77%	0.765	S	S	*	*			trans	-80.5	-4.6	-175.4	31.8	-36	0	0	0	115.9	Y343 S347	Y343-P345 HydrophobicContact CE1-CB 4.03Å; P345-S347 PolarHBondContact O-N 3.22Å
346	E	52	Low	47.2	Very low	169 Å²	169	135 Å²	135	79%	0.79	77%	0.77	S	S	*	*			trans	-93.8	14.5	-162.3	-59.3	-155.8	120.3	0	0	117.4	N344	N344-E346 PolarHBondContact O-N 3.43Å; N344-E346 PolarHBondContact OD1-N 3.06Å; N344-E346 VanDerWaalsContact OD1-N 3.16Å
347	S	51.2	Low	47.5	Very low	98 Å²	98	139.5 Å²	139.5	69%	0.685	77%	0.774	S	S	*	*			trans	-132.2	89.9	-176.6	63.2	0	0	0	0	115.7	P345	P345-S347 PolarHBondContact O-N 3.22Å
348	P	41.3	Very low	47.7	Very low	122 Å²	122	135 Å²	135	79%	0.792	78%	0.778	S	S	*	*			trans	-98	102.7	178.4	34.6	-31	0	0	0	113.9
349	S	38.6	Very low	47.8	Very low	113 Å²	113	129.2 Å²	129.2	79%	0.79	78%	0.777	S	S	*	*			trans	-176.5	150	168.5	-87.7	0	0	0	0	108.7
350	L	43.6	Very low	48	Very low	165 Å²	165	130 Å²	130	86%	0.864	79%	0.791	S	S	*	*			cis	-141.8	148.2	15.5	-62.5	162.5	0	0	0	110.7
351	T	40.1	Very low	47.7	Very low	125 Å²	125	128 Å²	128	77%	0.767	79%	0.785	S	S	*	*			trans	-163.5	126.1	131.1	-167.4	0	0	0	0	113.9
352	S	36.2	Very low	47.3	Very low	108 Å²	108	128 Å²	128	76%	0.755	79%	0.787	S	S	*	*			trans	63.5	141.9	147.5	-54.8	0	0	0	0	123.6
353	A	44.1	Very low	47	Very low	98 Å²	98	129.8 Å²	129.8	81%	0.81	79%	0.791	S	S	*	*			trans	87.2	156.1	164.2	0	0	0	0	0	116.8
354	P	45.1	Very low	46.5	Very low	120 Å²	120	123.9 Å²	123.9	78%	0.779	79%	0.786	S	S	*	*				-114.9	168.7	-111.6	6.9	17.5	0	0	0	115.6
355	P	40.1	Very low	45.6	Very low	126 Å²	126	130 Å²	130	82%	0.818	80%	0.803	S	S	*	*			trans	-88.4	143.7	-163.7	34	-36.3	0	0	0	115.7
356	V	51.4	Low	44.8	Very low	145 Å²	145	131.4 Å²	131.4	88%	0.879	81%	0.814	S	S	*	*			trans	-128.2	142	161.6	-179.1	0	0	0	0	108.7
357	K	46.7	Very low	45	Very low	213 Å²	213	132.2 Å²	132.2	93%	0.926	82%	0.818	S	S	*	*			trans	-90.6	133.8	-172.6	-61.2	174.2	-178.8	176.2	0	111.8
358	G	43.9	Very low	45.6	Very low	83 Å²	83	133.1 Å²	133.1	86%	0.856	82%	0.822	S	S	*	*			trans	-177.1	126.2	168.5	0	0	0	0	0	110.4
359	A	44.3	Very low	46.8	Very low	103 Å²	103	132.8 Å²	132.8	85%	0.851	82%	0.82	S	S	*	*			trans	-119.1	149.8	-172.6	0	0	0	0	0	112.4
360	V	49.3	Very low	47.7	Very low	154 Å²	154	133.5 Å²	133.5	93%	0.933	82%	0.822	S	S	*	*			trans	-171.8	153.2	148	140.6	0	0	0	0	106.5
361	A	43.6	Very low	48.7	Very low	85 Å²	85	133.8 Å²	133.8	70%	0.702	82%	0.822	S	S	*	*			trans	-137.2	138.4	-158.1	0	0	0	0	0	115.5
362	M	39.6	Very low	48.8	Very low	165 Å²	165	135.2 Å²	135.2	81%	0.813	82%	0.824	S	S	*	*			trans	62.9	167.6	143.1	-62.2	-52	-82.2	0	0	118.3
363	P	48.7	Very low	49.1	Very low	124 Å²	124	142 Å²	142	81%	0.805	83%	0.833	S	S	*	*			cis	-123.4	-168.1	7.1	42.7	-26.4	0	0	0	115.7
364	A	40.4	Very low	49.6	Very low	85 Å²	85	142.8 Å²	142.8	70%	0.702	83%	0.833	S	S	*	*			trans	-88.6	165.8	-164.5	0	0	0	0	0	116.1
365	Y	48.1	Very low	50	Low	235 Å²	235	145.9 Å²	145.9	92%	0.922	84%	0.837	S	S	*	*			trans	-129.4	139.8	163.8	-103.9	-100.8	0	0	0	109.6
366	S	52.8	Low	50.9	Low	123 Å²	123	145.4 Å²	145.4	86%	0.86	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-83.3	144.8	-174.3	-52.7	0	0	0	0	113.5
367	Q	55.9	Low	52	Low	187 Å²	187	144 Å²	144	87%	0.874	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-93.1	149.3	168.4	-70.9	-178.2	-18	0	0	111.7
368	P	63.3	Low	52.8	Low	116 Å²	116	139.4 Å²	139.4	75%	0.753	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-85.2	156.8	172.3	35	-34.5	0	0	0	112.7
369	P	66.3	Low	53.2	Low	116 Å²	116	141.5 Å²	141.5	75%	0.753	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-76.4	161	-177.8	31.8	-36.6	0	0	0	114
370	P	59.1	Low	53.6	Low	128 Å²	128	143.4 Å²	143.4	83%	0.831	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-73.4	155.9	-179.9	30.9	-36.2	0	0	0	113.6
371	I	62.9	Low	53.3	Low	171 Å²	171	142.1 Å²	142.1	88%	0.877	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-85.1	121.9	-178.7	-60.7	171.2	0	0	0	110.2
372	L	44.1	Very low	53.4	Low	154 Å²	154	146.3 Å²	146.3	81%	0.806	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-77.1	139.9	174.1	-173.1	66.9	0	0	0	111.3
373	W	42.7	Very low	53.5	Low	251 Å²	251	147.8 Å²	147.8	95%	0.951	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-70.6	126.4	170.7	-76.6	-42.2	0	0	0	111.5
374	S	53	Low	53.2	Low	115 Å²	115	150.5 Å²	150.5	80%	0.804	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-98.5	140.3	170.1	-65.6	0	0	0	0	111.4
375	Q	54.1	Low	53.3	Low	184 Å²	184	149.9 Å²	149.9	86%	0.86	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-69.2	156	-179.1	-69	178.1	-24.2	0	0	113.6
376	P	59.7	Low	53	Low	116 Å²	116	144.4 Å²	144.4	75%	0.753	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-75.7	143.4	160.6	33.2	-33.4	0	0	0	111.3
377	P	72.5	Confident	52.6	Low	117 Å²	117	147 Å²	147	76%	0.76	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-79.6	150.7	176.6	32.2	-35	0	0	0	112.9
378	P	65.6	Low	52.1	Low	116 Å²	116	146 Å²	146	75%	0.753	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-80	157.9	176.6	33.4	-35.8	0	0	0	113.2
379	P	51.1	Low	51	Low	127 Å²	127	145.3 Å²	145.3	83%	0.825	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-90.1	148.4	-179.4	35.5	-34.6	0	0	0	113.6
380	T	51.9	Low	49.7	Very low	142 Å²	142	150 Å²	150	87%	0.871	81%	0.813	S	S	*	*			trans	-134.5	147.7	170.6	-57.8	0	0	0	0	111.2
381	V	44.8	Very low	48.6	Very low	127 Å²	127	149.5 Å²	149.5	77%	0.77	81%	0.812	S	S	*	*			trans	-83	137.6	-162.7	-160.7	0	0	0	0	113.9
382	L	44.1	Very low	47.6	Very low	174 Å²	174	149.8 Å²	149.8	91%	0.911	81%	0.812	S	S	*	*			trans	-137.6	169.9	150.6	-79.7	-175.6	0	0	0	110.7
383	R	42.6	Very low	47.2	Very low	195 Å²	195	150.6 Å²	150.6	74%	0.736	81%	0.811	S	S	*	*			trans	-139.2	149.7	-142.4	-170.8	-175.8	177.1	-162.6	0.1	113.3
384	F	41.6	Very low	47.1	Very low	182 Å²	182	147.7 Å²	147.7	80%	0.798	81%	0.809	S	S	*	*			trans	68.8	144.6	-179.5	-44	-77.2	0	0	0	114.5
385	G	43.1	Very low	46.4	Very low	71 Å²	71	147.3 Å²	147.3	73%	0.732	81%	0.806	S	S	*	*			cis	-165.3	162.8	-7.4	0	0	0	0	0	110.5
386	P	41.9	Very low	45.8	Very low	120 Å²	120	144.6 Å²	144.6	78%	0.779	80%	0.801	S	S	*	*			trans	-102.5	147.3	-161.5	37.1	-34	0	0	0	116
387	M	44	Very low	44.9	Very low	177 Å²	177	147.9 Å²	147.9	87%	0.872	80%	0.804	S	S	*	*			trans	-156.1	168	153.4	-104.8	-50	110.4	0	0	113.5
388	H	45.9	Very low	43.3	Very low	166 Å²	166	151.6 Å²	151.6	77%	0.769	81%	0.814	S	S	*	*			trans	-68.4	160.5	-163.7	-108.5	-121.3	0	0	0	117.7
389	P	39.2	Very low	42.2	Very low	103 Å²	103	149.6 Å²	149.6	67%	0.669	81%	0.814	S	S	*	*			trans	-88.3	155.1	174.4	36.6	-35.3	0	0	0	113.8
390	F	40.5	Very low	41.5	Very low	215 Å²	215	151 Å²	151	94%	0.943	82%	0.82	S	S	*	*			trans	-145.9	171.3	164.2	-102.8	-80.5	0	0	0	111.7
391	S	35.8	Very low	40.9	Very low	117 Å²	117	147.7 Å²	147.7	82%	0.818	81%	0.814	S	S	*	*			trans	-85.3	170.4	-167.4	-166.3	0	0	0	0	115.1
392	M	41.6	Very low	40.8	Very low	177 Å²	177	150.6 Å²	150.6	87%	0.872	82%	0.819	S	S	*	*			trans	126.5	152.5	144.2	-156.9	162.3	-171.8	0	0	117
393	E	36	Very low	40.6	Very low	170 Å²	170	151 Å²	151	79%	0.794	82%	0.816	S	S	*	*			trans	-88.9	150.7	-167.2	-62.7	151.5	56.1	0	0	115.6
394	Q	40	Very low	40.3	Very low	191 Å²	191	146.2 Å²	146.2	89%	0.893	81%	0.813	S	S	*	*			trans	-163.9	137.5	149.1	-105.2	156.1	69.3	0	0	108
395	S	37.7	Very low	40.2	Very low	107 Å²	107	143.4 Å²	143.4	75%	0.748	81%	0.811	S	S	*	*			cis	99.5	92.3	20.9	-167.9	0	0	0	0	115.2
396	V	42.6	Very low	39.8	Very low	126 Å²	126	149.3 Å²	149.3	76%	0.764	82%	0.819	S	S	*	*			trans	-170.1	148.9	163.8	-91.5	0	0	0	0	108.6
397	K	40.2	Very low	39.6	Very low	186 Å²	186	147 Å²	147	81%	0.809	82%	0.818	S	S	*	*			cis	-165.7	-173.3	-17.9	-120.2	172.4	-170.7	170	0	108.5
398	M	38.4	Very low	39.3	Very low	195 Å²	195	145.3 Å²	145.3	96%	0.961	82%	0.817	S	S	*	*			trans	82.5	138.4	175.8	-45.5	-84.4	-88.9	0	0	114.7
399	G	42.5	Very low	38.8	Very low	74 Å²	74	145 Å²	145	76%	0.763	82%	0.815	S	S	*	*			cis	-165.6	161.7	-2.5	0	0	0	0	0	114.3
400	V	37.5	Very low	39	Very low	156 Å²	156	144.9 Å²	144.9	95%	0.945	81%	0.813	S	S	*	*			trans	-53.3	147.9	-168.5	175.5	0	0	0	0	118.1
401	G	39.7	Very low	39.1	Very low	73 Å²	73	142.8 Å²	142.8	75%	0.753	80%	0.803	S	S	*	*			trans	178.9	133.8	157.4	0	0	0	0	0	114
402	Q	41	Very low	39.1	Very low	187 Å²	187	143.3 Å²	143.3	87%	0.874	80%	0.804	S	S	*	*			trans	-131.1	164.6	-178.7	-69.8	-176.6	-68.8	0	0	113
403	Q	41.1	Very low	39	Very low	183 Å²	183	143.4 Å²	143.4	86%	0.855	81%	0.805	S	S	*	*			trans	118.5	115.5	169.3	-69.1	170.4	18.9	0	0	111.5
404	S	36.8	Very low	39	Very low	94 Å²	94	139 Å²	139	66%	0.657	80%	0.804	S	S	*	*				67.8	130.5	64	73	0	0	0	0	113.5
405	T	38.2	Very low	38.8	Very low	124 Å²	124	135.4 Å²	135.4	76%	0.761	81%	0.808	S	S	*	*			cis	-164.9	179.7	-2.6	13.4	0	0	0	0	108.5
406	E	36	Very low	38.6	Very low	194 Å²	194	134.4 Å²	134.4	91%	0.907	81%	0.814	S	S	*	*			trans	73.3	151.6	166	-41.9	-169.9	146.5	0	0	117.5
407	G	36.2	Very low	38.2	Very low	73 Å²	73	131.8 Å²	131.8	75%	0.753	81%	0.813	S	S	*	*			cis	171.2	32.1	-4.6	0	0	0	0	0	119.8
408	V	38.5	Very low	38.2	Very low	141 Å²	141	131.7 Å²	131.7	86%	0.855	82%	0.82	S	S	*	*			trans	-143.3	128.6	-179.4	-173.1	0	0	0	0	109.5
409	H	35.2	Very low	37.9	Very low	158 Å²	158	133.5 Å²	133.5	73%	0.731	82%	0.816	S	S	*	*			cis	113.4	128.2	23.2	-173.4	73.8	0	0	0	111.7
410	V	43.3	Very low	37.8	Very low	102 Å²	102	138.4 Å²	138.4	62%	0.618	82%	0.821	S	S	*	*			trans	58.6	148	175.4	-70.1	0	0	0	0	119.2
411	K	42	Very low	38	Very low	171 Å²	171	137 Å²	137	74%	0.743	82%	0.815	S	S	*	*			cis	-157.5	138.6	6.2	-125.6	154.9	-165.6	169.7	0	110.7
412	P	36.3	Very low	37.7	Very low	128 Å²	128	136.9 Å²	136.9	83%	0.831	81%	0.814	S	S	*	*			trans	-114.1	111	165.8	34.5	-23.7	0	0	0	112.6
413	M	40.1	Very low	37.8	Very low	179 Å²	179	133.8 Å²	133.8	88%	0.882	81%	0.808	S	S	*	*			trans	-149.6	145.3	170.1	-60.1	-178.2	80.2	0	0	109
414	G	35	Very low	37.8	Very low	76 Å²	76	134.2 Å²	134.2	78%	0.784	81%	0.81	S	S	*	*			cis	-169.2	167.5	-4.1	0	0	0	0	0	111
415	A	36.9	Very low	37.8	Very low	117 Å²	117	133.4 Å²	133.4	97%	0.967	82%	0.816	S	S	*	*			trans	-84.2	153.3	179.6	0	0	0	0	0	112.4
416	G	34.2	Very low	38	Very low	85 Å²	85	132.3 Å²	132.3	88%	0.876	81%	0.814	S	S	*	*			trans	178.1	104	173.4	0	0	0	0	0	113.2
417	G	33.2	Very low	38	Very low	72 Å²	72	128.4 Å²	128.4	74%	0.742	81%	0.808	S	S	*	*			trans	-134	136.1	172.3	0	0	0	0	0	111
418	L	39.9	Very low	38.5	Very low	183 Å²	183	134.7 Å²	134.7	96%	0.958	81%	0.811	S	S	*	*			trans	-139.5	163.8	174.4	-74.2	178.9	0	0	0	110.9
419	R	32.9	Very low	38.4	Very low	234 Å²	234	131.9 Å²	131.9	88%	0.883	81%	0.81	S	S	*	*			trans	-121.3	139.1	-166.4	-69.7	176.3	167.1	-169.1	-1.9	113
420	M	39.8	Very low	38.6	Very low	177 Å²	177	129.6 Å²	129.6	87%	0.872	81%	0.811	S	S	*	*			trans	59.9	-174	137.9	-63.2	-62.5	-171.7	0	0	116.2
421	P	41.4	Very low	38.5	Very low	125 Å²	125	136.1 Å²	136.1	81%	0.812	83%	0.825	S	S	*	*			cis	-130.9	-179	-6.7	42.9	-26.8	0	0	0	116.4
422	G	34.3	Very low	38.4	Very low	71 Å²	71	137.5 Å²	137.5	73%	0.732	83%	0.831	S	S	*	*			trans	98	152.9	161.7	0	0	0	0	0	116.3
423	T	43	Very low	38.9	Very low	122 Å²	122	142 Å²	142	75%	0.748	83%	0.832	S	S	*	*			cis	-157	132.6	-0.2	-64	0	0	0	0	111.1
424	Q	41.2	Very low	39	Very low	192 Å²	192	139.2 Å²	139.2	90%	0.897	83%	0.827	S	S	*	*			trans	43.5	139.8	155.7	-60.2	167.4	8.8	0	0	122.9
425	G	37.1	Very low	39.2	Very low	77 Å²	77	141.8 Å²	141.8	79%	0.794	83%	0.827	S	S	*	*			trans	164.4	123	162.4	0	0	0	0	0	114.7
426	S	41.4	Very low	39.3	Very low	101 Å²	101	147.9 Å²	147.9	71%	0.706	83%	0.825	S	S	*	*			trans	-61.4	144.6	-177	-60.9	0	0	0	0	113.7
427	S	36.4	Very low	39.7	Very low	112 Å²	112	147.2 Å²	147.2	78%	0.783	81%	0.806	S	S	*	*			cis	95.9	63.8	25.8	-169	0	0	0	0	116.2
428	Y	46.7	Very low	39.9	Very low	206 Å²	206	151.8 Å²	151.8	81%	0.808	81%	0.814	S	S	*	*			trans	-146.1	146.6	155.4	3.8	-96.1	0	0	0	113.4	S430	Y428-S430 PolarHBondContact O-N 3.49Å
429	G	35.8	Very low	39.8	Very low	81 Å²	81	149.3 Å²	149.3	84%	0.835	80%	0.801	S	S	*	*			trans	76.2	-18.4	146.3	0	0	0	0	0	121.2	R431	G429-R431 PolarHBondContact O-N 2.93Å
430	S	40	Very low	40.2	Very low	110 Å²	110	147.3 Å²	147.3	77%	0.769	80%	0.801	S	S	*	*			trans	-70.2	89.2	-172	-79.8	0	0	0	0	114.8	Y428 K432	Y428-S430 PolarHBondContact O-N 3.49Å; S430-K432 PolarHBondContact O-N 3.23Å
431	R	41.3	Very low	40.3	Very low	239 Å²	239	143.1 Å²	143.1	90%	0.902	79%	0.794	S	S	*	*			trans	-63.6	94.7	164.1	-65.7	-170.8	-169	-171.2	5.3	109.6	G429 R433	G429-R431 PolarHBondContact O-N 2.93Å; R431-R433 PolarHBondContact O-N 3.31Å
432	K	40.6	Very low	40.7	Very low	200 Å²	200	142.7 Å²	142.7	87%	0.87	78%	0.783	S	S	*	*			trans	-61.2	91.5	173.7	-69.8	-176.9	179.1	178.8	0	110.4	S430	S430-K432 PolarHBondContact O-N 3.23Å
433	R	46.6	Very low	41.5	Very low	224 Å²	224	144.4 Å²	144.4	85%	0.845	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-58.9	132.4	160.5	-67.5	-175.5	177.3	-164.2	-1.2	107.1	R431 V435	R431-R433 PolarHBondContact O-N 3.31Å; R433-V435 PolarHBondContact O-N 3.21Å; R433-V435 VanDerWaalsContact O-N 3.14Å
434	P	41.9	Very low	42	Very low	120 Å²	120	145.3 Å²	145.3	78%	0.779	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-60.9	122	172.5	25.7	-32.5	0	0	0	108	R436	P434-R436 PolarHBondContact O-N 2.81Å
435	V	38.2	Very low	42.9	Very low	129 Å²	129	137.7 Å²	137.7	78%	0.782	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-59.4	122.7	166.5	176.3	0	0	0	0	106	R433 S437	R433-V435 PolarHBondContact O-N 3.21Å; R433-V435 VanDerWaalsContact O-N 3.14Å; V435-S437 PolarHBondContact O-N 3.29Å
436	R	38.7	Very low	44.4	Very low	246 Å²	246	141.1 Å²	141.1	93%	0.928	74%	0.738	S	S	*	*			trans	-70.4	80.3	167.6	-86	-175.9	167.6	173.8	-4.7	107.8	P434	P434-R436 PolarHBondContact O-N 2.81Å
437	S	42.7	Very low	46.3	Very low	70 Å²	70	144.6 Å²	144.6	49%	0.49	74%	0.74	S	S	.	*			trans	-67.4	155.1	162.6	43.6	0	0	0	0	109.9	V435 I439	V435-S437 PolarHBondContact O-N 3.29Å; S437-I439 PolarHBondContact O-N 3.47Å
438	D	37.1	Very low	48.7	Very low	168 Å²	168	140.9 Å²	140.9	90%	0.898	71%	0.712	S	S	*	*			trans	-71.9	82.8	-171.6	-53.1	-90	0	0	0	112.1
439	I	39.7	Very low	50.8	Low	132 Å²	132	137 Å²	137	68%	0.677	70%	0.696	S	S	*	*			trans	-122.6	71.6	-177.8	-48.1	-180	0	0	0	110.6	S437	S437-I439 PolarHBondContact O-N 3.47Å
440	Q	39.5	Very low	53.5	Low	192 Å²	192	134.9 Å²	134.9	90%	0.897	67%	0.666	S	S	*	*			trans	-118.7	40	151.1	-75.5	-167.6	-16.9	0	0	110.9	M442	Q440-M442 PolarHBondContact O-N 3.12Å
441	A	43.2	Very low	56	Low	88 Å²	88	129.6 Å²	129.6	73%	0.727	63%	0.63	S	S	*	*			trans	-71.5	91.7	166.2	0	0	0	0	0	109.5
442	M	49	Very low	58.4	Low	116 Å²	116	119.1 Å²	119.1	57%	0.571	59%	0.591	S	S	*	*			trans	-49.5	130.4	176.1	-124.6	73.1	169.6	0	0	110.5	Q440 Y444 G445	Q440-M442 PolarHBondContact O-N 3.12Å; M442-Y444 HydrophobicContact CG-CD2 4.32Å; M442-Y444 PolarHBondContact O-N 3.22Å; M442-G445 PolarHBondContact O-N 3.13Å
443	P	52.7	Low	60.8	Low	107 Å²	107	109.6 Å²	109.6	70%	0.695	55%	0.55	S	S	*	.	G	3₁₀ helix	trans	-61.1	-26.9	-168.4	21.2	-33	0	0	0	114.2	G445	P443-G445 PolarHBondContact O-N 3.48Å
444	Y	53	Low	62.9	Low	142 Å²	142	101 Å²	101	56%	0.557	52%	0.517	S	S	*	.	G	3₁₀ helix	trans	-60.3	-25.4	176.5	-53.5	-75.1	0	0	0	114.1	M442 K446 N448	M442-Y444 HydrophobicContact CG-CD2 4.32Å; M442-Y444 PolarHBondContact O-N 3.22Å; Y444-K446 PolarHBondContact O-N 3.33Å; Y444-N448 PolarHBondContact O-OD1 2.9Å
445	G	60	Low	64.9	Low	31 Å²	31	101.3 Å²	101.3	32%	0.32	50%	0.503	S	S	.	.	G	3₁₀ helix	trans	-64.1	-4.9	-171	0	0	0	0	0	116.7	M442 P443 R508	M442-G445 PolarHBondContact O-N 3.13Å; P443-G445 PolarHBondContact O-N 3.48Å; G445-R508 VanDerWaalsContact O-CZ 3.29Å; G445-R508 PolarHBondContact O-NE 3Å; G445-R508 PolarHBondContact O-NH2 3.45Å
446	K	68.7	Low	67.3	Low	149 Å²	149	95.2 Å²	95.2	65%	0.648	47%	0.466	S	S	*	.	G	3₁₀ helix	trans	-85.4	-27.6	-176.8	-72.3	-173.2	178.9	179.9	0	115.4	Y444 R508	Y444-K446 PolarHBondContact O-N 3.33Å; K446-R508 WeakPolarHBondContact O-CD 3.44Å; K446-R508 PolarHBondContact O-NE 3.24Å; K446-R508 PolarHBondContact O-NH1 3.36Å; K446-R508 VanDerWaalsContact O-NH1 3.12Å
447	F	80.7	Confident	69.4	Low	175 Å²	175	85.7 Å²	85.7	77%	0.768	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-127.4	-11.8	-175.3	-61.9	-69.5	0	0	0	114.5	R449	F447-R449 PolarHBondContact O-N 2.87Å
448	N	85.9	Confident	71.3	Confident	34 Å²	34	86.3 Å²	86.3	18%	0.182	44%	0.436	C	S	.	.			trans	-55.5	130.4	176.9	-69.1	17.8	0	0	0	111.1	Y444 W531 H532	Y444-N448 PolarHBondContact O-OD1 2.9Å; N448-W531 HydrophobicContact CB-CE3 3.97Å; N448-W531 HydrophobicContact CB-CZ3 4.32Å; N448-W531 VanDerWaalsContact O-CZ3 3.27Å; N448-W531 WeakPolarHBondContact O-CZ3 3.29Å; N448-H532 PolarHBondContact ND2-O 3.31Å
449	R	91.3	Very high	73.5	Confident	124 Å²	124	82.9 Å²	82.9	47%	0.468	42%	0.423	S	S	.	.			trans	-110	5.5	170	-63.6	179.7	-76.2	172.1	-1	111.6	F447 T504 Y505 A506 R508	F447-R449 PolarHBondContact O-N 2.87Å; R449-T504 HydrophobicContact CB-CG2 4.46Å; R449-T504 WeakPolarHBondContact O-CA 3.38Å; R449-Y505 PolarHBondContact O-N 2.91Å; R449-A506 VanDerWaalsContact CD-O 3.25Å; R449-A506 WeakPolarHBondContact CD-O 3.49Å; R449-A506 PolarHBondContact NH1-O 3.45Å; R449-R508 HydrophobicContact CG-CB 4.17Å
450	T	92.9	Very high	75.6	Confident	36 Å²	36	78.8 Å²	78.8	22%	0.221	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	120	-169	40.7	0	0	0	0	110.6	I503 T504 H532	T450-I503 WeakPolarHBondContact CA-O 3.37Å; T450-T504 HydrophobicContact CG2-CG2 3.9Å; T450-H532 PolarHBondContact O-N 3.35Å
451	L	92.7	Very high	77.7	Confident	0 Å²	0	69.7 Å²	69.7	0%	0	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	143.1	172.6	-56.9	-176.3	0	0	0	109.8	L502 I503 Y505 A514 Y515 V529 F530 W531	L451-L502 WeakPolarHBondContact O-CA 3.19Å; L451-I503 PolarHBondContact N-O 3.08Å; L451-I503 PolarHBondContact O-N 2.99Å; L451-Y505 HydrophobicContact CD1-CE2 3.86Å; L451-Y505 HydrophobicContact CG-CE2 4.32Å; L451-A514 HydrophobicContact CD1-CB 3.83Å; L451-Y515 HydrophobicContact CD2-CD2 4.21Å; L451-V529 HydrophobicContact CB-CG1 3.95Å; L451-V529 HydrophobicContact CD1-CG1 3.87Å; L451-V529 HydrophobicContact CG-CG1 4.33Å; L451-F530 CarbonylContact C-O 3.57Å; L451-F530 WeakPolarHBondContact CA-O 3.35Å; L451-W531 HydrophobicContact CD2-CD2 3.87Å; L451-W531 HydrophobicContact CD2-CE3 3.62Å; L451-W531 HydrophobicContact CD2-CH2 3.85Å; L451-W531 HydrophobicContact CD2-CZ2 4.08Å; L451-W531 HydrophobicContact CD2-CZ3 3.61Å
452	E	91.6	Very high	79.9	Confident	19 Å²	19	68.2 Å²	68.2	9%	0.089	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	111	174.5	-177.1	175.2	146.3	0	0	108.6	R454 L502 F530 H532	E452-R454 HydrophobicContact CG-CG 4.3Å; E452-R454 IonicContact OE1-CZ 2.67Å; E452-R454 IonicContact OE1-NE 3.23Å; E452-R454 PolarHBondContact OE1-NE 3.14Å; E452-R454 IonicContact OE1-NH2 2.62Å; E452-R454 PolarHBondContact OE1-NH2 3.27Å; E452-L502 HydrophobicContact CB-CD2 3.81Å; E452-L502 HydrophobicContact CG-CD2 3.78Å; E452-F530 PolarHBondContact N-O 2.94Å; E452-F530 PolarHBondContact O-N 3.05Å; E452-H532 HydrophobicContact CB-CB 4.06Å; E452-H532 IonicContact OE2-CE1 2.71Å; E452-H532 IonicContact OE2-CG 2.65Å; E452-H532 IonicContact OE2-ND1 3.86Å; E452-H532 PolarHBondContact OE2-ND1 2.71Å
453	V	91.9	Very high	81.8	Confident	0 Å²	0	67 Å²	67	0%	0	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	125.1	-178.9	-173	0	0	0	0	108.3	I456 F470 G500 A501 I503 I527 V529	V453-I456 HydrophobicContact CB-CD1 4.01Å; V453-I456 HydrophobicContact CB-CG1 4.48Å; V453-I456 HydrophobicContact CG1-CD1 3.8Å; V453-I456 HydrophobicContact CG1-CG1 3.8Å; V453-F470 HydrophobicContact CG1-CZ 4.27Å; V453-F470 HydrophobicContact CG2-CE1 4.44Å; V453-F470 HydrophobicContact CG2-CE2 4.18Å; V453-F470 HydrophobicContact CG2-CZ 3.78Å; V453-G500 CarbonylContact O-C 3.56Å; V453-G500 WeakPolarHBondContact O-CA 3.3Å; V453-A501 PolarHBondContact N-O 2.72Å; V453-A501 PolarHBondContact O-N 3.04Å; V453-I503 HydrophobicContact CG2-CD1 3.69Å; V453-I503 HydrophobicContact CG2-CG1 4.19Å; V453-I527 HydrophobicContact CG1-CG2 3.39Å; V453-V529 HydrophobicContact CG1-CG2 4.48Å; V453-V529 HydrophobicContact CG2-CG1 4.36Å; V453-V529 HydrophobicContact CG2-CG2 4.29Å
454	R	88.9	Confident	83.7	Confident	43 Å²	43	66.5 Å²	66.5	16%	0.162	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	159.9	-174.5	-69	-173.2	173.9	-155.7	-4.7	112.1	E452 I456 D495 D497 K528 F530	E452-R454 HydrophobicContact CG-CG 4.3Å; E452-R454 IonicContact OE1-CZ 2.67Å; E452-R454 IonicContact OE1-NE 3.23Å; E452-R454 PolarHBondContact OE1-NE 3.14Å; E452-R454 IonicContact OE1-NH2 2.62Å; E452-R454 PolarHBondContact OE1-NH2 3.27Å; R454-I456 VanDerWaalsContact C-N 3.34Å; R454-D495 PolarHBondContact NH1-O 3.08Å; R454-D495 PolarHBondContact NH2-O 2.89Å; R454-D497 HydrophobicContact CB-CB 4.31Å; R454-D497 WeakPolarHBondContact CD-OD2 3.31Å; R454-D497 HydrophobicContact CG-CB 4.44Å; R454-K528 PolarHBondContact N-O 3.09Å; R454-K528 PolarHBondContact O-N 2.88Å; R454-F530 HydrophobicContact CB-CE2 4.36Å; R454-F530 HydrophobicContact CG-CD2 4.24Å; R454-F530 HydrophobicContact CG-CE2 4.42Å
455	R	85.6	Confident	85.5	Confident	127 Å²	127	64.1 Å²	64.1	48%	0.479	33%	0.328	S	S	.	.			trans	62.3	36.8	-175.6	-55.7	-175.4	170.4	-150.9	-6.7	113.3	P457 D497	R455-P457 WeakPolarHBondContact O-CD 3.38Å; R455-D497 IonicContact NE-OD1 3.39Å
456	I	86.7	Confident	87	Confident	1 Å²	1	62.6 Å²	62.6	1%	0.005	31%	0.313	C	S	.	.			trans	-82.1	118.7	174.4	-47.5	165.8	0	0	0	107.6	V453 R454 V458 L460 N461 L466 Q499 A501 F522 I527	V453-I456 HydrophobicContact CB-CD1 4.01Å; V453-I456 HydrophobicContact CB-CG1 4.48Å; V453-I456 HydrophobicContact CG1-CD1 3.8Å; V453-I456 HydrophobicContact CG1-CG1 3.8Å; R454-I456 VanDerWaalsContact C-N 3.34Å; I456-V458 PolarHBondContact O-N 2.87Å; I456-L460 HydrophobicContact CG2-CB 4.3Å; I456-N461 HydrophobicContact CB-CB 4.22Å; I456-N461 WeakPolarHBondContact CD1-OD1 3.3Å; I456-N461 HydrophobicContact CG2-CB 3.69Å; I456-L466 HydrophobicContact CD1-CD2 4.16Å; I456-Q499 PolarHBondContact N-O 2.68Å; I456-A501 HydrophobicContact CD1-CB 3.61Å; I456-F522 HydrophobicContact CG2-CE2 4.45Å; I456-I527 HydrophobicContact CG1-CG2 4.33Å
457	P	84.1	Confident	88.1	Confident	45 Å²	45	59 Å²	59	29%	0.292	30%	0.301	S	S	.	.			trans	-59.7	137.8	175.4	-22.9	34	0	0	0	110.9	R455 P459 L460 N461	R455-P457 WeakPolarHBondContact O-CD 3.38Å; P457-P459 VanDerWaalsContact C-CD 3.48Å; P457-L460 HydrophobicContact CB-CD1 4.43Å; P457-L460 HydrophobicContact CB-CG 4.39Å; P457-L460 HydrophobicContact CG-CD1 4.09Å; P457-L460 CarbonylContact O-C 3.47Å; P457-L460 WeakPolarHBondContact O-CA 3.15Å; P457-L460 WeakPolarHBondContact O-CB 3.26Å; P457-L460 PolarHBondContact O-N 3.03Å; P457-N461 PolarHBondContact O-N 3.33Å
458	V	82	Confident	88.6	Confident	84 Å²	84	53.3 Å²	53.3	51%	0.509	29%	0.292	S	S	.	.	G	3₁₀ helix	trans	-42	-51	179.9	-173.6	0	0	0	0	114.4	I456 L460 N461 Q499	I456-V458 PolarHBondContact O-N 2.87Å; V458-L460 PolarHBondContact O-N 3.36Å; V458-L460 VanDerWaalsContact O-N 3.14Å; V458-N461 PolarHBondContact O-N 2.84Å; V458-N461 VanDerWaalsContact O-N 3.11Å; V458-Q499 HydrophobicContact CG2-CG 4.28Å
459	P	83.2	Confident	88.9	Confident	95 Å²	95	53.1 Å²	53.1	62%	0.617	29%	0.29	S	S	*	.	G	3₁₀ helix	trans	-71.1	-6.2	-179.7	30	-37.8	0	0	0	114.8	P457 K465	P457-P459 VanDerWaalsContact C-CD 3.48Å; P459-K465 PolarHBondContact O-NZ 3.12Å
460	L	83.6	Confident	89	Confident	46 Å²	46	47.3 Å²	47.3	24%	0.241	27%	0.268	C	S	.	.	G	3₁₀ helix	trans	-104.6	-14.7	172.6	-56.5	-175.2	0	0	0	112.6	I456 P457 V458 T462 K465 F522	I456-L460 HydrophobicContact CG2-CB 4.3Å; P457-L460 HydrophobicContact CB-CD1 4.43Å; P457-L460 HydrophobicContact CB-CG 4.39Å; P457-L460 HydrophobicContact CG-CD1 4.09Å; P457-L460 CarbonylContact O-C 3.47Å; P457-L460 WeakPolarHBondContact O-CA 3.15Å; P457-L460 WeakPolarHBondContact O-CB 3.26Å; P457-L460 PolarHBondContact O-N 3.03Å; V458-L460 PolarHBondContact O-N 3.36Å; V458-L460 VanDerWaalsContact O-N 3.14Å; L460-T462 PolarHBondContact O-N 3.26Å; L460-K465 HydrophobicContact CD2-CD 4.25Å; L460-F522 HydrophobicContact CB-CD2 3.92Å; L460-F522 HydrophobicContact CB-CE2 4.27Å; L460-F522 HydrophobicContact CD1-CB 3.93Å; L460-F522 HydrophobicContact CD1-CD2 4.11Å; L460-F522 HydrophobicContact CD1-CG 4.36Å
461	N	84.6	Confident	89	Confident	2 Å²	2	48.5 Å²	48.5	1%	0.011	28%	0.278	C	S	.	.			trans	-80.3	56.7	-177.4	-156.2	15.3	0	0	0	111.7	I456 P457 V458 V481 Y483 G500	I456-N461 HydrophobicContact CB-CB 4.22Å; I456-N461 WeakPolarHBondContact CD1-OD1 3.3Å; I456-N461 HydrophobicContact CG2-CB 3.69Å; P457-N461 PolarHBondContact O-N 3.33Å; V458-N461 PolarHBondContact O-N 2.84Å; V458-N461 VanDerWaalsContact O-N 3.11Å; N461-V481 HydrophobicContact CB-CG1 4.45Å; N461-V481 VanDerWaalsContact CG-CG1 3.44Å; N461-V481 WeakPolarHBondContact ND2-CG1 3.43Å; N461-V481 WeakPolarHBondContact OD1-CG1 3.37Å; N461-Y483 WeakPolarHBondContact O-CE1 3.34Å; N461-Y483 PolarHBondContact O-OH 3.33Å; N461-G500 PolarHBondContact ND2-O 2.85Å
462	T	88.5	Confident	89	Confident	56 Å²	56	53.3 Å²	53.3	34%	0.344	31%	0.307	S	S	.	.			trans	-118.2	136.6	-178.3	-43.4	0	0	0	0	109.6	L460 S464 K465 L466	L460-T462 PolarHBondContact O-N 3.26Å; T462-S464 PolarHBondContact O-N 3.36Å; T462-S464 VanDerWaalsContact O-N 3.16Å; T462-K465 PolarHBondContact O-N 3.44Å; T462-L466 PolarHBondContact O-N 3.46Å
463	I	89.9	Confident	89	Confident	92 Å²	92	54.5 Å²	54.5	47%	0.472	31%	0.312	S	S	.	.	H	α-helix	trans	-51.1	-44.1	-178	-59.4	175	0	0	0	111.6	K465 L466 N467 I479 V481	I463-K465 PolarHBondContact O-N 3.32Å; I463-L466 PolarHBondContact O-N 3.22Å; I463-N467 VanDerWaalsContact O-CB 3.31Å; I463-N467 WeakPolarHBondContact O-CB 3.49Å; I463-N467 PolarHBondContact O-N 3.46Å; I463-I479 HydrophobicContact CG1-CG2 4.5Å; I463-I479 HydrophobicContact CG2-CB 4.31Å; I463-I479 HydrophobicContact CG2-CD1 4.23Å; I463-I479 HydrophobicContact CG2-CG2 4.43Å; I463-V481 HydrophobicContact CG1-CG2 3.85Å
464	S	91.4	Very high	89	Confident	96 Å²	96	55.4 Å²	55.4	67%	0.671	32%	0.321	S	S	*	.	H	α-helix	trans	-61	-40.1	179.9	-35.7	0	0	0	0	113.4	T462 G468	T462-S464 PolarHBondContact O-N 3.36Å; T462-S464 VanDerWaalsContact O-N 3.16Å; S464-G468 PolarHBondContact O-N 3.34Å
465	K	90.7	Very high	89.3	Confident	91 Å²	91	58.1 Å²	58.1	40%	0.396	34%	0.339	S	S	.	.	H	α-helix	trans	-70.7	-46.9	177.3	-66.9	179.4	-179.3	179	0	110.2	P459 L460 T462 I463 N467 G468 H469 F522	P459-K465 PolarHBondContact O-NZ 3.12Å; L460-K465 HydrophobicContact CD2-CD 4.25Å; T462-K465 PolarHBondContact O-N 3.44Å; I463-K465 PolarHBondContact O-N 3.32Å; K465-N467 PolarHBondContact O-N 2.82Å; K465-G468 PolarHBondContact O-N 2.65Å; K465-H469 PolarHBondContact O-N 2.86Å; K465-H469 VanDerWaalsContact O-N 3.13Å; K465-F522 HydrophobicContact CB-CE1 3.84Å; K465-F522 HydrophobicContact CB-CZ 3.76Å; K465-F522 VanDerWaalsContact O-CE1 3.23Å; K465-F522 WeakPolarHBondContact O-CE1 3.15Å; K465-F522 WeakPolarHBondContact O-CZ 3.04Å
466	L	91.5	Very high	89.6	Confident	0 Å²	0	53 Å²	53	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-58.7	-47.3	177.5	-67.4	168.2	0	0	0	111.2	I456 T462 I463 G468 H469 F470 I479 V481 A501 I503 F522	I456-L466 HydrophobicContact CD1-CD2 4.16Å; T462-L466 PolarHBondContact O-N 3.46Å; I463-L466 PolarHBondContact O-N 3.22Å; L466-G468 PolarHBondContact O-N 2.71Å; L466-H469 PolarHBondContact O-N 3.17Å; L466-F470 HydrophobicContact CD2-CD2 4.3Å; L466-F470 HydrophobicContact CD2-CE2 4Å; L466-F470 WeakPolarHBondContact O-CB 3.29Å; L466-F470 VanDerWaalsContact O-CD2 3.29Å; L466-F470 WeakPolarHBondContact O-CD2 3.38Å; L466-F470 PolarHBondContact O-N 3.28Å; L466-I479 HydrophobicContact CB-CD1 4.28Å; L466-I479 HydrophobicContact CB-CG2 4.21Å; L466-I479 HydrophobicContact CD1-CG2 3.89Å; L466-V481 HydrophobicContact CD1-CG2 3.75Å; L466-A501 HydrophobicContact CD1-CB 3.67Å; L466-A501 HydrophobicContact CD2-CB 4.49Å; L466-I503 HydrophobicContact CD2-CD1 4.47Å; L466-F522 HydrophobicContact CD2-CE2 4.03Å; L466-F522 HydrophobicContact CD2-CZ 3.97Å; L466-F522 HydrophobicContact CG-CZ 4.39Å
467	N	92.1	Very high	89.9	Confident	73 Å²	73	56.8 Å²	56.8	39%	0.39	35%	0.345	S	S	.	.	H	α-helix	trans	-60.1	-46.9	176.1	-165.1	26	0	0	0	111.4	I463 K465 H469 F470 S471 I479	I463-N467 VanDerWaalsContact O-CB 3.31Å; I463-N467 WeakPolarHBondContact O-CB 3.49Å; I463-N467 PolarHBondContact O-N 3.46Å; K465-N467 PolarHBondContact O-N 2.82Å; N467-H469 VanDerWaalsContact C-N 3.26Å; N467-H469 PolarHBondContact O-N 3.13Å; N467-F470 PolarHBondContact O-N 3.08Å; N467-S471 WeakPolarHBondContact O-CB 3.25Å; N467-S471 PolarHBondContact O-N 2.87Å; N467-I479 HydrophobicContact CB-CD1 3.76Å
468	G	91.7	Very high	90.3	Very high	56 Å²	56	58.6 Å²	58.6	58%	0.577	35%	0.353	S	S	*	.	H	α-helix	trans	-58.6	-31.3	179.3	0	0	0	0	0	114.8	S464 K465 L466	S464-G468 PolarHBondContact O-N 3.34Å; K465-G468 PolarHBondContact O-N 2.65Å; L466-G468 PolarHBondContact O-N 2.71Å
469	H	92.1	Very high	90.8	Very high	30 Å²	30	55.9 Å²	55.9	14%	0.139	34%	0.335	C	S	.	.	H	α-helix	trans	-85.4	-51.1	172.6	-175.9	-91.1	0	0	0	112.4	K465 L466 N467 T472 F473 I521 F522	K465-H469 PolarHBondContact O-N 2.86Å; K465-H469 VanDerWaalsContact O-N 3.13Å; L466-H469 PolarHBondContact O-N 3.17Å; N467-H469 VanDerWaalsContact C-N 3.26Å; N467-H469 PolarHBondContact O-N 3.13Å; H469-T472 WeakPolarHBondContact O-CB 3.23Å; H469-T472 WeakPolarHBondContact O-CG2 3.48Å; H469-T472 PolarHBondContact O-N 2.98Å; H469-T472 PolarHBondContact O-OG1 2.95Å; H469-F473 AromaticContact CE1-CE2 3.71Å; H469-F473 AromaticContact ND1-CE2 3.97Å; H469-I521 VanDerWaalsContact CE1-CG1 3.46Å; H469-I521 WeakPolarHBondContact CE1-CG1 3.4Å; H469-F522 HydrophobicContact CB-CE1 3.88Å; H469-F522 HydrophobicContact CB-CZ 4.49Å
470	F	93.1	Very high	91	Very high	1 Å²	1	55.6 Å²	55.6	0%	0.004	33%	0.328	C	S	.	.	H	α-helix	trans	-80.5	-22.7	-167.5	-73.5	-70.8	0	0	0	114.3	V453 L466 N467 T472 F473 V476 I503 Y505 I521	V453-F470 HydrophobicContact CG1-CZ 4.27Å; V453-F470 HydrophobicContact CG2-CE1 4.44Å; V453-F470 HydrophobicContact CG2-CE2 4.18Å; V453-F470 HydrophobicContact CG2-CZ 3.78Å; L466-F470 HydrophobicContact CD2-CD2 4.3Å; L466-F470 HydrophobicContact CD2-CE2 4Å; L466-F470 WeakPolarHBondContact O-CB 3.29Å; L466-F470 VanDerWaalsContact O-CD2 3.29Å; L466-F470 WeakPolarHBondContact O-CD2 3.38Å; L466-F470 PolarHBondContact O-N 3.28Å; N467-F470 PolarHBondContact O-N 3.08Å; F470-T472 PolarHBondContact O-N 2.8Å; F470-F473 HydrophobicContact CD1-CD2 4.24Å; F470-F473 HydrophobicContact CD1-CE2 4.23Å; F470-F473 PolarHBondContact O-N 3.37Å; F470-V476 HydrophobicContact CB-CG2 4.28Å; F470-I503 HydrophobicContact CB-CD1 4.23Å; F470-I503 HydrophobicContact CB-CG2 4.33Å; F470-I503 HydrophobicContact CD1-CD1 4.19Å; F470-I503 HydrophobicContact CD2-CD1 3.18Å; F470-I503 HydrophobicContact CE1-CD1 4.36Å; F470-I503 HydrophobicContact CE2-CD1 3.41Å; F470-I503 VanDerWaalsContact CE2-CD1 3.41Å; F470-I503 HydrophobicContact CG-CD1 3.6Å; F470-I503 HydrophobicContact CZ-CD1 4Å; F470-Y505 WeakPolarHBondContact CB-OH 3.42Å; F470-Y505 WeakPolarHBondContact CD1-OH 3.16Å; F470-Y505 PolarHBondContact O-OH 2.94Å; F470-I521 HydrophobicContact CE1-CD1 4.38Å; F470-I521 HydrophobicContact CE1-CG1 4.48Å; F470-I521 HydrophobicContact CE2-CG2 4.16Å; F470-I521 HydrophobicContact CZ-CD1 3.79Å; F470-I521 HydrophobicContact CZ-CG1 3.97Å; F470-I521 HydrophobicContact CZ-CG2 4.19Å
471	S	93.4	Very high	91.1	Very high	62 Å²	62	54.1 Å²	54.1	43%	0.434	32%	0.321	S	S	.	.	G	3₁₀ helix	trans	-63.4	-19.2	171	-169.2	0	0	0	0	113	N467 F473 G474	N467-S471 WeakPolarHBondContact O-CB 3.25Å; N467-S471 PolarHBondContact O-N 2.87Å; S471-F473 PolarHBondContact O-N 3.15Å; S471-G474 WeakPolarHBondContact CA-O 3.28Å; S471-G474 PolarHBondContact O-N 2.84Å
472	T	92.3	Very high	90.7	Very high	101 Å²	101	59.3 Å²	59.3	62%	0.62	34%	0.341	S	S	*	.	G	3₁₀ helix	trans	-65.8	-17.4	176	67.3	0	0	0	0	114.1	H469 F470	H469-T472 WeakPolarHBondContact O-CB 3.23Å; H469-T472 WeakPolarHBondContact O-CG2 3.48Å; H469-T472 PolarHBondContact O-N 2.98Å; H469-T472 PolarHBondContact O-OG1 2.95Å; F470-T472 PolarHBondContact O-N 2.8Å
473	F	92.4	Very high	89.6	Confident	43 Å²	43	63.3 Å²	63.3	19%	0.189	35%	0.35	C	S	.	.	G	3₁₀ helix	trans	-99.8	-5.2	178	-51.7	-69.6	0	0	0	113.8	H469 F470 S471 Y505 E510 A514 S517	H469-F473 AromaticContact CE1-CE2 3.71Å; H469-F473 AromaticContact ND1-CE2 3.97Å; F470-F473 HydrophobicContact CD1-CD2 4.24Å; F470-F473 HydrophobicContact CD1-CE2 4.23Å; F470-F473 PolarHBondContact O-N 3.37Å; S471-F473 PolarHBondContact O-N 3.15Å; F473-Y505 HydrophobicContact CB-CE1 4.36Å; F473-E510 WeakPolarHBondContact O-CB 3.42Å; F473-A514 HydrophobicContact CB-CB 3.82Å; F473-A514 HydrophobicContact CD2-CB 3.63Å; F473-A514 HydrophobicContact CE2-CB 4.39Å; F473-A514 HydrophobicContact CG-CB 3.74Å; F473-S517 WeakPolarHBondContact CZ-OG 3.38Å
474	G	91.8	Very high	88.1	Confident	19 Å²	19	61.3 Å²	61.3	20%	0.196	35%	0.347	C	S	.	.	S	Bend	trans	141.3	-177.8	-176.8	0	0	0	0	0	113.8	S471 V476 E510	S471-G474 WeakPolarHBondContact CA-O 3.28Å; S471-G474 PolarHBondContact O-N 2.84Å; G474-V476 PolarHBondContact O-N 2.85Å; G474-E510 VanDerWaalsContact CA-OE1 3.31Å; G474-E510 WeakPolarHBondContact CA-OE1 3.41Å
475	N	94	Very high	86.2	Confident	100 Å²	100	60.8 Å²	60.8	54%	0.535	34%	0.344	S	S	.	.			trans	-73.3	116.8	-174.3	-171.3	1.8	0	0	0	111.7	Y505 A506 E510	N475-Y505 CarbonylContact O-C 3.57Å; N475-Y505 WeakPolarHBondContact O-CA 3.29Å; N475-A506 HydrophobicContact CB-CB 4.1Å; N475-A506 PolarHBondContact O-N 3.31Å; N475-E510 PolarHBondContact N-OE1 2.9Å
476	V	93.5	Very high	84.5	Confident	20 Å²	20	60.7 Å²	60.7	12%	0.121	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	110.5	178.5	-177.1	0	0	0	0	109.5	F470 G474 I479 I503 T504 Y505	F470-V476 HydrophobicContact CB-CG2 4.28Å; G474-V476 PolarHBondContact O-N 2.85Å; V476-I479 HydrophobicContact CG1-CD1 3.96Å; V476-I479 HydrophobicContact CG1-CG1 3.48Å; V476-I479 VanDerWaalsContact CG1-CG1 3.48Å; V476-I503 HydrophobicContact CG1-CG2 3.72Å; V476-I503 HydrophobicContact CG2-CG2 4.34Å; V476-T504 CarbonylContact C-O 3.59Å; V476-T504 WeakPolarHBondContact CA-O 3.38Å; V476-T504 WeakPolarHBondContact CG1-O 3.44Å; V476-Y505 HydrophobicContact CG2-CD1 4.09Å; V476-Y505 HydrophobicContact CG2-CE1 3.71Å
477	T	93.3	Very high	82.5	Confident	80 Å²	80	66.2 Å²	66.2	49%	0.491	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	-24.5	-176.8	51	0	0	0	0	113.9	T504 A506	T477-T504 PolarHBondContact N-O 3.49Å; T477-T504 PolarHBondContact OG1-O 2.92Å; T477-A506 HydrophobicContact CG2-CB 3.88Å
478	N	91.2	Very high	80.3	Confident	84 Å²	84	73.4 Å²	73.4	45%	0.449	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.6	135.1	177.3	-170.1	-87.2	0	0	0	111.5	T504	N478-T504 PolarHBondContact N-O 3.22Å; N478-T504 PolarHBondContact O-N 2.86Å
479	I	92	Very high	78.2	Confident	26 Å²	26	75.2 Å²	75.2	13%	0.133	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	110	170.1	-57.6	177.1	0	0	0	107.4	I463 L466 N467 V476 V481 L502	I463-I479 HydrophobicContact CG1-CG2 4.5Å; I463-I479 HydrophobicContact CG2-CB 4.31Å; I463-I479 HydrophobicContact CG2-CD1 4.23Å; I463-I479 HydrophobicContact CG2-CG2 4.43Å; L466-I479 HydrophobicContact CB-CD1 4.28Å; L466-I479 HydrophobicContact CB-CG2 4.21Å; L466-I479 HydrophobicContact CD1-CG2 3.89Å; N467-I479 HydrophobicContact CB-CD1 3.76Å; V476-I479 HydrophobicContact CG1-CD1 3.96Å; V476-I479 HydrophobicContact CG1-CG1 3.48Å; V476-I479 VanDerWaalsContact CG1-CG1 3.48Å; I479-V481 HydrophobicContact CG2-CG2 4.19Å; I479-L502 WeakPolarHBondContact CA-O 3.47Å
480	N	88.4	Confident	76.1	Confident	89 Å²	89	81.4 Å²	81.4	48%	0.476	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	105.9	177.5	-172.8	-5.7	0	0	0	109.5	R482 L502	N480-R482 PolarHBondContact O-N 3.4Å; N480-L502 HydrophobicContact CB-CB 4.35Å; N480-L502 PolarHBondContact N-O 3.2Å; N480-L502 PolarHBondContact O-N 2.79Å
481	V	86.1	Confident	73.9	Confident	16 Å²	16	88.1 Å²	88.1	10%	0.097	49%	0.488	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	115.2	-177.1	-178.3	0	0	0	0	110	N461 I463 L466 I479 Y483 A501	N461-V481 HydrophobicContact CB-CG1 4.45Å; N461-V481 VanDerWaalsContact CG-CG1 3.44Å; N461-V481 WeakPolarHBondContact ND2-CG1 3.43Å; N461-V481 WeakPolarHBondContact OD1-CG1 3.37Å; I463-V481 HydrophobicContact CG1-CG2 3.85Å; L466-V481 HydrophobicContact CD1-CG2 3.75Å; I479-V481 HydrophobicContact CG2-CG2 4.19Å; V481-Y483 HydrophobicContact CB-CD2 4.28Å; V481-Y483 HydrophobicContact CB-CE2 3.76Å; V481-Y483 HydrophobicContact CG1-CD1 3.96Å; V481-Y483 HydrophobicContact CG1-CD2 3.93Å; V481-Y483 HydrophobicContact CG1-CE1 3.59Å; V481-Y483 HydrophobicContact CG1-CE2 3.57Å; V481-Y483 HydrophobicContact CG1-CG 4.12Å; V481-Y483 PolarHBondContact O-N 2.76Å; V481-Y483 VanDerWaalsContact O-N 3.08Å; V481-A501 HydrophobicContact CG2-CB 4.49Å
482	R	75.6	Confident	71.6	Confident	111 Å²	111	90.4 Å²	90.4	42%	0.419	50%	0.499	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	85	173.1	-69.7	-176.2	172.3	-164.5	-4.9	109.3	N480 G500	N480-R482 PolarHBondContact O-N 3.4Å; R482-G500 CarbonylContact C-O 3.57Å; R482-G500 WeakPolarHBondContact CA-O 3.5Å; R482-G500 WeakPolarHBondContact CB-O 3.49Å; R482-G500 PolarHBondContact N-O 3.33Å; R482-G500 PolarHBondContact O-N 2.84Å
483	Y	64.6	Low	69	Low	139 Å²	139	89.7 Å²	89.7	55%	0.545	51%	0.512	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	121.3	156.5	-48.2	-79.1	0	0	0	108.2	N461 V481 S485	N461-Y483 WeakPolarHBondContact O-CE1 3.34Å; N461-Y483 PolarHBondContact O-OH 3.33Å; V481-Y483 HydrophobicContact CB-CD2 4.28Å; V481-Y483 HydrophobicContact CB-CE2 3.76Å; V481-Y483 HydrophobicContact CG1-CD1 3.96Å; V481-Y483 HydrophobicContact CG1-CD2 3.93Å; V481-Y483 HydrophobicContact CG1-CE1 3.59Å; V481-Y483 HydrophobicContact CG1-CE2 3.57Å; V481-Y483 HydrophobicContact CG1-CG 4.12Å; V481-Y483 PolarHBondContact O-N 2.76Å; V481-Y483 VanDerWaalsContact O-N 3.08Å; Y483-S485 PolarHBondContact O-N 2.92Å
484	A	58.2	Low	66.6	Low	50 Å²	50	94.8 Å²	94.8	41%	0.413	53%	0.534	S	S	.	.	P	Polyproline II helix	trans	-69.4	116.5	159.1	0	0	0	0	0	108.8	V489 P498	A484-V489 HydrophobicContact CB-CG2 4.24Å; A484-P498 HydrophobicContact CB-CB 3.57Å; A484-P498 WeakPolarHBondContact CB-O 3.33Å; A484-P498 PolarHBondContact N-O 2.83Å
485	S	53.3	Low	64.6	Low	86 Å²	86	99.9 Å²	99.9	60%	0.601	56%	0.557	S	S	*	*	P	Polyproline II helix	trans	-62.5	138.9	161	56.2	0	0	0	0	108.5	Y483 S487 R488	Y483-S485 PolarHBondContact O-N 2.92Å; S485-S487 PolarHBondContact O-N 3.16Å; S485-R488 PolarHBondContact O-N 3.21Å
486	A	53.8	Low	62.4	Low	89 Å²	89	97.7 Å²	97.7	74%	0.736	55%	0.549	S	S	*	.	G	3₁₀ helix	trans	-55.2	-24.3	-173.2	0	0	0	0	0	113.7	R488 V489	A486-R488 PolarHBondContact O-N 3.24Å; A486-V489 PolarHBondContact O-N 3.19Å
487	S	49.9	Very low	60.6	Low	116 Å²	116	99.3 Å²	99.3	81%	0.811	56%	0.557	S	S	*	*	G	3₁₀ helix	trans	-58.4	-7.6	177.9	-173.3	0	0	0	0	116.1	S485	S485-S487 PolarHBondContact O-N 3.16Å
488	R	45.7	Very low	59	Low	224 Å²	224	98.9 Å²	98.9	85%	0.845	56%	0.556	S	S	*	*	G	3₁₀ helix	trans	-131.2	22	176.6	-137.8	176.4	-163.1	161.1	5	114.3	S485 A486	S485-R488 PolarHBondContact O-N 3.21Å; A486-R488 PolarHBondContact O-N 3.24Å
489	V	47.6	Very low	58	Low	94 Å²	94	98.9 Å²	98.9	57%	0.57	55%	0.553	S	S	*	*			trans	-90.7	-7.2	-174.7	177.6	0	0	0	0	113.2	A484 A486	A484-V489 HydrophobicContact CB-CG2 4.24Å; A486-V489 PolarHBondContact O-N 3.19Å
490	L	48.2	Very low	57.6	Low	159 Å²	159	97.9 Å²	97.9	83%	0.832	55%	0.549	S	S	*	.	S	Bend	trans	-90.9	135.6	165.4	-73.8	161.5	0	0	0	109.8
491	I	45.7	Very low	57.6	Low	142 Å²	142	93.7 Å²	93.7	73%	0.728	53%	0.527	S	S	*	.	S	Bend	trans	69.7	90.9	-172.5	-41.8	164.9	0	0	0	114.3
492	V	46.4	Very low	57.9	Low	111 Å²	111	93.9 Å²	93.9	67%	0.673	53%	0.527	S	S	*	.				-173	132.6	113	-91.1	0	0	0	0	111.7	F494	V492-F494 VanDerWaalsContact C-N 3.35Å; V492-F494 HydrophobicContact CB-CB 4.14Å; V492-F494 PolarHBondContact O-N 3.21Å
493	G	38	Very low	58.7	Low	86 Å²	86	88.6 Å²	88.6	89%	0.887	51%	0.507	S	S	*	.			trans	-88.5	70.8	159.4	0	0	0	0	0	110.3
494	F	42.2	Very low	60.1	Low	150 Å²	150	83.3 Å²	83.3	66%	0.658	49%	0.489	S	S	*	.	S	Bend	trans	-147.1	149	-177.4	-162.8	-104.7	0	0	0	111.3	V492 S496	V492-F494 VanDerWaalsContact C-N 3.35Å; V492-F494 HydrophobicContact CB-CB 4.14Å; V492-F494 PolarHBondContact O-N 3.21Å; F494-S496 VanDerWaalsContact C-N 3.25Å; F494-S496 PolarHBondContact O-N 3.36Å
495	D	48.5	Very low	61.8	Low	125 Å²	125	80.9 Å²	80.9	67%	0.668	47%	0.47	S	S	*	.	S	Bend	trans	-71	71.6	-175.6	-71.3	-76.3	0	0	0	113.3	R454	R454-D495 PolarHBondContact NH1-O 3.08Å; R454-D495 PolarHBondContact NH2-O 2.89Å
496	S	47.9	Very low	63.8	Low	54 Å²	54	78.2 Å²	78.2	38%	0.378	45%	0.453	S	S	.	.			trans	-135.7	70.1	172.2	-72.7	0	0	0	0	109.4	F494 P498	F494-S496 VanDerWaalsContact C-N 3.25Å; F494-S496 PolarHBondContact O-N 3.36Å; S496-P498 VanDerWaalsContact O-CD 3.26Å; S496-P498 WeakPolarHBondContact O-CD 3.2Å
497	D	56	Low	65.6	Low	54 Å²	54	77.3 Å²	77.3	29%	0.289	44%	0.438	S	S	.	.			trans	-43.1	110.1	178.5	-70.9	-65.6	0	0	0	110.5	R454 R455 Q499	R454-D497 HydrophobicContact CB-CB 4.31Å; R454-D497 WeakPolarHBondContact CD-OD2 3.31Å; R454-D497 HydrophobicContact CG-CB 4.44Å; R455-D497 IonicContact NE-OD1 3.39Å; D497-Q499 PolarHBondContact O-N 3.35Å
498	P	58.5	Low	67.7	Low	71 Å²	71	76.9 Å²	76.9	46%	0.461	42%	0.419	S	S	.	.	S	Bend	trans	-74.1	18.5	-171	27.6	-33.9	0	0	0	114.4	A484 S496	A484-P498 HydrophobicContact CB-CB 3.57Å; A484-P498 WeakPolarHBondContact CB-O 3.33Å; A484-P498 PolarHBondContact N-O 2.83Å; S496-P498 VanDerWaalsContact O-CD 3.26Å; S496-P498 WeakPolarHBondContact O-CD 3.2Å
499	Q	71.2	Confident	70	Confident	84 Å²	84	68.6 Å²	68.6	39%	0.393	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	69.1	-174.1	-58.6	179.7	18.3	0	0	108.2	I456 V458 D497	I456-Q499 PolarHBondContact N-O 2.68Å; V458-Q499 HydrophobicContact CG2-CG 4.28Å; D497-Q499 PolarHBondContact O-N 3.35Å
500	G	82.6	Confident	72.2	Confident	5 Å²	5	66 Å²	66	5%	0.052	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	173.1	-176.6	0	0	0	0	0	112.7	V453 N461 R482	V453-G500 CarbonylContact O-C 3.56Å; V453-G500 WeakPolarHBondContact O-CA 3.3Å; N461-G500 PolarHBondContact ND2-O 2.85Å; R482-G500 CarbonylContact C-O 3.57Å; R482-G500 WeakPolarHBondContact CA-O 3.5Å; R482-G500 WeakPolarHBondContact CB-O 3.49Å; R482-G500 PolarHBondContact N-O 3.33Å; R482-G500 PolarHBondContact O-N 2.84Å
501	A	89.3	Confident	74.4	Confident	1 Å²	1	58.4 Å²	58.4	1%	0.008	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	140.8	173.3	0	0	0	0	0	110.8	V453 I456 L466 V481	V453-A501 PolarHBondContact N-O 2.72Å; V453-A501 PolarHBondContact O-N 3.04Å; I456-A501 HydrophobicContact CD1-CB 3.61Å; L466-A501 HydrophobicContact CD1-CB 3.67Å; L466-A501 HydrophobicContact CD2-CB 4.49Å; V481-A501 HydrophobicContact CG2-CB 4.49Å
502	L	92	Very high	76.6	Confident	20 Å²	20	53.3 Å²	53.3	11%	0.105	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	131.8	169.7	-59.2	179.6	0	0	0	108.9	L451 E452 I479 N480 H532	L451-L502 WeakPolarHBondContact O-CA 3.19Å; E452-L502 HydrophobicContact CB-CD2 3.81Å; E452-L502 HydrophobicContact CG-CD2 3.78Å; I479-L502 WeakPolarHBondContact CA-O 3.47Å; N480-L502 HydrophobicContact CB-CB 4.35Å; N480-L502 PolarHBondContact N-O 3.2Å; N480-L502 PolarHBondContact O-N 2.79Å; L502-H532 HydrophobicContact CD2-CB 4.27Å; L502-H532 WeakPolarHBondContact CD2-ND1 3.44Å
503	I	92.9	Very high	78.9	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	118.7	-175.4	-54.7	-172.5	0	0	0	108.5	T450 L451 V453 L466 F470 V476 Y505	T450-I503 WeakPolarHBondContact CA-O 3.37Å; L451-I503 PolarHBondContact N-O 3.08Å; L451-I503 PolarHBondContact O-N 2.99Å; V453-I503 HydrophobicContact CG2-CD1 3.69Å; V453-I503 HydrophobicContact CG2-CG1 4.19Å; L466-I503 HydrophobicContact CD2-CD1 4.47Å; F470-I503 HydrophobicContact CB-CD1 4.23Å; F470-I503 HydrophobicContact CB-CG2 4.33Å; F470-I503 HydrophobicContact CD1-CD1 4.19Å; F470-I503 HydrophobicContact CD2-CD1 3.18Å; F470-I503 HydrophobicContact CE1-CD1 4.36Å; F470-I503 HydrophobicContact CE2-CD1 3.41Å; F470-I503 VanDerWaalsContact CE2-CD1 3.41Å; F470-I503 HydrophobicContact CG-CD1 3.6Å; F470-I503 HydrophobicContact CZ-CD1 4Å; V476-I503 HydrophobicContact CG1-CG2 3.72Å; V476-I503 HydrophobicContact CG2-CG2 4.34Å; I503-Y505 HydrophobicContact CG2-CD2 4.48Å; I503-Y505 HydrophobicContact CG2-CE2 3.83Å
504	T	93.5	Very high	81.5	Confident	28 Å²	28	46.2 Å²	46.2	17%	0.172	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	129.7	-178.1	-46.6	0	0	0	0	109.5	R449 T450 V476 T477 N478	R449-T504 HydrophobicContact CB-CG2 4.46Å; R449-T504 WeakPolarHBondContact O-CA 3.38Å; T450-T504 HydrophobicContact CG2-CG2 3.9Å; V476-T504 CarbonylContact C-O 3.59Å; V476-T504 WeakPolarHBondContact CA-O 3.38Å; V476-T504 WeakPolarHBondContact CG1-O 3.44Å; T477-T504 PolarHBondContact N-O 3.49Å; T477-T504 PolarHBondContact OG1-O 2.92Å; N478-T504 PolarHBondContact N-O 3.22Å; N478-T504 PolarHBondContact O-N 2.86Å
505	Y	95.4	Very high	84	Confident	0 Å²	0	44 Å²	44	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	158.8	175	-68.6	-93.9	0	0	0	112	R449 L451 F470 F473 N475 V476 I503 T507 E510 A511 A514	R449-Y505 PolarHBondContact O-N 2.91Å; L451-Y505 HydrophobicContact CD1-CE2 3.86Å; L451-Y505 HydrophobicContact CG-CE2 4.32Å; F470-Y505 WeakPolarHBondContact CB-OH 3.42Å; F470-Y505 WeakPolarHBondContact CD1-OH 3.16Å; F470-Y505 PolarHBondContact O-OH 2.94Å; F473-Y505 HydrophobicContact CB-CE1 4.36Å; N475-Y505 CarbonylContact O-C 3.57Å; N475-Y505 WeakPolarHBondContact O-CA 3.29Å; V476-Y505 HydrophobicContact CG2-CD1 4.09Å; V476-Y505 HydrophobicContact CG2-CE1 3.71Å; I503-Y505 HydrophobicContact CG2-CD2 4.48Å; I503-Y505 HydrophobicContact CG2-CE2 3.83Å; Y505-T507 WeakPolarHBondContact CB-O 3.44Å; Y505-E510 HydrophobicContact CD1-CB 3.59Å; Y505-E510 HydrophobicContact CE1-CB 4.33Å; Y505-E510 HydrophobicContact CG-CB 4.02Å; Y505-A511 HydrophobicContact CD2-CB 3.65Å; Y505-A511 HydrophobicContact CE2-CB 4.4Å; Y505-A511 HydrophobicContact CG-CB 4.13Å; Y505-A514 HydrophobicContact CE1-CB 4.46Å; Y505-A514 HydrophobicContact CE2-CB 4.05Å; Y505-A514 WeakPolarHBondContact OH-CB 3.35Å
506	A	93.4	Very high	86.1	Confident	30 Å²	30	45.5 Å²	45.5	25%	0.248	25%	0.253	C	S	.	.	S	Bend	trans	-59.8	-46.7	172.8	0	0	0	0	0	111.4	R449 N475 T477	R449-A506 VanDerWaalsContact CD-O 3.25Å; R449-A506 WeakPolarHBondContact CD-O 3.49Å; R449-A506 PolarHBondContact NH1-O 3.45Å; N475-A506 HydrophobicContact CB-CB 4.1Å; N475-A506 PolarHBondContact O-N 3.31Å; T477-A506 HydrophobicContact CG2-CB 3.88Å
507	T	93.2	Very high	88.1	Confident	69 Å²	69	44.6 Å²	44.6	42%	0.423	25%	0.247	S	C	.	.	S	Bend	trans	-117.9	161.3	178.8	78.4	0	0	0	0	112.5	Y505 G509 E510	Y505-T507 WeakPolarHBondContact CB-O 3.44Å; T507-G509 VanDerWaalsContact C-N 3.27Å; T507-G509 PolarHBondContact OG1-N 3.13Å; T507-E510 WeakPolarHBondContact CA-OE2 3.26Å; T507-E510 WeakPolarHBondContact CB-OE2 3.5Å; T507-E510 WeakPolarHBondContact CG2-OE2 3.44Å; T507-E510 PolarHBondContact N-OE2 2.98Å; T507-E510 VanDerWaalsContact OG1-CD 3.31Å; T507-E510 WeakPolarHBondContact OG1-CG 3.42Å; T507-E510 PolarHBondContact OG1-N 3.37Å; T507-E510 PolarHBondContact OG1-OE2 3.33Å
508	R	92.8	Very high	89.6	Confident	107 Å²	107	48.9 Å²	48.9	40%	0.404	28%	0.276	S	S	.	.	H	α-helix	trans	-73.6	-18.7	171	-177.8	165.2	168.6	-97	-2.9	112.6	G445 K446 R449 V512	G445-R508 VanDerWaalsContact O-CZ 3.29Å; G445-R508 PolarHBondContact O-NE 3Å; G445-R508 PolarHBondContact O-NH2 3.45Å; K446-R508 WeakPolarHBondContact O-CD 3.44Å; K446-R508 PolarHBondContact O-NE 3.24Å; K446-R508 PolarHBondContact O-NH1 3.36Å; K446-R508 VanDerWaalsContact O-NH1 3.12Å; R449-R508 HydrophobicContact CG-CB 4.17Å; R508-V512 HydrophobicContact CG-CG2 4.11Å; R508-V512 WeakPolarHBondContact O-CB 3.4Å; R508-V512 WeakPolarHBondContact O-CG2 3.46Å; R508-V512 PolarHBondContact O-N 3.46Å
509	G	93.8	Very high	91	Very high	50 Å²	50	48.8 Å²	48.8	52%	0.515	27%	0.274	S	S	.	.	H	α-helix	trans	-64.2	-48.9	176.4	0	0	0	0	0	111.6	T507 V512 A513	T507-G509 VanDerWaalsContact C-N 3.27Å; T507-G509 PolarHBondContact OG1-N 3.13Å; G509-V512 PolarHBondContact O-N 3.03Å; G509-A513 PolarHBondContact O-N 3Å
510	E	94.4	Very high	91.7	Very high	39 Å²	39	47.2 Å²	47.2	18%	0.182	27%	0.271	C	S	.	.	H	α-helix	trans	-65	-45	179.1	-59	156.4	119.9	0	0	111.2	F473 G474 N475 Y505 T507 V512 A513 A514	F473-E510 WeakPolarHBondContact O-CB 3.42Å; G474-E510 VanDerWaalsContact CA-OE1 3.31Å; G474-E510 WeakPolarHBondContact CA-OE1 3.41Å; N475-E510 PolarHBondContact N-OE1 2.9Å; Y505-E510 HydrophobicContact CD1-CB 3.59Å; Y505-E510 HydrophobicContact CE1-CB 4.33Å; Y505-E510 HydrophobicContact CG-CB 4.02Å; T507-E510 WeakPolarHBondContact CA-OE2 3.26Å; T507-E510 WeakPolarHBondContact CB-OE2 3.5Å; T507-E510 WeakPolarHBondContact CG2-OE2 3.44Å; T507-E510 PolarHBondContact N-OE2 2.98Å; T507-E510 VanDerWaalsContact OG1-CD 3.31Å; T507-E510 WeakPolarHBondContact OG1-CG 3.42Å; T507-E510 PolarHBondContact OG1-N 3.37Å; T507-E510 PolarHBondContact OG1-OE2 3.33Å; E510-V512 VanDerWaalsContact C-N 3.3Å; E510-V512 PolarHBondContact O-N 3.06Å; E510-A513 WeakPolarHBondContact O-CB 3.15Å; E510-A513 PolarHBondContact O-N 2.82Å; E510-A513 VanDerWaalsContact O-N 3.09Å; E510-A514 PolarHBondContact O-N 2.99Å
511	A	94	Very high	91.9	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-59.2	-39.2	173.4	0	0	0	0	0	112.7	Y505 Y515 W531	Y505-A511 HydrophobicContact CD2-CB 3.65Å; Y505-A511 HydrophobicContact CE2-CB 4.4Å; Y505-A511 HydrophobicContact CG-CB 4.13Å; A511-Y515 VanDerWaalsContact O-CB 3.27Å; A511-Y515 WeakPolarHBondContact O-CB 3.45Å; A511-Y515 PolarHBondContact O-N 2.76Å; A511-W531 HydrophobicContact CB-CH2 3.82Å; A511-W531 HydrophobicContact CB-CZ3 4Å
512	V	93.1	Very high	91.8	Very high	36 Å²	36	49.8 Å²	49.8	22%	0.218	28%	0.281	C	S	.	.	H	α-helix	trans	-71.2	-32.9	175.2	168.8	0	0	0	0	111.8	R508 G509 E510 K516 W531	R508-V512 HydrophobicContact CG-CG2 4.11Å; R508-V512 WeakPolarHBondContact O-CB 3.4Å; R508-V512 WeakPolarHBondContact O-CG2 3.46Å; R508-V512 PolarHBondContact O-N 3.46Å; G509-V512 PolarHBondContact O-N 3.03Å; E510-V512 VanDerWaalsContact C-N 3.3Å; E510-V512 PolarHBondContact O-N 3.06Å; V512-K516 HydrophobicContact CG1-CD 3.9Å; V512-K516 HydrophobicContact CG1-CG 4.47Å; V512-K516 WeakPolarHBondContact O-CB 3.42Å; V512-K516 VanDerWaalsContact O-CG 3.24Å; V512-K516 WeakPolarHBondContact O-CG 3.43Å; V512-K516 PolarHBondContact O-N 3.15Å; V512-K516 VanDerWaalsContact O-N 3.1Å; V512-W531 HydrophobicContact CG2-CH2 3.71Å; V512-W531 HydrophobicContact CG2-CZ2 3.77Å
513	A	93.7	Very high	91.5	Very high	46 Å²	46	56.1 Å²	56.1	38%	0.38	32%	0.315	S	S	.	.	H	α-helix	trans	-66.2	-49.7	174.4	0	0	0	0	0	111	G509 E510 Y515 K516 S517	G509-A513 PolarHBondContact O-N 3Å; E510-A513 WeakPolarHBondContact O-CB 3.15Å; E510-A513 PolarHBondContact O-N 2.82Å; E510-A513 VanDerWaalsContact O-N 3.09Å; A513-Y515 PolarHBondContact O-N 2.9Å; A513-K516 CarbonylContact O-C 3.59Å; A513-K516 PolarHBondContact O-N 3.48Å; A513-K516 VanDerWaalsContact O-N 3.17Å; A513-S517 PolarHBondContact O-N 3.01Å
514	A	93.6	Very high	91.2	Very high	1 Å²	1	57.9 Å²	57.9	1%	0.008	32%	0.324	C	S	.	.	H	α-helix	trans	-59.4	-45.3	175.3	0	0	0	0	0	112.4	L451 F473 Y505 E510 K516 S517	L451-A514 HydrophobicContact CD1-CB 3.83Å; F473-A514 HydrophobicContact CB-CB 3.82Å; F473-A514 HydrophobicContact CD2-CB 3.63Å; F473-A514 HydrophobicContact CE2-CB 4.39Å; F473-A514 HydrophobicContact CG-CB 3.74Å; Y505-A514 HydrophobicContact CE1-CB 4.46Å; Y505-A514 HydrophobicContact CE2-CB 4.05Å; Y505-A514 WeakPolarHBondContact OH-CB 3.35Å; E510-A514 PolarHBondContact O-N 2.99Å; A514-K516 VanDerWaalsContact C-N 3.25Å; A514-K516 PolarHBondContact O-N 3.49Å; A514-S517 WeakPolarHBondContact O-CB 3.43Å; A514-S517 PolarHBondContact O-N 3.27Å; A514-S517 VanDerWaalsContact O-N 3.13Å; A514-S517 PolarHBondContact O-OG 2.88Å
515	Y	93.5	Very high	90.9	Very high	103 Å²	103	67 Å²	67	40%	0.404	36%	0.356	S	S	.	.	H	α-helix	trans	-64.4	-26.5	177.3	-177.7	-94.3	0	0	0	113.6	L451 A511 A513 V529 W531	L451-Y515 HydrophobicContact CD2-CD2 4.21Å; A511-Y515 VanDerWaalsContact O-CB 3.27Å; A511-Y515 WeakPolarHBondContact O-CB 3.45Å; A511-Y515 PolarHBondContact O-N 2.76Å; A513-Y515 PolarHBondContact O-N 2.9Å; Y515-V529 HydrophobicContact CD2-CG1 4.24Å; Y515-V529 WeakPolarHBondContact CE2-O 3.36Å; Y515-W531 HydrophobicContact CD1-CZ2 4.21Å; Y515-W531 AromaticContact CD1-NE1 3.34Å; Y515-W531 VanDerWaalsContact CD1-NE1 3.34Å; Y515-W531 AromaticContact CD2-CD1 3.8Å; Y515-W531 AromaticContact CD2-CE2 3.98Å; Y515-W531 HydrophobicContact CD2-CG 4.5Å; Y515-W531 AromaticContact CD2-NE1 3.43Å; Y515-W531 AromaticContact CE1-NE1 3.41Å; Y515-W531 AromaticContact CE2-CD1 3.49Å; Y515-W531 VanDerWaalsContact CE2-CD1 3.49Å; Y515-W531 HydrophobicContact CE2-CG 4.41Å; Y515-W531 AromaticContact CE2-NE1 3.5Å; Y515-W531 AromaticContact CG-CE2 3.77Å; Y515-W531 AromaticContact CG-CZ2 3.92Å; Y515-W531 HydrophobicContact CG-CZ2 3.92Å; Y515-W531 AromaticContact CG-NE1 3.35Å; Y515-W531 AromaticContact CZ-CD1 3.62Å; Y515-W531 AromaticContact CZ-NE1 3.49Å
516	K	92.4	Very high	90.4	Very high	157 Å²	157	74.5 Å²	74.5	68%	0.683	39%	0.389	S	S	*	.	H	α-helix	trans	-91.2	-5	175.7	-73.3	176.1	176.8	179.3	0	113.7	V512 A513 A514	V512-K516 HydrophobicContact CG1-CD 3.9Å; V512-K516 HydrophobicContact CG1-CG 4.47Å; V512-K516 WeakPolarHBondContact O-CB 3.42Å; V512-K516 VanDerWaalsContact O-CG 3.24Å; V512-K516 WeakPolarHBondContact O-CG 3.43Å; V512-K516 PolarHBondContact O-N 3.15Å; V512-K516 VanDerWaalsContact O-N 3.1Å; A513-K516 CarbonylContact O-C 3.59Å; A513-K516 PolarHBondContact O-N 3.48Å; A513-K516 VanDerWaalsContact O-N 3.17Å; A514-K516 VanDerWaalsContact C-N 3.25Å; A514-K516 PolarHBondContact O-N 3.49Å
517	S	90.5	Very high	90.2	Very high	36 Å²	36	73.7 Å²	73.7	25%	0.252	38%	0.38	S	S	.	.			trans	-68	135.1	-178.6	72.3	0	0	0	0	111.1	F473 A513 A514 T519	F473-S517 WeakPolarHBondContact CZ-OG 3.38Å; A513-S517 PolarHBondContact O-N 3.01Å; A514-S517 WeakPolarHBondContact O-CB 3.43Å; A514-S517 PolarHBondContact O-N 3.27Å; A514-S517 VanDerWaalsContact O-N 3.13Å; A514-S517 PolarHBondContact O-OG 2.88Å; S517-T519 WeakPolarHBondContact CB-OG1 3.41Å
518	T	86.9	Confident	90	Very high	144 Å²	144	75.3 Å²	75.3	88%	0.883	38%	0.381	S	S	*	.			trans	-99.4	3.7	174.1	52.4	0	0	0	0	112.3
519	T	88.5	Confident	90	Very high	69 Å²	69	71.7 Å²	71.7	42%	0.423	37%	0.371	S	S	.	.	S	Bend	trans	-68.1	127.9	177.3	43.5	0	0	0	0	110.8	S517 I521	S517-T519 WeakPolarHBondContact CB-OG1 3.41Å; T519-I521 PolarHBondContact O-N 2.87Å
520	P	86.2	Confident	89.8	Confident	50 Å²	50	73.5 Å²	73.5	33%	0.325	37%	0.365	S	S	.	.			trans	-72.3	113.7	-177.1	29.4	-34.8	0	0	0	111.5	F522 N523 R525	P520-F522 PolarHBondContact O-N 2.83Å; P520-F522 VanDerWaalsContact O-N 3.14Å; P520-N523 PolarHBondContact O-N 2.77Å; P520-N523 VanDerWaalsContact O-N 3.12Å; P520-R525 HydrophobicContact CB-CG 3.85Å
521	I	87.1	Confident	89.8	Confident	9 Å²	9	74.4 Å²	74.4	5%	0.046	37%	0.366	C	S	.	.	G	3₁₀ helix	trans	-59.7	117.9	178.3	-57.4	152.8	0	0	0	108.7	H469 F470 T519 N523 N524 I527 V529	H469-I521 VanDerWaalsContact CE1-CG1 3.46Å; H469-I521 WeakPolarHBondContact CE1-CG1 3.4Å; F470-I521 HydrophobicContact CE1-CD1 4.38Å; F470-I521 HydrophobicContact CE1-CG1 4.48Å; F470-I521 HydrophobicContact CE2-CG2 4.16Å; F470-I521 HydrophobicContact CZ-CD1 3.79Å; F470-I521 HydrophobicContact CZ-CG1 3.97Å; F470-I521 HydrophobicContact CZ-CG2 4.19Å; T519-I521 PolarHBondContact O-N 2.87Å; I521-N523 VanDerWaalsContact C-N 3.27Å; I521-N523 PolarHBondContact O-N 3.35Å; I521-N524 WeakPolarHBondContact O-CA 3.29Å; I521-N524 WeakPolarHBondContact O-CB 3.5Å; I521-N524 PolarHBondContact O-N 2.61Å; I521-I527 HydrophobicContact CB-CB 4.26Å; I521-I527 HydrophobicContact CB-CD1 4.07Å; I521-I527 HydrophobicContact CB-CG2 4.26Å; I521-I527 HydrophobicContact CD1-CB 4.11Å; I521-I527 HydrophobicContact CD1-CG2 3.63Å; I521-I527 HydrophobicContact CG2-CD1 3.85Å; I521-I527 HydrophobicContact CG2-CG2 4.28Å; I521-V529 HydrophobicContact CD1-CG2 3.55Å
522	F	86.5	Confident	89.4	Confident	52 Å²	52	75.5 Å²	75.5	23%	0.228	37%	0.371	C	S	.	.	G	3₁₀ helix	trans	52.8	38.1	-176.4	-45.5	-44.7	0	0	0	114.7	I456 L460 K465 L466 H469 P520 N524 I527	I456-F522 HydrophobicContact CG2-CE2 4.45Å; L460-F522 HydrophobicContact CB-CD2 3.92Å; L460-F522 HydrophobicContact CB-CE2 4.27Å; L460-F522 HydrophobicContact CD1-CB 3.93Å; L460-F522 HydrophobicContact CD1-CD2 4.11Å; L460-F522 HydrophobicContact CD1-CG 4.36Å; K465-F522 HydrophobicContact CB-CE1 3.84Å; K465-F522 HydrophobicContact CB-CZ 3.76Å; K465-F522 VanDerWaalsContact O-CE1 3.23Å; K465-F522 WeakPolarHBondContact O-CE1 3.15Å; K465-F522 WeakPolarHBondContact O-CZ 3.04Å; L466-F522 HydrophobicContact CD2-CE2 4.03Å; L466-F522 HydrophobicContact CD2-CZ 3.97Å; L466-F522 HydrophobicContact CG-CZ 4.39Å; H469-F522 HydrophobicContact CB-CE1 3.88Å; H469-F522 HydrophobicContact CB-CZ 4.49Å; P520-F522 PolarHBondContact O-N 2.83Å; P520-F522 VanDerWaalsContact O-N 3.14Å; F522-N524 PolarHBondContact O-N 2.81Å; F522-N524 VanDerWaalsContact O-N 3.08Å; F522-I527 HydrophobicContact CD2-CD1 3.97Å
523	N	86.7	Confident	88.9	Confident	153 Å²	153	80.5 Å²	80.5	82%	0.818	39%	0.39	S	S	*	.	G	3₁₀ helix	trans	60	9.5	-171.9	-64.9	-18	0	0	0	114.7	P520 I521	P520-N523 PolarHBondContact O-N 2.77Å; P520-N523 VanDerWaalsContact O-N 3.12Å; I521-N523 VanDerWaalsContact C-N 3.27Å; I521-N523 PolarHBondContact O-N 3.35Å
524	N	85.5	Confident	87.6	Confident	37 Å²	37	81.5 Å²	81.5	20%	0.198	39%	0.394	C	S	.	.			trans	-106.8	106.7	-178.4	-176	-9.4	0	0	0	111	I521 F522 F526 I527	I521-N524 WeakPolarHBondContact O-CA 3.29Å; I521-N524 WeakPolarHBondContact O-CB 3.5Å; I521-N524 PolarHBondContact O-N 2.61Å; F522-N524 PolarHBondContact O-N 2.81Å; F522-N524 VanDerWaalsContact O-N 3.08Å; N524-F526 PolarHBondContact O-N 2.76Å; N524-F526 WeakPolarHBondContact OD1-CB 3.39Å; N524-F526 WeakPolarHBondContact OD1-CD2 3.41Å; N524-F526 PolarHBondContact OD1-N 2.85Å; N524-I527 HydrophobicContact CB-CD1 4.02Å; N524-I527 HydrophobicContact CB-CG1 4.04Å
525	R	88.1	Confident	85.7	Confident	219 Å²	219	88.1 Å²	88.1	83%	0.826	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.5	-7	178.4	-67.9	180	-178.1	-177.6	1.5	114.4	P520	P520-R525 HydrophobicContact CB-CG 3.85Å
526	F	85.6	Confident	82.9	Confident	158 Å²	158	86.8 Å²	86.8	69%	0.693	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.8	-8.6	-178.9	-54.6	-71.4	0	0	0	113.8	N524 K528	N524-F526 PolarHBondContact O-N 2.76Å; N524-F526 WeakPolarHBondContact OD1-CB 3.39Å; N524-F526 WeakPolarHBondContact OD1-CD2 3.41Å; N524-F526 PolarHBondContact OD1-N 2.85Å; F526-K528 PolarHBondContact O-N 2.78Å
527	I	88.8	Confident	80.3	Confident	13 Å²	13	83.6 Å²	83.6	7%	0.067	42%	0.422	C	S	.	.			trans	-68.4	121.8	170.8	-59.8	-176.5	0	0	0	108.1	V453 I456 I521 F522 N524	V453-I527 HydrophobicContact CG1-CG2 3.39Å; I456-I527 HydrophobicContact CG1-CG2 4.33Å; I521-I527 HydrophobicContact CB-CB 4.26Å; I521-I527 HydrophobicContact CB-CD1 4.07Å; I521-I527 HydrophobicContact CB-CG2 4.26Å; I521-I527 HydrophobicContact CD1-CB 4.11Å; I521-I527 HydrophobicContact CD1-CG2 3.63Å; I521-I527 HydrophobicContact CG2-CD1 3.85Å; I521-I527 HydrophobicContact CG2-CG2 4.28Å; F522-I527 HydrophobicContact CD2-CD1 3.97Å; N524-I527 HydrophobicContact CB-CD1 4.02Å; N524-I527 HydrophobicContact CB-CG1 4.04Å
528	K	88.9	Confident	77.8	Confident	102 Å²	102	87.5 Å²	87.5	44%	0.443	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	132.9	-176.6	-64.8	-173.8	-178.3	-179.1	0	110.4	R454 F526 F530	R454-K528 PolarHBondContact N-O 3.09Å; R454-K528 PolarHBondContact O-N 2.88Å; F526-K528 PolarHBondContact O-N 2.78Å; K528-F530 HydrophobicContact CB-CD2 4.33Å; K528-F530 HydrophobicContact CB-CE2 3.52Å; K528-F530 HydrophobicContact CB-CZ 3.83Å; K528-F530 HydrophobicContact CD-CE2 4.3Å; K528-F530 HydrophobicContact CD-CZ 3.92Å; K528-F530 HydrophobicContact CG-CZ 4.5Å
529	V	91.4	Very high	75.5	Confident	31 Å²	31	84.7 Å²	84.7	19%	0.188	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	128.7	175.3	-171.8	0	0	0	0	109.2	L451 V453 Y515 I521	L451-V529 HydrophobicContact CB-CG1 3.95Å; L451-V529 HydrophobicContact CD1-CG1 3.87Å; L451-V529 HydrophobicContact CG-CG1 4.33Å; V453-V529 HydrophobicContact CG1-CG2 4.48Å; V453-V529 HydrophobicContact CG2-CG1 4.36Å; V453-V529 HydrophobicContact CG2-CG2 4.29Å; Y515-V529 HydrophobicContact CD2-CG1 4.24Å; Y515-V529 WeakPolarHBondContact CE2-O 3.36Å; I521-V529 HydrophobicContact CD1-CG2 3.55Å
530	F	91.2	Very high	73.4	Confident	89 Å²	89	85.8 Å²	85.8	39%	0.39	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	159.6	177	-61.9	-76.2	0	0	0	110.3	L451 E452 R454 K528 H532	L451-F530 CarbonylContact C-O 3.57Å; L451-F530 WeakPolarHBondContact CA-O 3.35Å; E452-F530 PolarHBondContact N-O 2.94Å; E452-F530 PolarHBondContact O-N 3.05Å; R454-F530 HydrophobicContact CB-CE2 4.36Å; R454-F530 HydrophobicContact CG-CD2 4.24Å; R454-F530 HydrophobicContact CG-CE2 4.42Å; K528-F530 HydrophobicContact CB-CD2 4.33Å; K528-F530 HydrophobicContact CB-CE2 3.52Å; K528-F530 HydrophobicContact CB-CZ 3.83Å; K528-F530 HydrophobicContact CD-CE2 4.3Å; K528-F530 HydrophobicContact CD-CZ 3.92Å; K528-F530 HydrophobicContact CG-CZ 4.5Å; F530-H532 PolarHBondContact O-N 2.9Å
531	W	92.8	Very high	71.4	Confident	57 Å²	57	87.8 Å²	87.8	22%	0.216	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	125.3	162.5	-72.3	94	0	0	0	108.6	N448 L451 A511 V512 Y515 K533	N448-W531 HydrophobicContact CB-CE3 3.97Å; N448-W531 HydrophobicContact CB-CZ3 4.32Å; N448-W531 VanDerWaalsContact O-CZ3 3.27Å; N448-W531 WeakPolarHBondContact O-CZ3 3.29Å; L451-W531 HydrophobicContact CD2-CD2 3.87Å; L451-W531 HydrophobicContact CD2-CE3 3.62Å; L451-W531 HydrophobicContact CD2-CH2 3.85Å; L451-W531 HydrophobicContact CD2-CZ2 4.08Å; L451-W531 HydrophobicContact CD2-CZ3 3.61Å; A511-W531 HydrophobicContact CB-CH2 3.82Å; A511-W531 HydrophobicContact CB-CZ3 4Å; V512-W531 HydrophobicContact CG2-CH2 3.71Å; V512-W531 HydrophobicContact CG2-CZ2 3.77Å; Y515-W531 HydrophobicContact CD1-CZ2 4.21Å; Y515-W531 AromaticContact CD1-NE1 3.34Å; Y515-W531 VanDerWaalsContact CD1-NE1 3.34Å; Y515-W531 AromaticContact CD2-CD1 3.8Å; Y515-W531 AromaticContact CD2-CE2 3.98Å; Y515-W531 HydrophobicContact CD2-CG 4.5Å; Y515-W531 AromaticContact CD2-NE1 3.43Å; Y515-W531 AromaticContact CE1-NE1 3.41Å; Y515-W531 AromaticContact CE2-CD1 3.49Å; Y515-W531 VanDerWaalsContact CE2-CD1 3.49Å; Y515-W531 HydrophobicContact CE2-CG 4.41Å; Y515-W531 AromaticContact CE2-NE1 3.5Å; Y515-W531 AromaticContact CG-CE2 3.77Å; Y515-W531 AromaticContact CG-CZ2 3.92Å; Y515-W531 HydrophobicContact CG-CZ2 3.92Å; Y515-W531 AromaticContact CG-NE1 3.35Å; Y515-W531 AromaticContact CZ-CD1 3.62Å; Y515-W531 AromaticContact CZ-NE1 3.49Å; W531-K533 PolarHBondContact O-N 3.13Å
532	H	87.4	Confident	69.3	Low	23 Å²	23	94.7 Å²	94.7	11%	0.106	47%	0.465	C	S	.	.			trans	-61.9	131.5	178.7	-178.3	48.4	0	0	0	109.6	N448 T450 E452 L502 F530	N448-H532 PolarHBondContact ND2-O 3.31Å; T450-H532 PolarHBondContact O-N 3.35Å; E452-H532 HydrophobicContact CB-CB 4.06Å; E452-H532 IonicContact OE2-CE1 2.71Å; E452-H532 IonicContact OE2-CG 2.65Å; E452-H532 IonicContact OE2-ND1 3.86Å; E452-H532 PolarHBondContact OE2-ND1 2.71Å; L502-H532 HydrophobicContact CD2-CB 4.27Å; L502-H532 WeakPolarHBondContact CD2-ND1 3.44Å; F530-H532 PolarHBondContact O-N 2.9Å
533	K	81.9	Confident	67.5	Low	141 Å²	141	99.8 Å²	99.8	61%	0.613	49%	0.489	S	S	*	.			trans	-104.6	111	168.5	-59.8	170.8	-170.6	167.9	0	105.4	W531 E535	W531-K533 PolarHBondContact O-N 3.13Å; K533-E535 PolarHBondContact O-N 2.84Å; K533-E535 VanDerWaalsContact O-N 3.07Å
534	S	65.6	Low	65.4	Low	67 Å²	67	98 Å²	98	47%	0.469	48%	0.476	S	S	.	.			trans	-62.5	112.3	169.6	36.9	0	0	0	0	108.4	T536	S534-T536 PolarHBondContact O-N 3.39Å
535	E	54.3	Low	63.5	Low	140 Å²	140	106.1 Å²	106.1	65%	0.654	50%	0.504	S	S	*	.			trans	-64.1	117.2	161.9	-68.6	-178.1	133.8	0	0	106.3	K533 T537	K533-E535 PolarHBondContact O-N 2.84Å; K533-E535 VanDerWaalsContact O-N 3.07Å; E535-T537 PolarHBondContact O-N 3.41Å
536	T	34.9	Very low	61.6	Low	75 Å²	75	100.4 Å²	100.4	46%	0.46	49%	0.493	S	S	.	.			trans	-76.6	78.1	-177.6	46.3	0	0	0	0	110.3	S534 D538 K541	S534-T536 PolarHBondContact O-N 3.39Å; T536-D538 PolarHBondContact O-N 3.05Å; T536-K541 PolarHBondContact O-NZ 2.92Å; T536-K541 PolarHBondContact OG1-NZ 3.49Å
537	T	36.9	Very low	60	Low	90 Å²	90	98.2 Å²	98.2	55%	0.552	49%	0.492	S	S	*	.			trans	-48.3	134.6	155	43.7	0	0	0	0	108.7	E535 S539 D540	E535-T537 PolarHBondContact O-N 3.41Å; T537-S539 PolarHBondContact O-N 2.97Å; T537-D540 PolarHBondContact O-N 3.45Å
538	D	38.2	Very low	58	Low	118 Å²	118	104.7 Å²	104.7	63%	0.631	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-4.9	-163	-66.3	-78	0	0	0	115.9	T536 K541	T536-D538 PolarHBondContact O-N 3.05Å; D538-K541 WeakPolarHBondContact OD1-CD 3.47Å; D538-K541 IonicContact OD1-NZ 2.95Å; D538-K541 PolarHBondContact OD1-NZ 3.17Å
539	S	39.3	Very low	55.9	Low	86 Å²	86	103.6 Å²	103.6	60%	0.601	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-53.8	172.3	-45.7	0	0	0	0	113	T537 K541 Q542	T537-S539 PolarHBondContact O-N 2.97Å; S539-K541 PolarHBondContact O-N 3.19Å; S539-K541 VanDerWaalsContact O-N 3.1Å; S539-Q542 PolarHBondContact O-N 3.1Å
540	D	45.2	Very low	53.8	Low	92 Å²	92	107.7 Å²	107.7	49%	0.492	55%	0.55	S	S	.	*	H	α-helix	trans	-68	-18.8	-170.3	-57.9	-3.2	0	0	0	112.7	T537 Q542 E544	T537-D540 PolarHBondContact O-N 3.45Å; D540-Q542 PolarHBondContact O-N 3.45Å; D540-E544 PolarHBondContact O-N 2.82Å
541	K	43.5	Very low	51.4	Low	92 Å²	92	107.4 Å²	107.4	40%	0.4	56%	0.564	S	S	.	*	H	α-helix	trans	-70.3	-13.9	179.4	-66	174.3	177.9	128.4	0	113.2	T536 D538 S539	T536-K541 PolarHBondContact O-NZ 2.92Å; T536-K541 PolarHBondContact OG1-NZ 3.49Å; D538-K541 WeakPolarHBondContact OD1-CD 3.47Å; D538-K541 IonicContact OD1-NZ 2.95Å; D538-K541 PolarHBondContact OD1-NZ 3.17Å; S539-K541 PolarHBondContact O-N 3.19Å; S539-K541 VanDerWaalsContact O-N 3.1Å
542	Q	43.5	Very low	49	Very low	154 Å²	154	112.6 Å²	112.6	72%	0.72	60%	0.596	S	S	*	*	H	α-helix	trans	-85.7	-40.2	178.5	-65.5	-167.5	-22.2	0	0	112.3	S539 D540	S539-Q542 PolarHBondContact O-N 3.1Å; D540-Q542 PolarHBondContact O-N 3.45Å
543	E	47.3	Very low	47	Very low	158 Å²	158	120.2 Å²	120.2	74%	0.738	63%	0.632	S	S	*	*	H	α-helix	trans	-72.6	-42	178.1	-63.7	-167.5	140.7	0	0	112.5	R545 V546 V547	E543-R545 PolarHBondContact O-N 2.71Å; E543-R545 VanDerWaalsContact O-N 3.1Å; E543-V546 PolarHBondContact O-N 3.05Å; E543-V546 VanDerWaalsContact O-N 3.08Å; E543-V547 PolarHBondContact O-N 3.42Å
544	E	42.4	Very low	44.8	Very low	115 Å²	115	119.1 Å²	119.1	54%	0.537	64%	0.642	S	S	.	*	H	α-helix	trans	-63.4	-21.9	179.7	-152.2	-166.8	147.1	0	0	112.6	D540 K548	D540-E544 PolarHBondContact O-N 2.82Å; E544-K548 PolarHBondContact O-N 3.25Å; E544-K548 WeakPolarHBondContact OE1-CE 3.49Å; E544-K548 IonicContact OE1-NZ 3.18Å; E544-K548 PolarHBondContact OE1-NZ 2.94Å
545	R	46.5	Very low	43.8	Very low	208 Å²	208	120.1 Å²	120.1	79%	0.785	66%	0.655	S	S	*	*	H	α-helix	trans	-80.6	-19.2	178.5	-150.6	176.6	-165.5	-166.3	3.2	113.7	E543 S549	E543-R545 PolarHBondContact O-N 2.71Å; E543-R545 VanDerWaalsContact O-N 3.1Å; R545-S549 PolarHBondContact O-OG 3.18Å
546	V	48.2	Very low	43.4	Very low	99 Å²	99	122.7 Å²	122.7	60%	0.6	66%	0.663	S	S	*	*	H	α-helix	trans	-88	-32.8	176.8	178.9	0	0	0	0	111.3	E543 S549 V550	E543-V546 PolarHBondContact O-N 3.05Å; E543-V546 VanDerWaalsContact O-N 3.08Å; V546-S549 PolarHBondContact O-OG 3.02Å; V546-V550 WeakPolarHBondContact O-CG2 3.46Å
547	V	51.3	Low	43.5	Very low	112 Å²	112	125.7 Å²	125.7	68%	0.679	68%	0.677	S	S	*	*	H	α-helix	trans	-79.5	-28.6	-179.3	-176.8	0	0	0	0	112.5	E543 S549	E543-V547 PolarHBondContact O-N 3.42Å; V547-S549 PolarHBondContact O-N 3.04Å
548	K	47.2	Very low	44.1	Very low	149 Å²	149	128.9 Å²	128.9	65%	0.648	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.2	-7.7	179.8	-90.6	174.5	173.1	168.3	0	115.8	E544	E544-K548 PolarHBondContact O-N 3.25Å; E544-K548 WeakPolarHBondContact OE1-CE 3.49Å; E544-K548 IonicContact OE1-NZ 3.18Å; E544-K548 PolarHBondContact OE1-NZ 2.94Å
549	S	44.1	Very low	44.5	Very low	80 Å²	80	132.2 Å²	132.2	56%	0.559	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.5	3.1	-179.8	52.7	0	0	0	0	114.5	R545 V546 V547	R545-S549 PolarHBondContact O-OG 3.18Å; V546-S549 PolarHBondContact O-OG 3.02Å; V547-S549 PolarHBondContact O-N 3.04Å
550	V	48.2	Very low	44.6	Very low	116 Å²	116	134.4 Å²	134.4	70%	0.703	71%	0.711	S	S	*	*	S	Bend	trans	-124	9.7	-173.7	-159.6	0	0	0	0	112.1	V546	V546-V550 WeakPolarHBondContact O-CG2 3.46Å
551	A	41.8	Very low	44.5	Very low	83 Å²	83	135.9 Å²	135.9	69%	0.686	72%	0.724	S	S	*	*	S	Bend	trans	-112.7	-8.7	-172.1	0	0	0	0	0	115.3
552	D	42.4	Very low	44.4	Very low	166 Å²	166	140.8 Å²	140.8	89%	0.888	75%	0.745	S	S	*	*	S	Bend	trans	-113.3	5.7	-177.8	-103.8	-45.8	0	0	0	113.4
553	E	43.8	Very low	44	Very low	183 Å²	183	139.3 Å²	139.3	86%	0.855	75%	0.749	S	S	*	*	S	Bend	trans	-109	33.6	-174.6	-154.1	176.9	118.8	0	0	113
554	S	37	Very low	43.7	Very low	119 Å²	119	137.4 Å²	137.4	83%	0.832	75%	0.753	S	S	*	*			trans	-152.6	59.6	-176.8	-162.3	0	0	0	0	114.5
555	A	43.9	Very low	43.9	Very low	88 Å²	88	140.1 Å²	140.1	73%	0.727	76%	0.763	S	S	*	*			trans	-159.1	107.8	165.2	0	0	0	0	0	113.1
556	K	45.4	Very low	43.5	Very low	193 Å²	193	137.5 Å²	137.5	84%	0.839	76%	0.764	S	S	*	*			trans	73.4	146.5	178.2	-48.3	168	-173.3	172.9	0	114
557	D	38.2	Very low	43	Very low	139 Å²	139	136 Å²	136	74%	0.743	77%	0.769	S	S	*	*			cis	-122.7	150.7	8.5	-115.4	-39.7	0	0	0	114.1
558	L	48.1	Very low	42.7	Very low	157 Å²	157	138.4 Å²	138.4	82%	0.822	78%	0.775	S	S	*	*			trans	-99.1	112.4	163.6	-87.5	74	0	0	0	108.4
559	Q	46.7	Very low	42.4	Very low	188 Å²	188	137.4 Å²	137.4	88%	0.879	78%	0.781	S	S	*	*			trans	-151.1	118.5	151.9	-121.4	153.8	107.4	0	0	114.7
560	V	41.7	Very low	42.2	Very low	131 Å²	131	137.2 Å²	137.2	79%	0.794	78%	0.784	S	S	*	*			trans	-51.5	136.8	-179.6	170.4	0	0	0	0	114
561	T	43.3	Very low	42	Very low	124 Å²	124	139.2 Å²	139.2	76%	0.761	79%	0.791	S	S	*	*				-162.6	111.5	129.8	9.3	0	0	0	0	114.7
562	K	41.7	Very low	42.1	Very low	194 Å²	194	143.7 Å²	143.7	84%	0.843	80%	0.798	S	S	*	*			trans	60.3	124.4	148.1	-63.1	178.6	-179.9	178.9	0	120.3
563	P	35.8	Very low	41.9	Very low	124 Å²	124	144.4 Å²	144.4	81%	0.805	79%	0.793	S	S	*	*			trans	-107.2	152.3	-178.3	39.6	-34	0	0	0	115.8
564	S	40.5	Very low	42.1	Very low	117 Å²	117	140.6 Å²	140.6	82%	0.818	78%	0.784	S	S	*	*			trans	178.3	150.6	153.8	-86.2	0	0	0	0	110.9
565	K	45.3	Very low	42.2	Very low	172 Å²	172	143.3 Å²	143.3	75%	0.748	78%	0.784	S	S	*	*			cis	-170.6	153.5	-25.5	-140.5	180	-178.9	-178.5	0	108.6
566	N	38.7	Very low	42.2	Very low	153 Å²	153	143.7 Å²	143.7	82%	0.818	78%	0.777	S	S	*	*			trans	69.4	157.5	174.3	-37.7	-23.1	0	0	0	113.2
567	G	37.7	Very low	41.9	Very low	67 Å²	67	141.6 Å²	141.6	69%	0.691	78%	0.775	S	S	*	*			cis	143.9	146.7	5.5	0	0	0	0	0	108.1
568	M	44.8	Very low	41.7	Very low	164 Å²	164	142 Å²	142	81%	0.808	78%	0.777	S	S	*	*			cis	-159.4	167.5	7.5	-113.6	100	73	0	0	110
569	T	41.7	Very low	41.3	Very low	128 Å²	128	139.3 Å²	139.3	79%	0.785	77%	0.771	S	S	*	*			trans	58.4	136.7	155	50.1	0	0	0	0	119.3
570	A	39.9	Very low	41.2	Very low	76 Å²	76	138.6 Å²	138.6	63%	0.628	77%	0.768	S	S	*	*			cis	75.5	138.6	38.7	0	0	0	0	0	113.3
571	D	43.5	Very low	41.1	Very low	157 Å²	157	141.1 Å²	141.1	84%	0.84	77%	0.768	S	S	*	*			cis	-118.4	-140.2	0	-74.8	-75.3	0	0	0	110.4
572	E	43.2	Very low	40.6	Very low	178 Å²	178	141.2 Å²	141.2	83%	0.832	76%	0.764	S	S	*	*			cis	-155.2	-149.5	2	-145.1	-122.4	76.2	0	0	111.5
573	K	40.1	Very low	40.6	Very low	180 Å²	180	139.2 Å²	139.2	78%	0.783	76%	0.763	S	S	*	*			trans	-111.5	171.5	-165.5	-102.3	-172	69.8	-165.8	0	116.6
574	P	47	Very low	40.6	Very low	103 Å²	103	137.2 Å²	137.2	67%	0.669	76%	0.764	S	S	*	*			trans	-106.8	158.1	-172.4	39.7	-34.2	0	0	0	116.1
575	E	38.4	Very low	40.5	Very low	177 Å²	177	139.2 Å²	139.2	83%	0.827	77%	0.771	S	S	*	*			trans	-164.1	160.1	168.2	-95	-60.8	60.3	0	0	108.4
576	V	44.1	Very low	39.9	Very low	96 Å²	96	133.9 Å²	133.9	58%	0.582	77%	0.765	S	S	*	*			cis	-162.5	161.8	-9.8	67.9	0	0	0	0	111.1
577	N	39.9	Very low	39.8	Very low	149 Å²	149	133.7 Å²	133.7	80%	0.797	77%	0.769	S	S	*	*			trans	73.6	139.5	154.9	-82.1	-27.6	0	0	0	125.6
578	N	34	Very low	39.7	Very low	147 Å²	147	138.8 Å²	138.8	79%	0.786	78%	0.775	S	S	*	*			trans	-72.5	160	157.1	-67.8	-60.2	0	0	0	111.9
579	S	38.8	Very low	39.7	Very low	100 Å²	100	137.1 Å²	137.1	70%	0.699	78%	0.777	S	S	*	*				172.1	135.8	108.1	-81	0	0	0	0	117.1
580	Q	44.6	Very low	39.3	Very low	174 Å²	174	136.3 Å²	136.3	81%	0.813	78%	0.776	S	S	*	*			trans	66	154.1	142	-66.5	-179.7	-83.9	0	0	122.1
581	K	39.4	Very low	39	Very low	184 Å²	184	137 Å²	137	80%	0.8	78%	0.782	S	S	*	*			trans	74.5	144.8	166.3	-69.6	179.7	-178.9	177.4	0	117.7
582	N	34.2	Very low	38.9	Very low	125 Å²	125	139.2 Å²	139.2	67%	0.668	78%	0.784	S	S	*	*			cis	179.9	161.9	-32.4	-119.2	43.6	0	0	0	106.9
583	D	40.5	Very low	38.2	Very low	153 Å²	153	139.6 Å²	139.6	82%	0.818	78%	0.779	S	S	*	*			trans	59.6	118.5	157.2	-51.1	-40.5	0	0	0	118.9
584	G	37.3	Very low	38.1	Very low	81 Å²	81	136.8 Å²	136.8	84%	0.835	78%	0.777	S	S	*	*			trans	-179.8	68.2	-178.3	0	0	0	0	0	114.1
585	V	37.4	Very low	37.4	Very low	159 Å²	159	139.8 Å²	139.8	96%	0.964	78%	0.779	S	S	*	*			trans	-77	134	-178.9	175.4	0	0	0	0	111.7
586	G	33.5	Very low	37.4	Very low	61 Å²	61	137.4 Å²	137.4	63%	0.629	78%	0.777	S	S	*	*			trans	162.4	124.3	154.6	0	0	0	0	0	120
587	V	35.7	Very low	37	Very low	149 Å²	149	137 Å²	137	90%	0.903	78%	0.779	S	S	*	*			trans	72.2	121.7	141	-172.5	0	0	0	0	119.7
588	Q	36.3	Very low	37	Very low	173 Å²	173	137.2 Å²	137.2	81%	0.808	78%	0.78	S	S	*	*			trans	-84.4	152.1	164.5	-62.8	-175.5	45.3	0	0	112.2	S590	Q588-S590 PolarHBondContact O-N 3.29Å
589	P	43.4	Very low	37.1	Very low	130 Å²	130	133.6 Å²	133.6	84%	0.844	78%	0.777	S	S	*	*			trans	-74.4	104	163.7	31	-32.2	0	0	0	110.9
590	S	34.7	Very low	36.7	Very low	111 Å²	111	138.4 Å²	138.4	78%	0.776	79%	0.786	S	S	*	*			trans	-69	151.3	172.7	-171.8	0	0	0	0	112.3	Q588	Q588-S590 PolarHBondContact O-N 3.29Å
591	A	32.8	Very low	36.4	Very low	91 Å²	91	134.6 Å²	134.6	75%	0.752	78%	0.784	S	S	*	*			trans	-65.9	144.9	177.4	0	0	0	0	0	112.4
592	K	40.6	Very low	36.1	Very low	202 Å²	202	132.3 Å²	132.3	88%	0.878	78%	0.78	S	S	*	*			trans	-112.5	95.5	167.4	-73.4	-172.3	177.2	-178.9	0	110.4
593	Y	28.6	Very low	36.4	Very low	186 Å²	186	131 Å²	131	73%	0.729	79%	0.786	S	S	*	*			trans	-79.6	112.9	166.2	173.5	-102.6	0	0	0	108.6	K595	Y593-K595 HydrophobicContact CD1-CB 4.28Å; Y593-K595 HydrophobicContact CE1-CB 3.67Å; Y593-K595 HydrophobicContact CE1-CD 3.99Å; Y593-K595 HydrophobicContact CE1-CG 3.99Å
594	V	38.3	Very low	36.2	Very low	121 Å²	121	134.3 Å²	134.3	73%	0.733	79%	0.787	S	S	*	*			trans	-97.6	123.3	171.4	177.8	0	0	0	0	108.2
595	K	31.8	Very low	36.5	Very low	167 Å²	167	141.6 Å²	141.6	73%	0.726	79%	0.79	S	S	*	*			trans	-113.2	110	179.4	-162.9	-173.7	-164.8	-180	0	108.4	Y593	Y593-K595 HydrophobicContact CD1-CB 4.28Å; Y593-K595 HydrophobicContact CE1-CB 3.67Å; Y593-K595 HydrophobicContact CE1-CD 3.99Å; Y593-K595 HydrophobicContact CE1-CG 3.99Å
596	T	38.9	Very low	36.7	Very low	126 Å²	126	141.4 Å²	141.4	77%	0.773	78%	0.783	S	S	*	*			trans	-130.2	132.8	167.6	-38.6	0	0	0	0	107.6
597	S	35.9	Very low	36.7	Very low	89 Å²	89	143.6 Å²	143.6	62%	0.622	80%	0.795	S	S	*	*			trans	-95.5	-163.4	-178.1	49.3	0	0	0	0	111.2
598	D	41.3	Very low	37	Very low	153 Å²	153	141.3 Å²	141.3	82%	0.818	79%	0.792	S	S	*	*			trans	85.7	145.8	156.7	-43.4	-22.7	0	0	0	118.5
599	G	36.2	Very low	37	Very low	71 Å²	71	137.8 Å²	137.8	73%	0.732	79%	0.793	S	S	*	*			trans	106.7	56.4	136.1	0	0	0	0	0	118.2	A601	G599-A601 PolarHBondContact O-N 2.69Å
600	F	29.6	Very low	37.3	Very low	201 Å²	201	137 Å²	137	88%	0.882	79%	0.787	S	S	*	*			trans	-53.6	122.8	163.4	-147.4	-94.3	0	0	0	111.5	L602	F600-L602 HydrophobicContact CD1-CD1 4.02Å; F600-L602 HydrophobicContact CE1-CD1 3.58Å
601	A	39.1	Very low	37.8	Very low	94 Å²	94	137 Å²	137	78%	0.777	78%	0.782	S	S	*	*			trans	-148.3	116.3	171.1	0	0	0	0	0	112.2	G599	G599-A601 PolarHBondContact O-N 2.69Å
602	L	33	Very low	38.6	Very low	136 Å²	136	140.6 Å²	140.6	71%	0.712	79%	0.789	S	S	*	*			trans	-81.7	130.6	172	-91.8	73.4	0	0	0	110.8	F600	F600-L602 HydrophobicContact CD1-CD1 4.02Å; F600-L602 HydrophobicContact CE1-CD1 3.58Å
603	A	40.4	Very low	39.4	Very low	96 Å²	96	139.9 Å²	139.9	79%	0.793	79%	0.786	S	S	*	*			trans	-126.2	89.4	165.8	0	0	0	0	0	110.7	R605	A603-R605 PolarHBondContact O-N 2.84Å
604	R	34.5	Very low	40.1	Very low	224 Å²	224	136.5 Å²	136.5	85%	0.845	78%	0.777	S	S	*	*			trans	-69.2	116.6	171.5	-71.9	-179	177.5	178.3	-0.6	110.2
605	R	43.7	Very low	40.5	Very low	234 Å²	234	134.8 Å²	134.8	88%	0.883	78%	0.775	S	S	*	*			trans	-141.3	98.1	154	-76.5	-160.7	171.4	89.8	1.3	112.6	A603	A603-R605 PolarHBondContact O-N 2.84Å
606	N	42.2	Very low	41.3	Very low	155 Å²	155	132.5 Å²	132.5	83%	0.829	77%	0.767	S	S	*	*			trans	22.6	114.4	148.1	-56.4	-5.6	0	0	0	120.5
607	A	34.6	Very low	41.8	Very low	107 Å²	107	133.1 Å²	133.1	88%	0.884	76%	0.759	S	S	*	*				56.6	90.5	124.9	0	0	0	0	0	120.2
608	A	40.3	Very low	42.6	Very low	101 Å²	101	132.2 Å²	132.2	84%	0.835	75%	0.751	S	S	*	*			trans	-141.3	139	138.4	0	0	0	0	0	108.5
609	A	37.4	Very low	43.3	Very low	99 Å²	99	129.1 Å²	129.1	82%	0.818	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-85.8	124.9	-174.5	0	0	0	0	0	111.9
610	P	49.1	Very low	44.3	Very low	112 Å²	112	133 Å²	133	73%	0.727	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-80.5	145.2	174.5	32.8	-33.5	0	0	0	111.5
611	T	45.6	Very low	45.6	Very low	111 Å²	111	128.3 Å²	128.3	68%	0.681	71%	0.714	S	S	*	*	P	Polyproline II helix	trans	-87	162.3	177.3	54	0	0	0	0	112.1	K613	T611-K613 PolarHBondContact O-N 2.8Å
612	D	49.7	Very low	46.9	Very low	168 Å²	168	129.4 Å²	129.4	90%	0.898	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.1	46.4	-165.1	-49.2	-88.6	0	0	0	116.7
613	K	56.9	Low	47.9	Very low	187 Å²	187	126.6 Å²	126.6	81%	0.813	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-125.2	2.9	-174.1	-70.1	-174.5	172.9	177.4	0	115.9	T611	T611-K613 PolarHBondContact O-N 2.8Å
614	E	43.9	Very low	49.2	Very low	115 Å²	115	126.4 Å²	126.4	54%	0.537	68%	0.681	S	S	.	*	S	Bend	trans	-101.6	-11.7	-178.9	-64.4	-129	88.7	0	0	114.9	E616 K617	E614-E616 VanDerWaalsContact C-N 3.29Å; E614-E616 PolarHBondContact O-N 3.07Å; E614-K617 PolarHBondContact O-N 3.29Å; E614-K617 WeakPolarHBondContact OE1-CE 3.4Å; E614-K617 IonicContact OE1-NZ 2.78Å; E614-K617 PolarHBondContact OE1-NZ 3.31Å
615	A	46.5	Very low	50.9	Low	84 Å²	84	120 Å²	120	69%	0.694	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.6	-20.6	-172.1	0	0	0	0	0	115.5	P618	A615-P618 WeakPolarHBondContact O-CD 3.4Å
616	E	48.6	Very low	52.2	Low	120 Å²	120	111.6 Å²	111.6	56%	0.561	64%	0.644	S	S	*	*	H	α-helix	trans	-73.2	-30.7	178.7	-89.6	-146.6	83.1	0	0	114.3	E614 V619 R620	E614-E616 VanDerWaalsContact C-N 3.29Å; E614-E616 PolarHBondContact O-N 3.07Å; E616-V619 PolarHBondContact O-N 2.78Å; E616-R620 VanDerWaalsContact CD-NH2 3.28Å; E616-R620 PolarHBondContact O-N 3.34Å; E616-R620 IonicContact OE1-CZ 2.77Å; E616-R620 VanDerWaalsContact OE1-CZ 3.23Å; E616-R620 IonicContact OE1-NE 2.76Å; E616-R620 PolarHBondContact OE1-NE 3.27Å; E616-R620 IonicContact OE1-NH2 3.97Å; E616-R620 PolarHBondContact OE1-NH2 2.99Å; E616-R620 IonicContact OE2-NH2 3.85Å; E616-R620 PolarHBondContact OE2-NH2 3.45Å; E616-R620 VanDerWaalsContact OE2-NH2 3.15Å
617	K	48.8	Very low	53.7	Low	138 Å²	138	110.1 Å²	110.1	60%	0.6	63%	0.63	S	S	*	*	H	α-helix	trans	-58.3	-48.2	-171.9	-65.2	178.1	-178.4	175.3	0	114	E614 V619	E614-K617 PolarHBondContact O-N 3.29Å; E614-K617 WeakPolarHBondContact OE1-CE 3.4Å; E614-K617 IonicContact OE1-NZ 2.78Å; E614-K617 PolarHBondContact OE1-NZ 3.31Å; K617-V619 PolarHBondContact O-N 2.98Å
618	P	53.7	Low	55.4	Low	71 Å²	71	111.4 Å²	111.4	46%	0.461	62%	0.617	S	S	.	*	H	α-helix	trans	-68.1	-33.4	-179	25.9	-35.1	0	0	0	113.4	A615 L621 I622	A615-P618 WeakPolarHBondContact O-CD 3.4Å; P618-L621 PolarHBondContact O-N 3.02Å; P618-I622 WeakPolarHBondContact O-CD1 3.35Å; P618-I622 VanDerWaalsContact O-CG1 3.32Å; P618-I622 WeakPolarHBondContact O-CG1 3.46Å; P618-I622 PolarHBondContact O-N 2.7Å; P618-I622 VanDerWaalsContact O-N 3.13Å
619	V	56.4	Low	56.9	Low	88 Å²	88	112.2 Å²	112.2	53%	0.533	61%	0.606	S	S	.	*	H	α-helix	trans	-64.8	-46.9	-176.5	-174.7	0	0	0	0	110.7	E616 K617 L621 I622 C623	E616-V619 PolarHBondContact O-N 2.78Å; K617-V619 PolarHBondContact O-N 2.98Å; V619-L621 VanDerWaalsContact C-N 3.33Å; V619-L621 PolarHBondContact O-N 3.39Å; V619-I622 PolarHBondContact O-N 2.88Å; V619-C623 PolarHBondContact O-N 2.99Å; V619-C623 VanDerWaalsContact O-N 3.09Å; V619-C623 PolarHBondContact O-SG 3.18Å; V619-C623 VanDerWaalsContact O-SG 3.36Å
620	R	56.1	Low	58.6	Low	153 Å²	153	111.2 Å²	111.2	58%	0.577	58%	0.583	S	S	*	*	H	α-helix	trans	-62.5	-38.3	-179.7	-62.5	-174	-174.4	-161.9	6.3	112.2	E616 C623 I624	E616-R620 VanDerWaalsContact CD-NH2 3.28Å; E616-R620 PolarHBondContact O-N 3.34Å; E616-R620 IonicContact OE1-CZ 2.77Å; E616-R620 VanDerWaalsContact OE1-CZ 3.23Å; E616-R620 IonicContact OE1-NE 2.76Å; E616-R620 PolarHBondContact OE1-NE 3.27Å; E616-R620 IonicContact OE1-NH2 3.97Å; E616-R620 PolarHBondContact OE1-NH2 2.99Å; E616-R620 IonicContact OE2-NH2 3.85Å; E616-R620 PolarHBondContact OE2-NH2 3.45Å; E616-R620 VanDerWaalsContact OE2-NH2 3.15Å; R620-C623 PolarHBondContact O-N 3.47Å; R620-I624 VanDerWaalsContact O-CG1 3.32Å; R620-I624 WeakPolarHBondContact O-CG1 3.42Å; R620-I624 PolarHBondContact O-N 2.99Å
621	L	57.5	Low	59.7	Low	101 Å²	101	109.3 Å²	109.3	53%	0.529	57%	0.567	S	S	.	*	H	α-helix	trans	-68.6	-37.6	177.8	-173.6	60.6	0	0	0	112.5	P618 V619 I624 N625	P618-L621 PolarHBondContact O-N 3.02Å; V619-L621 VanDerWaalsContact C-N 3.33Å; V619-L621 PolarHBondContact O-N 3.39Å; L621-I624 PolarHBondContact O-N 3.43Å; L621-N625 PolarHBondContact O-N 3.15Å
622	I	65.9	Low	61.1	Low	118 Å²	118	108 Å²	108	61%	0.605	56%	0.559	S	S	*	*	H	α-helix	trans	-61.9	-44.4	173.5	-68.2	163.8	0	0	0	110.5	P618 V619 I624 N625 A626	P618-I622 WeakPolarHBondContact O-CD1 3.35Å; P618-I622 VanDerWaalsContact O-CG1 3.32Å; P618-I622 WeakPolarHBondContact O-CG1 3.46Å; P618-I622 PolarHBondContact O-N 2.7Å; P618-I622 VanDerWaalsContact O-N 3.13Å; V619-I622 PolarHBondContact O-N 2.88Å; I622-I624 PolarHBondContact O-N 3.24Å; I622-N625 PolarHBondContact O-N 2.98Å; I622-A626 WeakPolarHBondContact O-CB 3.38Å; I622-A626 PolarHBondContact O-N 3.22Å
623	C	53.6	Low	62.2	Low	76 Å²	76	103.5 Å²	103.5	51%	0.514	54%	0.54	S	S	.	.	H	α-helix	trans	-62.3	-41.5	176.8	-64.8	0	0	0	0	112.9	V619 R620 A626 F627	V619-C623 PolarHBondContact O-N 2.99Å; V619-C623 VanDerWaalsContact O-N 3.09Å; V619-C623 PolarHBondContact O-SG 3.18Å; V619-C623 VanDerWaalsContact O-SG 3.36Å; R620-C623 PolarHBondContact O-N 3.47Å; C623-A626 PolarHBondContact O-N 3.1Å; C623-F627 WeakPolarHBondContact O-CB 3.32Å; C623-F627 PolarHBondContact O-N 3.45Å
624	I	68.8	Low	63.1	Low	92 Å²	92	99.2 Å²	99.2	47%	0.472	52%	0.522	S	S	.	.	H	α-helix	trans	-64.4	-44.6	177.9	-69	163.1	0	0	0	111.1	R620 L621 I622 F627 F628	R620-I624 VanDerWaalsContact O-CG1 3.32Å; R620-I624 WeakPolarHBondContact O-CG1 3.42Å; R620-I624 PolarHBondContact O-N 2.99Å; L621-I624 PolarHBondContact O-N 3.43Å; I622-I624 PolarHBondContact O-N 3.24Å; I624-F627 PolarHBondContact O-N 3.18Å; I624-F628 HydrophobicContact CG2-CD2 4.39Å; I624-F628 PolarHBondContact O-N 3.29Å
625	N	70.4	Confident	64.5	Low	89 Å²	89	96.5 Å²	96.5	48%	0.476	52%	0.516	S	S	.	.	H	α-helix	trans	-66	-40.1	178.7	-70.4	-2.9	0	0	0	111.8	L621 I622 F627 F628 L629	L621-N625 PolarHBondContact O-N 3.15Å; I622-N625 PolarHBondContact O-N 2.98Å; N625-F627 VanDerWaalsContact C-N 3.33Å; N625-F627 PolarHBondContact O-N 2.98Å; N625-F628 PolarHBondContact O-N 2.65Å; N625-L629 WeakPolarHBondContact O-CG 3.49Å; N625-L629 PolarHBondContact O-N 2.98Å
626	A	71.3	Confident	65.8	Low	58 Å²	58	95.3 Å²	95.3	48%	0.479	51%	0.506	S	S	.	.	H	α-helix	trans	-62.9	-39	174	0	0	0	0	0	112.2	I622 C623 L629 F630	I622-A626 WeakPolarHBondContact O-CB 3.38Å; I622-A626 PolarHBondContact O-N 3.22Å; C623-A626 PolarHBondContact O-N 3.1Å; A626-L629 PolarHBondContact O-N 3.39Å; A626-F630 WeakPolarHBondContact O-CB 3.25Å; A626-F630 PolarHBondContact O-N 3.03Å
627	F	72.1	Confident	67.1	Low	124 Å²	124	94.5 Å²	94.5	54%	0.544	51%	0.505	S	S	.	.	H	α-helix	trans	-66.5	-41.1	176.3	-175.7	-108.2	0	0	0	112.4	C623 I624 N625 F630 L631	C623-F627 WeakPolarHBondContact O-CB 3.32Å; C623-F627 PolarHBondContact O-N 3.45Å; I624-F627 PolarHBondContact O-N 3.18Å; N625-F627 VanDerWaalsContact C-N 3.33Å; N625-F627 PolarHBondContact O-N 2.98Å; F627-F630 PolarHBondContact O-N 3.1Å; F627-L631 HydrophobicContact CD1-CD1 3.88Å; F627-L631 HydrophobicContact CE1-CD1 3.47Å; F627-L631 VanDerWaalsContact CE1-CD1 3.47Å; F627-L631 HydrophobicContact CE1-CG 4.25Å; F627-L631 HydrophobicContact CZ-CD1 3.91Å; F627-L631 HydrophobicContact CZ-CD2 4.44Å; F627-L631 HydrophobicContact CZ-CG 4.29Å; F627-L631 WeakPolarHBondContact O-CG 3.38Å; F627-L631 PolarHBondContact O-N 3.5Å
628	F	70.5	Confident	68.5	Low	135 Å²	135	92.4 Å²	92.4	59%	0.592	50%	0.497	S	S	*	.	H	α-helix	trans	-62.7	-45.9	174.2	-106.7	-83	0	0	0	112.5	I624 N625 F630 L631 T632	I624-F628 HydrophobicContact CG2-CD2 4.39Å; I624-F628 PolarHBondContact O-N 3.29Å; N625-F628 PolarHBondContact O-N 2.65Å; F628-F630 VanDerWaalsContact C-N 3.28Å; F628-F630 PolarHBondContact O-N 3.4Å; F628-L631 PolarHBondContact O-N 3.48Å; F628-T632 PolarHBondContact O-N 3.24Å; F628-T632 PolarHBondContact O-OG1 2.95Å
629	L	72.9	Confident	69.7	Low	117 Å²	117	96.3 Å²	96.3	61%	0.613	51%	0.507	S	S	*	.	H	α-helix	trans	-63.3	-34.3	175.9	-71.2	171.5	0	0	0	112.3	N625 A626 T632 S633	N625-L629 WeakPolarHBondContact O-CG 3.49Å; N625-L629 PolarHBondContact O-N 2.98Å; A626-L629 PolarHBondContact O-N 3.39Å; L629-T632 WeakPolarHBondContact CA-OG1 3.48Å; L629-T632 PolarHBondContact O-OG1 3.36Å; L629-S633 VanDerWaalsContact O-CB 3.31Å; L629-S633 WeakPolarHBondContact O-CB 3.49Å; L629-S633 PolarHBondContact O-N 3.1Å; L629-S633 PolarHBondContact O-OG 3.31Å
630	F	72.3	Confident	70.6	Confident	78 Å²	78	95.5 Å²	95.5	34%	0.342	50%	0.504	S	S	.	.	H	α-helix	trans	-66.4	-46.8	173.3	176.7	-108.3	0	0	0	111.5	F235 A626 F627 F628 T632 S633 F634	F235-F630 AromaticContact CD1-CD2 3.98Å; F235-F630 HydrophobicContact CD1-CD2 3.98Å; F235-F630 AromaticContact CD1-CE2 3.41Å; F235-F630 HydrophobicContact CD1-CE2 3.41Å; F235-F630 VanDerWaalsContact CD1-CE2 3.41Å; F235-F630 HydrophobicContact CD1-CZ 4.03Å; F235-F630 HydrophobicContact CE1-CD2 4.4Å; F235-F630 AromaticContact CE1-CE2 3.73Å; F235-F630 HydrophobicContact CE1-CE2 3.73Å; F235-F630 HydrophobicContact CG-CE2 4.41Å; A626-F630 WeakPolarHBondContact O-CB 3.25Å; A626-F630 PolarHBondContact O-N 3.03Å; F627-F630 PolarHBondContact O-N 3.1Å; F628-F630 VanDerWaalsContact C-N 3.28Å; F628-F630 PolarHBondContact O-N 3.4Å; F630-T632 PolarHBondContact O-N 2.8Å; F630-S633 PolarHBondContact O-N 3.12Å; F630-F634 HydrophobicContact CZ-CB 4.47Å; F630-F634 HydrophobicContact CZ-CD2 4.29Å; F630-F634 WeakPolarHBondContact O-CB 3.43Å; F630-F634 PolarHBondContact O-N 3.07Å
631	L	73	Confident	71.7	Confident	73 Å²	73	92.4 Å²	92.4	38%	0.382	50%	0.499	S	S	.	.	H	α-helix	trans	-60.2	-42.9	178.3	-74.4	170.4	0	0	0	112.4	F627 F628 S635	F627-L631 HydrophobicContact CD1-CD1 3.88Å; F627-L631 HydrophobicContact CE1-CD1 3.47Å; F627-L631 VanDerWaalsContact CE1-CD1 3.47Å; F627-L631 HydrophobicContact CE1-CG 4.25Å; F627-L631 HydrophobicContact CZ-CD1 3.91Å; F627-L631 HydrophobicContact CZ-CD2 4.44Å; F627-L631 HydrophobicContact CZ-CG 4.29Å; F627-L631 WeakPolarHBondContact O-CG 3.38Å; F627-L631 PolarHBondContact O-N 3.5Å; F628-L631 PolarHBondContact O-N 3.48Å; L631-S635 VanDerWaalsContact O-CB 3.32Å; L631-S635 WeakPolarHBondContact O-CB 3.26Å; L631-S635 PolarHBondContact O-N 2.89Å; L631-S635 PolarHBondContact O-OG 2.9Å
632	T	74.4	Confident	72.8	Confident	83 Å²	83	95.8 Å²	95.8	51%	0.509	51%	0.505	S	S	.	.	H	α-helix	trans	-65.8	-39.5	175.4	52.8	0	0	0	0	112.2	F628 L629 F630 S635 A636	F628-T632 PolarHBondContact O-N 3.24Å; F628-T632 PolarHBondContact O-OG1 2.95Å; L629-T632 WeakPolarHBondContact CA-OG1 3.48Å; L629-T632 PolarHBondContact O-OG1 3.36Å; F630-T632 PolarHBondContact O-N 2.8Å; T632-S635 PolarHBondContact O-N 3.17Å; T632-A636 WeakPolarHBondContact O-CB 3.37Å; T632-A636 PolarHBondContact O-N 3.31Å
633	S	73	Confident	73.4	Confident	73 Å²	73	93.3 Å²	93.3	51%	0.51	50%	0.498	S	S	.	.	H	α-helix	trans	-68.4	-43.5	178.7	-57.1	0	0	0	0	112	L629 F630 S635 A636 L637	L629-S633 VanDerWaalsContact O-CB 3.31Å; L629-S633 WeakPolarHBondContact O-CB 3.49Å; L629-S633 PolarHBondContact O-N 3.1Å; L629-S633 PolarHBondContact O-OG 3.31Å; F630-S633 PolarHBondContact O-N 3.12Å; S633-S635 PolarHBondContact O-N 2.95Å; S633-A636 WeakPolarHBondContact O-CB 3.22Å; S633-A636 PolarHBondContact O-N 2.74Å; S633-A636 VanDerWaalsContact O-N 3.15Å; S633-L637 PolarHBondContact O-N 3.45Å
634	F	75.9	Confident	74.9	Confident	97 Å²	97	92.1 Å²	92.1	43%	0.425	49%	0.488	S	S	.	.	H	α-helix	trans	-63.1	-41.8	175.5	-173.1	-93.7	0	0	0	111.6	F630 A636 L637 Q638	F630-F634 HydrophobicContact CZ-CB 4.47Å; F630-F634 HydrophobicContact CZ-CD2 4.29Å; F630-F634 WeakPolarHBondContact O-CB 3.43Å; F630-F634 PolarHBondContact O-N 3.07Å; F634-A636 PolarHBondContact O-N 3.2Å; F634-L637 PolarHBondContact O-N 2.95Å; F634-Q638 WeakPolarHBondContact O-CB 3.41Å; F634-Q638 PolarHBondContact O-N 2.82Å
635	S	74	Confident	75.7	Confident	59 Å²	59	92.8 Å²	92.8	41%	0.413	49%	0.489	S	S	.	.	H	α-helix	trans	-65.2	-25.4	174.8	-56	0	0	0	0	113.4	L631 T632 S633 K639	L631-S635 VanDerWaalsContact O-CB 3.32Å; L631-S635 WeakPolarHBondContact O-CB 3.26Å; L631-S635 PolarHBondContact O-N 2.89Å; L631-S635 PolarHBondContact O-OG 2.9Å; T632-S635 PolarHBondContact O-N 3.17Å; S633-S635 PolarHBondContact O-N 2.95Å; S635-K639 WeakPolarHBondContact O-CD 3.48Å; S635-K639 VanDerWaalsContact O-CG 3.29Å; S635-K639 WeakPolarHBondContact O-CG 3.35Å
636	A	73.7	Confident	76.4	Confident	58 Å²	58	94 Å²	94	48%	0.479	50%	0.496	S	S	.	.	H	α-helix	trans	-80.4	-42.8	173	0	0	0	0	0	111.3	T632 S633 F634 K639 C640	T632-A636 WeakPolarHBondContact O-CB 3.37Å; T632-A636 PolarHBondContact O-N 3.31Å; S633-A636 WeakPolarHBondContact O-CB 3.22Å; S633-A636 PolarHBondContact O-N 2.74Å; S633-A636 VanDerWaalsContact O-N 3.15Å; F634-A636 PolarHBondContact O-N 3.2Å; A636-K639 WeakPolarHBondContact O-CB 3.41Å; A636-K639 PolarHBondContact O-N 2.86Å; A636-K639 VanDerWaalsContact O-N 3.13Å; A636-C640 PolarHBondContact O-N 2.84Å
637	L	75.9	Confident	77	Confident	103 Å²	103	97.4 Å²	97.4	54%	0.539	50%	0.501	S	S	.	.	H	α-helix	trans	-61.9	-46	178.3	-162.9	69.7	0	0	0	111.4	S633 F634 K639 C640 D641	S633-L637 PolarHBondContact O-N 3.45Å; F634-L637 PolarHBondContact O-N 2.95Å; L637-K639 PolarHBondContact O-N 3.46Å; L637-K639 VanDerWaalsContact O-N 3.17Å; L637-C640 CarbonylContact O-C 3.48Å; L637-C640 WeakPolarHBondContact O-CA 3.31Å; L637-C640 VanDerWaalsContact O-CB 3.26Å; L637-C640 WeakPolarHBondContact O-CB 3.38Å; L637-C640 PolarHBondContact O-N 3.37Å; L637-D641 PolarHBondContact O-N 3.34Å
638	Q	77.3	Confident	77.8	Confident	95 Å²	95	97.9 Å²	97.9	44%	0.444	50%	0.5	S	S	.	.	H	α-helix	trans	-61.9	-25.6	176	-167.5	-179.1	33.6	0	0	113.5	F634 R642	F634-Q638 WeakPolarHBondContact O-CB 3.41Å; F634-Q638 PolarHBondContact O-N 2.82Å; Q638-R642 WeakPolarHBondContact O-CB 3.43Å; Q638-R642 VanDerWaalsContact O-CG 3.29Å; Q638-R642 WeakPolarHBondContact O-CG 3.36Å; Q638-R642 PolarHBondContact O-N 2.7Å
639	K	78.5	Confident	78.6	Confident	153 Å²	153	94.6 Å²	94.6	67%	0.665	49%	0.491	S	S	*	.	H	α-helix	trans	-77.9	-36.9	171.4	-71.1	171.9	-176.6	-179.7	0	111.6	S635 A636 L637 S643	S635-K639 WeakPolarHBondContact O-CD 3.48Å; S635-K639 VanDerWaalsContact O-CG 3.29Å; S635-K639 WeakPolarHBondContact O-CG 3.35Å; A636-K639 WeakPolarHBondContact O-CB 3.41Å; A636-K639 PolarHBondContact O-N 2.86Å; A636-K639 VanDerWaalsContact O-N 3.13Å; L637-K639 PolarHBondContact O-N 3.46Å; L637-K639 VanDerWaalsContact O-N 3.17Å; K639-S643 WeakPolarHBondContact O-CB 3.39Å; K639-S643 PolarHBondContact O-N 3.11Å
640	C	74.7	Confident	79.4	Confident	71 Å²	71	93.9 Å²	93.9	48%	0.48	49%	0.488	S	S	.	.	H	α-helix	trans	-62.5	-52.8	174.3	-161.2	0	0	0	0	110.8	A636 L637 R642 S643 V644	A636-C640 PolarHBondContact O-N 2.84Å; L637-C640 CarbonylContact O-C 3.48Å; L637-C640 WeakPolarHBondContact O-CA 3.31Å; L637-C640 VanDerWaalsContact O-CB 3.26Å; L637-C640 WeakPolarHBondContact O-CB 3.38Å; L637-C640 PolarHBondContact O-N 3.37Å; C640-R642 VanDerWaalsContact C-N 3.34Å; C640-R642 PolarHBondContact O-N 2.67Å; C640-S643 WeakPolarHBondContact O-CA 3.15Å; C640-S643 WeakPolarHBondContact O-CB 3.5Å; C640-S643 PolarHBondContact O-N 3.08Å; C640-V644 PolarHBondContact O-N 3.08Å
641	D	80.3	Confident	80.2	Confident	88 Å²	88	95.1 Å²	95.1	47%	0.471	50%	0.497	S	S	.	.	H	α-helix	trans	-55.5	-48.3	179	-63.5	-31.2	0	0	0	111.2	L637 S643 V644 E645	L637-D641 PolarHBondContact O-N 3.34Å; D641-S643 VanDerWaalsContact C-N 3.29Å; D641-S643 PolarHBondContact O-N 3.15Å; D641-V644 PolarHBondContact O-N 2.83Å; D641-E645 PolarHBondContact O-N 3.47Å
642	R	80.9	Confident	81.1	Confident	171 Å²	171	96.8 Å²	96.8	65%	0.645	50%	0.503	S	S	*	.	H	α-helix	trans	-61.1	-33.9	175.1	-77.1	177.8	174.7	-176.2	-0.8	113.6	Q638 C640 L646	Q638-R642 WeakPolarHBondContact O-CB 3.43Å; Q638-R642 VanDerWaalsContact O-CG 3.29Å; Q638-R642 WeakPolarHBondContact O-CG 3.36Å; Q638-R642 PolarHBondContact O-N 2.7Å; C640-R642 VanDerWaalsContact C-N 3.34Å; C640-R642 PolarHBondContact O-N 2.67Å; R642-L646 VanDerWaalsContact O-CB 3.29Å; R642-L646 WeakPolarHBondContact O-CB 3.4Å; R642-L646 PolarHBondContact O-N 3.44Å
643	S	77.9	Confident	81.8	Confident	66 Å²	66	98.8 Å²	98.8	46%	0.462	51%	0.51	S	S	.	.	H	α-helix	trans	-70.6	-38.2	176.4	-167	0	0	0	0	111.6	K639 C640 D641 Q647	K639-S643 WeakPolarHBondContact O-CB 3.39Å; K639-S643 PolarHBondContact O-N 3.11Å; C640-S643 WeakPolarHBondContact O-CA 3.15Å; C640-S643 WeakPolarHBondContact O-CB 3.5Å; C640-S643 PolarHBondContact O-N 3.08Å; D641-S643 VanDerWaalsContact C-N 3.29Å; D641-S643 PolarHBondContact O-N 3.15Å; S643-Q647 WeakPolarHBondContact O-CG 3.39Å; S643-Q647 PolarHBondContact O-N 3.27Å
644	V	85.8	Confident	82.5	Confident	52 Å²	52	100.9 Å²	100.9	32%	0.315	51%	0.51	S	S	.	.	H	α-helix	trans	-70.1	-41.4	175.2	176.7	0	0	0	0	110.7	C640 D641 L646 Q647 R648	C640-V644 PolarHBondContact O-N 3.08Å; D641-V644 PolarHBondContact O-N 2.83Å; V644-L646 VanDerWaalsContact C-N 3.33Å; V644-L646 PolarHBondContact O-N 3.27Å; V644-Q647 PolarHBondContact O-N 3.21Å; V644-R648 WeakPolarHBondContact O-CG 3.31Å; V644-R648 PolarHBondContact O-N 3.5Å
645	E	85	Confident	83.2	Confident	105 Å²	105	99.9 Å²	99.9	49%	0.491	51%	0.509	S	S	.	.	H	α-helix	trans	-59	-45.2	174	-135	80.5	-83.1	0	0	111.2	D641 Q647 R648 T649	D641-E645 PolarHBondContact O-N 3.47Å; E645-Q647 VanDerWaalsContact C-N 3.33Å; E645-Q647 PolarHBondContact O-N 3.05Å; E645-R648 WeakPolarHBondContact O-CB 3.41Å; E645-R648 PolarHBondContact O-N 3.5Å; E645-R648 IonicContact OE1-CZ 2.69Å; E645-R648 IonicContact OE1-NH1 3.72Å; E645-R648 PolarHBondContact OE1-NH1 3.08Å; E645-T649 PolarHBondContact O-N 3.46Å; E645-T649 PolarHBondContact O-OG1 3.27Å
646	L	84.3	Confident	83.9	Confident	116 Å²	116	101.2 Å²	101.2	61%	0.607	51%	0.512	S	S	*	.	H	α-helix	trans	-68.2	-32.1	179.2	-167	147	0	0	0	112.2	R642 V644 T649 N650	R642-L646 VanDerWaalsContact O-CB 3.29Å; R642-L646 WeakPolarHBondContact O-CB 3.4Å; R642-L646 PolarHBondContact O-N 3.44Å; V644-L646 VanDerWaalsContact C-N 3.33Å; V644-L646 PolarHBondContact O-N 3.27Å; L646-T649 WeakPolarHBondContact CA-OG1 3.19Å; L646-T649 PolarHBondContact O-OG1 3.49Å; L646-N650 VanDerWaalsContact O-CB 3.24Å; L646-N650 WeakPolarHBondContact O-CB 3.35Å; L646-N650 PolarHBondContact O-N 2.62Å; L646-N650 VanDerWaalsContact O-N 3.08Å
647	Q	83.8	Confident	84.6	Confident	129 Å²	129	101.9 Å²	101.9	60%	0.603	50%	0.502	S	S	*	.	H	α-helix	trans	-67.2	-40.8	169.7	-77.5	176.2	-38.3	0	0	112.3	S643 V644 E645 L651	S643-Q647 WeakPolarHBondContact O-CG 3.39Å; S643-Q647 PolarHBondContact O-N 3.27Å; V644-Q647 PolarHBondContact O-N 3.21Å; E645-Q647 VanDerWaalsContact C-N 3.33Å; E645-Q647 PolarHBondContact O-N 3.05Å; Q647-L651 WeakPolarHBondContact O-CB 3.27Å; Q647-L651 PolarHBondContact O-N 3.42Å
648	R	89.4	Confident	85.2	Confident	134 Å²	134	100.1 Å²	100.1	51%	0.506	49%	0.492	S	S	.	.	H	α-helix	trans	-61.6	-52.4	174	-71.9	176.8	-176.4	131.2	3.7	111.5	V644 E645 N650 L651 E652	V644-R648 WeakPolarHBondContact O-CG 3.31Å; V644-R648 PolarHBondContact O-N 3.5Å; E645-R648 WeakPolarHBondContact O-CB 3.41Å; E645-R648 PolarHBondContact O-N 3.5Å; E645-R648 IonicContact OE1-CZ 2.69Å; E645-R648 IonicContact OE1-NH1 3.72Å; E645-R648 PolarHBondContact OE1-NH1 3.08Å; R648-N650 VanDerWaalsContact C-N 3.27Å; R648-N650 PolarHBondContact O-N 2.97Å; R648-L651 WeakPolarHBondContact O-CB 3.27Å; R648-L651 PolarHBondContact O-N 3.4Å; R648-L651 VanDerWaalsContact O-N 3.11Å; R648-E652 WeakPolarHBondContact O-CG 3.24Å; R648-E652 PolarHBondContact O-N 3.46Å
649	T	87.8	Confident	85.8	Confident	66 Å²	66	101.4 Å²	101.4	41%	0.405	50%	0.498	S	S	.	.	H	α-helix	trans	-64	-32.4	-178.4	54.7	0	0	0	0	112.5	E645 L646 L653	E645-T649 PolarHBondContact O-N 3.46Å; E645-T649 PolarHBondContact O-OG1 3.27Å; L646-T649 WeakPolarHBondContact CA-OG1 3.19Å; L646-T649 PolarHBondContact O-OG1 3.49Å; T649-L653 WeakPolarHBondContact O-CB 3.33Å; T649-L653 VanDerWaalsContact O-CG 3.23Å; T649-L653 WeakPolarHBondContact O-CG 3.49Å; T649-L653 PolarHBondContact O-N 2.98Å
650	N	88.9	Confident	86.2	Confident	102 Å²	102	99.2 Å²	99.2	55%	0.545	49%	0.49	S	S	.	.	H	α-helix	trans	-69.3	-42.1	174	-166.4	-10.6	0	0	0	111.3	L646 R648 E652 L653 F654	L646-N650 VanDerWaalsContact O-CB 3.24Å; L646-N650 WeakPolarHBondContact O-CB 3.35Å; L646-N650 PolarHBondContact O-N 2.62Å; L646-N650 VanDerWaalsContact O-N 3.08Å; R648-N650 VanDerWaalsContact C-N 3.27Å; R648-N650 PolarHBondContact O-N 2.97Å; N650-E652 PolarHBondContact O-N 3.04Å; N650-L653 PolarHBondContact O-N 3.49Å; N650-F654 WeakPolarHBondContact O-CB 3.5Å; N650-F654 PolarHBondContact O-N 3.05Å
651	L	90.4	Very high	86.6	Confident	104 Å²	104	98.3 Å²	98.3	55%	0.545	48%	0.479	S	S	.	.	H	α-helix	trans	-64.2	-38.4	173.5	-175.7	64.1	0	0	0	112.4	Q647 R648 F654 N655	Q647-L651 WeakPolarHBondContact O-CB 3.27Å; Q647-L651 PolarHBondContact O-N 3.42Å; R648-L651 WeakPolarHBondContact O-CB 3.27Å; R648-L651 PolarHBondContact O-N 3.4Å; R648-L651 VanDerWaalsContact O-N 3.11Å; L651-F654 PolarHBondContact O-N 3.07Å; L651-N655 WeakPolarHBondContact O-CB 3.36Å; L651-N655 VanDerWaalsContact O-CG 3.27Å; L651-N655 PolarHBondContact O-N 3.02Å; L651-N655 PolarHBondContact O-ND2 2.92Å
652	E	90.9	Very high	87	Confident	108 Å²	108	100.6 Å²	100.6	51%	0.505	49%	0.485	S	S	.	.	H	α-helix	trans	-64.4	-45.2	173.9	-73.7	166.4	-169.9	0	0	111.6	R648 N650 N655 N656	R648-E652 WeakPolarHBondContact O-CG 3.24Å; R648-E652 PolarHBondContact O-N 3.46Å; N650-E652 PolarHBondContact O-N 3.04Å; E652-N655 PolarHBondContact O-N 3.23Å; E652-N656 WeakPolarHBondContact O-CB 3.04Å; E652-N656 PolarHBondContact O-N 3.12Å; E652-N656 PolarHBondContact O-ND2 3.44Å
653	L	88.4	Confident	87.3	Confident	125 Å²	125	98.6 Å²	98.6	65%	0.654	48%	0.481	S	S	*	.	H	α-helix	trans	-61.7	-42.8	174.3	-74.8	168.2	0	0	0	111.7	T649 N650 N656 Y657	T649-L653 WeakPolarHBondContact O-CB 3.33Å; T649-L653 VanDerWaalsContact O-CG 3.23Å; T649-L653 WeakPolarHBondContact O-CG 3.49Å; T649-L653 PolarHBondContact O-N 2.98Å; N650-L653 PolarHBondContact O-N 3.49Å; L653-N656 PolarHBondContact O-N 3.24Å; L653-Y657 WeakPolarHBondContact O-CB 3.43Å; L653-Y657 PolarHBondContact O-N 2.87Å
654	F	88.8	Confident	87.6	Confident	116 Å²	116	96.6 Å²	96.6	51%	0.509	47%	0.465	S	S	.	.	H	α-helix	trans	-62.9	-42.3	175.3	-176.8	-96.8	0	0	0	112.3	N650 L651 Y657 M658	N650-F654 WeakPolarHBondContact O-CB 3.5Å; N650-F654 PolarHBondContact O-N 3.05Å; L651-F654 PolarHBondContact O-N 3.07Å; F654-Y657 PolarHBondContact O-N 3.37Å; F654-M658 HydrophobicContact CD1-CG 4.11Å; F654-M658 HydrophobicContact CE1-CG 3.7Å; F654-M658 HydrophobicContact CE1-SD 4.44Å; F654-M658 HydrophobicContact CE2-CG 4.42Å; F654-M658 HydrophobicContact CZ-CG 3.87Å; F654-M658 HydrophobicContact CZ-SD 4.07Å; F654-M658 WeakPolarHBondContact O-CB 3.46Å; F654-M658 VanDerWaalsContact O-CG 3.31Å; F654-M658 WeakPolarHBondContact O-CG 3.48Å; F654-M658 PolarHBondContact O-N 3.01Å
655	N	89.7	Confident	87.5	Confident	77 Å²	77	99.9 Å²	99.9	41%	0.412	48%	0.475	S	S	.	.	H	α-helix	trans	-64.8	-45	175.8	-75	-23.5	0	0	0	111.9	L651 E652 Y657 M658 E659	L651-N655 WeakPolarHBondContact O-CB 3.36Å; L651-N655 VanDerWaalsContact O-CG 3.27Å; L651-N655 PolarHBondContact O-N 3.02Å; L651-N655 PolarHBondContact O-ND2 2.92Å; E652-N655 PolarHBondContact O-N 3.23Å; N655-Y657 VanDerWaalsContact C-N 3.31Å; N655-Y657 PolarHBondContact O-N 3.47Å; N655-M658 PolarHBondContact O-N 3.39Å; N655-E659 WeakPolarHBondContact O-CG 3.39Å; N655-E659 PolarHBondContact O-N 3.14Å
656	N	90.3	Very high	87.5	Confident	87 Å²	87	97.2 Å²	97.2	47%	0.465	47%	0.471	S	S	.	.	H	α-helix	trans	-58.8	-42.5	174.3	-83.4	-89.8	0	0	0	111.6	E652 L653 E659 Q660	E652-N656 WeakPolarHBondContact O-CB 3.04Å; E652-N656 PolarHBondContact O-N 3.12Å; E652-N656 PolarHBondContact O-ND2 3.44Å; L653-N656 PolarHBondContact O-N 3.24Å; N656-E659 PolarHBondContact O-N 3.34Å; N656-Q660 WeakPolarHBondContact O-CG 3.42Å; N656-Q660 PolarHBondContact O-N 3.29Å
657	Y	88	Confident	87.5	Confident	72 Å²	72	97.5 Å²	97.5	28%	0.282	46%	0.464	S	S	.	.	H	α-helix	trans	-62.3	-45.5	175.2	177.6	-93.3	0	0	0	112.1	L653 F654 N655 E659 Q660 Q661 N687	L653-Y657 WeakPolarHBondContact O-CB 3.43Å; L653-Y657 PolarHBondContact O-N 2.87Å; F654-Y657 PolarHBondContact O-N 3.37Å; N655-Y657 VanDerWaalsContact C-N 3.31Å; N655-Y657 PolarHBondContact O-N 3.47Å; Y657-E659 VanDerWaalsContact C-N 3.32Å; Y657-E659 PolarHBondContact O-N 2.92Å; Y657-Q660 PolarHBondContact O-N 2.86Å; Y657-Q661 HydrophobicContact CD1-CG 4.37Å; Y657-Q661 HydrophobicContact CE1-CG 3.95Å; Y657-Q661 PolarHBondContact O-N 3.05Å; Y657-Q661 PolarHBondContact OH-NE2 3.38Å; Y657-N687 HydrophobicContact CE2-CB 4.16Å; Y657-N687 WeakPolarHBondContact CE2-O 3.39Å; Y657-N687 PolarHBondContact OH-O 2.87Å
658	M	88.6	Confident	87.3	Confident	65 Å²	65	92.7 Å²	92.7	32%	0.32	44%	0.442	S	S	.	.	H	α-helix	trans	-64	-34.3	176	-73.3	-62.4	-61.8	0	0	112.6	F654 N655 K662	F654-M658 HydrophobicContact CD1-CG 4.11Å; F654-M658 HydrophobicContact CE1-CG 3.7Å; F654-M658 HydrophobicContact CE1-SD 4.44Å; F654-M658 HydrophobicContact CE2-CG 4.42Å; F654-M658 HydrophobicContact CZ-CG 3.87Å; F654-M658 HydrophobicContact CZ-SD 4.07Å; F654-M658 WeakPolarHBondContact O-CB 3.46Å; F654-M658 VanDerWaalsContact O-CG 3.31Å; F654-M658 WeakPolarHBondContact O-CG 3.48Å; F654-M658 PolarHBondContact O-N 3.01Å; N655-M658 PolarHBondContact O-N 3.39Å; M658-K662 WeakPolarHBondContact O-CB 3.14Å; M658-K662 WeakPolarHBondContact O-CD 3.45Å; M658-K662 WeakPolarHBondContact O-CG 3.36Å; M658-K662 PolarHBondContact O-N 3.42Å
659	E	89.6	Confident	86.9	Confident	123 Å²	123	94 Å²	94	58%	0.575	45%	0.454	S	S	*	.	H	α-helix	trans	-70.3	-41.4	173.3	-75	179.1	-174.3	0	0	112.2	N655 N656 Y657 Q661 K662 F663	N655-E659 WeakPolarHBondContact O-CG 3.39Å; N655-E659 PolarHBondContact O-N 3.14Å; N656-E659 PolarHBondContact O-N 3.34Å; Y657-E659 VanDerWaalsContact C-N 3.32Å; Y657-E659 PolarHBondContact O-N 2.92Å; E659-Q661 PolarHBondContact O-N 3.38Å; E659-K662 PolarHBondContact O-N 3.13Å; E659-F663 WeakPolarHBondContact O-CB 3.44Å; E659-F663 PolarHBondContact O-N 3.26Å
660	Q	86.3	Confident	86.7	Confident	106 Å²	106	96.1 Å²	96.1	50%	0.495	47%	0.467	S	S	.	.	H	α-helix	trans	-61.3	-42.4	172.3	-72.8	176.5	11.8	0	0	111.8	N656 Y657 F663 L664	N656-Q660 WeakPolarHBondContact O-CG 3.42Å; N656-Q660 PolarHBondContact O-N 3.29Å; Y657-Q660 PolarHBondContact O-N 2.86Å; Q660-F663 PolarHBondContact O-N 3.38Å; Q660-L664 WeakPolarHBondContact O-CG 3.08Å; Q660-L664 PolarHBondContact O-N 3.36Å
661	Q	84.2	Confident	86.1	Confident	53 Å²	53	92.4 Å²	92.4	25%	0.248	45%	0.449	C	S	.	.	H	α-helix	trans	-62.2	-47.8	173.5	-74.7	-157.2	-27.4	0	0	112	Y657 E659 F663 L664 F665	Y657-Q661 HydrophobicContact CD1-CG 4.37Å; Y657-Q661 HydrophobicContact CE1-CG 3.95Å; Y657-Q661 PolarHBondContact O-N 3.05Å; Y657-Q661 PolarHBondContact OH-NE2 3.38Å; E659-Q661 PolarHBondContact O-N 3.38Å; Q661-F663 VanDerWaalsContact C-N 3.29Å; Q661-F663 PolarHBondContact O-N 3.09Å; Q661-L664 PolarHBondContact O-N 2.86Å; Q661-L664 VanDerWaalsContact O-N 3.17Å; Q661-F665 WeakPolarHBondContact O-CD2 3.31Å; Q661-F665 PolarHBondContact O-N 3.05Å
662	K	88.3	Confident	85.4	Confident	135 Å²	135	94.5 Å²	94.5	59%	0.587	46%	0.461	S	S	*	.	H	α-helix	trans	-56.4	-42.7	175.5	-74.6	165.8	-176.4	173.8	0	112.1	M658 E659 F665 A666	M658-K662 WeakPolarHBondContact O-CB 3.14Å; M658-K662 WeakPolarHBondContact O-CD 3.45Å; M658-K662 WeakPolarHBondContact O-CG 3.36Å; M658-K662 PolarHBondContact O-N 3.42Å; E659-K662 PolarHBondContact O-N 3.13Å; K662-F665 PolarHBondContact O-N 2.9Å; K662-A666 WeakPolarHBondContact O-CB 3.23Å; K662-A666 PolarHBondContact O-N 3.14Å
663	F	86.6	Confident	84.9	Confident	130 Å²	130	94.4 Å²	94.4	57%	0.57	46%	0.464	S	S	*	.	H	α-helix	trans	-65.1	-41.4	177	-177.5	-97.3	0	0	0	112.3	E659 Q660 Q661 R667	E659-F663 WeakPolarHBondContact O-CB 3.44Å; E659-F663 PolarHBondContact O-N 3.26Å; Q660-F663 PolarHBondContact O-N 3.38Å; Q661-F663 VanDerWaalsContact C-N 3.29Å; Q661-F663 PolarHBondContact O-N 3.09Å; F663-R667 VanDerWaalsContact O-CB 3.29Å; F663-R667 WeakPolarHBondContact O-CB 3.43Å; F663-R667 PolarHBondContact O-N 2.96Å
664	L	83.6	Confident	84.4	Confident	23 Å²	23	92.2 Å²	92.2	12%	0.12	46%	0.463	C	S	.	.	H	α-helix	trans	-63.7	-42	174.8	-71.9	165.9	0	0	0	111.9	Q660 Q661 R667 L668 L680 V683	Q660-L664 WeakPolarHBondContact O-CG 3.08Å; Q660-L664 PolarHBondContact O-N 3.36Å; Q661-L664 PolarHBondContact O-N 2.86Å; Q661-L664 VanDerWaalsContact O-N 3.17Å; L664-R667 PolarHBondContact O-N 3.3Å; L664-L668 WeakPolarHBondContact O-CB 3.42Å; L664-L668 WeakPolarHBondContact O-CG 3.19Å; L664-L668 PolarHBondContact O-N 3.46Å; L664-L680 HydrophobicContact CD2-CD2 3.78Å; L664-V683 HydrophobicContact CD1-CG1 4.11Å; L664-V683 HydrophobicContact CD2-CG1 4Å
665	F	83.9	Confident	84	Confident	122 Å²	122	91.3 Å²	91.3	54%	0.535	46%	0.46	S	S	.	.	H	α-helix	trans	-65	-49	175.2	-78.6	-65.3	0	0	0	112.3	Q661 K662 R667 L668 E669	Q661-F665 WeakPolarHBondContact O-CD2 3.31Å; Q661-F665 PolarHBondContact O-N 3.05Å; K662-F665 PolarHBondContact O-N 2.9Å; F665-R667 PolarHBondContact O-N 3.45Å; F665-L668 HydrophobicContact CD1-CD1 4.46Å; F665-L668 WeakPolarHBondContact O-CB 3.16Å; F665-L668 PolarHBondContact O-N 2.9Å; F665-E669 WeakPolarHBondContact O-CG 3.48Å; F665-E669 PolarHBondContact O-N 3.24Å
666	A	85.7	Confident	83.5	Confident	48 Å²	48	90.6 Å²	90.6	40%	0.397	46%	0.456	S	S	.	.	H	α-helix	trans	-59.5	-31.8	176.4	0	0	0	0	0	112.6	K662 T670	K662-A666 WeakPolarHBondContact O-CB 3.23Å; K662-A666 PolarHBondContact O-N 3.14Å; A666-T670 WeakPolarHBondContact O-CB 3.41Å; A666-T670 WeakPolarHBondContact O-CG2 3.4Å; A666-T670 PolarHBondContact O-N 2.95Å; A666-T670 PolarHBondContact O-OG1 3.43Å
667	R	83.6	Confident	83.1	Confident	123 Å²	123	89.8 Å²	89.8	46%	0.464	45%	0.449	S	S	.	.	H	α-helix	trans	-78	-30.2	174.9	-158.4	173.9	-178.5	101.1	-0.3	113.1	F663 L664 F665 C671 L680	F663-R667 VanDerWaalsContact O-CB 3.29Å; F663-R667 WeakPolarHBondContact O-CB 3.43Å; F663-R667 PolarHBondContact O-N 2.96Å; L664-R667 PolarHBondContact O-N 3.3Å; F665-R667 PolarHBondContact O-N 3.45Å; R667-C671 WeakPolarHBondContact O-CB 3.4Å; R667-C671 PolarHBondContact O-N 3.48Å; R667-C671 VanDerWaalsContact O-N 3.13Å; R667-C671 PolarHBondContact O-SG 2.69Å; R667-C671 VanDerWaalsContact O-SG 3.34Å; R667-L680 HydrophobicContact CB-CD1 4.24Å; R667-L680 HydrophobicContact CG-CD1 4Å; R667-L680 HydrophobicContact CG-CD2 4.42Å
668	L	79.8	Confident	82.9	Confident	28 Å²	28	91.6 Å²	91.6	15%	0.147	46%	0.458	C	S	.	.	H	α-helix	trans	-68.6	-35.2	170.4	-81.7	163	0	0	0	112.4	L664 F665 K677 L680 L681	L664-L668 WeakPolarHBondContact O-CB 3.42Å; L664-L668 WeakPolarHBondContact O-CG 3.19Å; L664-L668 PolarHBondContact O-N 3.46Å; F665-L668 HydrophobicContact CD1-CD1 4.46Å; F665-L668 WeakPolarHBondContact O-CB 3.16Å; F665-L668 PolarHBondContact O-N 2.9Å; L668-K677 HydrophobicContact CD2-CB 4.42Å; L668-K677 HydrophobicContact CD2-CG 4.23Å; L668-K677 WeakPolarHBondContact O-CE 3.35Å; L668-L680 HydrophobicContact CD1-CB 4.41Å; L668-L680 HydrophobicContact CD2-CB 3.55Å; L668-L680 HydrophobicContact CD2-CD1 4.13Å; L668-L680 HydrophobicContact CD2-CG 4.5Å; L668-L680 HydrophobicContact CG-CB 3.8Å; L668-L680 HydrophobicContact CG-CD1 4.13Å; L668-L681 HydrophobicContact CD2-CG 4.11Å
669	E	81.5	Confident	82.5	Confident	160 Å²	160	93.6 Å²	93.6	75%	0.748	47%	0.466	S	S	*	.	H	α-helix	trans	-71.5	-30.5	175.7	-71.8	174.2	176.8	0	0	113	F665	F665-E669 WeakPolarHBondContact O-CG 3.48Å; F665-E669 PolarHBondContact O-N 3.24Å
670	T	83.1	Confident	81.9	Confident	112 Å²	112	88.6 Å²	88.6	69%	0.687	44%	0.443	S	S	*	.	H	α-helix	trans	-102.3	-10.2	-173.8	50.6	0	0	0	0	115.6	A666	A666-T670 WeakPolarHBondContact O-CB 3.41Å; A666-T670 WeakPolarHBondContact O-CG2 3.4Å; A666-T670 PolarHBondContact O-N 2.95Å; A666-T670 PolarHBondContact O-OG1 3.43Å
671	C	76.6	Confident	81.6	Confident	23 Å²	23	87.8 Å²	87.8	16%	0.155	44%	0.442	C	S	.	.			trans	-89.4	125	172	-75.4	0	0	0	0	111.3	R667 I676 K677	R667-C671 WeakPolarHBondContact O-CB 3.4Å; R667-C671 PolarHBondContact O-N 3.48Å; R667-C671 VanDerWaalsContact O-N 3.13Å; R667-C671 PolarHBondContact O-SG 2.69Å; R667-C671 VanDerWaalsContact O-SG 3.34Å; C671-I676 HydrophobicContact CB-CG2 4.27Å; C671-K677 WeakPolarHBondContact O-CD 3.26Å; C671-K677 WeakPolarHBondContact O-CE 3.32Å; C671-K677 PolarHBondContact O-NZ 3.35Å
672	D	77.2	Confident	81.4	Confident	149 Å²	149	90.3 Å²	90.3	80%	0.797	45%	0.454	S	S	*	.			trans	-83.8	-27.4	168.3	-75.4	-44.7	0	0	0	113.4	A674	D672-A674 PolarHBondContact O-N 3.39Å
673	D	78.5	Confident	80.8	Confident	106 Å²	106	87.2 Å²	87.2	57%	0.567	45%	0.446	S	S	*	.			trans	-58.8	118.8	179.7	-84.1	-54	0	0	0	113.4	E675 I676 K677	D673-E675 VanDerWaalsContact C-N 3.34Å; D673-E675 PolarHBondContact O-N 3.48Å; D673-I676 HydrophobicContact CB-CB 3.98Å; D673-I676 HydrophobicContact CB-CD1 3.82Å; D673-I676 HydrophobicContact CB-CG1 3.77Å; D673-I676 PolarHBondContact O-N 3.15Å; D673-K677 PolarHBondContact O-N 3.35Å
674	A	79.2	Confident	80.2	Confident	78 Å²	78	82.7 Å²	82.7	65%	0.645	43%	0.43	S	S	*	.	H	α-helix	trans	-61.5	-37.5	-179.4	0	0	0	0	0	113.2	D672 K677 K678	D672-A674 PolarHBondContact O-N 3.39Å; A674-K677 PolarHBondContact O-N 2.84Å; A674-K678 WeakPolarHBondContact O-CB 3.32Å; A674-K678 PolarHBondContact O-N 3.19Å
675	E	80.4	Confident	79.6	Confident	97 Å²	97	90.9 Å²	90.9	45%	0.453	46%	0.46	S	S	.	.	H	α-helix	trans	-73.3	-33.8	179.6	-168.1	60	-150.2	0	0	111.6	D673 K678 Q679	D673-E675 VanDerWaalsContact C-N 3.34Å; D673-E675 PolarHBondContact O-N 3.48Å; E675-K678 PolarHBondContact O-N 3.46Å; E675-K678 IonicContact OE1-NZ 2.96Å; E675-K678 PolarHBondContact OE1-NZ 3.12Å; E675-K678 IonicContact OE2-NZ 3.54Å; E675-K678 PolarHBondContact OE2-NZ 3.12Å; E675-Q679 WeakPolarHBondContact O-CG 3.37Å; E675-Q679 PolarHBondContact O-N 3.33Å
676	I	78.5	Confident	78.7	Confident	63 Å²	63	92.6 Å²	92.6	32%	0.323	47%	0.467	S	S	.	.	H	α-helix	trans	-69.8	-42.6	173.4	-57.6	-178.6	0	0	0	110.1	C671 D673 K678 Q679 L680	C671-I676 HydrophobicContact CB-CG2 4.27Å; D673-I676 HydrophobicContact CB-CB 3.98Å; D673-I676 HydrophobicContact CB-CD1 3.82Å; D673-I676 HydrophobicContact CB-CG1 3.77Å; D673-I676 PolarHBondContact O-N 3.15Å; I676-K678 VanDerWaalsContact C-N 3.3Å; I676-K678 PolarHBondContact O-N 3.21Å; I676-Q679 PolarHBondContact O-N 2.76Å; I676-L680 HydrophobicContact CG2-CD1 3.92Å; I676-L680 HydrophobicContact CG2-CG 4.33Å; I676-L680 WeakPolarHBondContact O-CB 3.4Å; I676-L680 VanDerWaalsContact O-CG 3.31Å; I676-L680 WeakPolarHBondContact O-CG 3.43Å; I676-L680 PolarHBondContact O-N 3.18Å
677	K	82.7	Confident	77.6	Confident	70 Å²	70	93.2 Å²	93.2	30%	0.304	46%	0.464	S	S	.	.	H	α-helix	trans	-55.6	-43.6	171.5	-87.3	169.1	160.1	141.7	0	111.8	L668 C671 D673 A674 L680 L681	L668-K677 HydrophobicContact CD2-CB 4.42Å; L668-K677 HydrophobicContact CD2-CG 4.23Å; L668-K677 WeakPolarHBondContact O-CE 3.35Å; C671-K677 WeakPolarHBondContact O-CD 3.26Å; C671-K677 WeakPolarHBondContact O-CE 3.32Å; C671-K677 PolarHBondContact O-NZ 3.35Å; D673-K677 PolarHBondContact O-N 3.35Å; A674-K677 PolarHBondContact O-N 2.84Å; K677-L680 PolarHBondContact O-N 3.4Å; K677-L681 WeakPolarHBondContact O-CB 3.38Å; K677-L681 VanDerWaalsContact O-CG 3.27Å; K677-L681 WeakPolarHBondContact O-CG 3.41Å; K677-L681 PolarHBondContact O-N 3.31Å
678	K	83	Confident	76.4	Confident	110 Å²	110	92 Å²	92	48%	0.478	47%	0.47	S	S	.	.	H	α-helix	trans	-62.7	-45.3	175.9	175.1	178.9	155.2	-132.8	0	112.6	A674 E675 I676 L681 E682	A674-K678 WeakPolarHBondContact O-CB 3.32Å; A674-K678 PolarHBondContact O-N 3.19Å; E675-K678 PolarHBondContact O-N 3.46Å; E675-K678 IonicContact OE1-NZ 2.96Å; E675-K678 PolarHBondContact OE1-NZ 3.12Å; E675-K678 IonicContact OE2-NZ 3.54Å; E675-K678 PolarHBondContact OE2-NZ 3.12Å; I676-K678 VanDerWaalsContact C-N 3.3Å; I676-K678 PolarHBondContact O-N 3.21Å; K678-L681 PolarHBondContact O-N 2.98Å; K678-E682 PolarHBondContact O-N 2.65Å
679	Q	79.9	Confident	74.7	Confident	107 Å²	107	99.1 Å²	99.1	50%	0.5	50%	0.502	S	S	.	.	H	α-helix	trans	-64.2	-41.2	176	-70.7	173.6	15.9	0	0	112.2	E675 I676 L681 E682 V683	E675-Q679 WeakPolarHBondContact O-CG 3.37Å; E675-Q679 PolarHBondContact O-N 3.33Å; I676-Q679 PolarHBondContact O-N 2.76Å; Q679-L681 VanDerWaalsContact C-N 3.34Å; Q679-L681 PolarHBondContact O-N 3.35Å; Q679-E682 PolarHBondContact O-N 3.27Å; Q679-E682 VanDerWaalsContact O-N 3.15Å; Q679-V683 WeakPolarHBondContact O-CG2 3.41Å; Q679-V683 PolarHBondContact O-N 3.29Å
680	L	77.4	Confident	72.9	Confident	17 Å²	17	100.4 Å²	100.4	9%	0.089	52%	0.524	C	S	.	.	H	α-helix	trans	-65.5	-35.7	175.3	-69.7	167.5	0	0	0	112.3	L664 R667 L668 I676 K677 E682 S684	L664-L680 HydrophobicContact CD2-CD2 3.78Å; R667-L680 HydrophobicContact CB-CD1 4.24Å; R667-L680 HydrophobicContact CG-CD1 4Å; R667-L680 HydrophobicContact CG-CD2 4.42Å; L668-L680 HydrophobicContact CD1-CB 4.41Å; L668-L680 HydrophobicContact CD2-CB 3.55Å; L668-L680 HydrophobicContact CD2-CD1 4.13Å; L668-L680 HydrophobicContact CD2-CG 4.5Å; L668-L680 HydrophobicContact CG-CB 3.8Å; L668-L680 HydrophobicContact CG-CD1 4.13Å; I676-L680 HydrophobicContact CG2-CD1 3.92Å; I676-L680 HydrophobicContact CG2-CG 4.33Å; I676-L680 WeakPolarHBondContact O-CB 3.4Å; I676-L680 VanDerWaalsContact O-CG 3.31Å; I676-L680 WeakPolarHBondContact O-CG 3.43Å; I676-L680 PolarHBondContact O-N 3.18Å; K677-L680 PolarHBondContact O-N 3.4Å; L680-E682 VanDerWaalsContact C-N 3.29Å; L680-E682 PolarHBondContact O-N 2.74Å; L680-S684 WeakPolarHBondContact O-CB 3.17Å; L680-S684 PolarHBondContact O-N 2.93Å; L680-S684 PolarHBondContact O-OG 3.49Å
681	L	79.1	Confident	72.4	Confident	89 Å²	89	99.9 Å²	99.9	47%	0.466	52%	0.516	S	S	.	.	H	α-helix	trans	-69.7	-21.6	172.3	-77.6	166.3	0	0	0	113.7	L668 K677 K678 Q679 S684 R685	L668-L681 HydrophobicContact CD2-CG 4.11Å; K677-L681 WeakPolarHBondContact O-CB 3.38Å; K677-L681 VanDerWaalsContact O-CG 3.27Å; K677-L681 WeakPolarHBondContact O-CG 3.41Å; K677-L681 PolarHBondContact O-N 3.31Å; K678-L681 PolarHBondContact O-N 2.98Å; Q679-L681 VanDerWaalsContact C-N 3.34Å; Q679-L681 PolarHBondContact O-N 3.35Å; L681-S684 WeakPolarHBondContact CA-OG 3.27Å; L681-S684 PolarHBondContact O-OG 3.08Å; L681-R685 WeakPolarHBondContact O-CD 3.46Å; L681-R685 VanDerWaalsContact O-CG 3.28Å; L681-R685 WeakPolarHBondContact O-CG 3.37Å
682	E	80	Confident	72.2	Confident	107 Å²	107	103.9 Å²	103.9	50%	0.5	54%	0.535	S	S	.	.	H	α-helix	trans	-82.4	-46.2	173.7	-171.4	158.9	-155.3	0	0	110.7	K678 Q679 L680 S684 R685 F686	K678-E682 PolarHBondContact O-N 2.65Å; Q679-E682 PolarHBondContact O-N 3.27Å; Q679-E682 VanDerWaalsContact O-N 3.15Å; L680-E682 VanDerWaalsContact C-N 3.29Å; L680-E682 PolarHBondContact O-N 2.74Å; E682-S684 VanDerWaalsContact C-N 3.3Å; E682-S684 PolarHBondContact O-N 3.49Å; E682-R685 WeakPolarHBondContact O-CB 3.48Å; E682-R685 PolarHBondContact O-N 2.95Å; E682-F686 HydrophobicContact CG-CD2 4.08Å; E682-F686 HydrophobicContact CG-CE2 3.87Å; E682-F686 WeakPolarHBondContact O-CD2 3.12Å; E682-F686 PolarHBondContact O-N 3.14Å; E682-F686 VanDerWaalsContact O-N 3.15Å
683	V	77.5	Confident	71.9	Confident	70 Å²	70	101.4 Å²	101.4	42%	0.424	52%	0.521	S	S	.	.	H	α-helix	trans	-58	-41.3	173	174.3	0	0	0	0	111.7	L664 Q679 R685 F686 N687	L664-V683 HydrophobicContact CD1-CG1 4.11Å; L664-V683 HydrophobicContact CD2-CG1 4Å; Q679-V683 WeakPolarHBondContact O-CG2 3.41Å; Q679-V683 PolarHBondContact O-N 3.29Å; V683-R685 PolarHBondContact O-N 3.18Å; V683-F686 PolarHBondContact O-N 3.34Å; V683-N687 PolarHBondContact O-N 2.83Å
684	S	73.2	Confident	71.6	Confident	34 Å²	34	101.1 Å²	101.1	24%	0.238	52%	0.518	C	S	.	.	H	α-helix	trans	-70.1	-16.6	178	69.9	0	0	0	0	114.2	L680 L681 E682 V688	L680-S684 WeakPolarHBondContact O-CB 3.17Å; L680-S684 PolarHBondContact O-N 2.93Å; L680-S684 PolarHBondContact O-OG 3.49Å; L681-S684 WeakPolarHBondContact CA-OG 3.27Å; L681-S684 PolarHBondContact O-OG 3.08Å; E682-S684 VanDerWaalsContact C-N 3.3Å; E682-S684 PolarHBondContact O-N 3.49Å; S684-V688 VanDerWaalsContact O-CG2 3.3Å; S684-V688 WeakPolarHBondContact O-CG2 3.49Å
685	R	71	Confident	71.1	Confident	196 Å²	196	102.6 Å²	102.6	74%	0.74	51%	0.51	S	S	*	.	H	α-helix	trans	-83.2	-41.5	171.4	-74.5	170.5	178.3	-165	-0.8	112.5	L681 E682 V683 N687 V688	L681-R685 WeakPolarHBondContact O-CD 3.46Å; L681-R685 VanDerWaalsContact O-CG 3.28Å; L681-R685 WeakPolarHBondContact O-CG 3.37Å; E682-R685 WeakPolarHBondContact O-CB 3.48Å; E682-R685 PolarHBondContact O-N 2.95Å; V683-R685 PolarHBondContact O-N 3.18Å; R685-N687 VanDerWaalsContact C-N 3.28Å; R685-N687 PolarHBondContact O-N 3Å; R685-V688 PolarHBondContact O-N 2.89Å
686	F	66	Low	70.5	Confident	158 Å²	158	102.9 Å²	102.9	69%	0.693	51%	0.514	S	S	*	.	H	α-helix	trans	-66.2	-28.8	-178.4	-85.3	-74.5	0	0	0	113.4	E682 V683 V688	E682-F686 HydrophobicContact CG-CD2 4.08Å; E682-F686 HydrophobicContact CG-CE2 3.87Å; E682-F686 WeakPolarHBondContact O-CD2 3.12Å; E682-F686 PolarHBondContact O-N 3.14Å; E682-F686 VanDerWaalsContact O-N 3.15Å; V683-F686 PolarHBondContact O-N 3.34Å; F686-V688 PolarHBondContact O-N 3.5Å
687	N	62	Low	69.9	Low	60 Å²	60	105.8 Å²	105.8	32%	0.321	53%	0.528	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-1.5	178.2	-81.7	-1.7	0	0	0	115.2	Y657 V683 R685	Y657-N687 HydrophobicContact CE2-CB 4.16Å; Y657-N687 WeakPolarHBondContact CE2-O 3.39Å; Y657-N687 PolarHBondContact OH-O 2.87Å; V683-N687 PolarHBondContact O-N 2.83Å; R685-N687 VanDerWaalsContact C-N 3.28Å; R685-N687 PolarHBondContact O-N 3Å
688	V	58.4	Low	68.9	Low	99 Å²	99	108.5 Å²	108.5	60%	0.6	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.6	-3.4	-171.4	179.9	0	0	0	0	113.7	S684 R685 F686	S684-V688 VanDerWaalsContact O-CG2 3.3Å; S684-V688 WeakPolarHBondContact O-CG2 3.49Å; R685-V688 PolarHBondContact O-N 2.89Å; F686-V688 PolarHBondContact O-N 3.5Å
689	H	44.7	Very low	67.7	Low	177 Å²	177	108.4 Å²	108.4	82%	0.819	55%	0.55	S	S	*	*			trans	-93.6	125.6	177	-120.6	-77.1	0	0	0	112.1
690	P	43.8	Very low	66.6	Low	187 Å²	187	108.5 Å²	108.5	100%	1.214	56%	0.555	S	S	*	*			trans	-82	0	176.6	35.7	-37	0	0	0	113.5

Retrieved 690 of 690 residues in 485 ms (Link to these results)

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