X2JDK7_DROME Loading...

UNC93-like protein

AlphaFold DB , UniProt , Accession X2JDK7, Species DROME (Drosophila melanogaster, Fruit fly), Gene Dmel\CG3078, Length 744 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	37.4	Very low	61.7	Low	250 Å²	250	126.3 Å²	126.3	100%	1.232	70%	0.703	S	S	*	*				0	129.4	0	-70.3	155	168.7	0	0	107.4
2	G	43.3	Very low	62.9	Low	77 Å²	77	124.6 Å²	124.6	79%	0.794	69%	0.685	S	S	*	*	P	Polyproline II helix	trans	-89.3	141.7	173.8	0	0	0	0	0	110.4
3	S	52.9	Low	63.8	Low	122 Å²	122	118 Å²	118	85%	0.853	66%	0.657	S	S	*	*	P	Polyproline II helix	trans	-70.3	132.5	175.3	46	0	0	0	0	110.8
4	L	58.9	Low	65.2	Low	163 Å²	163	117.7 Å²	117.7	85%	0.853	65%	0.648	S	S	*	*	P	Polyproline II helix	trans	-63.8	138	168.5	-75.9	158.2	0	0	0	109.3
5	P	57.8	Low	66.2	Low	89 Å²	89	117.5 Å²	117.5	58%	0.578	63%	0.634	S	S	*	*	P	Polyproline II helix	trans	-63.9	148.4	172.4	28.5	-34.2	0	0	0	110.1	L7 L10	P5-L7 PolarHBondContact O-N 3.48Å; P5-L10 HydrophobicContact CG-CD1 4.33Å
6	N	66.6	Low	67	Low	111 Å²	111	118.4 Å²	118.4	59%	0.594	63%	0.63	S	S	*	*	P	Polyproline II helix	trans	-67.5	126.2	-172.6	-165.5	-6.1	0	0	0	110.5	H8 E9	N6-H8 PolarHBondContact O-N 3.47Å; N6-E9 HydrophobicContact CB-CG 4.48Å; N6-E9 PolarHBondContact O-N 3.3Å
7	L	68.9	Low	67.9	Low	142 Å²	142	120.3 Å²	120.3	74%	0.743	63%	0.627	S	S	*	*	H	α-helix	trans	-55.6	-33.5	-169	-161.7	75.6	0	0	0	112.5	P5 L10 E11	P5-L7 PolarHBondContact O-N 3.48Å; L7-L10 WeakPolarHBondContact O-CB 3.32Å; L7-L10 PolarHBondContact O-N 3.14Å; L7-E11 PolarHBondContact O-N 3.29Å; L7-E11 VanDerWaalsContact O-N 3.12Å
8	H	70.1	Confident	68.9	Low	110 Å²	110	119.4 Å²	119.4	51%	0.509	62%	0.619	S	S	.	*	H	α-helix	trans	-65.5	-36.3	179.5	-164.6	49.3	0	0	0	113.8	N6 L10 E11 E12	N6-H8 PolarHBondContact O-N 3.47Å; H8-L10 VanDerWaalsContact C-N 3.32Å; H8-E11 PolarHBondContact O-N 3.48Å; H8-E12 PolarHBondContact O-N 3.09Å
9	E	68	Low	69.6	Low	136 Å²	136	121.1 Å²	121.1	64%	0.636	62%	0.621	S	S	*	*	H	α-helix	trans	-69.5	-33.2	176.5	-65.1	-171	127.7	0	0	111.7	N6 A13	N6-E9 HydrophobicContact CB-CG 4.48Å; N6-E9 PolarHBondContact O-N 3.3Å; E9-A13 VanDerWaalsContact O-CB 3.24Å; E9-A13 WeakPolarHBondContact O-CB 3.47Å; E9-A13 PolarHBondContact O-N 3.29Å
10	L	75.1	Confident	70	Confident	95 Å²	95	123 Å²	123	50%	0.497	62%	0.62	S	S	.	*	H	α-helix	trans	-64.9	-44.4	173.7	-109.3	163.8	0	0	0	110.9	P5 L7 H8 A13 E14	P5-L10 HydrophobicContact CG-CD1 4.33Å; L7-L10 WeakPolarHBondContact O-CB 3.32Å; L7-L10 PolarHBondContact O-N 3.14Å; H8-L10 VanDerWaalsContact C-N 3.32Å; L10-A13 PolarHBondContact O-N 3.25Å; L10-E14 PolarHBondContact O-N 3.21Å
11	E	79.3	Confident	70.8	Confident	94 Å²	94	125.2 Å²	125.2	44%	0.439	62%	0.621	S	S	.	*	H	α-helix	trans	-64.7	-45.3	177.3	-152.5	-157.6	151.2	0	0	112.1	L7 H8 A13 E14 R15	L7-E11 PolarHBondContact O-N 3.29Å; L7-E11 VanDerWaalsContact O-N 3.12Å; H8-E11 PolarHBondContact O-N 3.48Å; E11-A13 VanDerWaalsContact C-N 3.32Å; E11-A13 PolarHBondContact O-N 3.24Å; E11-E14 PolarHBondContact O-N 3.05Å; E11-R15 VanDerWaalsContact CD-NH2 3.26Å; E11-R15 WeakPolarHBondContact O-CG 3.3Å; E11-R15 PolarHBondContact O-N 3.02Å; E11-R15 IonicContact OE1-CZ 3.33Å; E11-R15 IonicContact OE1-NE 3.26Å; E11-R15 PolarHBondContact OE1-NE 3.12Å; E11-R15 IonicContact OE1-NH2 2.65Å; E11-R15 PolarHBondContact OE1-NH2 3.29Å; E11-R15 IonicContact OE2-NH2 3.49Å; E11-R15 PolarHBondContact OE2-NH2 3.36Å
12	E	76.7	Confident	73.2	Confident	106 Å²	106	118.9 Å²	118.9	50%	0.495	59%	0.588	S	S	.	*	H	α-helix	trans	-59.8	-41.9	172.6	-76.3	-137.7	137.9	0	0	112.2	H8 E14 K16	H8-E12 PolarHBondContact O-N 3.09Å; E12-E14 VanDerWaalsContact C-N 3.28Å; E12-E14 PolarHBondContact O-N 3.22Å; E12-K16 WeakPolarHBondContact O-CB 3.42Å; E12-K16 PolarHBondContact O-N 3.37Å
13	A	74.1	Confident	74.9	Confident	39 Å²	39	122.4 Å²	122.4	32%	0.322	58%	0.579	S	S	.	*	H	α-helix	trans	-64.1	-33.5	177.8	0	0	0	0	0	112.4	E9 L10 E11 R17	E9-A13 VanDerWaalsContact O-CB 3.24Å; E9-A13 WeakPolarHBondContact O-CB 3.47Å; E9-A13 PolarHBondContact O-N 3.29Å; L10-A13 PolarHBondContact O-N 3.25Å; E11-A13 VanDerWaalsContact C-N 3.32Å; E11-A13 PolarHBondContact O-N 3.24Å; A13-R17 VanDerWaalsContact O-CG 3.32Å; A13-R17 WeakPolarHBondContact O-CG 3.3Å; A13-R17 PolarHBondContact O-N 3.24Å
14	E	83.1	Confident	76.4	Confident	114 Å²	114	122.5 Å²	122.5	53%	0.533	57%	0.566	S	S	.	*	H	α-helix	trans	-72.9	-51	177	-168	130.2	-101.7	0	0	112.2	L10 E11 E12 K16 R17 E18	L10-E14 PolarHBondContact O-N 3.21Å; E11-E14 PolarHBondContact O-N 3.05Å; E12-E14 VanDerWaalsContact C-N 3.28Å; E12-E14 PolarHBondContact O-N 3.22Å; E14-K16 PolarHBondContact O-N 2.94Å; E14-R17 WeakPolarHBondContact O-CA 3.49Å; E14-R17 WeakPolarHBondContact O-CB 3.44Å; E14-R17 PolarHBondContact O-N 3.32Å; E14-E18 PolarHBondContact O-N 3.39Å
15	R	80.3	Confident	77.7	Confident	114 Å²	114	119.9 Å²	119.9	43%	0.43	55%	0.552	S	S	.	*	H	α-helix	trans	-54	-32.3	172.7	-62.2	178.5	-162	167.1	-1.4	111.9	E11 K19	E11-R15 VanDerWaalsContact CD-NH2 3.26Å; E11-R15 WeakPolarHBondContact O-CG 3.3Å; E11-R15 PolarHBondContact O-N 3.02Å; E11-R15 IonicContact OE1-CZ 3.33Å; E11-R15 IonicContact OE1-NE 3.26Å; E11-R15 PolarHBondContact OE1-NE 3.12Å; E11-R15 IonicContact OE1-NH2 2.65Å; E11-R15 PolarHBondContact OE1-NH2 3.29Å; E11-R15 IonicContact OE2-NH2 3.49Å; E11-R15 PolarHBondContact OE2-NH2 3.36Å; R15-K19 WeakPolarHBondContact O-CG 3.38Å; R15-K19 PolarHBondContact O-N 3.48Å; R15-K19 VanDerWaalsContact O-N 3.16Å
16	K	79.4	Confident	79.1	Confident	132 Å²	132	120.9 Å²	120.9	57%	0.574	55%	0.552	S	S	*	*	H	α-helix	trans	-83.5	-4.7	178.2	-160.5	173.8	-161.1	163.4	0	114.2	E12 E14 R20	E12-K16 WeakPolarHBondContact O-CB 3.42Å; E12-K16 PolarHBondContact O-N 3.37Å; E14-K16 PolarHBondContact O-N 2.94Å; K16-R20 WeakPolarHBondContact O-CD 3.28Å; K16-R20 WeakPolarHBondContact O-CG 3.44Å; K16-R20 PolarHBondContact O-NE 3.29Å
17	R	81.6	Confident	80	Confident	151 Å²	151	119.5 Å²	119.5	57%	0.57	54%	0.544	S	S	*	.	H	α-helix	trans	-93.9	-42.2	163.8	-71.1	163.4	177.9	-175.8	0.1	110.7	A13 E14 R20 R21	A13-R17 VanDerWaalsContact O-CG 3.32Å; A13-R17 WeakPolarHBondContact O-CG 3.3Å; A13-R17 PolarHBondContact O-N 3.24Å; E14-R17 WeakPolarHBondContact O-CA 3.49Å; E14-R17 WeakPolarHBondContact O-CB 3.44Å; E14-R17 PolarHBondContact O-N 3.32Å; R17-R20 WeakPolarHBondContact O-CB 3.41Å; R17-R20 PolarHBondContact O-N 2.99Å; R17-R20 VanDerWaalsContact O-N 3.1Å; R17-R21 PolarHBondContact O-N 3.47Å
18	E	86.5	Confident	80.9	Confident	105 Å²	105	117.3 Å²	117.3	49%	0.491	53%	0.53	S	S	.	.	H	α-helix	trans	-58.8	-50.8	177.1	-66.4	-175.2	126.8	0	0	112	E14 R20 R21 E22	E14-E18 PolarHBondContact O-N 3.39Å; E18-R20 PolarHBondContact O-N 2.9Å; E18-R21 WeakPolarHBondContact O-CA 3.4Å; E18-R21 WeakPolarHBondContact O-CB 3.4Å; E18-R21 PolarHBondContact O-N 3.34Å; E18-E22 PolarHBondContact O-N 3.36Å
19	K	83	Confident	81.7	Confident	150 Å²	150	117.6 Å²	117.6	65%	0.652	53%	0.531	S	S	*	.	H	α-helix	trans	-59.5	-15.9	175.9	-71.5	-176.6	176.6	-176	0	114.8	R15 E22 Y23	R15-K19 WeakPolarHBondContact O-CG 3.38Å; R15-K19 PolarHBondContact O-N 3.48Å; R15-K19 VanDerWaalsContact O-N 3.16Å; K19-E22 WeakPolarHBondContact CA-OE2 3.43Å; K19-Y23 WeakPolarHBondContact O-CB 3.44Å; K19-Y23 PolarHBondContact O-N 2.92Å
20	R	76.6	Confident	82.7	Confident	159 Å²	159	119.7 Å²	119.7	60%	0.6	53%	0.534	S	S	*	.	H	α-helix	trans	-83	-43	170.2	-62.5	175.6	-167.4	-110.6	5.4	111.5	K16 R17 E18 E22 Y23 E24	K16-R20 WeakPolarHBondContact O-CD 3.28Å; K16-R20 WeakPolarHBondContact O-CG 3.44Å; K16-R20 PolarHBondContact O-NE 3.29Å; R17-R20 WeakPolarHBondContact O-CB 3.41Å; R17-R20 PolarHBondContact O-N 2.99Å; R17-R20 VanDerWaalsContact O-N 3.1Å; E18-R20 PolarHBondContact O-N 2.9Å; R20-E22 VanDerWaalsContact C-N 3.33Å; R20-E22 PolarHBondContact O-N 3.05Å; R20-Y23 PolarHBondContact O-N 2.93Å; R20-E24 WeakPolarHBondContact O-CB 3.24Å; R20-E24 WeakPolarHBondContact O-CG 3.48Å; R20-E24 PolarHBondContact O-N 3.32Å
21	R	88	Confident	83	Confident	171 Å²	171	117.8 Å²	117.8	65%	0.645	53%	0.532	S	S	*	.	H	α-helix	trans	-59.4	-44.1	174.6	-66.6	175.9	173.6	166.6	-2.6	111.2	R17 E18 Y23 E24 L25	R17-R21 PolarHBondContact O-N 3.47Å; E18-R21 WeakPolarHBondContact O-CA 3.4Å; E18-R21 WeakPolarHBondContact O-CB 3.4Å; E18-R21 PolarHBondContact O-N 3.34Å; R21-Y23 VanDerWaalsContact C-N 3.35Å; R21-Y23 PolarHBondContact O-N 3.33Å; R21-E24 PolarHBondContact O-N 2.98Å; R21-L25 WeakPolarHBondContact O-CB 3.38Å; R21-L25 VanDerWaalsContact O-CG 3.28Å; R21-L25 WeakPolarHBondContact O-CG 3.45Å; R21-L25 PolarHBondContact O-N 3.49Å
22	E	86.2	Confident	83.4	Confident	117 Å²	117	119.8 Å²	119.8	55%	0.547	54%	0.535	S	S	.	.	H	α-helix	trans	-57.8	-45.9	173.7	-65.9	-179.8	133.3	0	0	112	E18 K19 R20 L25 L26	E18-E22 PolarHBondContact O-N 3.36Å; K19-E22 WeakPolarHBondContact CA-OE2 3.43Å; R20-E22 VanDerWaalsContact C-N 3.33Å; R20-E22 PolarHBondContact O-N 3.05Å; E22-L25 PolarHBondContact O-N 2.89Å; E22-L26 WeakPolarHBondContact O-CG 3.47Å; E22-L26 PolarHBondContact O-N 2.67Å
23	Y	80.3	Confident	83.8	Confident	151 Å²	151	118.2 Å²	118.2	59%	0.592	53%	0.53	S	S	*	.	H	α-helix	trans	-68.6	-35.7	179.9	-171.1	-101	0	0	0	112.9	K19 R20 R21 L27	K19-Y23 WeakPolarHBondContact O-CB 3.44Å; K19-Y23 PolarHBondContact O-N 2.92Å; R20-Y23 PolarHBondContact O-N 2.93Å; R21-Y23 VanDerWaalsContact C-N 3.35Å; R21-Y23 PolarHBondContact O-N 3.33Å; Y23-L27 HydrophobicContact CD1-CD1 3.86Å; Y23-L27 HydrophobicContact CE1-CD1 3.56Å; Y23-L27 HydrophobicContact CE1-CG 4.25Å; Y23-L27 WeakPolarHBondContact O-CG 3.25Å; Y23-L27 PolarHBondContact O-N 3.2Å
24	E	84.6	Confident	84.1	Confident	123 Å²	123	119.5 Å²	119.5	58%	0.575	53%	0.534	S	S	*	.	H	α-helix	trans	-67.6	-41.2	173.4	-74.3	170.9	171.6	0	0	111.6	R20 R21 L27 E28	R20-E24 WeakPolarHBondContact O-CB 3.24Å; R20-E24 WeakPolarHBondContact O-CG 3.48Å; R20-E24 PolarHBondContact O-N 3.32Å; R21-E24 PolarHBondContact O-N 2.98Å; E24-L27 WeakPolarHBondContact O-CB 3.36Å; E24-L27 PolarHBondContact O-N 2.99Å; E24-E28 PolarHBondContact O-N 3.24Å
25	L	86.3	Confident	84.3	Confident	109 Å²	109	116.7 Å²	116.7	57%	0.571	53%	0.527	S	S	*	.	H	α-helix	trans	-63.8	-41.8	173.8	-72.3	168.3	0	0	0	112.3	R21 E22 L27 E28 Q29	R21-L25 WeakPolarHBondContact O-CB 3.38Å; R21-L25 VanDerWaalsContact O-CG 3.28Å; R21-L25 WeakPolarHBondContact O-CG 3.45Å; R21-L25 PolarHBondContact O-N 3.49Å; E22-L25 PolarHBondContact O-N 2.89Å; L25-L27 VanDerWaalsContact C-N 3.29Å; L25-L27 PolarHBondContact O-N 3.18Å; L25-E28 PolarHBondContact O-N 3.21Å; L25-Q29 WeakPolarHBondContact O-CB 3.45Å; L25-Q29 PolarHBondContact O-N 2.96Å
26	L	87.4	Confident	84.6	Confident	109 Å²	109	118.3 Å²	118.3	57%	0.571	53%	0.533	S	S	*	.	H	α-helix	trans	-63.9	-33.4	174.2	-74.9	168.8	0	0	0	112.5	E22 R30	E22-L26 WeakPolarHBondContact O-CG 3.47Å; E22-L26 PolarHBondContact O-N 2.67Å; L26-R30 WeakPolarHBondContact O-CB 3.4Å; L26-R30 PolarHBondContact O-N 3.39Å; L26-R30 VanDerWaalsContact O-N 3.11Å
27	L	84.8	Confident	84.8	Confident	83 Å²	83	117.8 Å²	117.8	44%	0.435	53%	0.533	S	S	.	.	H	α-helix	trans	-70.4	-43.3	172.7	-78.6	170.5	0	0	0	112.1	Y23 E24 L25 Q29 R30 A31	Y23-L27 HydrophobicContact CD1-CD1 3.86Å; Y23-L27 HydrophobicContact CE1-CD1 3.56Å; Y23-L27 HydrophobicContact CE1-CG 4.25Å; Y23-L27 WeakPolarHBondContact O-CG 3.25Å; Y23-L27 PolarHBondContact O-N 3.2Å; E24-L27 WeakPolarHBondContact O-CB 3.36Å; E24-L27 PolarHBondContact O-N 2.99Å; L25-L27 VanDerWaalsContact C-N 3.29Å; L25-L27 PolarHBondContact O-N 3.18Å; L27-Q29 VanDerWaalsContact C-N 3.34Å; L27-Q29 PolarHBondContact O-N 3.42Å; L27-R30 PolarHBondContact O-N 3.41Å; L27-A31 WeakPolarHBondContact O-CB 3.41Å; L27-A31 PolarHBondContact O-N 3.14Å
28	E	87.9	Confident	84.7	Confident	96 Å²	96	119.8 Å²	119.8	45%	0.449	54%	0.54	S	S	.	.	H	α-helix	trans	-60	-43.1	172.9	-76.1	-151	140.5	0	0	112	E24 L25 A31 R32	E24-E28 PolarHBondContact O-N 3.24Å; L25-E28 PolarHBondContact O-N 3.21Å; E28-A31 WeakPolarHBondContact O-CB 3.28Å; E28-A31 PolarHBondContact O-N 3.34Å; E28-R32 VanDerWaalsContact CD-NH2 3.34Å; E28-R32 WeakPolarHBondContact O-CG 3.41Å; E28-R32 PolarHBondContact O-N 3.14Å; E28-R32 IonicContact OE1-NH2 3.64Å; E28-R32 IonicContact OE2-CZ 3.41Å; E28-R32 IonicContact OE2-NH1 3.51Å; E28-R32 IonicContact OE2-NH2 2.67Å; E28-R32 PolarHBondContact OE2-NH2 3.01Å
29	Q	87.6	Confident	84.5	Confident	115 Å²	115	120.6 Å²	120.6	54%	0.537	54%	0.544	S	S	.	.	H	α-helix	trans	-63.2	-46.8	-179.9	-170.5	168.4	-2.5	0	0	110.9	L25 L27 A31 R32 D33	L25-Q29 WeakPolarHBondContact O-CB 3.45Å; L25-Q29 PolarHBondContact O-N 2.96Å; L27-Q29 VanDerWaalsContact C-N 3.34Å; L27-Q29 PolarHBondContact O-N 3.42Å; Q29-A31 VanDerWaalsContact C-N 3.27Å; Q29-A31 PolarHBondContact O-N 2.91Å; Q29-R32 PolarHBondContact O-N 2.65Å; Q29-R32 VanDerWaalsContact O-N 3.14Å; Q29-D33 PolarHBondContact O-N 3.43Å
30	R	87.3	Confident	84.6	Confident	180 Å²	180	122.2 Å²	122.2	68%	0.679	55%	0.546	S	S	*	.	H	α-helix	trans	-61.5	-33.2	173.5	-173.7	175.4	-71	166.5	-1.3	112.8	L26 L27 T34	L26-R30 WeakPolarHBondContact O-CB 3.4Å; L26-R30 PolarHBondContact O-N 3.39Å; L26-R30 VanDerWaalsContact O-N 3.11Å; L27-R30 PolarHBondContact O-N 3.41Å; R30-T34 WeakPolarHBondContact O-CG2 3.46Å; R30-T34 PolarHBondContact O-N 3.14Å; R30-T34 VanDerWaalsContact O-N 3.07Å; R30-T34 PolarHBondContact O-OG1 3.43Å
31	A	82.4	Confident	84.6	Confident	56 Å²	56	120 Å²	120	46%	0.463	55%	0.546	S	S	.	.	H	α-helix	trans	-68.2	-41	173.7	0	0	0	0	0	112.3	L27 E28 Q29 T34 S35	L27-A31 WeakPolarHBondContact O-CB 3.41Å; L27-A31 PolarHBondContact O-N 3.14Å; E28-A31 WeakPolarHBondContact O-CB 3.28Å; E28-A31 PolarHBondContact O-N 3.34Å; Q29-A31 VanDerWaalsContact C-N 3.27Å; Q29-A31 PolarHBondContact O-N 2.91Å; A31-T34 PolarHBondContact O-OG1 3.24Å; A31-T34 VanDerWaalsContact O-OG1 3.12Å; A31-S35 PolarHBondContact O-N 2.98Å
32	R	87.1	Confident	84.2	Confident	135 Å²	135	115 Å²	115	51%	0.509	54%	0.537	S	S	.	.	H	α-helix	trans	-68	-36.3	176.1	-70	173.8	-174.5	138.5	13.8	112.8	E28 Q29 S35 R36	E28-R32 VanDerWaalsContact CD-NH2 3.34Å; E28-R32 WeakPolarHBondContact O-CG 3.41Å; E28-R32 PolarHBondContact O-N 3.14Å; E28-R32 IonicContact OE1-NH2 3.64Å; E28-R32 IonicContact OE2-CZ 3.41Å; E28-R32 IonicContact OE2-NH1 3.51Å; E28-R32 IonicContact OE2-NH2 2.67Å; E28-R32 PolarHBondContact OE2-NH2 3.01Å; Q29-R32 PolarHBondContact O-N 2.65Å; Q29-R32 VanDerWaalsContact O-N 3.14Å; R32-S35 PolarHBondContact O-N 2.8Å; R32-S35 PolarHBondContact O-OG 3.2Å; R32-R36 WeakPolarHBondContact O-CD 3.4Å; R32-R36 VanDerWaalsContact O-CG 3.28Å; R32-R36 WeakPolarHBondContact O-CG 3.49Å; R32-R36 PolarHBondContact O-N 3.48Å
33	D	85	Confident	83.9	Confident	73 Å²	73	112.1 Å²	112.1	39%	0.39	53%	0.533	S	S	.	.	H	α-helix	trans	-73.7	-37.9	177.5	-67.5	-32.5	0	0	0	111.7	Q29 S35 R36 E37	Q29-D33 PolarHBondContact O-N 3.43Å; D33-S35 PolarHBondContact O-N 3.47Å; D33-R36 PolarHBondContact O-N 2.94Å; D33-R36 IonicContact OD1-NH1 3.29Å; D33-R36 PolarHBondContact OD1-NH1 3.48Å; D33-E37 WeakPolarHBondContact O-CB 3.4Å; D33-E37 PolarHBondContact O-N 2.97Å
34	T	81.5	Confident	83.8	Confident	67 Å²	67	111.3 Å²	111.3	41%	0.411	53%	0.533	S	S	.	.	H	α-helix	trans	-70.7	-25.9	172.4	51.3	0	0	0	0	113.6	R30 A31 R38	R30-T34 WeakPolarHBondContact O-CG2 3.46Å; R30-T34 PolarHBondContact O-N 3.14Å; R30-T34 VanDerWaalsContact O-N 3.07Å; R30-T34 PolarHBondContact O-OG1 3.43Å; A31-T34 PolarHBondContact O-OG1 3.24Å; A31-T34 VanDerWaalsContact O-OG1 3.12Å; T34-R38 WeakPolarHBondContact O-CG 3.46Å; T34-R38 PolarHBondContact O-N 3.46Å
35	S	85.9	Confident	83.4	Confident	55 Å²	55	108 Å²	108	39%	0.385	53%	0.526	S	S	.	.	H	α-helix	trans	-71.1	-44	169.2	72.1	0	0	0	0	111.7	A31 R32 D33 E37 R38 E39	A31-S35 PolarHBondContact O-N 2.98Å; R32-S35 PolarHBondContact O-N 2.8Å; R32-S35 PolarHBondContact O-OG 3.2Å; D33-S35 PolarHBondContact O-N 3.47Å; S35-E37 VanDerWaalsContact C-N 3.29Å; S35-E37 PolarHBondContact O-N 3.35Å; S35-R38 WeakPolarHBondContact O-CB 3.35Å; S35-R38 PolarHBondContact O-N 2.9Å; S35-R38 VanDerWaalsContact O-N 3.13Å; S35-E39 WeakPolarHBondContact O-CG 3.41Å; S35-E39 PolarHBondContact O-N 3.19Å
36	R	86.7	Confident	82.9	Confident	148 Å²	148	109.1 Å²	109.1	56%	0.558	53%	0.529	S	S	*	.	H	α-helix	trans	-60	-36.6	173.9	-74.7	164.9	164.9	176.7	-7.6	112.9	R32 D33 E39 R40	R32-R36 WeakPolarHBondContact O-CD 3.4Å; R32-R36 VanDerWaalsContact O-CG 3.28Å; R32-R36 WeakPolarHBondContact O-CG 3.49Å; R32-R36 PolarHBondContact O-N 3.48Å; D33-R36 PolarHBondContact O-N 2.94Å; D33-R36 IonicContact OD1-NH1 3.29Å; D33-R36 PolarHBondContact OD1-NH1 3.48Å; R36-E39 PolarHBondContact O-N 3.16Å; R36-R40 WeakPolarHBondContact O-CG 3.37Å; R36-R40 PolarHBondContact O-N 2.97Å
37	E	83.4	Confident	82.3	Confident	121 Å²	121	110 Å²	110	57%	0.565	53%	0.53	S	S	*	.	H	α-helix	trans	-67.2	-39.9	175	-170.3	171.2	-146	0	0	111.7	D33 S35 R40 L41	D33-E37 WeakPolarHBondContact O-CB 3.4Å; D33-E37 PolarHBondContact O-N 2.97Å; S35-E37 VanDerWaalsContact C-N 3.29Å; S35-E37 PolarHBondContact O-N 3.35Å; E37-R40 PolarHBondContact O-N 2.98Å; E37-L41 HydrophobicContact CG-CD1 4.42Å; E37-L41 WeakPolarHBondContact O-CG 3.5Å; E37-L41 PolarHBondContact O-N 3.1Å
38	R	79.9	Confident	81.6	Confident	192 Å²	192	115.9 Å²	115.9	73%	0.725	55%	0.546	S	S	*	.	H	α-helix	trans	-62.9	-39.1	171.5	-72.3	172.1	177.1	-157.1	-2.1	112.6	T34 S35 L41 S42	T34-R38 WeakPolarHBondContact O-CG 3.46Å; T34-R38 PolarHBondContact O-N 3.46Å; S35-R38 WeakPolarHBondContact O-CB 3.35Å; S35-R38 PolarHBondContact O-N 2.9Å; S35-R38 VanDerWaalsContact O-N 3.13Å; R38-L41 PolarHBondContact O-N 3.02Å; R38-S42 PolarHBondContact O-N 2.82Å; R38-S42 PolarHBondContact O-OG 2.65Å
39	E	82.8	Confident	80.7	Confident	122 Å²	122	118.6 Å²	118.6	57%	0.57	56%	0.557	S	S	*	*	H	α-helix	trans	-65.3	-39.5	174.9	-71.6	172.9	155.3	0	0	112.3	S35 R36 S42 A43	S35-E39 WeakPolarHBondContact O-CG 3.41Å; S35-E39 PolarHBondContact O-N 3.19Å; R36-E39 PolarHBondContact O-N 3.16Å; E39-S42 WeakPolarHBondContact CA-OG 3.49Å; E39-S42 PolarHBondContact O-N 3.06Å; E39-S42 PolarHBondContact O-OG 3.49Å; E39-A43 VanDerWaalsContact O-CB 3.3Å; E39-A43 WeakPolarHBondContact O-CB 3.41Å; E39-A43 PolarHBondContact O-N 3.26Å
40	R	84.4	Confident	79.8	Confident	184 Å²	184	118.1 Å²	118.1	69%	0.694	56%	0.555	S	S	*	*	H	α-helix	trans	-62.7	-44.4	172.2	-72.9	171	175.9	178.5	-1.7	111.4	R36 E37 A43 F44	R36-R40 WeakPolarHBondContact O-CG 3.37Å; R36-R40 PolarHBondContact O-N 2.97Å; E37-R40 PolarHBondContact O-N 2.98Å; R40-A43 PolarHBondContact O-N 2.97Å; R40-F44 WeakPolarHBondContact O-CD2 3.47Å; R40-F44 PolarHBondContact O-N 3.22Å
41	L	77.8	Confident	78.6	Confident	112 Å²	112	113.4 Å²	113.4	59%	0.586	55%	0.549	S	S	*	.	H	α-helix	trans	-67.4	-36.8	178.7	-70.9	169.7	0	0	0	112.7	E37 R38 A45	E37-L41 HydrophobicContact CG-CD1 4.42Å; E37-L41 WeakPolarHBondContact O-CG 3.5Å; E37-L41 PolarHBondContact O-N 3.1Å; R38-L41 PolarHBondContact O-N 3.02Å; L41-A45 WeakPolarHBondContact O-CB 3.36Å; L41-A45 PolarHBondContact O-N 2.98Å
42	S	78.1	Confident	77.6	Confident	66 Å²	66	114.2 Å²	114.2	46%	0.462	55%	0.551	S	S	.	*	H	α-helix	trans	-70.1	-39.1	174.3	68.2	0	0	0	0	111.8	R38 E39 A45 Q46	R38-S42 PolarHBondContact O-N 2.82Å; R38-S42 PolarHBondContact O-OG 2.65Å; E39-S42 WeakPolarHBondContact CA-OG 3.49Å; E39-S42 PolarHBondContact O-N 3.06Å; E39-S42 PolarHBondContact O-OG 3.49Å; S42-A45 PolarHBondContact O-N 3.42Å; S42-Q46 WeakPolarHBondContact O-CB 3.47Å; S42-Q46 PolarHBondContact O-N 3.3Å
43	A	79.8	Confident	76	Confident	57 Å²	57	114.7 Å²	114.7	47%	0.471	55%	0.554	S	S	.	*	H	α-helix	trans	-60.2	-46.6	172.5	0	0	0	0	0	111.9	E39 R40 A45 Q46 Q47	E39-A43 VanDerWaalsContact O-CB 3.3Å; E39-A43 WeakPolarHBondContact O-CB 3.41Å; E39-A43 PolarHBondContact O-N 3.26Å; R40-A43 PolarHBondContact O-N 2.97Å; A43-A45 PolarHBondContact O-N 3.43Å; A43-Q46 PolarHBondContact O-N 3.35Å; A43-Q47 WeakPolarHBondContact O-CB 3.4Å; A43-Q47 PolarHBondContact O-N 3.31Å
44	F	79.9	Confident	74.9	Confident	135 Å²	135	115.2 Å²	115.2	59%	0.592	56%	0.557	S	S	*	*	H	α-helix	trans	-61	-41.6	173.5	-83.9	-61.3	0	0	0	112.5	R40 Q46 Q47 R48	R40-F44 WeakPolarHBondContact O-CD2 3.47Å; R40-F44 PolarHBondContact O-N 3.22Å; F44-Q46 VanDerWaalsContact C-N 3.34Å; F44-Q46 PolarHBondContact O-N 3.12Å; F44-Q47 PolarHBondContact O-N 3.04Å; F44-R48 PolarHBondContact O-N 3.34Å
45	A	74.8	Confident	73.6	Confident	52 Å²	52	115 Å²	115	43%	0.43	56%	0.562	S	S	.	*	H	α-helix	trans	-64.7	-37.6	176.3	0	0	0	0	0	112.2	L41 S42 A43 R48 K49	L41-A45 WeakPolarHBondContact O-CB 3.36Å; L41-A45 PolarHBondContact O-N 2.98Å; S42-A45 PolarHBondContact O-N 3.42Å; A43-A45 PolarHBondContact O-N 3.43Å; A45-R48 WeakPolarHBondContact O-CB 3.49Å; A45-R48 PolarHBondContact O-N 3.03Å; A45-K49 WeakPolarHBondContact O-CG 3.21Å; A45-K49 PolarHBondContact O-N 2.95Å
46	Q	75.8	Confident	71.9	Confident	133 Å²	133	121.5 Å²	121.5	62%	0.621	58%	0.579	S	S	*	*	H	α-helix	trans	-72.3	-39.2	177.2	-171.6	159.7	-30.3	0	0	111.9	S42 A43 F44 R48 K49 Q50	S42-Q46 WeakPolarHBondContact O-CB 3.47Å; S42-Q46 PolarHBondContact O-N 3.3Å; A43-Q46 PolarHBondContact O-N 3.35Å; F44-Q46 VanDerWaalsContact C-N 3.34Å; F44-Q46 PolarHBondContact O-N 3.12Å; Q46-R48 VanDerWaalsContact C-N 3.29Å; Q46-R48 PolarHBondContact O-N 3.37Å; Q46-K49 WeakPolarHBondContact O-CB 3.34Å; Q46-K49 PolarHBondContact O-N 3.11Å; Q46-K49 VanDerWaalsContact O-N 3.17Å; Q46-Q50 PolarHBondContact O-N 3.1Å
47	Q	75.2	Confident	70.2	Confident	128 Å²	128	118.1 Å²	118.1	60%	0.598	57%	0.572	S	S	*	*	H	α-helix	trans	-60.7	-38.6	170.8	-169.6	179.7	11.5	0	0	111.5	A43 F44 Q50 S51	A43-Q47 WeakPolarHBondContact O-CB 3.4Å; A43-Q47 PolarHBondContact O-N 3.31Å; F44-Q47 PolarHBondContact O-N 3.04Å; Q47-Q50 PolarHBondContact O-N 3.45Å; Q47-S51 WeakPolarHBondContact O-CB 3.4Å; Q47-S51 PolarHBondContact O-N 2.87Å
48	R	70.1	Confident	68.7	Low	206 Å²	206	119.9 Å²	119.9	78%	0.777	58%	0.581	S	S	*	*	H	α-helix	trans	-62.8	-43.3	173	-129.8	177	-172.5	173.5	2.7	112.1	F44 A45 Q46 S51 S52	F44-R48 PolarHBondContact O-N 3.34Å; A45-R48 WeakPolarHBondContact O-CB 3.49Å; A45-R48 PolarHBondContact O-N 3.03Å; Q46-R48 VanDerWaalsContact C-N 3.29Å; Q46-R48 PolarHBondContact O-N 3.37Å; R48-S51 WeakPolarHBondContact O-CB 3.49Å; R48-S51 PolarHBondContact O-N 3.25Å; R48-S52 PolarHBondContact O-N 3.24Å; R48-S52 PolarHBondContact O-OG 3.11Å
49	K	70.2	Confident	67.6	Low	153 Å²	153	114.8 Å²	114.8	67%	0.665	58%	0.581	S	S	*	*	H	α-helix	trans	-62.9	-43.5	174.2	-73.3	178.9	178.6	-177	0	112	A45 Q46 S51 S52 Y53	A45-K49 WeakPolarHBondContact O-CG 3.21Å; A45-K49 PolarHBondContact O-N 2.95Å; Q46-K49 WeakPolarHBondContact O-CB 3.34Å; Q46-K49 PolarHBondContact O-N 3.11Å; Q46-K49 VanDerWaalsContact O-N 3.17Å; K49-S51 VanDerWaalsContact C-N 3.32Å; K49-S51 PolarHBondContact O-N 2.91Å; K49-S52 WeakPolarHBondContact CA-OG 3.48Å; K49-S52 PolarHBondContact O-N 3.05Å; K49-S52 PolarHBondContact O-OG 3.12Å; K49-Y53 WeakPolarHBondContact O-CB 3.35Å; K49-Y53 PolarHBondContact O-N 3.34Å
50	Q	67	Low	66	Low	106 Å²	106	111.8 Å²	111.8	50%	0.495	58%	0.583	S	S	.	*	H	α-helix	trans	-59.8	-43.2	175.3	-155.2	76.2	22.2	0	0	111.1	Q46 Q47 S52 Y53 N54	Q46-Q50 PolarHBondContact O-N 3.1Å; Q47-Q50 PolarHBondContact O-N 3.45Å; Q50-S52 PolarHBondContact O-N 3.45Å; Q50-Y53 PolarHBondContact O-N 2.9Å; Q50-N54 WeakPolarHBondContact O-CB 3.5Å; Q50-N54 VanDerWaalsContact O-CG 3.3Å; Q50-N54 PolarHBondContact O-N 3.37Å; Q50-N54 PolarHBondContact O-OD1 3.17Å
51	S	63.8	Low	64.2	Low	81 Å²	81	109.5 Å²	109.5	57%	0.566	58%	0.583	S	S	*	*	H	α-helix	trans	-61.4	-42.5	175.6	-170.2	0	0	0	0	112.4	Q47 R48 K49 A55	Q47-S51 WeakPolarHBondContact O-CB 3.4Å; Q47-S51 PolarHBondContact O-N 2.87Å; R48-S51 WeakPolarHBondContact O-CB 3.49Å; R48-S51 PolarHBondContact O-N 3.25Å; K49-S51 VanDerWaalsContact C-N 3.32Å; K49-S51 PolarHBondContact O-N 2.91Å; S51-A55 WeakPolarHBondContact O-CB 3.34Å; S51-A55 PolarHBondContact O-N 3.49Å; S51-A55 VanDerWaalsContact O-N 3.1Å
52	S	61.4	Low	62.2	Low	72 Å²	72	107.7 Å²	107.7	50%	0.503	59%	0.592	S	S	.	*	H	α-helix	trans	-69.6	-32.7	175.5	50.5	0	0	0	0	113.2	R48 K49 Q50 Y56	R48-S52 PolarHBondContact O-N 3.24Å; R48-S52 PolarHBondContact O-OG 3.11Å; K49-S52 WeakPolarHBondContact CA-OG 3.48Å; K49-S52 PolarHBondContact O-N 3.05Å; K49-S52 PolarHBondContact O-OG 3.12Å; Q50-S52 PolarHBondContact O-N 3.45Å; S52-Y56 PolarHBondContact O-N 3.29Å; S52-Y56 VanDerWaalsContact O-N 3.12Å
53	Y	52.6	Low	60.3	Low	145 Å²	145	112.5 Å²	112.5	57%	0.569	61%	0.611	S	S	*	*	H	α-helix	trans	-72.1	-42.6	177.9	-169.7	-105.5	0	0	0	111.6	K49 Q50 A55 Y56 I57	K49-Y53 WeakPolarHBondContact O-CB 3.35Å; K49-Y53 PolarHBondContact O-N 3.34Å; Q50-Y53 PolarHBondContact O-N 2.9Å; Y53-A55 VanDerWaalsContact C-N 3.32Å; Y53-A55 PolarHBondContact O-N 3.05Å; Y53-Y56 WeakPolarHBondContact O-CA 3.41Å; Y53-Y56 WeakPolarHBondContact O-CB 3.43Å; Y53-Y56 PolarHBondContact O-N 3.42Å; Y53-Y56 VanDerWaalsContact O-N 3.11Å; Y53-I57 HydrophobicContact CD1-CD1 3.95Å; Y53-I57 HydrophobicContact CE1-CD1 3.48Å; Y53-I57 VanDerWaalsContact CE1-CD1 3.48Å; Y53-I57 HydrophobicContact CE1-CG1 4.38Å; Y53-I57 PolarHBondContact O-N 3.42Å
54	N	61.2	Low	58.1	Low	85 Å²	85	113.4 Å²	113.4	46%	0.455	63%	0.625	S	S	.	*	H	α-helix	trans	-63.6	-37.3	173.6	-70.9	8.2	0	0	0	111.8	Q50 Y56 I57 M58	Q50-N54 WeakPolarHBondContact O-CB 3.5Å; Q50-N54 VanDerWaalsContact O-CG 3.3Å; Q50-N54 PolarHBondContact O-N 3.37Å; Q50-N54 PolarHBondContact O-OD1 3.17Å; N54-Y56 VanDerWaalsContact C-N 3.31Å; N54-Y56 PolarHBondContact O-N 2.84Å; N54-I57 PolarHBondContact O-N 2.78Å; N54-M58 VanDerWaalsContact O-CG 3.3Å; N54-M58 WeakPolarHBondContact O-CG 3.44Å; N54-M58 PolarHBondContact O-N 2.83Å
55	A	55.1	Low	55.7	Low	61 Å²	61	111 Å²	111	50%	0.504	64%	0.639	S	S	.	*	H	α-helix	trans	-62.2	-38.1	172	0	0	0	0	0	112.2	S51 Y53 M58 A59	S51-A55 WeakPolarHBondContact O-CB 3.34Å; S51-A55 PolarHBondContact O-N 3.49Å; S51-A55 VanDerWaalsContact O-N 3.1Å; Y53-A55 VanDerWaalsContact C-N 3.32Å; Y53-A55 PolarHBondContact O-N 3.05Å; A55-M58 PolarHBondContact O-N 3.49Å; A55-A59 PolarHBondContact O-N 3.24Å; A55-A59 VanDerWaalsContact O-N 3.11Å
56	Y	50.4	Low	53.5	Low	192 Å²	192	112.5 Å²	112.5	75%	0.753	66%	0.659	S	S	*	*	H	α-helix	trans	-66.5	-38.2	174.2	-122.8	-91.3	0	0	0	112.8	S52 Y53 N54 A59 G60	S52-Y56 PolarHBondContact O-N 3.29Å; S52-Y56 VanDerWaalsContact O-N 3.12Å; Y53-Y56 WeakPolarHBondContact O-CA 3.41Å; Y53-Y56 WeakPolarHBondContact O-CB 3.43Å; Y53-Y56 PolarHBondContact O-N 3.42Å; Y53-Y56 VanDerWaalsContact O-N 3.11Å; N54-Y56 VanDerWaalsContact C-N 3.31Å; N54-Y56 PolarHBondContact O-N 2.84Å; Y56-A59 PolarHBondContact O-N 2.84Å; Y56-G60 PolarHBondContact O-N 3.46Å
57	I	49.9	Very low	51.2	Low	78 Å²	78	111.2 Å²	111.2	40%	0.4	67%	0.665	S	S	.	*	H	α-helix	trans	-71.5	-36.8	175.8	-72.2	179.8	0	0	0	111.8	Y53 N54 A59 G60 L61	Y53-I57 HydrophobicContact CD1-CD1 3.95Å; Y53-I57 HydrophobicContact CE1-CD1 3.48Å; Y53-I57 VanDerWaalsContact CE1-CD1 3.48Å; Y53-I57 HydrophobicContact CE1-CG1 4.38Å; Y53-I57 PolarHBondContact O-N 3.42Å; N54-I57 PolarHBondContact O-N 2.78Å; I57-A59 VanDerWaalsContact C-N 3.26Å; I57-A59 PolarHBondContact O-N 2.98Å; I57-G60 PolarHBondContact O-N 3.46Å; I57-L61 HydrophobicContact CG2-CD1 3.9Å; I57-L61 PolarHBondContact O-N 3.25Å
58	M	53.4	Low	49	Very low	157 Å²	157	113.1 Å²	113.1	77%	0.773	68%	0.678	S	S	*	*	H	α-helix	trans	-62.9	-32.3	172.1	-71.5	-70.7	-72.3	0	0	112.2	N54 A55	N54-M58 VanDerWaalsContact O-CG 3.3Å; N54-M58 WeakPolarHBondContact O-CG 3.44Å; N54-M58 PolarHBondContact O-N 2.83Å; A55-M58 PolarHBondContact O-N 3.49Å
59	A	55.5	Low	47	Very low	86 Å²	86	107.5 Å²	107.5	71%	0.711	67%	0.67	S	S	*	*	H	α-helix	trans	-76.4	-21.2	170.5	0	0	0	0	0	113.6	A55 Y56 I57	A55-A59 PolarHBondContact O-N 3.24Å; A55-A59 VanDerWaalsContact O-N 3.11Å; Y56-A59 PolarHBondContact O-N 2.84Å; I57-A59 VanDerWaalsContact C-N 3.26Å; I57-A59 PolarHBondContact O-N 2.98Å
60	G	49.9	Very low	45	Very low	59 Å²	59	107.7 Å²	107.7	61%	0.608	68%	0.678	S	S	*	*	H	α-helix	trans	-92.1	-4.5	-176.3	0	0	0	0	0	116.1	Y56 I57	Y56-G60 PolarHBondContact O-N 3.46Å; I57-G60 PolarHBondContact O-N 3.46Å
61	L	45.5	Very low	43	Very low	135 Å²	135	109.7 Å²	109.7	71%	0.707	69%	0.692	S	S	*	*			trans	-100.4	15.9	-177.9	-79.4	166.3	0	0	0	114.2	I57 I63	I57-L61 HydrophobicContact CG2-CD1 3.9Å; I57-L61 PolarHBondContact O-N 3.25Å; L61-I63 PolarHBondContact O-N 2.98Å
62	G	37.5	Very low	41.4	Very low	74 Å²	74	109.3 Å²	109.3	76%	0.763	69%	0.693	S	S	*	*			trans	-84.2	96.1	174	0	0	0	0	0	113.2
63	I	37.2	Very low	39.8	Very low	168 Å²	168	112 Å²	112	86%	0.862	71%	0.707	S	S	*	*			trans	-128.2	130.1	168.7	-54.6	174	0	0	0	106.8	L61	L61-I63 PolarHBondContact O-N 2.98Å
64	G	33.3	Very low	38.6	Very low	75 Å²	75	111 Å²	111	77%	0.773	72%	0.721	S	S	*	*			cis	-163.1	-171.2	-6.5	0	0	0	0	0	107.8
65	G	30	Very low	37	Very low	85 Å²	85	109.7 Å²	109.7	88%	0.876	73%	0.728	S	S	*	*			cis	-178.8	-179	-0.1	0	0	0	0	0	109.9
66	G	28.6	Very low	35.7	Very low	83 Å²	83	113.5 Å²	113.5	86%	0.856	75%	0.745	S	S	*	*			trans	175.7	139.9	-179.6	0	0	0	0	0	109.2
67	S	28.5	Very low	34.5	Very low	107 Å²	107	108.3 Å²	108.3	75%	0.748	74%	0.742	S	S	*	*			trans	-101.5	169.7	-163.3	54.6	0	0	0	0	114.5
68	L	27.2	Very low	33.5	Very low	168 Å²	168	111.5 Å²	111.5	88%	0.88	77%	0.765	S	S	*	*			trans	80.2	145.7	172.4	-52	164.4	0	0	0	116.1
69	S	28.1	Very low	32.3	Very low	87 Å²	87	107.3 Å²	107.3	61%	0.608	76%	0.763	S	S	*	*			cis	161.7	102.3	-38.8	163.7	0	0	0	0	108.5
70	L	28.3	Very low	31	Very low	157 Å²	157	111.1 Å²	111.1	82%	0.822	77%	0.771	S	S	*	*			trans	63.2	165.6	165	-60.1	161.3	0	0	0	114.5
71	N	26.8	Very low	30	Very low	149 Å²	149	111.5 Å²	111.5	80%	0.797	78%	0.776	S	S	*	*			cis	-141.2	-172.4	0.8	-150.9	-5	0	0	0	111.8
72	A	28.6	Very low	29.2	Very low	72 Å²	72	112.5 Å²	112.5	60%	0.595	78%	0.776	S	S	*	*			trans	-81.3	150.3	-175.6	0	0	0	0	0	116.1
73	T	29	Very low	28.7	Very low	129 Å²	129	115.7 Å²	115.7	79%	0.791	78%	0.775	S	S	*	*			trans	52.3	138	143.7	53.7	0	0	0	0	123
74	S	27.3	Very low	28.3	Very low	123 Å²	123	115.6 Å²	115.6	86%	0.86	78%	0.776	S	S	*	*			trans	94.9	148.9	145.9	82.7	0	0	0	0	119.6
75	G	27.9	Very low	28.1	Very low	59 Å²	59	115.8 Å²	115.8	61%	0.608	78%	0.777	S	S	*	*			trans	96.2	97.8	138.2	0	0	0	0	0	119.8
76	T	26.2	Very low	28.1	Very low	140 Å²	140	115.4 Å²	115.4	86%	0.859	77%	0.774	S	S	*	*				59.4	143.6	129.5	51.5	0	0	0	0	123.6
77	A	26.7	Very low	28.3	Very low	83 Å²	83	119.6 Å²	119.6	69%	0.686	78%	0.777	S	S	*	*			trans	76.9	99.3	142.1	0	0	0	0	0	121.6
78	T	28.3	Very low	28.4	Very low	145 Å²	145	117.1 Å²	117.1	89%	0.89	77%	0.768	S	S	*	*				37.7	130.1	123	57.5	0	0	0	0	122
79	G	27.3	Very low	28.5	Very low	70 Å²	70	115.6 Å²	115.6	72%	0.722	77%	0.766	S	S	*	*			trans	172.1	84.9	155.7	0	0	0	0	0	119.7
80	N	29.2	Very low	28.8	Very low	165 Å²	165	118 Å²	118	88%	0.882	78%	0.777	S	S	*	*			trans	58.3	167.1	145.4	-62.5	7.5	0	0	0	122.8
81	G	29.1	Very low	28.7	Very low	68 Å²	68	114.4 Å²	114.4	70%	0.701	78%	0.778	S	S	*	*			trans	114.8	48.6	-177.3	0	0	0	0	0	113.6
82	E	28.2	Very low	28.9	Very low	155 Å²	155	110.8 Å²	110.8	72%	0.724	78%	0.776	S	S	*	*				58.4	112.1	89.8	-74	-161.2	107.7	0	0	117.1
83	L	28	Very low	29	Very low	142 Å²	142	117.8 Å²	117.8	74%	0.743	79%	0.793	S	S	*	*			trans	62.2	138.3	131.3	-60	175.4	0	0	0	119.7
84	L	28	Very low	29	Very low	165 Å²	165	115.3 Å²	115.3	86%	0.864	79%	0.792	S	S	*	*			cis	-131.4	170.3	-1.3	-65.4	91.7	0	0	0	107.9
85	G	28.9	Very low	30.2	Very low	79 Å²	79	114.8 Å²	114.8	81%	0.814	79%	0.786	S	S	*	*			cis	134.7	120.3	5.2	0	0	0	0	0	109.8
86	G	29.7	Very low	30.5	Very low	78 Å²	78	118.2 Å²	118.2	80%	0.804	79%	0.791	S	S	*	*			trans	-176	37.1	-165.4	0	0	0	0	0	122.5
87	N	32.3	Very low	30.7	Very low	171 Å²	171	120.3 Å²	120.3	91%	0.914	79%	0.791	S	S	*	*			trans	54.5	150.2	148.2	-153.2	19.5	0	0	0	123.6
88	G	31.4	Very low	30.9	Very low	55 Å²	55	120.2 Å²	120.2	57%	0.567	79%	0.79	S	S	*	*			trans	91.8	117	172.2	0	0	0	0	0	114.5
89	T	29.9	Very low	31.1	Very low	136 Å²	136	120.3 Å²	120.3	83%	0.834	79%	0.79	S	S	*	*			cis	54.3	128	41.4	79.4	0	0	0	0	112.7
90	T	32.9	Very low	31.1	Very low	137 Å²	137	120 Å²	120	84%	0.84	79%	0.786	S	S	*	*			cis	-137.9	174.9	17.6	50.1	0	0	0	0	111.2
91	G	27.7	Very low	31.8	Very low	81 Å²	81	118 Å²	118	84%	0.835	78%	0.783	S	S	*	*			cis	134.2	101.8	-0.5	0	0	0	0	0	113.3
92	G	30	Very low	31.8	Very low	73 Å²	73	119.1 Å²	119.1	75%	0.753	79%	0.785	S	S	*	*			trans	145.4	117.9	174.7	0	0	0	0	0	111.3
93	K	31.1	Very low	31.9	Very low	220 Å²	220	117.6 Å²	117.6	96%	0.957	79%	0.791	S	S	*	*				77.6	122.4	58.4	-80.6	-167	173.9	-177.4	0	114.6
94	G	28.6	Very low	31.9	Very low	76 Å²	76	113.9 Å²	113.9	78%	0.784	79%	0.788	S	S	*	*			trans	137.8	131.2	150.9	0	0	0	0	0	115.8
95	P	53.8	Low	31.9	Very low	112 Å²	112	114.7 Å²	114.7	73%	0.727	79%	0.792	S	S	*	*			trans	-125.9	-174.7	-176.6	42.4	-29.4	0	0	0	115.2
96	N	33.1	Very low	31.8	Very low	132 Å²	132	114.3 Å²	114.3	71%	0.706	78%	0.782	S	S	*	*			trans	109	138	149.9	-68.4	-16.4	0	0	0	120.1
97	Q	30.2	Very low	31.7	Very low	184 Å²	184	117.2 Å²	117.2	86%	0.86	78%	0.784	S	S	*	*			trans	66.2	158.2	152.6	-69.8	168.5	30.5	0	0	118.1
98	A	31.2	Very low	31.4	Very low	81 Å²	81	113.8 Å²	113.8	67%	0.669	77%	0.773	S	S	*	*			cis	-176.1	-161.9	-28	0	0	0	0	0	107.4
99	V	31.9	Very low	31.3	Very low	147 Å²	147	116.7 Å²	116.7	89%	0.891	79%	0.785	S	S	*	*			trans	85.1	130.1	160.8	-176.7	0	0	0	0	117.5
100	G	28	Very low	31.1	Very low	62 Å²	62	114.4 Å²	114.4	64%	0.639	79%	0.788	S	S	*	*			trans	-106.2	-142.1	165.3	0	0	0	0	0	110.7
101	P	44.5	Very low	30.7	Very low	124 Å²	124	112.5 Å²	112.5	81%	0.805	79%	0.786	S	S	*	*			cis	-140.1	-166.2	4.6	43.2	-24.1	0	0	0	114.8
102	A	29	Very low	31.2	Very low	92 Å²	92	114.2 Å²	114.2	76%	0.76	78%	0.783	S	S	*	*			trans	66.5	161.6	148.8	0	0	0	0	0	120.1
103	S	29.6	Very low	31	Very low	122 Å²	122	116.9 Å²	116.9	85%	0.853	78%	0.784	S	S	*	*			cis	-173.1	155.1	-28.8	56.5	0	0	0	0	111.7
104	G	27.9	Very low	30.7	Very low	65 Å²	65	110.3 Å²	110.3	67%	0.67	77%	0.771	S	S	*	*			trans	142.5	122.7	168.4	0	0	0	0	0	112.6
105	L	27.7	Very low	30.5	Very low	181 Å²	181	112.8 Å²	112.8	95%	0.948	77%	0.771	S	S	*	*				64.8	135.1	74.7	-91.1	75.7	0	0	0	114.4
106	A	28.1	Very low	29.1	Very low	72 Å²	72	113 Å²	113	60%	0.595	78%	0.775	S	S	*	*			cis	-164.6	167.4	-5.2	0	0	0	0	0	112.1
107	T	26.6	Very low	28.7	Very low	139 Å²	139	110 Å²	110	85%	0.853	78%	0.775	S	S	*	*			trans	60.9	153.6	153.4	43.4	0	0	0	0	119.9
108	S	27.1	Very low	28.5	Very low	99 Å²	99	111.1 Å²	111.1	69%	0.692	78%	0.777	S	S	*	*			cis	-163.5	167	-11.9	50.6	0	0	0	0	111.5
109	S	27.6	Very low	28.2	Very low	116 Å²	116	111.5 Å²	111.5	81%	0.811	78%	0.78	S	S	*	*			trans	55	121.5	148.3	59.4	0	0	0	0	121.3
110	G	27	Very low	28	Very low	87 Å²	87	113.4 Å²	113.4	90%	0.897	78%	0.782	S	S	*	*			trans	157.8	110.6	157.4	0	0	0	0	0	116.4
111	A	24.2	Very low	27.9	Very low	97 Å²	97	118.6 Å²	118.6	80%	0.802	79%	0.794	S	S	*	*			trans	-141.2	167.1	164.2	0	0	0	0	0	107.7
112	P	38.8	Very low	27	Very low	118 Å²	118	115.7 Å²	115.7	77%	0.766	79%	0.786	S	S	*	*			cis	-133.8	-151.4	7.4	32.9	-8.7	0	0	0	113.5
113	V	25.8	Very low	27	Very low	128 Å²	128	119.9 Å²	119.9	78%	0.776	80%	0.795	S	S	*	*			trans	90.2	92.9	161.5	-167	0	0	0	0	119.3
114	A	24.6	Very low	26.9	Very low	82 Å²	82	116.9 Å²	116.9	68%	0.678	78%	0.784	S	S	*	*				51.5	152.9	122.7	0	0	0	0	0	125.2
115	T	23.3	Very low	26.9	Very low	129 Å²	129	123.4 Å²	123.4	79%	0.791	79%	0.794	S	S	*	*			trans	76.8	111.1	152.9	36.7	0	0	0	0	122
116	S	24.5	Very low	26.9	Very low	117 Å²	117	122.9 Å²	122.9	82%	0.818	78%	0.784	S	S	*	*			trans	59.9	118.8	135.8	62.9	0	0	0	0	122.2
117	G	24.7	Very low	26.9	Very low	67 Å²	67	129.8 Å²	129.8	69%	0.691	80%	0.796	S	S	*	*				110	99.2	118.9	0	0	0	0	0	118.6
118	F	25.7	Very low	26.9	Very low	209 Å²	209	127.2 Å²	127.2	92%	0.917	79%	0.789	S	S	*	*			trans	-125.4	119	148.9	-85.9	-101.4	0	0	0	106.9
119	A	26.6	Very low	27.9	Very low	89 Å²	89	127.3 Å²	127.3	74%	0.736	79%	0.787	S	S	*	*			cis	92.2	118.7	48.4	0	0	0	0	0	111.8
120	M	26.8	Very low	27.9	Very low	187 Å²	187	129.7 Å²	129.7	92%	0.921	79%	0.785	S	S	*	*			trans	-92.8	144	174.4	-66.7	-151.1	-56.7	0	0	111.4
121	L	25.5	Very low	27.8	Very low	170 Å²	170	129.4 Å²	129.4	89%	0.89	77%	0.77	S	S	*	*			trans	-98.7	143.4	145.8	-65.7	101.9	0	0	0	108.2
122	G	27	Very low	27.9	Very low	63 Å²	63	133.3 Å²	133.3	65%	0.649	77%	0.771	S	S	*	*			cis	113.3	101.5	-4.4	0	0	0	0	0	113.2
123	L	27.6	Very low	27.4	Very low	180 Å²	180	135.7 Å²	135.7	94%	0.942	77%	0.771	S	S	*	*			trans	173.3	140.6	162	-97.6	161.2	0	0	0	107.5
124	G	28.9	Very low	27.4	Very low	60 Å²	60	137.8 Å²	137.8	62%	0.619	77%	0.772	S	S	*	*			cis	164.1	155.6	-12.6	0	0	0	0	0	113.1
125	K	27.3	Very low	27.5	Very low	202 Å²	202	142.9 Å²	142.9	88%	0.878	78%	0.782	S	S	*	*			trans	74.8	153.1	173.5	-59.3	177.3	-179.3	175.9	0	117.9
126	K	27.7	Very low	27.8	Very low	170 Å²	170	144.9 Å²	144.9	74%	0.739	78%	0.782	S	S	*	*			cis	-172.4	161.7	-42.4	-124.8	-174.1	179.6	-172	0	110.5
127	Y	28.3	Very low	27.9	Very low	216 Å²	216	148.1 Å²	148.1	85%	0.847	78%	0.784	S	S	*	*			trans	101.9	148.5	165.7	-69.1	-73.5	0	0	0	119.4
128	A	26.9	Very low	28.2	Very low	86 Å²	86	152.8 Å²	152.8	71%	0.711	79%	0.788	S	S	*	*			trans	-165.1	-168.4	-168.4	0	0	0	0	0	106.2
129	P	47.9	Very low	28.2	Very low	101 Å²	101	151.6 Å²	151.6	66%	0.656	79%	0.785	S	S	*	*			cis	-133.7	-147.6	-5.3	39.7	-18.1	0	0	0	113.1
130	H	27.5	Very low	28.3	Very low	166 Å²	166	155 Å²	155	77%	0.769	79%	0.785	S	S	*	*			trans	87.6	157.2	170.7	-61.8	-69.1	0	0	0	119.4
131	S	25.2	Very low	28.2	Very low	81 Å²	81	155.5 Å²	155.5	57%	0.566	79%	0.785	S	S	*	*				-178.5	136.6	-64.2	48.5	0	0	0	0	112.1
132	H	26.3	Very low	28.4	Very low	178 Å²	178	155 Å²	155	82%	0.824	78%	0.778	S	S	*	*			trans	64.4	166	177	-57.8	-75.8	0	0	0	114.8
133	H	26.7	Very low	28.3	Very low	169 Å²	169	161.3 Å²	161.3	78%	0.782	79%	0.791	S	S	*	*			cis	-144.6	-164.3	12.1	-145	-10.5	0	0	0	113.2
134	H	27.2	Very low	28.3	Very low	171 Å²	171	160.4 Å²	160.4	79%	0.792	78%	0.782	S	S	*	*			trans	-83.3	164.9	-179.4	-70.8	-86.6	0	0	0	113.5
135	Q	26.1	Very low	28.1	Very low	190 Å²	190	167 Å²	167	89%	0.888	80%	0.796	S	S	*	*				176.7	154.4	107.2	-170.2	152.2	-18.2	0	0	113
136	H	30.7	Very low	28.1	Very low	171 Å²	171	165.3 Å²	165.3	79%	0.792	79%	0.791	S	S	*	*			trans	-87.5	149.3	172.1	-82.5	-95.4	0	0	0	112.3
137	Q	26.1	Very low	28.1	Very low	185 Å²	185	165.2 Å²	165.2	86%	0.864	79%	0.793	S	S	*	*			trans	-155	148.3	141.8	-139.8	164.7	-3.5	0	0	113.2
138	H	30.1	Very low	28.1	Very low	164 Å²	164	162.2 Å²	162.2	76%	0.759	79%	0.787	S	S	*	*			trans	-112.9	145.3	169.1	-89.8	-88.7	0	0	0	109.1
139	Q	25.8	Very low	28	Very low	185 Å²	185	165.7 Å²	165.7	86%	0.864	79%	0.788	S	S	*	*			trans	-155.5	151.4	147.1	-143.5	161	-7	0	0	112.3
140	H	28.4	Very low	26.9	Very low	159 Å²	159	172.8 Å²	172.8	74%	0.736	80%	0.802	S	S	*	*			trans	-109.9	150.5	174.2	-78.5	-98	0	0	0	110.4
141	Q	25.5	Very low	26.9	Very low	198 Å²	198	172.9 Å²	172.9	93%	0.925	80%	0.802	S	S	*	*			trans	-156.6	157.9	137.5	-123.3	166.1	-15.1	0	0	112.6
142	H	28.4	Very low	27.1	Very low	160 Å²	160	174.8 Å²	174.8	74%	0.741	82%	0.815	S	S	*	*			trans	-106.5	153.6	-178.6	-76.5	-101.5	0	0	0	111.5
143	Q	25.4	Very low	27.2	Very low	195 Å²	195	174 Å²	174	91%	0.911	82%	0.816	S	S	*	*			trans	-150.3	148	140.3	-151.3	159.5	-0.7	0	0	111.8
144	H	27.9	Very low	27.5	Very low	162 Å²	162	172.5 Å²	172.5	75%	0.75	82%	0.819	S	S	*	*			trans	-118.5	148.2	177.1	-90.4	-81.3	0	0	0	110.3
145	Q	25.5	Very low	27.5	Very low	197 Å²	197	169.9 Å²	169.9	92%	0.921	82%	0.816	S	S	*	*			trans	-157.1	159.7	149.4	-115.1	171.7	5.9	0	0	111.3
146	H	27.5	Very low	27.8	Very low	167 Å²	167	172.8 Å²	172.8	77%	0.773	82%	0.818	S	S	*	*			trans	-110.7	154	-178.1	-76	-97.3	0	0	0	111.2
147	H	26.4	Very low	27.7	Very low	169 Å²	169	173 Å²	173	78%	0.782	82%	0.819	S	S	*	*				-175.7	126.4	117.4	-99.9	-74.6	0	0	0	115.2
148	Q	28	Very low	28	Very low	152 Å²	152	175.9 Å²	175.9	71%	0.71	82%	0.822	S	S	*	*			trans	14.2	133.6	149.6	-68	160.9	-44.4	0	0	125.3
149	H	25.9	Very low	27.9	Very low	160 Å²	160	174.4 Å²	174.4	74%	0.741	82%	0.824	S	S	*	*			trans	47.5	125.5	134	-67.2	-66.3	0	0	0	124
150	R	25.1	Very low	28	Very low	250 Å²	250	173.3 Å²	173.3	94%	0.943	82%	0.824	S	S	*	*				-152.9	158.1	113	-138.9	170.1	-177.4	162.6	0.9	112.5
151	H	26.9	Very low	27.9	Very low	168 Å²	168	177.3 Å²	177.3	78%	0.778	83%	0.832	S	S	*	*			trans	-96.1	155.5	178.1	-74.5	-94	0	0	0	112.7
152	S	28.2	Very low	28	Very low	121 Å²	121	174.3 Å²	174.3	85%	0.846	83%	0.828	S	S	*	*			trans	-147.5	153.4	151.2	-170.2	0	0	0	0	110.5
153	L	29.6	Very low	28	Very low	160 Å²	160	178.6 Å²	178.6	84%	0.838	84%	0.837	S	S	*	*			trans	-123.7	132.1	-176	-82.7	159.2	0	0	0	110.1
154	T	31.8	Very low	28.1	Very low	139 Å²	139	175.1 Å²	175.1	85%	0.853	84%	0.835	S	S	*	*			trans	-138.7	121.4	160	57.8	0	0	0	0	110.1
155	T	28.7	Very low	28.1	Very low	116 Å²	116	173.4 Å²	173.4	71%	0.712	84%	0.841	S	S	*	*			trans	-85.5	151.2	179.2	44.6	0	0	0	0	112
156	R	31	Very low	28.2	Very low	251 Å²	251	168 Å²	168	95%	0.947	84%	0.838	S	S	*	*			trans	-132.8	119.4	159.3	-83.4	-171.7	169	176.8	-2.9	109.5
157	H	29.8	Very low	28.1	Very low	175 Å²	175	163.8 Å²	163.8	81%	0.81	84%	0.84	S	S	*	*			trans	-72	145.8	-179.6	-77.6	-108.7	0	0	0	111.6
158	R	32.3	Very low	28.1	Very low	245 Å²	245	160.4 Å²	160.4	93%	0.925	84%	0.841	S	S	*	*			trans	-110.8	111	168.7	-159.4	178.6	-160.3	169.7	6.2	108	L160	R158-L160 PolarHBondContact O-N 2.96Å
159	V	28.6	Very low	28	Very low	133 Å²	133	161 Å²	161	81%	0.806	84%	0.843	S	S	*	*			trans	-72.8	118.8	-175	178.7	0	0	0	0	110.2
160	L	27.1	Very low	27.9	Very low	163 Å²	163	159.4 Å²	159.4	85%	0.853	84%	0.841	S	S	*	*			trans	-85.8	128.1	165.3	-82.5	161.8	0	0	0	108.8	R158	R158-L160 PolarHBondContact O-N 2.96Å
161	R	26.8	Very low	27.8	Very low	243 Å²	243	153.2 Å²	153.2	92%	0.917	83%	0.831	S	S	*	*			trans	-104.4	89.2	-178.4	-158.7	173.1	-163.5	150.9	3.8	110
162	T	27.9	Very low	27.8	Very low	134 Å²	134	157.6 Å²	157.6	82%	0.822	84%	0.84	S	S	*	*			trans	-66.7	152.4	167.4	46.8	0	0	0	0	110.2
163	R	27.1	Very low	27.6	Very low	250 Å²	250	159 Å²	159	94%	0.943	83%	0.834	S	S	*	*			trans	-134.8	116.4	174.4	-158	175	-171.4	-179.5	1.4	108.5
164	S	27.5	Very low	27.3	Very low	123 Å²	123	160 Å²	160	86%	0.86	83%	0.834	S	S	*	*			trans	-89.4	173.3	-175.9	49.9	0	0	0	0	112.7
165	S	29.6	Very low	27	Very low	126 Å²	126	159.5 Å²	159.5	88%	0.881	82%	0.822	S	S	*	*			trans	-99.1	169.6	-170.8	47.1	0	0	0	0	114.9
166	G	26.2	Very low	26.8	Very low	83 Å²	83	161.3 Å²	161.3	86%	0.856	82%	0.824	S	S	*	*			trans	127.2	132.5	-178.4	0	0	0	0	0	109.8
167	G	25.5	Very low	26.5	Very low	79 Å²	79	157.4 Å²	157.4	81%	0.814	82%	0.819	S	S	*	*			cis	145.9	147.2	3	0	0	0	0	0	109
168	A	26	Very low	26.4	Very low	97 Å²	97	156.7 Å²	156.7	80%	0.802	82%	0.816	S	S	*	*			cis	-117.1	-121.7	-10.9	0	0	0	0	0	109.8
169	Q	25.9	Very low	25.9	Very low	164 Å²	164	152.9 Å²	152.9	77%	0.766	81%	0.808	S	S	*	*			cis	-162.2	175.6	-5.2	-149.3	-178.5	-91.1	0	0	109.6
170	N	25	Very low	25.7	Very low	128 Å²	128	153.6 Å²	153.6	68%	0.684	80%	0.803	S	S	*	*			trans	66.4	102.3	171.8	-54.8	-3.9	0	0	0	114.7
171	V	23.4	Very low	25.7	Very low	120 Å²	120	154.3 Å²	154.3	73%	0.727	80%	0.799	S	S	*	*			cis	78.5	106.6	48.4	-176	0	0	0	0	113.9
172	W	26	Very low	25.6	Very low	260 Å²	260	148.3 Å²	148.3	99%	0.985	79%	0.79	S	S	*	*				-149.5	159.1	127.3	-94.5	100.1	0	0	0	107.6
173	E	23.8	Very low	25.4	Very low	151 Å²	151	147.1 Å²	147.1	71%	0.706	78%	0.782	S	S	*	*			trans	-129.3	-165.9	-160.6	-140.8	-177.5	140.2	0	0	113.2
174	E	24.6	Very low	25.4	Very low	179 Å²	179	145.2 Å²	145.2	84%	0.836	78%	0.777	S	S	*	*			trans	81.3	150.9	175.2	-55.8	-168.7	130.2	0	0	119
175	Q	25.1	Very low	25.5	Very low	130 Å²	130	144.7 Å²	144.7	61%	0.607	77%	0.773	S	S	*	*				-168	156	-59.2	-111.9	-176.1	34	0	0	109.4
176	M	24.2	Very low	25.6	Very low	153 Å²	153	145 Å²	145	75%	0.754	77%	0.772	S	S	*	*			trans	41.2	122.5	156.8	-57.3	-170.3	-172.1	0	0	121.7
177	M	25.2	Very low	25.8	Very low	170 Å²	170	146.3 Å²	146.3	84%	0.837	77%	0.768	S	S	*	*				-160.2	149.5	106.7	-131.1	157.2	-77.2	0	0	113.4
178	E	26.1	Very low	26.3	Very low	159 Å²	159	148.2 Å²	148.2	74%	0.743	77%	0.766	S	S	*	*			trans	1.2	132	163.8	-64.1	165.5	154.8	0	0	119.8
179	Q	23.6	Very low	26.3	Very low	165 Å²	165	151.8 Å²	151.8	77%	0.771	77%	0.77	S	S	*	*				61.3	101.7	63.8	-66.7	-170.8	-91.1	0	0	115.6
180	H	24.1	Very low	26.3	Very low	149 Å²	149	148.4 Å²	148.4	69%	0.69	76%	0.764	S	S	*	*				165.4	162.2	116.7	-95	-82.4	0	0	0	113.1
181	F	25.4	Very low	26.5	Very low	178 Å²	178	148.4 Å²	148.4	78%	0.781	77%	0.769	S	S	*	*			trans	64.7	108.6	176.9	-52.5	-73.3	0	0	0	115.9
182	T	25.1	Very low	26.6	Very low	117 Å²	117	154 Å²	154	72%	0.718	78%	0.777	S	S	*	*				65.5	136.5	58.1	79.1	0	0	0	0	112.7
183	T	24.4	Very low	26.8	Very low	109 Å²	109	146.6 Å²	146.6	67%	0.669	77%	0.765	S	S	*	*			cis	-159.1	-178.9	23	-36.1	0	0	0	0	111.6
184	Y	26.2	Very low	27.1	Very low	210 Å²	210	146.9 Å²	146.9	82%	0.824	77%	0.766	S	S	*	*			trans	83.3	100.2	156.3	-73.4	-65.6	0	0	0	121
185	S	30.4	Very low	27.7	Very low	112 Å²	112	150 Å²	150	78%	0.783	77%	0.77	S	S	*	*			trans	-101	147.9	132.4	-62.3	0	0	0	0	109.4
186	P	32.1	Very low	28.2	Very low	131 Å²	131	150.7 Å²	150.7	85%	0.851	78%	0.777	S	S	*	*			trans	-93.6	112.4	162.8	33	-27	0	0	0	110.5
187	S	30.3	Very low	28.6	Very low	111 Å²	111	150.1 Å²	150.1	78%	0.776	78%	0.777	S	S	*	*			trans	-103.9	158.5	153.5	71.3	0	0	0	0	107.7
188	P	36.2	Very low	29.3	Very low	119 Å²	119	148.1 Å²	148.1	77%	0.773	78%	0.777	S	S	*	*				-149.2	158.1	84.4	38.6	-21.9	0	0	0	115.7
189	I	26.1	Very low	29.8	Very low	173 Å²	173	146 Å²	146	89%	0.887	77%	0.774	S	S	*	*			trans	-154	141.1	131.6	-108.8	161.4	0	0	0	107.9
190	S	25.4	Very low	30.9	Very low	93 Å²	93	144.2 Å²	144.2	65%	0.65	78%	0.78	S	S	*	*			trans	-99.2	147.4	-166.4	-172	0	0	0	0	113.3
191	T	28.1	Very low	32.3	Very low	128 Å²	128	139.5 Å²	139.5	79%	0.785	76%	0.764	S	S	*	*			trans	40.4	113.6	149.4	51.1	0	0	0	0	119.4
192	R	26.9	Very low	33.4	Very low	236 Å²	236	141.4 Å²	141.4	89%	0.891	77%	0.767	S	S	*	*				-149.9	132.6	110.2	-144.1	171.2	-175.8	173.2	1.2	112
193	S	30.2	Very low	34.6	Very low	106 Å²	106	143.8 Å²	143.8	74%	0.741	77%	0.77	S	S	*	*			trans	-84.5	146	171	47.5	0	0	0	0	110.6
194	H	30.4	Very low	35.8	Very low	157 Å²	157	142.6 Å²	142.6	73%	0.727	76%	0.763	S	S	*	*			trans	-153	113.6	154	-109.6	-77	0	0	0	110.1
195	R	35.5	Very low	37.2	Very low	243 Å²	243	139.5 Å²	139.5	92%	0.917	76%	0.756	S	S	*	*			trans	-73	138.4	154.2	-74.6	178.9	173	170.1	-3.3	107.5
196	I	36.1	Very low	38.3	Very low	146 Å²	146	137 Å²	137	75%	0.749	74%	0.742	S	S	*	*			trans	-135.9	141.3	161.2	-61.8	-175.8	0	0	0	107.4
197	N	33.7	Very low	39.2	Very low	140 Å²	140	133.8 Å²	133.8	75%	0.749	73%	0.727	S	S	*	*			trans	-67.1	161.7	-174.5	-83.8	-10.4	0	0	0	113.7	V199	N197-V199 PolarHBondContact O-N 3.41Å
198	P	38.9	Very low	40.1	Very low	129 Å²	129	133.4 Å²	133.4	84%	0.838	72%	0.715	S	S	*	*			trans	-62.4	126	167.3	27.8	-34.9	0	0	0	110.5
199	V	37.6	Very low	40.9	Very low	113 Å²	113	130.6 Å²	130.6	69%	0.685	70%	0.702	S	S	*	*			trans	-106	117.9	173.5	179.7	0	0	0	0	108.9	N197 S201	N197-V199 PolarHBondContact O-N 3.41Å; V199-S201 PolarHBondContact O-N 2.93Å
200	S	46.6	Very low	41.9	Very low	128 Å²	128	125.2 Å²	125.2	90%	0.895	68%	0.683	S	S	*	*			trans	-81.5	72.7	-173.1	42.9	0	0	0	0	113.3
201	S	53.3	Low	43	Very low	50 Å²	50	123.7 Å²	123.7	35%	0.35	67%	0.673	S	S	.	*			trans	-149.6	121.4	162.7	60.5	0	0	0	0	114	V199 Q203 V204	V199-S201 PolarHBondContact O-N 2.93Å; S201-Q203 PolarHBondContact O-N 2.86Å; S201-V204 PolarHBondContact O-N 3.34Å; S201-V204 VanDerWaalsContact OG-CG2 3.32Å; S201-V204 WeakPolarHBondContact OG-CG2 3.42Å
202	Y	47.3	Very low	43.9	Very low	218 Å²	218	127 Å²	127	86%	0.855	67%	0.671	S	S	*	*	H	α-helix	trans	-62.4	-29.8	-177.5	-131.1	-93.1	0	0	0	113	A206	Y202-A206 PolarHBondContact O-N 2.97Å
203	Q	51.5	Low	44.5	Very low	167 Å²	167	124.9 Å²	124.9	78%	0.78	66%	0.663	S	S	*	*	H	α-helix	trans	-71.8	-41.1	-176.3	-67.9	178	-16.6	0	0	113	S201 Q205 A206 A207	S201-Q203 PolarHBondContact O-N 2.86Å; Q203-Q205 VanDerWaalsContact C-N 3.33Å; Q203-Q205 PolarHBondContact O-N 3.48Å; Q203-A206 PolarHBondContact O-N 3.35Å; Q203-A207 PolarHBondContact O-N 3.02Å; Q203-A207 VanDerWaalsContact O-N 3.14Å
204	V	49.4	Very low	45.2	Very low	85 Å²	85	128.9 Å²	128.9	52%	0.515	66%	0.662	S	S	.	*	H	α-helix	trans	-66.7	-38.5	179.7	177.8	0	0	0	0	110.8	S201 A206 A207 L208	S201-V204 PolarHBondContact O-N 3.34Å; S201-V204 VanDerWaalsContact OG-CG2 3.32Å; S201-V204 WeakPolarHBondContact OG-CG2 3.42Å; V204-A206 VanDerWaalsContact C-N 3.34Å; V204-A206 PolarHBondContact O-N 2.94Å; V204-A207 PolarHBondContact O-N 3.39Å; V204-L208 HydrophobicContact CG1-CD1 4.43Å; V204-L208 PolarHBondContact O-N 3.19Å; V204-L208 VanDerWaalsContact O-N 3.12Å
205	Q	55.2	Low	45.5	Very low	145 Å²	145	127.2 Å²	127.2	68%	0.678	65%	0.654	S	S	*	*	H	α-helix	trans	-68.8	-32.5	178	-160.4	162.4	3.2	0	0	112.3	Q203 A209	Q203-Q205 VanDerWaalsContact C-N 3.33Å; Q203-Q205 PolarHBondContact O-N 3.48Å; Q205-A209 WeakPolarHBondContact O-CB 3.39Å; Q205-A209 PolarHBondContact O-N 3.37Å
206	A	52.9	Low	46.2	Very low	59 Å²	59	118.8 Å²	118.8	49%	0.488	63%	0.633	S	S	.	*	H	α-helix	trans	-66.5	-40.6	171.6	0	0	0	0	0	112.7	Y202 Q203 V204 A209 A210	Y202-A206 PolarHBondContact O-N 2.97Å; Q203-A206 PolarHBondContact O-N 3.35Å; V204-A206 VanDerWaalsContact C-N 3.34Å; V204-A206 PolarHBondContact O-N 2.94Å; A206-A209 PolarHBondContact O-N 3.5Å; A206-A210 WeakPolarHBondContact O-CB 3.26Å; A206-A210 PolarHBondContact O-N 2.97Å
207	A	50.6	Low	46.6	Very low	64 Å²	64	116.2 Å²	116.2	53%	0.529	62%	0.619	S	S	.	*	H	α-helix	trans	-64.3	-43.1	176.9	0	0	0	0	0	112.5	Q203 V204 A210 S211	Q203-A207 PolarHBondContact O-N 3.02Å; Q203-A207 VanDerWaalsContact O-N 3.14Å; V204-A207 PolarHBondContact O-N 3.39Å; A207-A210 PolarHBondContact O-N 3.49Å; A207-S211 PolarHBondContact O-N 3.07Å; A207-S211 VanDerWaalsContact O-N 3.09Å
208	L	49.8	Very low	47.2	Very low	103 Å²	103	114.1 Å²	114.1	54%	0.539	61%	0.608	S	S	.	*	H	α-helix	trans	-67.9	-31.2	174.7	-87	162	0	0	0	113.3	V204 S211 R212	V204-L208 HydrophobicContact CG1-CD1 4.43Å; V204-L208 PolarHBondContact O-N 3.19Å; V204-L208 VanDerWaalsContact O-N 3.12Å; L208-S211 PolarHBondContact O-OG 3.13Å; L208-R212 WeakPolarHBondContact O-CG 3.49Å; L208-R212 PolarHBondContact O-N 2.93Å
209	A	53	Low	47.6	Very low	59 Å²	59	111.9 Å²	111.9	49%	0.488	60%	0.595	S	S	.	*	H	α-helix	trans	-67.6	-40.2	170.1	0	0	0	0	0	111.5	Q205 A206 R213	Q205-A209 WeakPolarHBondContact O-CB 3.39Å; Q205-A209 PolarHBondContact O-N 3.37Å; A206-A209 PolarHBondContact O-N 3.5Å; A209-R213 WeakPolarHBondContact O-CB 3.43Å; A209-R213 PolarHBondContact O-N 2.9Å
210	A	47.3	Very low	48.2	Very low	60 Å²	60	109 Å²	109	50%	0.496	58%	0.58	S	S	.	*	H	α-helix	trans	-65.5	-41.1	179.3	0	0	0	0	0	113	A206 A207 R213 R214	A206-A210 WeakPolarHBondContact O-CB 3.26Å; A206-A210 PolarHBondContact O-N 2.97Å; A207-A210 PolarHBondContact O-N 3.49Å; A210-R213 WeakPolarHBondContact O-CB 3.27Å; A210-R213 PolarHBondContact O-N 2.82Å; A210-R214 PolarHBondContact O-N 3.12Å
211	S	48.2	Very low	48.3	Very low	62 Å²	62	108 Å²	108	43%	0.434	56%	0.564	S	S	.	*	H	α-helix	trans	-66.6	-46.3	176.6	64	0	0	0	0	112.2	A207 L208 R213 R214 E215	A207-S211 PolarHBondContact O-N 3.07Å; A207-S211 VanDerWaalsContact O-N 3.09Å; L208-S211 PolarHBondContact O-OG 3.13Å; S211-R213 PolarHBondContact O-N 3.14Å; S211-R214 WeakPolarHBondContact O-CB 3.46Å; S211-R214 PolarHBondContact O-N 3.45Å; S211-E215 PolarHBondContact O-N 2.91Å
212	R	47	Very low	48	Very low	197 Å²	197	107.1 Å²	107.1	74%	0.743	56%	0.563	S	S	*	*	H	α-helix	trans	-58.2	-32.6	172.6	-73.8	-176.8	173.7	-169.5	-0.7	112.8	L208 R214 S216	L208-R212 WeakPolarHBondContact O-CG 3.49Å; L208-R212 PolarHBondContact O-N 2.93Å; R212-R214 VanDerWaalsContact C-N 3.3Å; R212-R214 PolarHBondContact O-N 2.94Å; R212-S216 PolarHBondContact O-N 3.24Å; R212-S216 PolarHBondContact O-OG 3.25Å
213	R	40.1	Very low	48.1	Very low	192 Å²	192	99 Å²	99	73%	0.725	54%	0.54	S	S	*	.	H	α-helix	trans	-70.2	-24.4	174.8	-152.9	178.3	-157.3	-153.1	6.7	112.9	A209 A210 S211 S216 I217	A209-R213 WeakPolarHBondContact O-CB 3.43Å; A209-R213 PolarHBondContact O-N 2.9Å; A210-R213 WeakPolarHBondContact O-CB 3.27Å; A210-R213 PolarHBondContact O-N 2.82Å; S211-R213 PolarHBondContact O-N 3.14Å; R213-S216 WeakPolarHBondContact CA-OG 3.36Å; R213-S216 PolarHBondContact O-OG 3.11Å; R213-I217 VanDerWaalsContact O-CD1 3.25Å; R213-I217 WeakPolarHBondContact O-CD1 3.46Å; R213-I217 VanDerWaalsContact O-CG1 3.24Å; R213-I217 WeakPolarHBondContact O-CG1 3.48Å
214	R	44.6	Very low	48	Very low	190 Å²	190	94.4 Å²	94.4	72%	0.717	52%	0.524	S	S	*	.	H	α-helix	trans	-80.7	-44.2	177.2	-138	175	-170.8	-171.7	2.2	111.9	A210 S211 R212 S216 I217 N218	A210-R214 PolarHBondContact O-N 3.12Å; S211-R214 WeakPolarHBondContact O-CB 3.46Å; S211-R214 PolarHBondContact O-N 3.45Å; R212-R214 VanDerWaalsContact C-N 3.3Å; R212-R214 PolarHBondContact O-N 2.94Å; R214-S216 VanDerWaalsContact C-N 3.34Å; R214-S216 PolarHBondContact O-N 3.05Å; R214-I217 PolarHBondContact O-N 2.69Å; R214-I217 VanDerWaalsContact O-N 3.14Å; R214-N218 PolarHBondContact O-N 2.98Å; R214-N218 VanDerWaalsContact O-N 3.14Å
215	E	37.9	Very low	48.2	Very low	121 Å²	121	93.3 Å²	93.3	57%	0.565	52%	0.52	S	S	*	.	H	α-helix	trans	-63.6	-37.2	176.7	-68.2	-51.7	138.8	0	0	113.4	S211 I217 N218 S219	S211-E215 PolarHBondContact O-N 2.91Å; E215-I217 VanDerWaalsContact C-N 3.32Å; E215-I217 PolarHBondContact O-N 3.49Å; E215-N218 PolarHBondContact O-N 2.97Å; E215-S219 WeakPolarHBondContact O-CB 3.45Å; E215-S219 PolarHBondContact O-N 3.29Å; E215-S219 PolarHBondContact O-OG 2.86Å
216	S	48.9	Very low	47.9	Very low	67 Å²	67	91.2 Å²	91.2	47%	0.469	51%	0.512	S	S	.	.	H	α-helix	trans	-68.4	-28.4	174.5	49.6	0	0	0	0	113.4	R212 R213 R214 S220	R212-S216 PolarHBondContact O-N 3.24Å; R212-S216 PolarHBondContact O-OG 3.25Å; R213-S216 WeakPolarHBondContact CA-OG 3.36Å; R213-S216 PolarHBondContact O-OG 3.11Å; R214-S216 VanDerWaalsContact C-N 3.34Å; R214-S216 PolarHBondContact O-N 3.05Å; S216-S220 WeakPolarHBondContact O-CB 3.11Å; S216-S220 PolarHBondContact O-N 3.19Å
217	I	44.7	Very low	47.9	Very low	92 Å²	92	97.1 Å²	97.1	47%	0.472	52%	0.522	S	S	.	.	H	α-helix	trans	-70.8	-45.7	172.6	-69.5	165.3	0	0	0	110.6	R213 R214 E215 S219 S220 I221	R213-I217 VanDerWaalsContact O-CD1 3.25Å; R213-I217 WeakPolarHBondContact O-CD1 3.46Å; R213-I217 VanDerWaalsContact O-CG1 3.24Å; R213-I217 WeakPolarHBondContact O-CG1 3.48Å; R214-I217 PolarHBondContact O-N 2.69Å; R214-I217 VanDerWaalsContact O-N 3.14Å; E215-I217 VanDerWaalsContact C-N 3.32Å; E215-I217 PolarHBondContact O-N 3.49Å; I217-S219 VanDerWaalsContact C-N 3.33Å; I217-S219 PolarHBondContact O-N 3.14Å; I217-S220 WeakPolarHBondContact O-CA 3.36Å; I217-S220 WeakPolarHBondContact O-CB 3.45Å; I217-S220 PolarHBondContact O-N 3.47Å; I217-S220 PolarHBondContact O-OG 2.78Å; I217-I221 PolarHBondContact O-N 3.31Å; I217-I221 VanDerWaalsContact O-N 3.14Å
218	N	45.9	Very low	47.9	Very low	96 Å²	96	102.8 Å²	102.8	51%	0.513	53%	0.53	S	S	.	.	H	α-helix	trans	-59.2	-45.5	175.7	-70.7	-9.7	0	0	0	111.4	R214 E215 S220 I221	R214-N218 PolarHBondContact O-N 2.98Å; R214-N218 VanDerWaalsContact O-N 3.14Å; E215-N218 PolarHBondContact O-N 2.97Å; N218-S220 PolarHBondContact O-N 3.5Å; N218-I221 PolarHBondContact O-N 3.21Å; N218-I221 VanDerWaalsContact O-N 3.14Å
219	S	48.3	Very low	47.6	Very low	81 Å²	81	103.9 Å²	103.9	57%	0.566	54%	0.535	S	S	*	.	H	α-helix	trans	-58.5	-35.9	173.1	-56.1	0	0	0	0	112.3	E215 I217 I221 G222 A223	E215-S219 WeakPolarHBondContact O-CB 3.45Å; E215-S219 PolarHBondContact O-N 3.29Å; E215-S219 PolarHBondContact O-OG 2.86Å; I217-S219 VanDerWaalsContact C-N 3.33Å; I217-S219 PolarHBondContact O-N 3.14Å; S219-I221 PolarHBondContact O-N 3.06Å; S219-G222 PolarHBondContact O-N 3.49Å; S219-A223 WeakPolarHBondContact O-CB 3.45Å; S219-A223 PolarHBondContact O-N 2.85Å
220	S	49.6	Very low	47.5	Very low	52 Å²	52	106 Å²	106	36%	0.364	54%	0.537	S	S	.	.	H	α-helix	trans	-70.6	-25.4	178.1	83.2	0	0	0	0	113.7	S216 I217 N218 A223 T224	S216-S220 WeakPolarHBondContact O-CB 3.11Å; S216-S220 PolarHBondContact O-N 3.19Å; I217-S220 WeakPolarHBondContact O-CA 3.36Å; I217-S220 WeakPolarHBondContact O-CB 3.45Å; I217-S220 PolarHBondContact O-N 3.47Å; I217-S220 PolarHBondContact O-OG 2.78Å; N218-S220 PolarHBondContact O-N 3.5Å; S220-A223 PolarHBondContact O-N 3.46Å; S220-T224 VanDerWaalsContact O-CB 3.27Å; S220-T224 WeakPolarHBondContact O-CB 3.24Å; S220-T224 VanDerWaalsContact O-CG2 3.26Å; S220-T224 WeakPolarHBondContact O-CG2 3.48Å; S220-T224 PolarHBondContact O-N 3Å; S220-T224 PolarHBondContact O-OG1 3.34Å
221	I	48.2	Very low	47.5	Very low	108 Å²	108	106.6 Å²	106.6	55%	0.554	54%	0.535	S	S	*	.	H	α-helix	trans	-70.4	-43.4	175.9	-70.9	172	0	0	0	110.2	I217 N218 S219 T224 S225	I217-I221 PolarHBondContact O-N 3.31Å; I217-I221 VanDerWaalsContact O-N 3.14Å; N218-I221 PolarHBondContact O-N 3.21Å; N218-I221 VanDerWaalsContact O-N 3.14Å; S219-I221 PolarHBondContact O-N 3.06Å; I221-T224 PolarHBondContact O-N 2.95Å; I221-T224 PolarHBondContact O-OG1 3.16Å; I221-S225 WeakPolarHBondContact O-CB 3.14Å; I221-S225 PolarHBondContact O-N 3.44Å; I221-S225 PolarHBondContact O-OG 2.86Å
222	G	47.4	Very low	47.2	Very low	32 Å²	32	108.6 Å²	108.6	33%	0.33	54%	0.54	S	S	.	.	H	α-helix	trans	-62.6	-46.2	169.7	0	0	0	0	0	112.3	S219 T224 S225 I226	S219-G222 PolarHBondContact O-N 3.49Å; G222-T224 VanDerWaalsContact C-N 3.33Å; G222-T224 PolarHBondContact O-N 3Å; G222-S225 PolarHBondContact O-N 2.83Å; G222-S225 PolarHBondContact O-OG 3.37Å; G222-I226 WeakPolarHBondContact O-CB 3.29Å; G222-I226 VanDerWaalsContact O-CG1 3.3Å; G222-I226 WeakPolarHBondContact O-CG1 3.48Å; G222-I226 PolarHBondContact O-N 2.91Å
223	A	49.2	Very low	46.8	Very low	46 Å²	46	104.7 Å²	104.7	38%	0.38	53%	0.534	S	S	.	.	H	α-helix	trans	-67.3	-29.4	179.2	0	0	0	0	0	113.5	S219 S220 R227	S219-A223 WeakPolarHBondContact O-CB 3.45Å; S219-A223 PolarHBondContact O-N 2.85Å; S220-A223 PolarHBondContact O-N 3.46Å; A223-R227 VanDerWaalsContact O-CB 3.25Å; A223-R227 WeakPolarHBondContact O-CB 3.28Å; A223-R227 VanDerWaalsContact O-CG 3.22Å; A223-R227 WeakPolarHBondContact O-CG 3.32Å; A223-R227 PolarHBondContact O-N 3.38Å
224	T	50.2	Low	46.7	Very low	71 Å²	71	100.2 Å²	100.2	44%	0.436	53%	0.525	S	S	.	.	H	α-helix	trans	-83.7	-29.8	175.3	52.7	0	0	0	0	112.8	S220 I221 G222 R228	S220-T224 VanDerWaalsContact O-CB 3.27Å; S220-T224 WeakPolarHBondContact O-CB 3.24Å; S220-T224 VanDerWaalsContact O-CG2 3.26Å; S220-T224 WeakPolarHBondContact O-CG2 3.48Å; S220-T224 PolarHBondContact O-N 3Å; S220-T224 PolarHBondContact O-OG1 3.34Å; I221-T224 PolarHBondContact O-N 2.95Å; I221-T224 PolarHBondContact O-OG1 3.16Å; G222-T224 VanDerWaalsContact C-N 3.33Å; G222-T224 PolarHBondContact O-N 3Å; T224-R228 VanDerWaalsContact O-CB 3.28Å; T224-R228 WeakPolarHBondContact O-CB 3.25Å; T224-R228 VanDerWaalsContact O-CG 3.29Å; T224-R228 WeakPolarHBondContact O-CG 3.37Å; T224-R228 PolarHBondContact O-N 3.48Å
225	S	53.5	Low	46.5	Very low	62 Å²	62	99.2 Å²	99.2	43%	0.434	52%	0.521	S	S	.	.	H	α-helix	trans	-67	-44.2	168.1	76.4	0	0	0	0	110.5	I221 G222 R228 L229	I221-S225 WeakPolarHBondContact O-CB 3.14Å; I221-S225 PolarHBondContact O-N 3.44Å; I221-S225 PolarHBondContact O-OG 2.86Å; G222-S225 PolarHBondContact O-N 2.83Å; G222-S225 PolarHBondContact O-OG 3.37Å; S225-R228 CarbonylContact O-C 3.6Å; S225-R228 WeakPolarHBondContact O-CB 3.22Å; S225-R228 PolarHBondContact O-N 2.78Å; S225-R228 VanDerWaalsContact O-N 3.16Å; S225-L229 WeakPolarHBondContact O-CB 3.31Å; S225-L229 PolarHBondContact O-N 2.9Å
226	I	49	Very low	46.3	Very low	101 Å²	101	98.5 Å²	98.5	52%	0.518	52%	0.521	S	S	.	.	H	α-helix	trans	-66	-41.8	174.9	-68.1	168.4	0	0	0	111.2	G222 R228 L229 I230	G222-I226 WeakPolarHBondContact O-CB 3.29Å; G222-I226 VanDerWaalsContact O-CG1 3.3Å; G222-I226 WeakPolarHBondContact O-CG1 3.48Å; G222-I226 PolarHBondContact O-N 2.91Å; I226-R228 VanDerWaalsContact C-N 3.32Å; I226-R228 PolarHBondContact O-N 3.2Å; I226-L229 PolarHBondContact O-N 3.02Å; I226-I230 HydrophobicContact CG2-CD1 3.72Å; I226-I230 HydrophobicContact CG2-CG1 4.3Å; I226-I230 WeakPolarHBondContact O-CB 3.19Å; I226-I230 VanDerWaalsContact O-CG1 3.29Å; I226-I230 WeakPolarHBondContact O-CG1 3.28Å; I226-I230 PolarHBondContact O-N 2.94Å
227	R	52.1	Low	45.9	Very low	183 Å²	183	100 Å²	100	69%	0.691	53%	0.531	S	S	*	.	H	α-helix	trans	-65.6	-31	171.2	-77.6	178.7	-173	-175.1	3.9	112.9	A223 T231	A223-R227 VanDerWaalsContact O-CB 3.25Å; A223-R227 WeakPolarHBondContact O-CB 3.28Å; A223-R227 VanDerWaalsContact O-CG 3.22Å; A223-R227 WeakPolarHBondContact O-CG 3.32Å; A223-R227 PolarHBondContact O-N 3.38Å; R227-T231 VanDerWaalsContact O-CB 3.31Å; R227-T231 WeakPolarHBondContact O-CB 3.31Å; R227-T231 VanDerWaalsContact O-CG2 3.28Å; R227-T231 WeakPolarHBondContact O-CG2 3.21Å; R227-T231 PolarHBondContact O-N 2.77Å; R227-T231 PolarHBondContact O-OG1 2.69Å
228	R	50.5	Low	45.8	Very low	184 Å²	184	104.5 Å²	104.5	69%	0.694	54%	0.542	S	S	*	.	H	α-helix	trans	-70.4	-37	170.2	-80.9	177.7	174.3	-177.4	-0.8	111.8	T224 S225 I226 T231 L232	T224-R228 VanDerWaalsContact O-CB 3.28Å; T224-R228 WeakPolarHBondContact O-CB 3.25Å; T224-R228 VanDerWaalsContact O-CG 3.29Å; T224-R228 WeakPolarHBondContact O-CG 3.37Å; T224-R228 PolarHBondContact O-N 3.48Å; S225-R228 CarbonylContact O-C 3.6Å; S225-R228 WeakPolarHBondContact O-CB 3.22Å; S225-R228 PolarHBondContact O-N 2.78Å; S225-R228 VanDerWaalsContact O-N 3.16Å; I226-R228 VanDerWaalsContact C-N 3.32Å; I226-R228 PolarHBondContact O-N 3.2Å; R228-T231 WeakPolarHBondContact CA-OG1 3.43Å; R228-T231 PolarHBondContact O-N 3.43Å; R228-T231 PolarHBondContact O-OG1 3.5Å; R228-L232 WeakPolarHBondContact O-CB 3.46Å; R228-L232 WeakPolarHBondContact O-CD1 3.3Å; R228-L232 WeakPolarHBondContact O-CG 3.42Å; R228-L232 PolarHBondContact O-N 2.85Å
229	L	44.3	Very low	45.9	Very low	125 Å²	125	107.7 Å²	107.7	65%	0.654	55%	0.553	S	S	*	*	H	α-helix	trans	-71.5	-40.5	176.9	-124.2	148.8	0	0	0	111.5	S225 I226 L232 N233	S225-L229 WeakPolarHBondContact O-CB 3.31Å; S225-L229 PolarHBondContact O-N 2.9Å; I226-L229 PolarHBondContact O-N 3.02Å; L229-L232 PolarHBondContact O-N 3.31Å; L229-N233 VanDerWaalsContact O-CB 3.23Å; L229-N233 WeakPolarHBondContact O-CB 3.16Å; L229-N233 PolarHBondContact O-N 3.48Å
230	I	50.6	Low	46.3	Very low	104 Å²	104	110.8 Å²	110.8	53%	0.533	56%	0.556	S	S	.	*	H	α-helix	trans	-65.8	-44.1	171.5	-67.9	169.8	0	0	0	110.4	I226 N233 N234	I226-I230 HydrophobicContact CG2-CD1 3.72Å; I226-I230 HydrophobicContact CG2-CG1 4.3Å; I226-I230 WeakPolarHBondContact O-CB 3.19Å; I226-I230 VanDerWaalsContact O-CG1 3.29Å; I226-I230 WeakPolarHBondContact O-CG1 3.28Å; I226-I230 PolarHBondContact O-N 2.94Å; I230-N233 CarbonylContact O-C 3.53Å; I230-N233 PolarHBondContact O-N 2.75Å; I230-N234 VanDerWaalsContact O-CB 3.23Å; I230-N234 WeakPolarHBondContact O-CB 3.23Å; I230-N234 PolarHBondContact O-N 2.77Å
231	T	47.3	Very low	47	Very low	72 Å²	72	109.2 Å²	109.2	44%	0.442	54%	0.544	S	S	.	.	H	α-helix	trans	-74	-22.5	176.3	53.9	0	0	0	0	113.6	R227 R228 R235	R227-T231 VanDerWaalsContact O-CB 3.31Å; R227-T231 WeakPolarHBondContact O-CB 3.31Å; R227-T231 VanDerWaalsContact O-CG2 3.28Å; R227-T231 WeakPolarHBondContact O-CG2 3.21Å; R227-T231 PolarHBondContact O-N 2.77Å; R227-T231 PolarHBondContact O-OG1 2.69Å; R228-T231 WeakPolarHBondContact CA-OG1 3.43Å; R228-T231 PolarHBondContact O-N 3.43Å; R228-T231 PolarHBondContact O-OG1 3.5Å; T231-R235 WeakPolarHBondContact O-CB 3.29Å; T231-R235 WeakPolarHBondContact O-CG 3.38Å; T231-R235 PolarHBondContact O-N 3.38Å
232	L	42	Very low	48.4	Very low	105 Å²	105	106.9 Å²	106.9	55%	0.55	54%	0.536	S	S	.	.	H	α-helix	trans	-73.8	-39.9	167.1	-76.7	165.4	0	0	0	111.3	R228 L229 N234 R235 N236	R228-L232 WeakPolarHBondContact O-CB 3.46Å; R228-L232 WeakPolarHBondContact O-CD1 3.3Å; R228-L232 WeakPolarHBondContact O-CG 3.42Å; R228-L232 PolarHBondContact O-N 2.85Å; L229-L232 PolarHBondContact O-N 3.31Å; L232-N234 VanDerWaalsContact C-N 3.29Å; L232-N234 PolarHBondContact O-N 2.83Å; L232-R235 PolarHBondContact O-N 3.49Å; L232-N236 PolarHBondContact O-N 3.01Å
233	N	38.7	Very low	49.9	Very low	115 Å²	115	108.1 Å²	108.1	62%	0.615	54%	0.544	S	S	*	.	H	α-helix	trans	-70	-25	172.9	-163.4	47.5	0	0	0	112.8	L229 I230 N236	L229-N233 VanDerWaalsContact O-CB 3.23Å; L229-N233 WeakPolarHBondContact O-CB 3.16Å; L229-N233 PolarHBondContact O-N 3.48Å; I230-N233 CarbonylContact O-C 3.53Å; I230-N233 PolarHBondContact O-N 2.75Å; N233-N236 VanDerWaalsContact O-CB 3.28Å; N233-N236 WeakPolarHBondContact O-CB 3.46Å
234	N	37.9	Very low	51.5	Low	98 Å²	98	112.6 Å²	112.6	52%	0.524	56%	0.556	S	S	.	*	H	α-helix	trans	-88.7	-27.4	173.1	-152.7	23.5	0	0	0	112	I230 L232 N236 C237	I230-N234 VanDerWaalsContact O-CB 3.23Å; I230-N234 WeakPolarHBondContact O-CB 3.23Å; I230-N234 PolarHBondContact O-N 2.77Å; L232-N234 VanDerWaalsContact C-N 3.29Å; L232-N234 PolarHBondContact O-N 2.83Å; N234-N236 CarbonylContact O-C 3.52Å; N234-N236 PolarHBondContact O-N 2.77Å; N234-C237 PolarHBondContact O-N 3.18Å; N234-C237 PolarHBondContact O-SG 3.15Å
235	R	40.3	Very low	53	Low	169 Å²	169	111.4 Å²	111.4	64%	0.638	55%	0.549	S	S	*	.	H	α-helix	trans	-64.6	-23.8	163.6	-83	170.5	168.6	-169.1	-7.5	111.8	T231 L232 C237 D390	T231-R235 WeakPolarHBondContact O-CB 3.29Å; T231-R235 WeakPolarHBondContact O-CG 3.38Å; T231-R235 PolarHBondContact O-N 3.38Å; L232-R235 PolarHBondContact O-N 3.49Å; R235-C237 PolarHBondContact O-N 3.16Å; R235-D390 IonicContact CZ-OD2 2.62Å; R235-D390 IonicContact NH2-OD2 2.75Å; R235-D390 PolarHBondContact NH2-OD2 3.15Å
236	N	34.5	Very low	54.5	Low	105 Å²	105	113.9 Å²	113.9	56%	0.561	55%	0.549	S	S	*	.			trans	-69	61	150.2	-81	-36.5	0	0	0	111.1	L232 N233 N234 R238	L232-N236 PolarHBondContact O-N 3.01Å; N233-N236 VanDerWaalsContact O-CB 3.28Å; N233-N236 WeakPolarHBondContact O-CB 3.46Å; N234-N236 CarbonylContact O-C 3.52Å; N234-N236 PolarHBondContact O-N 2.77Å; N236-R238 PolarHBondContact O-N 3.49Å
237	C	40.5	Very low	56.3	Low	100 Å²	100	116 Å²	116	68%	0.676	56%	0.556	S	S	*	*			trans	-67.1	45.6	156.4	-83	0	0	0	0	110.3	N234 R235 H239	N234-C237 PolarHBondContact O-N 3.18Å; N234-C237 PolarHBondContact O-SG 3.15Å; R235-C237 PolarHBondContact O-N 3.16Å; C237-H239 PolarHBondContact O-N 2.98Å
238	R	42.1	Very low	58	Low	186 Å²	186	111.4 Å²	111.4	70%	0.702	54%	0.541	S	S	*	.			trans	-83.8	44	-179.2	-156.5	-173.6	-166.6	-170	7.8	109.9	N236 K240	N236-R238 PolarHBondContact O-N 3.49Å; R238-K240 PolarHBondContact O-N 3.19Å
239	H	47.5	Very low	59.7	Low	162 Å²	162	103 Å²	103	75%	0.75	51%	0.511	S	S	*	.			trans	-67.6	72.6	164.5	-115.8	101.5	0	0	0	108.2	C237 V241 C378	C237-H239 PolarHBondContact O-N 2.98Å; H239-V241 PolarHBondContact O-N 3.2Å; H239-V241 VanDerWaalsContact O-N 3.17Å; H239-C378 PolarHBondContact O-SG 3.02Å
240	K	56.8	Low	61.8	Low	146 Å²	146	101.9 Å²	101.9	64%	0.635	50%	0.498	S	S	*	.			trans	-52.7	120.8	166.4	-89	-179.6	171.2	179.1	0	106.3	R238	R238-K240 PolarHBondContact O-N 3.19Å
241	V	65.3	Low	63.7	Low	19 Å²	19	103.7 Å²	103.7	12%	0.115	50%	0.498	C	S	.	.			trans	-39.9	119	171.6	179.4	0	0	0	0	108.9	H239 V245 R246 C378	H239-V241 PolarHBondContact O-N 3.2Å; H239-V241 VanDerWaalsContact O-N 3.17Å; V241-V245 HydrophobicContact CG1-CB 3.96Å; V241-V245 HydrophobicContact CG1-CG1 3.87Å; V241-R246 HydrophobicContact CG1-CB 4.29Å; V241-R246 PolarHBondContact O-NH1 3.11Å; V241-C378 VanDerWaalsContact CG2-SG 3.56Å
242	P	77.6	Confident	65.7	Low	59 Å²	59	100.7 Å²	100.7	38%	0.383	48%	0.479	S	S	.	.			trans	-51.5	143.2	-170.3	-30	34.5	0	0	0	111.6	H244 V245 R246	P242-H244 PolarHBondContact O-N 2.78Å; P242-H244 VanDerWaalsContact O-N 3.16Å; P242-V245 HydrophobicContact CB-CG2 4.13Å; P242-V245 HydrophobicContact CG-CG2 4.31Å; P242-V245 PolarHBondContact O-N 2.89Å; P242-R246 PolarHBondContact O-N 3.06Å
243	A	79.1	Confident	68.1	Low	59 Å²	59	95.9 Å²	95.9	49%	0.488	45%	0.454	S	S	.	.	H	α-helix	trans	-54.2	-41.9	-172	0	0	0	0	0	112	R246 Q247	A243-R246 PolarHBondContact O-N 3.44Å; A243-Q247 VanDerWaalsContact O-CB 3.27Å; A243-Q247 WeakPolarHBondContact O-CB 3.2Å; A243-Q247 PolarHBondContact O-N 3.1Å
244	H	82	Confident	70.7	Confident	140 Å²	140	93.4 Å²	93.4	65%	0.648	45%	0.445	S	S	*	.	H	α-helix	trans	-62.6	-43.2	176.1	71.9	-101.2	0	0	0	113.2	P242 Q247 K248	P242-H244 PolarHBondContact O-N 2.78Å; P242-H244 VanDerWaalsContact O-N 3.16Å; H244-Q247 PolarHBondContact O-N 3.22Å; H244-K248 WeakPolarHBondContact O-CB 3.24Å; H244-K248 PolarHBondContact O-N 3.29Å
245	V	81.9	Confident	73.3	Confident	46 Å²	46	90.1 Å²	90.1	28%	0.279	43%	0.43	S	S	.	.	H	α-helix	trans	-63.5	-46.9	176.8	-179.8	0	0	0	0	110	V241 P242 Q247 K248 V249	V241-V245 HydrophobicContact CG1-CB 3.96Å; V241-V245 HydrophobicContact CG1-CG1 3.87Å; P242-V245 HydrophobicContact CB-CG2 4.13Å; P242-V245 HydrophobicContact CG-CG2 4.31Å; P242-V245 PolarHBondContact O-N 2.89Å; V245-Q247 VanDerWaalsContact C-N 3.34Å; V245-Q247 PolarHBondContact O-N 3.01Å; V245-K248 PolarHBondContact O-N 3.45Å; V245-V249 HydrophobicContact CG1-CG2 4.36Å; V245-V249 WeakPolarHBondContact O-CB 3.47Å; V245-V249 WeakPolarHBondContact O-CG2 3.23Å; V245-V249 PolarHBondContact O-N 3.13Å
246	R	84.6	Confident	75.8	Confident	113 Å²	113	82.1 Å²	82.1	43%	0.426	40%	0.399	S	S	.	.	H	α-helix	trans	-60.5	-44.1	178.5	-175	172.9	68.8	-103	0.6	111.1	V241 P242 A243 W250 L376	V241-R246 HydrophobicContact CG1-CB 4.29Å; V241-R246 PolarHBondContact O-NH1 3.11Å; P242-R246 PolarHBondContact O-N 3.06Å; A243-R246 PolarHBondContact O-N 3.44Å; R246-W250 WeakPolarHBondContact O-CB 3.28Å; R246-W250 VanDerWaalsContact O-CD1 3.29Å; R246-W250 PolarHBondContact O-N 2.69Å; R246-L376 HydrophobicContact CG-CD2 4.03Å
247	Q	87.4	Confident	78.6	Confident	145 Å²	145	77.7 Å²	77.7	68%	0.678	38%	0.377	S	S	*	.	H	α-helix	trans	-66.7	-44.4	178.9	-172	174.1	-0.1	0	0	112.2	A243 H244 V245 W250 R251	A243-Q247 VanDerWaalsContact O-CB 3.27Å; A243-Q247 WeakPolarHBondContact O-CB 3.2Å; A243-Q247 PolarHBondContact O-N 3.1Å; H244-Q247 PolarHBondContact O-N 3.22Å; V245-Q247 VanDerWaalsContact C-N 3.34Å; V245-Q247 PolarHBondContact O-N 3.01Å; Q247-W250 PolarHBondContact O-N 2.61Å; Q247-R251 WeakPolarHBondContact O-CB 3.29Å; Q247-R251 PolarHBondContact O-N 3.44Å
248	K	86.4	Confident	81.2	Confident	87 Å²	87	77.4 Å²	77.4	38%	0.378	37%	0.368	S	S	.	.	H	α-helix	trans	-64.3	-41.3	175.9	-179.5	159.5	172.7	157.4	0	112	H244 V245 R251 Q252 D536	H244-K248 WeakPolarHBondContact O-CB 3.24Å; H244-K248 PolarHBondContact O-N 3.29Å; V245-K248 PolarHBondContact O-N 3.45Å; K248-R251 PolarHBondContact O-N 3.18Å; K248-Q252 WeakPolarHBondContact O-CG 3.38Å; K248-Q252 PolarHBondContact O-N 3.39Å; K248-D536 VanDerWaalsContact CE-CG 3.47Å; K248-D536 WeakPolarHBondContact CE-O 3.39Å; K248-D536 VanDerWaalsContact CE-OD1 3.28Å; K248-D536 WeakPolarHBondContact CE-OD1 3.45Å; K248-D536 WeakPolarHBondContact CE-OD2 3.24Å; K248-D536 VanDerWaalsContact NZ-CG 3.26Å; K248-D536 PolarHBondContact NZ-O 2.99Å; K248-D536 IonicContact NZ-OD1 3.69Å; K248-D536 PolarHBondContact NZ-OD1 3.31Å; K248-D536 IonicContact NZ-OD2 2.71Å
249	V	86.9	Confident	83.8	Confident	9 Å²	9	68.6 Å²	68.6	6%	0.055	34%	0.335	C	S	.	.	H	α-helix	trans	-64.5	-44.6	175.8	170.5	0	0	0	0	111.7	V245 Q252 F253 F372 K375 L376	V245-V249 HydrophobicContact CG1-CG2 4.36Å; V245-V249 WeakPolarHBondContact O-CB 3.47Å; V245-V249 WeakPolarHBondContact O-CG2 3.23Å; V245-V249 PolarHBondContact O-N 3.13Å; V249-Q252 PolarHBondContact O-N 3.07Å; V249-F253 WeakPolarHBondContact O-CB 3.49Å; V249-F253 PolarHBondContact O-N 2.87Å; V249-F372 HydrophobicContact CG1-CB 4.01Å; V249-F372 HydrophobicContact CG1-CD1 3.76Å; V249-F372 HydrophobicContact CG1-CG 4.18Å; V249-K375 HydrophobicContact CG2-CB 4.25Å; V249-L376 HydrophobicContact CB-CD2 4.2Å; V249-L376 HydrophobicContact CG1-CD1 4.1Å; V249-L376 HydrophobicContact CG1-CD2 3.9Å; V249-L376 HydrophobicContact CG1-CG 3.78Å
250	W	88.9	Confident	86	Confident	101 Å²	101	61.7 Å²	61.7	38%	0.383	30%	0.303	S	S	.	.	H	α-helix	trans	-64.7	-41.5	175.6	-87.5	100.2	0	0	0	112.5	R246 Q247 Q252 F253 S254 L409	R246-W250 WeakPolarHBondContact O-CB 3.28Å; R246-W250 VanDerWaalsContact O-CD1 3.29Å; R246-W250 PolarHBondContact O-N 2.69Å; Q247-W250 PolarHBondContact O-N 2.61Å; W250-Q252 PolarHBondContact O-N 3.38Å; W250-F253 HydrophobicContact CE3-CD1 4.23Å; W250-F253 HydrophobicContact CZ3-CD1 4.12Å; W250-F253 HydrophobicContact CZ3-CE1 4.42Å; W250-F253 PolarHBondContact O-N 3.19Å; W250-S254 WeakPolarHBondContact O-CB 3.42Å; W250-S254 PolarHBondContact O-N 3.23Å; W250-S254 PolarHBondContact O-OG 3.16Å; W250-L409 HydrophobicContact CH2-CD2 4.18Å; W250-L409 HydrophobicContact CZ2-CD2 4.43Å; W250-L409 HydrophobicContact CZ3-CD2 4.49Å
251	R	90.7	Very high	87.9	Confident	141 Å²	141	55.1 Å²	55.1	53%	0.532	28%	0.277	S	S	.	.	H	α-helix	trans	-56.4	-51.4	174	-172.8	178.7	74.2	-179.2	4.2	111.4	Q247 K248 F253 S254 C255 D536	Q247-R251 WeakPolarHBondContact O-CB 3.29Å; Q247-R251 PolarHBondContact O-N 3.44Å; K248-R251 PolarHBondContact O-N 3.18Å; R251-F253 PolarHBondContact O-N 3.49Å; R251-S254 PolarHBondContact O-N 2.68Å; R251-C255 PolarHBondContact O-N 3.32Å; R251-C255 PolarHBondContact O-SG 2.9Å; R251-C255 VanDerWaalsContact O-SG 3.32Å; R251-D536 IonicContact CZ-OD2 3.62Å; R251-D536 IonicContact NE-OD2 3.58Å; R251-D536 IonicContact NH2-OD1 3.47Å; R251-D536 PolarHBondContact NH2-OD1 2.99Å; R251-D536 VanDerWaalsContact NH2-OD1 3.1Å; R251-D536 IonicContact NH2-OD2 3.27Å; R251-D536 PolarHBondContact NH2-OD2 2.62Å
252	Q	89.5	Confident	89.3	Confident	9 Å²	9	55.9 Å²	55.9	4%	0.042	28%	0.28	C	S	.	.	H	α-helix	trans	-64.2	-37.9	179.8	-70.7	-174.3	-8.1	0	0	112.7	K248 V249 W250 L256 F372 D536	K248-Q252 WeakPolarHBondContact O-CG 3.38Å; K248-Q252 PolarHBondContact O-N 3.39Å; V249-Q252 PolarHBondContact O-N 3.07Å; W250-Q252 PolarHBondContact O-N 3.38Å; Q252-L256 WeakPolarHBondContact O-CB 3.42Å; Q252-L256 PolarHBondContact O-N 3.44Å; Q252-F372 HydrophobicContact CB-CE1 4.12Å; Q252-F372 HydrophobicContact CB-CZ 3.9Å; Q252-D536 VanDerWaalsContact NE2-CG 3.3Å; Q252-D536 PolarHBondContact NE2-O 2.91Å; Q252-D536 PolarHBondContact NE2-OD2 3.45Å
253	F	91.4	Very high	90.1	Very high	4 Å²	4	53.2 Å²	53.2	2%	0.018	26%	0.263	C	S	.	.	H	α-helix	trans	-68.9	-39.5	176.3	177.9	-98.3	0	0	0	112.7	V249 W250 R251 L256 S257 I369 F372 L409 W412 F413	V249-F253 WeakPolarHBondContact O-CB 3.49Å; V249-F253 PolarHBondContact O-N 2.87Å; W250-F253 HydrophobicContact CE3-CD1 4.23Å; W250-F253 HydrophobicContact CZ3-CD1 4.12Å; W250-F253 HydrophobicContact CZ3-CE1 4.42Å; W250-F253 PolarHBondContact O-N 3.19Å; R251-F253 PolarHBondContact O-N 3.49Å; F253-L256 PolarHBondContact O-N 2.87Å; F253-S257 WeakPolarHBondContact CE1-OG 3.32Å; F253-S257 WeakPolarHBondContact CZ-OG 3.48Å; F253-S257 WeakPolarHBondContact O-CB 3.07Å; F253-S257 PolarHBondContact O-N 2.91Å; F253-S257 PolarHBondContact O-OG 3.28Å; F253-I369 HydrophobicContact CE2-CG1 4.49Å; F253-F372 HydrophobicContact CB-CD2 4.37Å; F253-F372 HydrophobicContact CD2-CD2 4.14Å; F253-L409 HydrophobicContact CD1-CD2 3.78Å; F253-L409 HydrophobicContact CD2-CB 4.49Å; F253-L409 HydrophobicContact CD2-CD2 4.08Å; F253-L409 HydrophobicContact CE1-CD2 3.77Å; F253-L409 HydrophobicContact CE2-CB 3.87Å; F253-L409 HydrophobicContact CE2-CD2 4.07Å; F253-L409 HydrophobicContact CE2-CG 4.42Å; F253-L409 HydrophobicContact CG-CD2 3.95Å; F253-L409 HydrophobicContact CZ-CB 3.98Å; F253-L409 HydrophobicContact CZ-CD2 3.93Å; F253-L409 VanDerWaalsContact CZ-O 3.31Å; F253-L409 WeakPolarHBondContact CZ-O 3.29Å; F253-W412 HydrophobicContact CE1-CB 3.84Å; F253-W412 HydrophobicContact CZ-CB 3.96Å; F253-F413 HydrophobicContact CE2-CB 4.49Å; F253-F413 HydrophobicContact CZ-CB 4.35Å
254	S	92.4	Very high	90.9	Very high	63 Å²	63	51 Å²	51	44%	0.441	24%	0.242	S	C	.	.	H	α-helix	trans	-65	-44.4	175.2	-66	0	0	0	0	111.7	W250 R251 L256 S257 L258	W250-S254 WeakPolarHBondContact O-CB 3.42Å; W250-S254 PolarHBondContact O-N 3.23Å; W250-S254 PolarHBondContact O-OG 3.16Å; R251-S254 PolarHBondContact O-N 2.68Å; S254-L256 PolarHBondContact O-N 3.12Å; S254-S257 PolarHBondContact O-N 3.02Å; S254-L258 WeakPolarHBondContact O-CB 3.26Å; S254-L258 PolarHBondContact O-N 3.37Å
255	C	92.9	Very high	91.5	Very high	29 Å²	29	44.8 Å²	44.8	20%	0.196	21%	0.214	C	C	.	.	H	α-helix	trans	-60.6	-43.7	173.8	-63.9	0	0	0	0	111.8	R251 S257 A259 I533	R251-C255 PolarHBondContact O-N 3.32Å; R251-C255 PolarHBondContact O-SG 2.9Å; R251-C255 VanDerWaalsContact O-SG 3.32Å; C255-S257 VanDerWaalsContact C-N 3.33Å; C255-S257 PolarHBondContact O-N 2.93Å; C255-A259 VanDerWaalsContact O-CB 3.22Å; C255-A259 WeakPolarHBondContact O-CB 3.31Å; C255-A259 PolarHBondContact O-N 3.47Å; C255-I533 HydrophobicContact CB-CD1 3.91Å; C255-I533 HydrophobicContact CB-CG1 3.86Å
256	L	92.9	Very high	92	Very high	1 Å²	1	42.6 Å²	42.6	1%	0.005	20%	0.201	C	C	.	.	H	α-helix	trans	-61.7	-41.9	178.1	179.5	60.9	0	0	0	111.9	Q252 F253 S254 H260 I325 L368 F372 F413 I533	Q252-L256 WeakPolarHBondContact O-CB 3.42Å; Q252-L256 PolarHBondContact O-N 3.44Å; F253-L256 PolarHBondContact O-N 2.87Å; S254-L256 PolarHBondContact O-N 3.12Å; L256-H260 WeakPolarHBondContact O-CB 3.35Å; L256-H260 PolarHBondContact O-N 3.41Å; L256-I325 HydrophobicContact CD1-CD1 4.12Å; L256-L368 HydrophobicContact CD2-CB 4.08Å; L256-L368 HydrophobicContact CD2-CD1 4.04Å; L256-F372 HydrophobicContact CD2-CE2 4.01Å; L256-F413 HydrophobicContact CG-CE2 4.27Å; L256-I533 HydrophobicContact CB-CD1 3.89Å; L256-I533 HydrophobicContact CD1-CD1 4.4Å
257	S	94.2	Very high	92.4	Very high	12 Å²	12	38.1 Å²	38.1	8%	0.084	19%	0.186	C	C	.	.	H	α-helix	trans	-68.7	-53.1	180	-55.3	0	0	0	0	110.5	F253 S254 C255 A259 H260 G261 S416	F253-S257 WeakPolarHBondContact CE1-OG 3.32Å; F253-S257 WeakPolarHBondContact CZ-OG 3.48Å; F253-S257 WeakPolarHBondContact O-CB 3.07Å; F253-S257 PolarHBondContact O-N 2.91Å; F253-S257 PolarHBondContact O-OG 3.28Å; S254-S257 PolarHBondContact O-N 3.02Å; C255-S257 VanDerWaalsContact C-N 3.33Å; C255-S257 PolarHBondContact O-N 2.93Å; S257-A259 VanDerWaalsContact C-N 3.35Å; S257-A259 PolarHBondContact O-N 2.89Å; S257-H260 CarbonylContact O-C 3.25Å; S257-H260 WeakPolarHBondContact O-CA 3.4Å; S257-H260 WeakPolarHBondContact O-CB 3.4Å; S257-H260 PolarHBondContact O-N 3.5Å; S257-G261 PolarHBondContact O-N 2.85Å; S257-S416 PolarHBondContact O-OG 2.9Å
258	L	95.4	Very high	92.7	Very high	95 Å²	95	33.1 Å²	33.1	50%	0.497	16%	0.163	S	C	.	.	H	α-helix	trans	-57	-46	179.2	-179.9	61.4	0	0	0	112	S254 H260 G261 L262 L529	S254-L258 WeakPolarHBondContact O-CB 3.26Å; S254-L258 PolarHBondContact O-N 3.37Å; L258-H260 VanDerWaalsContact C-N 3.32Å; L258-H260 PolarHBondContact O-N 3Å; L258-G261 PolarHBondContact O-N 3.05Å; L258-L262 HydrophobicContact CD1-CD1 4.47Å; L258-L262 HydrophobicContact CD1-CG 4.47Å; L258-L262 HydrophobicContact CG-CD1 4.31Å; L258-L262 WeakPolarHBondContact O-CG 3.5Å; L258-L262 PolarHBondContact O-N 2.73Å; L258-L529 HydrophobicContact CB-CD1 4.38Å; L258-L529 HydrophobicContact CD2-CD1 3.79Å; L258-L529 HydrophobicContact CG-CD1 3.84Å
259	A	95.2	Very high	92.9	Very high	0 Å²	0	29 Å²	29	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-62.4	-38.7	175.6	0	0	0	0	0	112	C255 S257 M263 Y329 S526 L529	C255-A259 VanDerWaalsContact O-CB 3.22Å; C255-A259 WeakPolarHBondContact O-CB 3.31Å; C255-A259 PolarHBondContact O-N 3.47Å; S257-A259 VanDerWaalsContact C-N 3.35Å; S257-A259 PolarHBondContact O-N 2.89Å; A259-M263 VanDerWaalsContact O-CB 3.28Å; A259-M263 WeakPolarHBondContact O-CB 3.46Å; A259-M263 PolarHBondContact O-N 3.43Å; A259-Y329 HydrophobicContact CB-CE2 3.99Å; A259-S526 PolarHBondContact O-OG 3.43Å; A259-L529 HydrophobicContact CB-CB 3.88Å; A259-L529 HydrophobicContact CB-CD1 4.28Å
260	H	95.3	Very high	93	Very high	17 Å²	17	28.6 Å²	28.6	8%	0.079	14%	0.143	C	C	.	.	H	α-helix	trans	-67.2	-38.9	173.9	-170.8	39.4	0	0	0	112.7	L256 S257 L258 M263 N264 Y329 F413	L256-H260 WeakPolarHBondContact O-CB 3.35Å; L256-H260 PolarHBondContact O-N 3.41Å; S257-H260 CarbonylContact O-C 3.25Å; S257-H260 WeakPolarHBondContact O-CA 3.4Å; S257-H260 WeakPolarHBondContact O-CB 3.4Å; S257-H260 PolarHBondContact O-N 3.5Å; L258-H260 VanDerWaalsContact C-N 3.32Å; L258-H260 PolarHBondContact O-N 3Å; H260-M263 PolarHBondContact O-N 3.27Å; H260-N264 PolarHBondContact CD2-ND2 3.48Å; H260-N264 PolarHBondContact CE1-ND2 3.03Å; H260-N264 PolarHBondContact ND1-ND2 2.93Å; H260-N264 PolarHBondContact NE2-ND2 2.91Å; H260-N264 VanDerWaalsContact NE2-ND2 3.12Å; H260-N264 PolarHBondContact O-N 3.46Å; H260-N264 PolarHBondContact O-ND2 3.05Å; H260-Y329 WeakPolarHBondContact CA-OH 3.48Å; H260-F413 HydrophobicContact CB-CE2 3.95Å; H260-F413 HydrophobicContact CB-CZ 4.16Å; H260-F413 AromaticContact CD2-CE1 3.35Å; H260-F413 WeakPolarHBondContact CD2-CE1 3.46Å; H260-F413 AromaticContact CD2-CE2 3.56Å; H260-F413 AromaticContact CD2-CZ 3.03Å; H260-F413 WeakPolarHBondContact CD2-CZ 3.49Å; H260-F413 AromaticContact CG-CE2 3.94Å; H260-F413 AromaticContact CG-CZ 3.64Å; H260-F413 AromaticContact NE2-CE1 3.58Å; H260-F413 AromaticContact NE2-CZ 3.58Å
261	G	95.9	Very high	93.1	Very high	8 Å²	8	24.1 Å²	24.1	8%	0.082	13%	0.127	C	C	.	.	H	α-helix	trans	-62.8	-48.9	175.5	0	0	0	0	0	112.8	S257 L258 M263 N264 C265 S416 G420	S257-G261 PolarHBondContact O-N 2.85Å; L258-G261 PolarHBondContact O-N 3.05Å; G261-M263 PolarHBondContact O-N 3.01Å; G261-N264 PolarHBondContact O-N 2.98Å; G261-C265 VanDerWaalsContact O-CB 3.31Å; G261-C265 WeakPolarHBondContact O-CB 3.27Å; G261-C265 PolarHBondContact O-N 2.73Å; G261-S416 WeakPolarHBondContact CA-O 3.48Å; G261-G420 WeakPolarHBondContact O-CA 3.44Å
262	L	95.5	Very high	93	Very high	35 Å²	35	17.4 Å²	17.4	18%	0.183	10%	0.101	C	C	.	.	H	α-helix	trans	-58	-37.9	172.5	-69.4	171.5	0	0	0	112	L258 C265 V266 F522 V525 L529	L258-L262 HydrophobicContact CD1-CD1 4.47Å; L258-L262 HydrophobicContact CD1-CG 4.47Å; L258-L262 HydrophobicContact CG-CD1 4.31Å; L258-L262 WeakPolarHBondContact O-CG 3.5Å; L258-L262 PolarHBondContact O-N 2.73Å; L262-C265 WeakPolarHBondContact O-CB 3.34Å; L262-C265 PolarHBondContact O-N 3.1Å; L262-V266 PolarHBondContact O-N 2.99Å; L262-F522 HydrophobicContact CD2-CD2 4.44Å; L262-F522 HydrophobicContact CD2-CG 4.4Å; L262-V525 HydrophobicContact CD1-CB 4.16Å; L262-V525 HydrophobicContact CD1-CG1 3.62Å; L262-L529 HydrophobicContact CD1-CD1 4.01Å
263	M	94	Very high	92.7	Very high	4 Å²	4	17.5 Å²	17.5	2%	0.02	10%	0.102	C	C	.	.	H	α-helix	trans	-69.2	-37.9	177.4	-169.8	54.3	65.1	0	0	112.8	A259 H260 G261 V266 L267 Y329 V332	A259-M263 VanDerWaalsContact O-CB 3.28Å; A259-M263 WeakPolarHBondContact O-CB 3.46Å; A259-M263 PolarHBondContact O-N 3.43Å; H260-M263 PolarHBondContact O-N 3.27Å; G261-M263 PolarHBondContact O-N 3.01Å; M263-V266 PolarHBondContact O-N 3.37Å; M263-L267 WeakPolarHBondContact O-CB 3.13Å; M263-L267 PolarHBondContact O-N 2.85Å; M263-Y329 HydrophobicContact CB-CE1 4.15Å; M263-Y329 HydrophobicContact CE-CD1 3.64Å; M263-Y329 HydrophobicContact CE-CD2 4.17Å; M263-Y329 HydrophobicContact CE-CE1 4.18Å; M263-Y329 HydrophobicContact CE-CG 3.65Å; M263-Y329 HydrophobicContact CG-CD1 4.06Å; M263-Y329 HydrophobicContact CG-CE1 3.69Å; M263-Y329 HydrophobicContact SD-CD1 4.37Å; M263-V332 HydrophobicContact CE-CB 4.07Å; M263-V332 HydrophobicContact CE-CG1 4.23Å; M263-V332 HydrophobicContact SD-CB 3.63Å; M263-V332 HydrophobicContact SD-CG1 3.39Å; M263-V332 WeakPolarHBondContact SD-CG1 3.48Å; M263-V332 HydrophobicContact SD-CG2 3.81Å
264	N	94.9	Very high	92.4	Very high	11 Å²	11	17.4 Å²	17.4	6%	0.059	10%	0.102	C	C	.	.	H	α-helix	trans	-72.8	-33	174.7	-69.9	-55.4	0	0	0	112.5	H260 G261 V266 L267 L268 Q417	H260-N264 PolarHBondContact CD2-ND2 3.48Å; H260-N264 PolarHBondContact CE1-ND2 3.03Å; H260-N264 PolarHBondContact ND1-ND2 2.93Å; H260-N264 PolarHBondContact NE2-ND2 2.91Å; H260-N264 VanDerWaalsContact NE2-ND2 3.12Å; H260-N264 PolarHBondContact O-N 3.46Å; H260-N264 PolarHBondContact O-ND2 3.05Å; G261-N264 PolarHBondContact O-N 2.98Å; N264-V266 PolarHBondContact O-N 3.46Å; N264-L267 PolarHBondContact O-N 3.06Å; N264-L268 HydrophobicContact CB-CD1 3.89Å; N264-L268 HydrophobicContact CB-CG 4.23Å; N264-L268 WeakPolarHBondContact O-CB 3.38Å; N264-L268 PolarHBondContact O-N 3.26Å; N264-Q417 WeakPolarHBondContact ND2-CA 3.28Å; N264-Q417 WeakPolarHBondContact ND2-CB 3.4Å
265	C	95.3	Very high	92	Very high	10 Å²	10	14.4 Å²	14.4	7%	0.068	8%	0.081	C	C	.	.	H	α-helix	trans	-57.9	-34	173	178.8	0	0	0	0	112.5	G261 L262 P269 G420 G424	G261-C265 VanDerWaalsContact O-CB 3.31Å; G261-C265 WeakPolarHBondContact O-CB 3.27Å; G261-C265 PolarHBondContact O-N 2.73Å; L262-C265 WeakPolarHBondContact O-CB 3.34Å; L262-C265 PolarHBondContact O-N 3.1Å; C265-P269 WeakPolarHBondContact O-CD 3.39Å; C265-P269 WeakPolarHBondContact O-CG 3.28Å; C265-G420 WeakPolarHBondContact CA-O 3.35Å; C265-G420 WeakPolarHBondContact CB-O 3.25Å; C265-G424 WeakPolarHBondContact O-CA 3.34Å; C265-G424 WeakPolarHBondContact SG-CA 3.43Å; C265-G424 PolarHBondContact SG-N 3.14Å
266	V	93.1	Very high	91.5	Very high	0 Å²	0	13.1 Å²	13.1	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-85	-54.8	171.4	176	0	0	0	0	111.6	L262 M263 N264 V270 L336 Y519 F522	L262-V266 PolarHBondContact O-N 2.99Å; M263-V266 PolarHBondContact O-N 3.37Å; N264-V266 PolarHBondContact O-N 3.46Å; V266-V270 VanDerWaalsContact O-CG2 3.25Å; V266-V270 WeakPolarHBondContact O-CG2 3.43Å; V266-V270 PolarHBondContact O-N 3.37Å; V266-L336 HydrophobicContact CG1-CD1 3.6Å; V266-L336 HydrophobicContact CG1-CD2 3.48Å; V266-L336 VanDerWaalsContact CG1-CD2 3.48Å; V266-L336 HydrophobicContact CG1-CG 4.13Å; V266-Y519 HydrophobicContact CB-CD1 4.31Å; V266-Y519 HydrophobicContact CB-CG 4.3Å; V266-Y519 HydrophobicContact CG1-CD1 4.32Å; V266-Y519 HydrophobicContact CG1-CD2 4.17Å; V266-Y519 HydrophobicContact CG1-CG 3.8Å; V266-Y519 HydrophobicContact CG2-CD1 3.84Å; V266-Y519 HydrophobicContact CG2-CG 4.07Å; V266-Y519 WeakPolarHBondContact CG2-O 3.39Å; V266-F522 HydrophobicContact CG2-CB 3.69Å; V266-F522 HydrophobicContact CG2-CD2 4.44Å
267	L	92.8	Very high	90.6	Very high	20 Å²	20	14 Å²	14	11%	0.105	8%	0.077	C	C	.	.	H	α-helix	trans	-71.8	-40.4	-163.8	-171.2	63	0	0	0	113	M263 N264 V270 M271 F335 L354	M263-L267 WeakPolarHBondContact O-CB 3.13Å; M263-L267 PolarHBondContact O-N 2.85Å; N264-L267 PolarHBondContact O-N 3.06Å; L267-V270 PolarHBondContact O-N 3.32Å; L267-M271 HydrophobicContact CD1-CG 3.7Å; L267-M271 HydrophobicContact CD1-SD 3.79Å; L267-M271 HydrophobicContact CG-CG 3.86Å; L267-M271 HydrophobicContact CG-SD 4.42Å; L267-M271 WeakPolarHBondContact O-CB 3.3Å; L267-M271 WeakPolarHBondContact O-CG 3.42Å; L267-M271 PolarHBondContact O-N 3.04Å; L267-F335 HydrophobicContact CD1-CE1 4.34Å; L267-L354 HydrophobicContact CD1-CD2 4.28Å
268	L	93.3	Very high	89.6	Confident	39 Å²	39	14.2 Å²	14.2	20%	0.204	8%	0.079	C	C	.	.	H	α-helix	trans	-68.7	-44.8	-174	-59.8	175.5	0	0	0	112.9	N264 M271 A272 L421	N264-L268 HydrophobicContact CB-CD1 3.89Å; N264-L268 HydrophobicContact CB-CG 4.23Å; N264-L268 WeakPolarHBondContact O-CB 3.38Å; N264-L268 PolarHBondContact O-N 3.26Å; L268-M271 PolarHBondContact O-N 3.07Å; L268-A272 WeakPolarHBondContact O-CB 3.39Å; L268-A272 PolarHBondContact O-N 3.34Å; L268-A272 VanDerWaalsContact O-N 3.11Å; L268-L421 HydrophobicContact CB-CD1 3.89Å; L268-L421 HydrophobicContact CD1-CB 3.99Å; L268-L421 HydrophobicContact CD1-CD1 4.4Å
269	P	90.3	Very high	88.1	Confident	1 Å²	1	11.4 Å²	11.4	1%	0.006	7%	0.066	C	C	.	.	H	α-helix	trans	-62.4	-41.3	172.1	-22.8	33.8	0	0	0	113.4	C265 M271 A272 L273 G424 Y519	C265-P269 WeakPolarHBondContact O-CD 3.39Å; C265-P269 WeakPolarHBondContact O-CG 3.28Å; P269-M271 PolarHBondContact O-N 3.18Å; P269-A272 PolarHBondContact O-N 2.85Å; P269-L273 WeakPolarHBondContact O-CB 3.4Å; P269-L273 WeakPolarHBondContact O-CG 3.37Å; P269-L273 PolarHBondContact O-N 3.15Å; P269-G424 VanDerWaalsContact CG-C 3.47Å; P269-Y519 WeakPolarHBondContact CB-OH 3.3Å
270	V	88.6	Confident	86.4	Confident	1 Å²	1	12.4 Å²	12.4	1%	0.006	7%	0.07	C	C	.	.	H	α-helix	trans	-62.4	-45.2	178.7	171.5	0	0	0	0	111.2	V266 L267 A272 L273 Q274 W280 F335 L336 Y519	V266-V270 VanDerWaalsContact O-CG2 3.25Å; V266-V270 WeakPolarHBondContact O-CG2 3.43Å; V266-V270 PolarHBondContact O-N 3.37Å; L267-V270 PolarHBondContact O-N 3.32Å; V270-A272 VanDerWaalsContact C-N 3.29Å; V270-A272 PolarHBondContact O-N 3Å; V270-L273 PolarHBondContact O-N 2.92Å; V270-Q274 VanDerWaalsContact O-CB 3.23Å; V270-Q274 WeakPolarHBondContact O-CB 3.42Å; V270-Q274 PolarHBondContact O-N 3.17Å; V270-W280 HydrophobicContact CB-CH2 4.43Å; V270-W280 HydrophobicContact CB-CZ3 4.25Å; V270-W280 HydrophobicContact CG1-CE3 4.37Å; V270-W280 HydrophobicContact CG1-CH2 4.48Å; V270-W280 HydrophobicContact CG1-CZ3 3.93Å; V270-W280 HydrophobicContact CG2-CH2 4.07Å; V270-W280 HydrophobicContact CG2-CZ3 4.33Å; V270-F335 HydrophobicContact CG1-CE1 4.04Å; V270-L336 HydrophobicContact CG2-CD2 4.46Å; V270-Y519 HydrophobicContact CG2-CD2 3.53Å; V270-Y519 HydrophobicContact CG2-CE2 3.44Å; V270-Y519 VanDerWaalsContact CG2-CE2 3.44Å
271	M	91.3	Very high	84.6	Confident	7 Å²	7	13 Å²	13	3%	0.034	7%	0.072	C	C	.	.	H	α-helix	trans	-67.7	-30.2	179.9	-57.3	-84.4	-76.8	0	0	111.7	L267 L268 P269 G275 L298 L301 F302 F335	L267-M271 HydrophobicContact CD1-CG 3.7Å; L267-M271 HydrophobicContact CD1-SD 3.79Å; L267-M271 HydrophobicContact CG-CG 3.86Å; L267-M271 HydrophobicContact CG-SD 4.42Å; L267-M271 WeakPolarHBondContact O-CB 3.3Å; L267-M271 WeakPolarHBondContact O-CG 3.42Å; L267-M271 PolarHBondContact O-N 3.04Å; L268-M271 PolarHBondContact O-N 3.07Å; P269-M271 PolarHBondContact O-N 3.18Å; M271-G275 WeakPolarHBondContact O-CA 3.36Å; M271-G275 PolarHBondContact O-N 3.13Å; M271-L298 HydrophobicContact CB-CD2 4.16Å; M271-L298 HydrophobicContact CE-CD2 3.38Å; M271-L298 HydrophobicContact CG-CD2 4.27Å; M271-L298 WeakPolarHBondContact O-CD1 3.41Å; M271-L298 HydrophobicContact SD-CD2 3.25Å; M271-L298 WeakPolarHBondContact SD-CD2 3.13Å; M271-L301 HydrophobicContact CE-CD1 4.14Å; M271-L301 HydrophobicContact CE-CD2 4.13Å; M271-L301 HydrophobicContact SD-CD1 4.36Å; M271-F302 HydrophobicContact CE-CE1 4.14Å; M271-F302 HydrophobicContact CE-CE2 3.49Å; M271-F302 VanDerWaalsContact CE-CE2 3.49Å; M271-F302 HydrophobicContact CE-CZ 3.24Å; M271-F335 HydrophobicContact SD-CZ 4.27Å
272	A	88.6	Confident	82.7	Confident	0 Å²	0	16.8 Å²	16.8	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-75.5	-44.4	174.9	0	0	0	0	0	113.2	L268 P269 V270 G275 S276 M576 L580 L597	L268-A272 WeakPolarHBondContact O-CB 3.39Å; L268-A272 PolarHBondContact O-N 3.34Å; L268-A272 VanDerWaalsContact O-N 3.11Å; P269-A272 PolarHBondContact O-N 2.85Å; V270-A272 VanDerWaalsContact C-N 3.29Å; V270-A272 PolarHBondContact O-N 3Å; A272-G275 PolarHBondContact O-N 3.16Å; A272-S276 WeakPolarHBondContact O-CB 3.24Å; A272-S276 PolarHBondContact O-N 2.91Å; A272-S276 PolarHBondContact O-OG 3.43Å; A272-M576 CarbonylContact C-O 3.6Å; A272-M576 WeakPolarHBondContact CA-O 3.3Å; A272-M576 HydrophobicContact CB-CB 4.29Å; A272-M576 HydrophobicContact CB-CG 4.29Å; A272-L580 HydrophobicContact CB-CD1 3.89Å; A272-L597 HydrophobicContact CB-CD1 4.02Å; A272-L597 HydrophobicContact CB-CD2 4.32Å
273	L	83	Confident	80.6	Confident	11 Å²	11	18.8 Å²	18.8	6%	0.058	9%	0.093	C	C	.	.	H	α-helix	trans	-67.1	-44	177.7	-75.1	164.8	0	0	0	111.4	P269 V270 N277 A278 V279 W280 I593	P269-L273 WeakPolarHBondContact O-CB 3.4Å; P269-L273 WeakPolarHBondContact O-CG 3.37Å; P269-L273 PolarHBondContact O-N 3.15Å; V270-L273 PolarHBondContact O-N 2.92Å; L273-N277 PolarHBondContact O-N 2.88Å; L273-N277 VanDerWaalsContact O-N 3.12Å; L273-A278 PolarHBondContact O-N 3.36Å; L273-V279 HydrophobicContact CB-CG2 4.18Å; L273-V279 HydrophobicContact CD2-CG2 4.45Å; L273-W280 HydrophobicContact CB-CH2 3.77Å; L273-W280 HydrophobicContact CB-CZ3 3.6Å; L273-W280 HydrophobicContact CD1-CH2 3.7Å; L273-W280 HydrophobicContact CD1-CZ3 4.41Å; L273-W280 HydrophobicContact CG-CH2 4.38Å; L273-I593 HydrophobicContact CD2-CD1 3.66Å; L273-I593 HydrophobicContact CD2-CG2 4.2Å
274	Q	85.7	Confident	78.6	Confident	1 Å²	1	20.7 Å²	20.7	1%	0.005	10%	0.102	C	C	.	.	H	α-helix	trans	-68.6	-35.9	174.6	-167.1	78.3	-25.7	0	0	112.1	V270 A278 W280 G294 L298 Y351	V270-Q274 VanDerWaalsContact O-CB 3.23Å; V270-Q274 WeakPolarHBondContact O-CB 3.42Å; V270-Q274 PolarHBondContact O-N 3.17Å; Q274-A278 VanDerWaalsContact O-CA 3.31Å; Q274-A278 WeakPolarHBondContact O-CA 3.43Å; Q274-A278 PolarHBondContact O-N 3.21Å; Q274-W280 HydrophobicContact CB-CE3 4.35Å; Q274-W280 PolarHBondContact NE2-O 2.92Å; Q274-G294 WeakPolarHBondContact O-CA 3.4Å; Q274-L298 HydrophobicContact CB-CD1 4.45Å; Q274-Y351 WeakPolarHBondContact CG-OH 3.48Å
275	G	84.9	Confident	76.4	Confident	1 Å²	1	28 Å²	28	1%	0.01	14%	0.136	C	C	.	.	H	α-helix	trans	-76.8	-21.5	-176.4	0	0	0	0	0	115.6	M271 A272 G577 H703	M271-G275 WeakPolarHBondContact O-CA 3.36Å; M271-G275 PolarHBondContact O-N 3.13Å; A272-G275 PolarHBondContact O-N 3.16Å; G275-G577 VanDerWaalsContact O-CA 3.3Å; G275-G577 WeakPolarHBondContact O-CA 3.29Å; G275-H703 PolarHBondContact O-NE2 3.45Å
276	S	81.9	Confident	74.2	Confident	1 Å²	1	34.6 Å²	34.6	1%	0.007	16%	0.159	C	C	.	.	H	α-helix	trans	-105.1	-27.1	178.7	59.1	0	0	0	0	114	A272 G577 R581	A272-S276 WeakPolarHBondContact O-CB 3.24Å; A272-S276 PolarHBondContact O-N 2.91Å; A272-S276 PolarHBondContact O-OG 3.43Å; S276-G577 WeakPolarHBondContact CB-O 3.23Å; S276-R581 WeakPolarHBondContact O-CB 3.37Å; S276-R581 WeakPolarHBondContact O-CD 3.39Å; S276-R581 WeakPolarHBondContact O-CG 3.48Å; S276-R581 PolarHBondContact O-NH1 3.22Å
277	N	73.5	Confident	72.3	Confident	20 Å²	20	36 Å²	36	11%	0.107	17%	0.167	C	C	.	.	H	α-helix	trans	-141.8	2.1	-170.2	-76.2	-85	0	0	0	114.6	L273 V279 T585	L273-N277 PolarHBondContact O-N 2.88Å; L273-N277 VanDerWaalsContact O-N 3.12Å; N277-V279 HydrophobicContact CB-CG2 3.9Å; N277-V279 PolarHBondContact O-N 2.92Å; N277-V279 VanDerWaalsContact O-N 3.09Å; N277-T585 VanDerWaalsContact ND2-CG2 3.33Å; N277-T585 WeakPolarHBondContact ND2-CG2 3.46Å; N277-T585 PolarHBondContact ND2-OG1 3.11Å
278	A	73	Confident	70.4	Confident	16 Å²	16	40.9 Å²	40.9	13%	0.132	20%	0.199	C	C	.	.			trans	49.9	34.5	178.9	0	0	0	0	0	114.6	L273 Q274 W280 H281	L273-A278 PolarHBondContact O-N 3.36Å; Q274-A278 VanDerWaalsContact O-CA 3.31Å; Q274-A278 WeakPolarHBondContact O-CA 3.43Å; Q274-A278 PolarHBondContact O-N 3.21Å; A278-W280 PolarHBondContact O-N 3.35Å; A278-H281 PolarHBondContact O-N 3.03Å
279	V	63.1	Low	68.5	Low	36 Å²	36	42.8 Å²	42.8	22%	0.218	21%	0.209	C	C	.	.			trans	-49.3	-32.6	-168.2	175	0	0	0	0	114.4	L273 N277	L273-V279 HydrophobicContact CB-CG2 4.18Å; L273-V279 HydrophobicContact CD2-CG2 4.45Å; N277-V279 HydrophobicContact CB-CG2 3.9Å; N277-V279 PolarHBondContact O-N 2.92Å; N277-V279 VanDerWaalsContact O-N 3.09Å
280	W	61.3	Low	66.7	Low	21 Å²	21	44.4 Å²	44.4	8%	0.08	23%	0.226	C	C	.	.	S	Bend	trans	-114.8	73.5	179	-55.9	-84	0	0	0	110.9	V270 L273 Q274 A278 H339 G512 L515	V270-W280 HydrophobicContact CB-CH2 4.43Å; V270-W280 HydrophobicContact CB-CZ3 4.25Å; V270-W280 HydrophobicContact CG1-CE3 4.37Å; V270-W280 HydrophobicContact CG1-CH2 4.48Å; V270-W280 HydrophobicContact CG1-CZ3 3.93Å; V270-W280 HydrophobicContact CG2-CH2 4.07Å; V270-W280 HydrophobicContact CG2-CZ3 4.33Å; L273-W280 HydrophobicContact CB-CH2 3.77Å; L273-W280 HydrophobicContact CB-CZ3 3.6Å; L273-W280 HydrophobicContact CD1-CH2 3.7Å; L273-W280 HydrophobicContact CD1-CZ3 4.41Å; L273-W280 HydrophobicContact CG-CH2 4.38Å; Q274-W280 HydrophobicContact CB-CE3 4.35Å; Q274-W280 PolarHBondContact NE2-O 2.92Å; A278-W280 PolarHBondContact O-N 3.35Å; W280-H339 HydrophobicContact CB-CB 4.48Å; W280-G512 PolarHBondContact NE1-O 3.44Å; W280-L515 HydrophobicContact CZ2-CD2 4.47Å
281	H	57.4	Low	65.3	Low	29 Å²	29	46 Å²	46	13%	0.134	24%	0.236	C	C	.	.			trans	-147.7	132.9	166.6	179.9	45.1	0	0	0	111.2	A278 A342	A278-H281 PolarHBondContact O-N 3.03Å; H281-A342 PolarHBondContact ND1-O 3.05Å
282	H	54.9	Low	64.3	Low	89 Å²	89	47.2 Å²	47.2	41%	0.412	24%	0.242	S	C	.	.			trans	-94.9	117.5	168.7	-166.6	56.9	0	0	0	109.3	E284 A342	H282-E284 PolarHBondContact O-N 3.21Å; H282-A342 PolarHBondContact N-O 2.94Å
283	R	50.8	Low	63.8	Low	77 Å²	77	47.6 Å²	47.6	29%	0.291	24%	0.244	S	C	.	.			trans	-79	106.3	-172.7	-172.1	179.3	-169.3	-115.3	0.1	111.4	L287 L289	R283-L287 PolarHBondContact NH2-O 3.26Å; R283-L289 PolarHBondContact NH2-O 3.13Å
284	E	53.6	Low	63.8	Low	44 Å²	44	47 Å²	47	21%	0.206	24%	0.242	C	C	.	.			trans	-62.6	133.8	170.4	-44.9	-73.3	171.9	0	0	110.8	H282 W286 L287 S343 I344	H282-E284 PolarHBondContact O-N 3.21Å; E284-W286 VanDerWaalsContact C-N 3.28Å; E284-W286 PolarHBondContact O-N 3.28Å; E284-L287 PolarHBondContact O-N 2.93Å; E284-S343 WeakPolarHBondContact OE1-CB 3.32Å; E284-S343 PolarHBondContact OE1-OG 2.93Å; E284-I344 HydrophobicContact CG-CG2 3.9Å
285	E	47.5	Very low	63.9	Low	164 Å²	164	47.1 Å²	47.1	77%	0.766	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-26.6	-172.5	-60.4	-172.4	144.3	0	0	114.3	L287	E285-L287 VanDerWaalsContact C-N 3.32Å; E285-L287 PolarHBondContact O-N 3.22Å
286	W	50	Low	64.1	Low	149 Å²	149	49.5 Å²	49.5	56%	0.564	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-6.7	-175.1	62.9	-91.8	0	0	0	114.5	E284 P288 I344 Y345	E284-W286 VanDerWaalsContact C-N 3.28Å; E284-W286 PolarHBondContact O-N 3.28Å; W286-P288 VanDerWaalsContact O-CD 3.29Å; W286-P288 WeakPolarHBondContact O-CD 3.41Å; W286-I344 HydrophobicContact CZ2-CG2 4.17Å; W286-Y345 HydrophobicContact CZ2-CE1 4.5Å; W286-Y345 HydrophobicContact CZ2-CE2 4.42Å; W286-Y345 AromaticContact CZ2-CZ 3.85Å; W286-Y345 VanDerWaalsContact CZ2-OH 3.27Å; W286-Y345 WeakPolarHBondContact CZ2-OH 3.45Å
287	L	52.3	Low	64.6	Low	30 Å²	30	49.7 Å²	49.7	16%	0.157	26%	0.255	C	S	.	.			trans	-105.1	101.6	-172.6	-169.3	64.1	0	0	0	111.2	R283 E284 E285 L289 I344	R283-L287 PolarHBondContact NH2-O 3.26Å; E284-L287 PolarHBondContact O-N 2.93Å; E285-L287 VanDerWaalsContact C-N 3.32Å; E285-L287 PolarHBondContact O-N 3.22Å; L287-L289 HydrophobicContact CD1-CD1 4.12Å; L287-L289 HydrophobicContact CD1-CG 4.22Å; L287-L289 HydrophobicContact CD2-CD1 4.19Å; L287-L289 HydrophobicContact CG-CB 4.22Å; L287-L289 HydrophobicContact CG-CD1 4.15Å; L287-L289 HydrophobicContact CG-CG 4.13Å; L287-L289 PolarHBondContact O-N 2.95Å; L287-I344 HydrophobicContact CD2-CG1 4.47Å
288	P	52.6	Low	65.6	Low	121 Å²	121	48.8 Å²	48.8	79%	0.786	25%	0.25	S	S	*	.			trans	-73.9	11.9	-176	31.6	-37.6	0	0	0	114.4	W286	W286-P288 VanDerWaalsContact O-CD 3.29Å; W286-P288 WeakPolarHBondContact O-CD 3.41Å
289	L	53.2	Low	66.6	Low	79 Å²	79	48.3 Å²	48.3	41%	0.414	25%	0.246	S	C	.	.			trans	-66.1	143.5	167.3	-61.6	177.7	0	0	0	109.4	R283 L287 V293 L296	R283-L289 PolarHBondContact NH2-O 3.13Å; L287-L289 HydrophobicContact CD1-CD1 4.12Å; L287-L289 HydrophobicContact CD1-CG 4.22Å; L287-L289 HydrophobicContact CD2-CD1 4.19Å; L287-L289 HydrophobicContact CG-CB 4.22Å; L287-L289 HydrophobicContact CG-CD1 4.15Å; L287-L289 HydrophobicContact CG-CG 4.13Å; L287-L289 PolarHBondContact O-N 2.95Å; L289-V293 HydrophobicContact CB-CG2 4.39Å; L289-L296 HydrophobicContact CD1-CD1 4.26Å
290	G	54	Low	68.2	Low	35 Å²	35	48 Å²	48	36%	0.361	25%	0.247	S	C	.	.			trans	-74.5	-163.2	-174.2	0	0	0	0	0	114	E292	G290-E292 PolarHBondContact O-N 3.17Å
291	P	57.7	Low	69.9	Low	34 Å²	34	47 Å²	47	22%	0.221	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-6.2	178.3	26.2	-34	0	0	0	114.5	V293 F461 Y500	P291-V293 PolarHBondContact O-N 3.14Å; P291-F461 HydrophobicContact CG-CD1 4.33Å; P291-Y500 HydrophobicContact CB-CE2 4.14Å; P291-Y500 VanDerWaalsContact CB-OH 3.3Å; P291-Y500 WeakPolarHBondContact CB-OH 3.42Å
292	E	71.4	Confident	71.8	Confident	33 Å²	33	46.2 Å²	46.2	15%	0.154	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95	24.6	-167	-46	-60.7	169.9	0	0	113.4	G290 G294 S295 L296 R581 H703	G290-E292 PolarHBondContact O-N 3.17Å; E292-G294 VanDerWaalsContact C-N 3.26Å; E292-G294 PolarHBondContact O-N 2.99Å; E292-S295 PolarHBondContact O-N 3.42Å; E292-S295 PolarHBondContact O-OG 3.2Å; E292-L296 WeakPolarHBondContact O-CG 3.32Å; E292-L296 PolarHBondContact O-N 2.78Å; E292-L296 VanDerWaalsContact O-N 3.13Å; E292-R581 IonicContact OE1-CZ 3.75Å; E292-R581 VanDerWaalsContact OE1-CZ 3.27Å; E292-R581 IonicContact OE1-NE 2.94Å; E292-R581 PolarHBondContact OE1-NE 2.7Å; E292-R581 VanDerWaalsContact OE1-NE 3.07Å; E292-R581 IonicContact OE1-NH2 3.87Å; E292-R581 PolarHBondContact OE1-NH2 2.86Å; E292-R581 IonicContact OE2-CZ 3.11Å; E292-R581 IonicContact OE2-NE 2.73Å; E292-R581 PolarHBondContact OE2-NE 3.08Å; E292-R581 IonicContact OE2-NH2 2.79Å; E292-H703 IonicContact OE2-CD2 3.79Å; E292-H703 PolarHBondContact OE2-CD2 3.24Å; E292-H703 IonicContact OE2-NE2 3.92Å
293	V	78.3	Confident	73.8	Confident	8 Å²	8	45.2 Å²	45.2	5%	0.048	24%	0.237	C	C	.	.	H	α-helix	trans	-62.1	-34.3	179.6	179.5	0	0	0	0	111.6	L289 P291 L296 L297 I344	L289-V293 HydrophobicContact CB-CG2 4.39Å; P291-V293 PolarHBondContact O-N 3.14Å; V293-L296 PolarHBondContact O-N 2.85Å; V293-L297 HydrophobicContact CG1-CD1 4.01Å; V293-L297 HydrophobicContact CG1-CG 4.29Å; V293-L297 WeakPolarHBondContact O-CG 3.27Å; V293-L297 PolarHBondContact O-N 3.15Å; V293-I344 HydrophobicContact CG1-CD1 4.28Å
294	G	82.7	Confident	76.1	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-61.2	-48.9	178	0	0	0	0	0	113.2	Q274 E292 L297 L298	Q274-G294 WeakPolarHBondContact O-CA 3.4Å; E292-G294 VanDerWaalsContact C-N 3.26Å; E292-G294 PolarHBondContact O-N 2.99Å; G294-L297 PolarHBondContact O-N 3.21Å; G294-L298 WeakPolarHBondContact O-CD1 3.44Å; G294-L298 VanDerWaalsContact O-CG 3.3Å; G294-L298 WeakPolarHBondContact O-CG 3.28Å; G294-L298 PolarHBondContact O-N 3.25Å; G294-L298 VanDerWaalsContact O-N 3.08Å
295	S	88.4	Confident	78.1	Confident	3 Å²	3	41.4 Å²	41.4	2%	0.021	23%	0.226	C	C	.	.	H	α-helix	trans	-67.6	-35.2	175.6	55.9	0	0	0	0	112.4	E292 L298 S299 H703	E292-S295 PolarHBondContact O-N 3.42Å; E292-S295 PolarHBondContact O-OG 3.2Å; S295-L298 PolarHBondContact O-N 2.99Å; S295-S299 WeakPolarHBondContact O-CB 3.42Å; S295-S299 PolarHBondContact O-N 2.97Å; S295-H703 PolarHBondContact OG-CD2 2.92Å
296	L	88.9	Confident	80.5	Confident	50 Å²	50	34.3 Å²	34.3	26%	0.262	20%	0.195	S	C	.	.	H	α-helix	trans	-64.1	-41.1	173.9	-74.1	172	0	0	0	112.9	L289 E292 V293 S299 A300 F705	L289-L296 HydrophobicContact CD1-CD1 4.26Å; E292-L296 WeakPolarHBondContact O-CG 3.32Å; E292-L296 PolarHBondContact O-N 2.78Å; E292-L296 VanDerWaalsContact O-N 3.13Å; V293-L296 PolarHBondContact O-N 2.85Å; L296-S299 WeakPolarHBondContact O-CB 3.5Å; L296-S299 PolarHBondContact O-N 3.48Å; L296-A300 PolarHBondContact O-N 2.92Å; L296-F705 HydrophobicContact CD2-CE2 4.06Å; L296-F705 HydrophobicContact CD2-CZ 4.44Å
297	L	91.8	Very high	82.7	Confident	6 Å²	6	29.7 Å²	29.7	3%	0.031	19%	0.193	C	C	.	.	H	α-helix	trans	-64.1	-42.3	174.2	-75.8	169.3	0	0	0	111.7	V293 G294 S299 A300 L301 I344 L347 L348 Y351	V293-L297 HydrophobicContact CG1-CD1 4.01Å; V293-L297 HydrophobicContact CG1-CG 4.29Å; V293-L297 WeakPolarHBondContact O-CG 3.27Å; V293-L297 PolarHBondContact O-N 3.15Å; G294-L297 PolarHBondContact O-N 3.21Å; L297-S299 VanDerWaalsContact C-N 3.35Å; L297-A300 PolarHBondContact O-N 3.5Å; L297-L301 PolarHBondContact O-N 2.97Å; L297-I344 HydrophobicContact CD2-CD1 4.26Å; L297-L347 HydrophobicContact CD1-CB 4.06Å; L297-L347 HydrophobicContact CD1-CD1 4.16Å; L297-L348 HydrophobicContact CD2-CB 4.2Å; L297-L348 HydrophobicContact CD2-CD1 4.03Å; L297-Y351 VanDerWaalsContact C-CD1 3.44Å; L297-Y351 HydrophobicContact CB-CD1 3.68Å; L297-Y351 HydrophobicContact CB-CD2 4.3Å; L297-Y351 HydrophobicContact CB-CE1 3.76Å; L297-Y351 HydrophobicContact CB-CE2 4.37Å; L297-Y351 HydrophobicContact CB-CG 3.97Å; L297-Y351 HydrophobicContact CD1-CE2 4.29Å; L297-Y351 HydrophobicContact CD2-CD2 4.43Å; L297-Y351 HydrophobicContact CD2-CG 4.39Å; L297-Y351 VanDerWaalsContact O-CD1 3.26Å; L297-Y351 WeakPolarHBondContact O-CD1 3.39Å
298	L	94.1	Very high	84.7	Confident	0 Å²	0	30.6 Å²	30.6	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-62.7	-40.8	174.1	-70.5	164.4	0	0	0	112	M271 Q274 G294 S295 L301 F302 Y351 F700	M271-L298 HydrophobicContact CB-CD2 4.16Å; M271-L298 HydrophobicContact CE-CD2 3.38Å; M271-L298 HydrophobicContact CG-CD2 4.27Å; M271-L298 WeakPolarHBondContact O-CD1 3.41Å; M271-L298 HydrophobicContact SD-CD2 3.25Å; M271-L298 WeakPolarHBondContact SD-CD2 3.13Å; Q274-L298 HydrophobicContact CB-CD1 4.45Å; G294-L298 WeakPolarHBondContact O-CD1 3.44Å; G294-L298 VanDerWaalsContact O-CG 3.3Å; G294-L298 WeakPolarHBondContact O-CG 3.28Å; G294-L298 PolarHBondContact O-N 3.25Å; G294-L298 VanDerWaalsContact O-N 3.08Å; S295-L298 PolarHBondContact O-N 2.99Å; L298-L301 PolarHBondContact O-N 3.05Å; L298-F302 WeakPolarHBondContact O-CD2 3.26Å; L298-F302 PolarHBondContact O-N 3.46Å; L298-Y351 HydrophobicContact CD2-CE1 3.89Å; L298-Y351 HydrophobicContact CG-CE1 4.07Å; L298-F700 HydrophobicContact CB-CB 4.41Å; L298-F700 HydrophobicContact CB-CD1 4.27Å; L298-F700 HydrophobicContact CB-CD2 4.1Å; L298-F700 HydrophobicContact CB-CE2 4.44Å; L298-F700 HydrophobicContact CB-CG 4.02Å; L298-F700 HydrophobicContact CD1-CD1 4.21Å; L298-F700 HydrophobicContact CD1-CE1 3.9Å; L298-F700 HydrophobicContact CD1-CZ 4.16Å
299	S	95.6	Very high	86.7	Confident	7 Å²	7	25 Å²	25	5%	0.049	16%	0.161	C	C	.	.	H	α-helix	trans	-57.8	-50.4	173.7	-178.2	0	0	0	0	111.3	S295 L296 L297 L301 F302 L303 G697 A701	S295-S299 WeakPolarHBondContact O-CB 3.42Å; S295-S299 PolarHBondContact O-N 2.97Å; L296-S299 WeakPolarHBondContact O-CB 3.5Å; L296-S299 PolarHBondContact O-N 3.48Å; L297-S299 VanDerWaalsContact C-N 3.35Å; S299-L301 PolarHBondContact O-N 3.49Å; S299-F302 PolarHBondContact O-N 2.69Å; S299-L303 WeakPolarHBondContact O-CB 3.44Å; S299-L303 VanDerWaalsContact O-CG 3.29Å; S299-L303 WeakPolarHBondContact O-CG 3.47Å; S299-L303 PolarHBondContact O-N 2.74Å; S299-G697 WeakPolarHBondContact CB-O 3.35Å; S299-G697 PolarHBondContact OG-O 3.35Å; S299-A701 WeakPolarHBondContact OG-CB 3.3Å
300	A	95.6	Very high	88.5	Confident	29 Å²	29	26.1 Å²	26.1	24%	0.24	17%	0.167	C	C	.	.	H	α-helix	trans	-58.6	-45	177.7	0	0	0	0	0	112.4	L296 L297 F302 L303 V304 L352	L296-A300 PolarHBondContact O-N 2.92Å; L297-A300 PolarHBondContact O-N 3.5Å; A300-F302 PolarHBondContact O-N 2.64Å; A300-L303 PolarHBondContact O-N 2.99Å; A300-V304 WeakPolarHBondContact O-CB 3.47Å; A300-V304 WeakPolarHBondContact O-CG2 3.46Å; A300-V304 PolarHBondContact O-N 2.95Å; A300-L352 HydrophobicContact CB-CD2 4.4Å
301	L	96.6	Very high	90.4	Very high	0 Å²	0	27 Å²	27	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-56.2	-48.9	175	176.1	165	0	0	0	111.7	M271 L297 L298 S299 A305 F335 Y351 L354 G355 L358	M271-L301 HydrophobicContact CE-CD1 4.14Å; M271-L301 HydrophobicContact CE-CD2 4.13Å; M271-L301 HydrophobicContact SD-CD1 4.36Å; L297-L301 PolarHBondContact O-N 2.97Å; L298-L301 PolarHBondContact O-N 3.05Å; S299-L301 PolarHBondContact O-N 3.49Å; L301-A305 WeakPolarHBondContact O-CB 3.27Å; L301-A305 PolarHBondContact O-N 3.19Å; L301-F335 HydrophobicContact CD1-CE2 4.18Å; L301-Y351 HydrophobicContact CB-CD1 3.97Å; L301-Y351 HydrophobicContact CD1-CD1 3.69Å; L301-Y351 HydrophobicContact CD1-CE1 4.29Å; L301-Y351 HydrophobicContact CD1-CG 4.35Å; L301-Y351 WeakPolarHBondContact CG-O 3.4Å; L301-L354 HydrophobicContact CD1-CB 4.21Å; L301-L354 HydrophobicContact CD1-CD2 3.83Å; L301-L354 HydrophobicContact CD1-CG 3.99Å; L301-G355 VanDerWaalsContact O-CA 3.31Å; L301-G355 WeakPolarHBondContact O-CA 3.45Å; L301-L358 HydrophobicContact CD2-CD2 3.96Å
302	F	97.8	Very high	92	Very high	12 Å²	12	25.5 Å²	25.5	5%	0.053	16%	0.156	C	C	.	.	H	α-helix	trans	-74.4	-34.7	-177.3	-75.1	-57.5	0	0	0	113.3	M271 L298 S299 A300 A305 A306 L358 F693 L696 F700	M271-F302 HydrophobicContact CE-CE1 4.14Å; M271-F302 HydrophobicContact CE-CE2 3.49Å; M271-F302 VanDerWaalsContact CE-CE2 3.49Å; M271-F302 HydrophobicContact CE-CZ 3.24Å; L298-F302 WeakPolarHBondContact O-CD2 3.26Å; L298-F302 PolarHBondContact O-N 3.46Å; S299-F302 PolarHBondContact O-N 2.69Å; A300-F302 PolarHBondContact O-N 2.64Å; F302-A305 PolarHBondContact O-N 2.72Å; F302-A306 WeakPolarHBondContact O-CB 3.26Å; F302-A306 PolarHBondContact O-N 2.98Å; F302-L358 HydrophobicContact CD1-CD2 4.28Å; F302-L358 HydrophobicContact CE1-CD2 3.95Å; F302-F693 AromaticContact CD1-CD1 3.62Å; F302-F693 HydrophobicContact CD1-CD1 3.62Å; F302-F693 HydrophobicContact CD1-CE1 4.16Å; F302-F693 HydrophobicContact CD1-CG 4.41Å; F302-F693 AromaticContact CE1-CD1 3.99Å; F302-F693 HydrophobicContact CE1-CD1 3.99Å; F302-F693 HydrophobicContact CE1-CE1 4.13Å; F302-L696 HydrophobicContact CB-CB 4.15Å; F302-L696 HydrophobicContact CD1-CB 4.06Å; F302-L696 HydrophobicContact CD1-CD1 3.99Å; F302-L696 HydrophobicContact CD2-CB 3.89Å; F302-L696 HydrophobicContact CE1-CB 4.42Å; F302-L696 HydrophobicContact CE1-CD1 3.79Å; F302-L696 HydrophobicContact CE2-CB 4.27Å; F302-L696 HydrophobicContact CE2-CD2 4.42Å; F302-L696 HydrophobicContact CG-CB 3.77Å; F302-L696 HydrophobicContact CZ-CD1 4.18Å; F302-L696 HydrophobicContact CZ-CD2 4.34Å; F302-F700 AromaticContact CD2-CD2 3.79Å; F302-F700 HydrophobicContact CD2-CD2 3.79Å; F302-F700 HydrophobicContact CD2-CE2 4.01Å; F302-F700 AromaticContact CE2-CD2 3.86Å; F302-F700 HydrophobicContact CE2-CD2 3.86Å; F302-F700 AromaticContact CE2-CE2 3.58Å; F302-F700 HydrophobicContact CE2-CE2 3.58Å
303	L	97.6	Very high	92.8	Very high	69 Å²	69	25.3 Å²	25.3	36%	0.361	16%	0.156	S	C	.	.	H	α-helix	trans	-65.6	-39.5	173.3	-68.7	173	0	0	0	111.6	S299 A300 A306 G307 L694 L698	S299-L303 WeakPolarHBondContact O-CB 3.44Å; S299-L303 VanDerWaalsContact O-CG 3.29Å; S299-L303 WeakPolarHBondContact O-CG 3.47Å; S299-L303 PolarHBondContact O-N 2.74Å; A300-L303 PolarHBondContact O-N 2.99Å; L303-A306 PolarHBondContact O-N 3.11Å; L303-G307 PolarHBondContact O-N 3.31Å; L303-L694 HydrophobicContact CD2-CD1 3.91Å; L303-L698 HydrophobicContact CD2-CD2 4.48Å
304	V	97.5	Very high	93.3	Very high	41 Å²	41	34.8 Å²	34.8	25%	0.248	19%	0.191	C	C	.	.	H	α-helix	trans	-64.8	-42.1	171.2	171.2	0	0	0	0	111.3	A300 A306 G307 M308 L352 M356	A300-V304 WeakPolarHBondContact O-CB 3.47Å; A300-V304 WeakPolarHBondContact O-CG2 3.46Å; A300-V304 PolarHBondContact O-N 2.95Å; V304-A306 VanDerWaalsContact C-N 3.32Å; V304-A306 PolarHBondContact O-N 3.16Å; V304-G307 PolarHBondContact O-N 3.35Å; V304-M308 HydrophobicContact CG1-CG 4.25Å; V304-M308 WeakPolarHBondContact O-CB 3.29Å; V304-M308 WeakPolarHBondContact O-CG 3.5Å; V304-M308 PolarHBondContact O-N 2.99Å; V304-L352 HydrophobicContact CG2-CD2 3.69Å; V304-M356 HydrophobicContact CG1-CB 4.46Å; V304-M356 HydrophobicContact CG1-CG 3.63Å
305	A	97.3	Very high	93.6	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-62.3	-37.9	175.6	0	0	0	0	0	112.5	L301 F302 M308 S309 G355 L358 S359 F693	L301-A305 WeakPolarHBondContact O-CB 3.27Å; L301-A305 PolarHBondContact O-N 3.19Å; F302-A305 PolarHBondContact O-N 2.72Å; A305-M308 PolarHBondContact O-N 3.21Å; A305-S309 PolarHBondContact O-N 3.45Å; A305-G355 VanDerWaalsContact CA-O 3.26Å; A305-G355 WeakPolarHBondContact CA-O 3.44Å; A305-G355 WeakPolarHBondContact CB-O 3.31Å; A305-L358 HydrophobicContact CB-CB 4.36Å; A305-L358 HydrophobicContact CB-CD2 4.29Å; A305-S359 WeakPolarHBondContact O-CB 3.32Å; A305-F693 HydrophobicContact CB-CB 4.33Å; A305-F693 HydrophobicContact CB-CD1 4.39Å; A305-F693 HydrophobicContact CB-CD2 3.58Å; A305-F693 HydrophobicContact CB-CE2 3.86Å; A305-F693 HydrophobicContact CB-CG 3.88Å; A305-F693 HydrophobicContact CB-CZ 4.41Å
306	A	97.3	Very high	93.6	Very high	14 Å²	14	37.7 Å²	37.7	12%	0.116	21%	0.206	C	C	.	.	H	α-helix	trans	-62.9	-47.2	173.8	0	0	0	0	0	111.4	F302 L303 V304 S309 F693 L694	F302-A306 WeakPolarHBondContact O-CB 3.26Å; F302-A306 PolarHBondContact O-N 2.98Å; L303-A306 PolarHBondContact O-N 3.11Å; V304-A306 VanDerWaalsContact C-N 3.32Å; V304-A306 PolarHBondContact O-N 3.16Å; A306-S309 VanDerWaalsContact O-CB 3.3Å; A306-S309 WeakPolarHBondContact O-CB 3.23Å; A306-S309 PolarHBondContact O-N 2.93Å; A306-S309 PolarHBondContact O-OG 3.45Å; A306-F693 HydrophobicContact CB-CB 3.82Å; A306-L694 HydrophobicContact CB-CB 4.32Å
307	G	96.1	Very high	93.4	Very high	52 Å²	52	40.8 Å²	40.8	54%	0.536	22%	0.217	S	C	.	.	H	α-helix	trans	-63.9	-38.5	176	0	0	0	0	0	113.7	L303 V304 S309 P311	L303-G307 PolarHBondContact O-N 3.31Å; V304-G307 PolarHBondContact O-N 3.35Å; G307-S309 VanDerWaalsContact C-N 3.27Å; G307-S309 PolarHBondContact O-N 2.85Å; G307-P311 VanDerWaalsContact O-CD 3.23Å; G307-P311 WeakPolarHBondContact O-CD 3.22Å
308	M	95.3	Very high	93.2	Very high	50 Å²	50	49.9 Å²	49.9	25%	0.246	25%	0.251	C	S	.	.	H	α-helix	trans	-78.3	-6	-178.4	-74.2	-68.1	-73.1	0	0	114.5	V304 A305 P311 S312 L315 M356	V304-M308 HydrophobicContact CG1-CG 4.25Å; V304-M308 WeakPolarHBondContact O-CB 3.29Å; V304-M308 WeakPolarHBondContact O-CG 3.5Å; V304-M308 PolarHBondContact O-N 2.99Å; A305-M308 PolarHBondContact O-N 3.21Å; M308-P311 WeakPolarHBondContact O-CD 3.5Å; M308-P311 HydrophobicContact SD-CB 4.27Å; M308-P311 HydrophobicContact SD-CG 4.27Å; M308-S312 WeakPolarHBondContact O-CB 3.39Å; M308-S312 PolarHBondContact O-N 3.49Å; M308-L315 HydrophobicContact CE-CD1 4.46Å; M308-M356 HydrophobicContact CE-CB 4.28Å; M308-M356 HydrophobicContact CE-CG 4.4Å; M308-M356 HydrophobicContact CG-CG 4.23Å
309	S	93.8	Very high	92.7	Very high	2 Å²	2	55.9 Å²	55.9	1%	0.014	28%	0.275	C	S	.	.	H	α-helix	trans	-57.6	-51.5	177.4	64.9	0	0	0	0	114.3	A305 A306 G307 S312 S359 A690	A305-S309 PolarHBondContact O-N 3.45Å; A306-S309 VanDerWaalsContact O-CB 3.3Å; A306-S309 WeakPolarHBondContact O-CB 3.23Å; A306-S309 PolarHBondContact O-N 2.93Å; A306-S309 PolarHBondContact O-OG 3.45Å; G307-S309 VanDerWaalsContact C-N 3.27Å; G307-S309 PolarHBondContact O-N 2.85Å; S309-S312 WeakPolarHBondContact O-CB 3.35Å; S309-S312 PolarHBondContact O-N 2.67Å; S309-S312 PolarHBondContact O-OG 3.08Å; S309-S359 VanDerWaalsContact CA-OG 3.29Å; S309-S359 WeakPolarHBondContact CA-OG 3.43Å; S309-A690 WeakPolarHBondContact OG-CB 3.44Å
310	L	91.1	Very high	92.1	Very high	103 Å²	103	56.6 Å²	56.6	54%	0.539	28%	0.284	S	S	.	.	H	α-helix	trans	-71.6	-42.2	-179.5	-57	179	0	0	0	112.3	S312 I313 P687	L310-S312 PolarHBondContact O-N 2.76Å; L310-I313 PolarHBondContact O-N 3.28Å; L310-P687 HydrophobicContact CD2-CB 4.25Å
311	P	93.3	Very high	91.7	Very high	53 Å²	53	58 Å²	58	34%	0.344	28%	0.283	S	S	.	.	H	α-helix	trans	-53.1	-36.1	166	-29.1	36.1	0	0	0	113.9	G307 M308 I313 R314 L315	G307-P311 VanDerWaalsContact O-CD 3.23Å; G307-P311 WeakPolarHBondContact O-CD 3.22Å; M308-P311 WeakPolarHBondContact O-CD 3.5Å; M308-P311 HydrophobicContact SD-CB 4.27Å; M308-P311 HydrophobicContact SD-CG 4.27Å; P311-I313 PolarHBondContact O-N 3.42Å; P311-I313 VanDerWaalsContact O-N 3.14Å; P311-R314 WeakPolarHBondContact O-CB 3.47Å; P311-R314 PolarHBondContact O-N 2.91Å; P311-L315 PolarHBondContact O-N 2.85Å; P311-L315 VanDerWaalsContact O-N 3.13Å
312	S	90.9	Very high	91.3	Very high	3 Å²	3	59 Å²	59	2%	0.021	29%	0.294	C	S	.	.	H	α-helix	trans	-59.4	-28	-178.5	84.7	0	0	0	0	113.7	M308 S309 L310 R314 L315 M316	M308-S312 WeakPolarHBondContact O-CB 3.39Å; M308-S312 PolarHBondContact O-N 3.49Å; S309-S312 WeakPolarHBondContact O-CB 3.35Å; S309-S312 PolarHBondContact O-N 2.67Å; S309-S312 PolarHBondContact O-OG 3.08Å; L310-S312 PolarHBondContact O-N 2.76Å; S312-R314 VanDerWaalsContact C-N 3.32Å; S312-R314 PolarHBondContact O-N 3.16Å; S312-L315 PolarHBondContact O-N 3.38Å; S312-M316 WeakPolarHBondContact O-CB 3.24Å; S312-M316 WeakPolarHBondContact O-CG 3.17Å; S312-M316 PolarHBondContact O-N 2.92Å
313	I	89.5	Confident	90.9	Very high	30 Å²	30	61.5 Å²	61.5	15%	0.154	31%	0.311	C	S	.	.	H	α-helix	trans	-62.6	-40.7	174.2	-51.3	173.8	0	0	0	110.6	L310 P311 K317 E683 A686	L310-I313 PolarHBondContact O-N 3.28Å; P311-I313 PolarHBondContact O-N 3.42Å; P311-I313 VanDerWaalsContact O-N 3.14Å; I313-K317 HydrophobicContact CG2-CD 4.42Å; I313-K317 WeakPolarHBondContact O-CB 3.22Å; I313-K317 WeakPolarHBondContact O-CG 3.34Å; I313-K317 PolarHBondContact O-N 3.16Å; I313-K317 VanDerWaalsContact O-N 3.15Å; I313-E683 HydrophobicContact CG2-CG 4.34Å; I313-A686 HydrophobicContact CD1-CB 3.78Å; I313-A686 HydrophobicContact CG1-CB 3.59Å
314	R	88.4	Confident	90.7	Very high	206 Å²	206	59.4 Å²	59.4	78%	0.777	30%	0.3	S	S	*	.	H	α-helix	trans	-69.8	-40.1	176.1	-61.5	-175.9	-179.3	-178.8	1.4	111.1	P311 S312 K317 R318	P311-R314 WeakPolarHBondContact O-CB 3.47Å; P311-R314 PolarHBondContact O-N 2.91Å; S312-R314 VanDerWaalsContact C-N 3.32Å; S312-R314 PolarHBondContact O-N 3.16Å; R314-K317 PolarHBondContact O-N 3.25Å; R314-R318 WeakPolarHBondContact O-CB 3.44Å; R314-R318 PolarHBondContact O-N 2.85Å
315	L	88.9	Confident	90.5	Very high	57 Å²	57	57.8 Å²	57.8	30%	0.298	29%	0.29	S	S	.	.	H	α-helix	trans	-64	-46.2	177	-63.3	176.2	0	0	0	111.7	M308 P311 S312 K317 R318 Y319 L324	M308-L315 HydrophobicContact CE-CD1 4.46Å; P311-L315 PolarHBondContact O-N 2.85Å; P311-L315 VanDerWaalsContact O-N 3.13Å; S312-L315 PolarHBondContact O-N 3.38Å; L315-K317 VanDerWaalsContact C-N 3.29Å; L315-K317 PolarHBondContact O-N 3.25Å; L315-R318 PolarHBondContact O-N 3.01Å; L315-R318 VanDerWaalsContact O-N 3.13Å; L315-Y319 HydrophobicContact CD2-CD2 4.1Å; L315-Y319 HydrophobicContact CD2-CE2 3.84Å; L315-Y319 PolarHBondContact O-N 3.12Å; L315-L324 HydrophobicContact CB-CD1 4.18Å; L315-L324 HydrophobicContact CB-CD2 4.21Å
316	M	87.6	Confident	90.3	Very high	7 Å²	7	58.7 Å²	58.7	3%	0.034	30%	0.295	C	S	.	.	H	α-helix	trans	-59.5	-39	175.4	-76.8	-174.6	-74.1	0	0	111.9	S312 G320 Y321 L324 T682	S312-M316 WeakPolarHBondContact O-CB 3.24Å; S312-M316 WeakPolarHBondContact O-CG 3.17Å; S312-M316 PolarHBondContact O-N 2.92Å; M316-G320 VanDerWaalsContact O-CA 3.23Å; M316-G320 WeakPolarHBondContact O-CA 3.28Å; M316-G320 PolarHBondContact O-N 3.41Å; M316-G320 VanDerWaalsContact O-N 3.08Å; M316-Y321 HydrophobicContact CB-CD1 4.34Å; M316-Y321 HydrophobicContact CB-CE1 4.11Å; M316-Y321 HydrophobicContact CG-CD1 4.17Å; M316-Y321 HydrophobicContact CG-CE1 4.29Å; M316-Y321 HydrophobicContact SD-CD1 4.17Å; M316-Y321 HydrophobicContact SD-CE1 4.11Å; M316-L324 HydrophobicContact CB-CD1 4.24Å; M316-L324 HydrophobicContact CG-CD1 3.56Å; M316-T682 HydrophobicContact CE-CG2 3.87Å; M316-T682 HydrophobicContact SD-CG2 3.7Å
317	K	85.3	Confident	90.2	Very high	116 Å²	116	59.9 Å²	59.9	50%	0.504	31%	0.306	S	S	.	.	H	α-helix	trans	-74.3	-22.4	176.6	-71.2	179.4	-179	-175.4	0	114	I313 R314 L315 E683	I313-K317 HydrophobicContact CG2-CD 4.42Å; I313-K317 WeakPolarHBondContact O-CB 3.22Å; I313-K317 WeakPolarHBondContact O-CG 3.34Å; I313-K317 PolarHBondContact O-N 3.16Å; I313-K317 VanDerWaalsContact O-N 3.15Å; R314-K317 PolarHBondContact O-N 3.25Å; L315-K317 VanDerWaalsContact C-N 3.29Å; L315-K317 PolarHBondContact O-N 3.25Å; K317-E683 IonicContact NZ-OE1 3.38Å; K317-E683 PolarHBondContact NZ-OE1 3.4Å
318	R	86.8	Confident	90.2	Very high	197 Å²	197	57.5 Å²	57.5	74%	0.743	28%	0.281	S	S	*	.	H	α-helix	trans	-94	-42.4	179.6	-173.6	174.7	-174.1	176.7	3.5	114	R314 L315	R314-R318 WeakPolarHBondContact O-CB 3.44Å; R314-R318 PolarHBondContact O-N 2.85Å; L315-R318 PolarHBondContact O-N 3.01Å; L315-R318 VanDerWaalsContact O-N 3.13Å
319	Y	84.3	Confident	90.2	Very high	125 Å²	125	55.1 Å²	55.1	49%	0.49	27%	0.269	S	S	.	.	H	α-helix	trans	-110	-8.3	-173	-59.8	-77.8	0	0	0	113.6	L315 P323	L315-Y319 HydrophobicContact CD2-CD2 4.1Å; L315-Y319 HydrophobicContact CD2-CE2 3.84Å; L315-Y319 PolarHBondContact O-N 3.12Å; Y319-P323 WeakPolarHBondContact O-CD 3.35Å; Y319-P323 WeakPolarHBondContact O-CG 3.29Å
320	G	84	Confident	90.3	Very high	23 Å²	23	59 Å²	59	24%	0.237	29%	0.288	C	S	.	.			trans	72.2	177.2	-174.8	0	0	0	0	0	113.7	M316	M316-G320 VanDerWaalsContact O-CA 3.23Å; M316-G320 WeakPolarHBondContact O-CA 3.28Å; M316-G320 PolarHBondContact O-N 3.41Å; M316-G320 VanDerWaalsContact O-N 3.08Å
321	Y	87.3	Confident	90.5	Very high	57 Å²	57	54.6 Å²	54.6	22%	0.224	27%	0.265	C	S	.	.	H	α-helix	trans	-78.1	-29	-170.8	-50.5	-59.6	0	0	0	114.5	M316 I325 A367 L368 I541 T682	M316-Y321 HydrophobicContact CB-CD1 4.34Å; M316-Y321 HydrophobicContact CB-CE1 4.11Å; M316-Y321 HydrophobicContact CG-CD1 4.17Å; M316-Y321 HydrophobicContact CG-CE1 4.29Å; M316-Y321 HydrophobicContact SD-CD1 4.17Å; M316-Y321 HydrophobicContact SD-CE1 4.11Å; Y321-I325 WeakPolarHBondContact O-CG1 3.43Å; Y321-I325 PolarHBondContact O-N 2.91Å; Y321-A367 HydrophobicContact CD1-CB 3.97Å; Y321-A367 HydrophobicContact CE1-CB 3.61Å; Y321-A367 HydrophobicContact CE2-CB 4.45Å; Y321-L368 HydrophobicContact CD2-CD2 4.22Å; Y321-L368 HydrophobicContact CG-CD2 4.5Å; Y321-L368 HydrophobicContact CG-CG 4.37Å; Y321-I541 HydrophobicContact CD2-CD1 4.17Å; Y321-I541 HydrophobicContact CE2-CD1 4.37Å; Y321-T682 HydrophobicContact CE1-CG2 4.07Å
322	G	87.4	Confident	90.6	Very high	22 Å²	22	52.1 Å²	52.1	23%	0.227	25%	0.249	C	C	.	.	H	α-helix	trans	-69.4	-58.1	-173.8	0	0	0	0	0	113.3	L324 I325 V326	G322-L324 PolarHBondContact O-N 2.87Å; G322-I325 PolarHBondContact O-N 2.61Å; G322-V326 PolarHBondContact O-N 2.85Å; G322-V326 VanDerWaalsContact O-N 3.15Å
323	P	90	Very high	90.8	Very high	65 Å²	65	52.8 Å²	52.8	42%	0.422	25%	0.252	S	S	.	.	H	α-helix	trans	-57.2	-34.3	179.8	-28.7	37.7	0	0	0	113.8	Y319 I325 V326 A327	Y319-P323 WeakPolarHBondContact O-CD 3.35Å; Y319-P323 WeakPolarHBondContact O-CG 3.29Å; P323-I325 PolarHBondContact O-N 2.94Å; P323-V326 PolarHBondContact O-N 3.5Å; P323-A327 VanDerWaalsContact O-CB 3.26Å; P323-A327 WeakPolarHBondContact O-CB 3.49Å; P323-A327 PolarHBondContact O-N 3.3Å
324	L	92.3	Very high	91.1	Very high	24 Å²	24	55.8 Å²	55.8	13%	0.126	27%	0.268	C	S	.	.	H	α-helix	trans	-69.2	-29.8	177.6	-63.7	176	0	0	0	113.4	L315 M316 G322 N328	L315-L324 HydrophobicContact CB-CD1 4.18Å; L315-L324 HydrophobicContact CB-CD2 4.21Å; M316-L324 HydrophobicContact CB-CD1 4.24Å; M316-L324 HydrophobicContact CG-CD1 3.56Å; G322-L324 PolarHBondContact O-N 2.87Å; L324-N328 PolarHBondContact O-N 3.2Å
325	I	93.2	Very high	91.4	Very high	7 Å²	7	46 Å²	46	4%	0.036	23%	0.231	C	C	.	.	H	α-helix	trans	-75.1	-43.7	174.1	-67.7	168.2	0	0	0	110.2	L256 Y321 G322 P323 N328 Y329 K365 L368	L256-I325 HydrophobicContact CD1-CD1 4.12Å; Y321-I325 WeakPolarHBondContact O-CG1 3.43Å; Y321-I325 PolarHBondContact O-N 2.91Å; G322-I325 PolarHBondContact O-N 2.61Å; P323-I325 PolarHBondContact O-N 2.94Å; I325-N328 PolarHBondContact O-N 3.12Å; I325-Y329 HydrophobicContact CG2-CD2 4.45Å; I325-Y329 HydrophobicContact CG2-CE2 4.08Å; I325-Y329 PolarHBondContact O-N 3.31Å; I325-Y329 VanDerWaalsContact O-N 3.1Å; I325-K365 HydrophobicContact CD1-CG 4.03Å; I325-K365 HydrophobicContact CG1-CG 4.4Å; I325-L368 HydrophobicContact CD1-CD1 3.51Å
326	V	93.9	Very high	91.6	Very high	19 Å²	19	43.3 Å²	43.3	12%	0.115	22%	0.217	C	C	.	.	H	α-helix	trans	-61.7	-45.3	175.1	171.4	0	0	0	0	111.3	G322 P323 N328 Y329 M330 L527 L531 V534	G322-V326 PolarHBondContact O-N 2.85Å; G322-V326 VanDerWaalsContact O-N 3.15Å; P323-V326 PolarHBondContact O-N 3.5Å; V326-N328 VanDerWaalsContact C-N 3.3Å; V326-N328 PolarHBondContact O-N 3.22Å; V326-Y329 PolarHBondContact O-N 2.99Å; V326-M330 PolarHBondContact O-N 3.47Å; V326-L527 HydrophobicContact CG1-CD1 4.21Å; V326-L531 HydrophobicContact CG1-CD2 3.64Å; V326-L531 HydrophobicContact CG1-CG 4.28Å; V326-L531 HydrophobicContact CG2-CD2 4.28Å; V326-V534 HydrophobicContact CG2-CG2 3.6Å
327	A	94.4	Very high	91.8	Very high	40 Å²	40	46.4 Å²	46.4	33%	0.331	23%	0.233	S	C	.	.	H	α-helix	trans	-56.8	-43.9	176.3	0	0	0	0	0	111.7	P323 Y329 M330 T331	P323-A327 VanDerWaalsContact O-CB 3.26Å; P323-A327 WeakPolarHBondContact O-CB 3.49Å; P323-A327 PolarHBondContact O-N 3.3Å; A327-Y329 VanDerWaalsContact C-N 3.33Å; A327-Y329 PolarHBondContact O-N 3.16Å; A327-M330 WeakPolarHBondContact O-CB 3.49Å; A327-M330 PolarHBondContact O-N 3.21Å; A327-T331 WeakPolarHBondContact O-CG2 3.08Å; A327-T331 PolarHBondContact O-N 3Å; A327-T331 PolarHBondContact O-OG1 2.97Å
328	N	95.9	Very high	92	Very high	2 Å²	2	41.6 Å²	41.6	1%	0.011	21%	0.214	C	C	.	.	H	α-helix	trans	-63.7	-35.1	175.3	-172.7	121.2	0	0	0	113.4	L324 I325 V326 T331 V332 T357 L358 S361	L324-N328 PolarHBondContact O-N 3.2Å; I325-N328 PolarHBondContact O-N 3.12Å; V326-N328 VanDerWaalsContact C-N 3.3Å; V326-N328 PolarHBondContact O-N 3.22Å; N328-T331 WeakPolarHBondContact CA-OG1 3.5Å; N328-T331 PolarHBondContact O-N 3.08Å; N328-T331 PolarHBondContact O-OG1 3.44Å; N328-V332 WeakPolarHBondContact O-CG2 3.28Å; N328-V332 PolarHBondContact O-N 2.96Å; N328-T357 PolarHBondContact OD1-O 3.48Å; N328-L358 WeakPolarHBondContact OD1-CA 3.43Å; N328-L358 PolarHBondContact OD1-N 2.94Å; N328-S361 VanDerWaalsContact CB-CB 3.48Å; N328-S361 VanDerWaalsContact CG-CB 3.42Å; N328-S361 WeakPolarHBondContact OD1-CB 3.49Å
329	Y	95.8	Very high	91.9	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-78.8	-30.4	-179.2	-67.3	-0.4	0	0	0	111.1	A259 H260 M263 I325 V326 A327 L333 K365 S526 S530	A259-Y329 HydrophobicContact CB-CE2 3.99Å; H260-Y329 WeakPolarHBondContact CA-OH 3.48Å; M263-Y329 HydrophobicContact CB-CE1 4.15Å; M263-Y329 HydrophobicContact CE-CD1 3.64Å; M263-Y329 HydrophobicContact CE-CD2 4.17Å; M263-Y329 HydrophobicContact CE-CE1 4.18Å; M263-Y329 HydrophobicContact CE-CG 3.65Å; M263-Y329 HydrophobicContact CG-CD1 4.06Å; M263-Y329 HydrophobicContact CG-CE1 3.69Å; M263-Y329 HydrophobicContact SD-CD1 4.37Å; I325-Y329 HydrophobicContact CG2-CD2 4.45Å; I325-Y329 HydrophobicContact CG2-CE2 4.08Å; I325-Y329 PolarHBondContact O-N 3.31Å; I325-Y329 VanDerWaalsContact O-N 3.1Å; V326-Y329 PolarHBondContact O-N 2.99Å; A327-Y329 VanDerWaalsContact C-N 3.33Å; A327-Y329 PolarHBondContact O-N 3.16Å; Y329-L333 WeakPolarHBondContact O-CB 3.44Å; Y329-L333 PolarHBondContact O-N 3.49Å; Y329-K365 WeakPolarHBondContact OH-CE 3.15Å; Y329-K365 PolarHBondContact OH-NZ 3.39Å; Y329-S526 VanDerWaalsContact CD2-OG 3.3Å; Y329-S526 WeakPolarHBondContact CD2-OG 3.47Å; Y329-S526 VanDerWaalsContact CE2-OG 3.26Å; Y329-S526 WeakPolarHBondContact CE2-OG 3.36Å; Y329-S530 WeakPolarHBondContact CD2-OG 3.43Å; Y329-S530 WeakPolarHBondContact CE2-OG 3.43Å
330	M	95.9	Very high	91.9	Very high	83 Å²	83	28.9 Å²	28.9	41%	0.409	17%	0.169	S	C	.	.	H	α-helix	trans	-59.8	-45.4	162.5	-74.7	-66.5	-160.4	0	0	112.1	V326 A327 V332 L333 L334 L527	V326-M330 PolarHBondContact O-N 3.47Å; A327-M330 WeakPolarHBondContact O-CB 3.49Å; A327-M330 PolarHBondContact O-N 3.21Å; M330-V332 PolarHBondContact O-N 2.97Å; M330-L333 WeakPolarHBondContact O-CB 3.45Å; M330-L333 PolarHBondContact O-N 2.95Å; M330-L334 WeakPolarHBondContact O-CG 3.1Å; M330-L334 PolarHBondContact O-N 3.48Å; M330-L527 HydrophobicContact CE-CD1 4.21Å; M330-L527 HydrophobicContact CE-CD2 3.99Å; M330-L527 HydrophobicContact CG-CD1 3.82Å; M330-L527 HydrophobicContact CG-CD2 4.49Å; M330-L527 HydrophobicContact SD-CD1 3.91Å; M330-L527 HydrophobicContact SD-CD2 3.52Å; M330-L527 VanDerWaalsContact SD-CD2 3.52Å; M330-L527 HydrophobicContact SD-CG 4.37Å
331	T	95.9	Very high	91.7	Very high	11 Å²	11	35.9 Å²	35.9	7%	0.067	19%	0.19	C	C	.	.	H	α-helix	trans	-69.9	-31.7	179.4	56.4	0	0	0	0	113.2	A327 N328 F335 L353 T357	A327-T331 WeakPolarHBondContact O-CG2 3.08Å; A327-T331 PolarHBondContact O-N 3Å; A327-T331 PolarHBondContact O-OG1 2.97Å; N328-T331 WeakPolarHBondContact CA-OG1 3.5Å; N328-T331 PolarHBondContact O-N 3.08Å; N328-T331 PolarHBondContact O-OG1 3.44Å; T331-F335 WeakPolarHBondContact O-CB 3.32Å; T331-F335 PolarHBondContact O-N 3.13Å; T331-L353 HydrophobicContact CG2-CD1 4.46Å; T331-L353 HydrophobicContact CG2-CD2 3.71Å; T331-L353 HydrophobicContact CG2-CG 3.65Å; T331-T357 HydrophobicContact CG2-CG2 3.66Å; T331-T357 PolarHBondContact OG1-OG1 3.06Å
332	V	95.4	Very high	91.2	Very high	0 Å²	0	34 Å²	34	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-70.5	-37.3	171.4	-179.9	0	0	0	0	111.3	M263 N328 M330 F335 L336 L354	M263-V332 HydrophobicContact CE-CB 4.07Å; M263-V332 HydrophobicContact CE-CG1 4.23Å; M263-V332 HydrophobicContact SD-CB 3.63Å; M263-V332 HydrophobicContact SD-CG1 3.39Å; M263-V332 WeakPolarHBondContact SD-CG1 3.48Å; M263-V332 HydrophobicContact SD-CG2 3.81Å; N328-V332 WeakPolarHBondContact O-CG2 3.28Å; N328-V332 PolarHBondContact O-N 2.96Å; M330-V332 PolarHBondContact O-N 2.97Å; V332-F335 WeakPolarHBondContact O-CB 3.04Å; V332-F335 PolarHBondContact O-N 3.06Å; V332-L336 HydrophobicContact CG1-CD1 3.96Å; V332-L336 HydrophobicContact CG1-CG 4.28Å; V332-L336 WeakPolarHBondContact O-CD1 3.48Å; V332-L336 VanDerWaalsContact O-CG 3.26Å; V332-L336 WeakPolarHBondContact O-CG 3.29Å; V332-L336 PolarHBondContact O-N 2.9Å; V332-L354 HydrophobicContact CG2-CD1 3.42Å; V332-L354 VanDerWaalsContact CG2-CD1 3.42Å; V332-L354 HydrophobicContact CG2-CD2 4.19Å; V332-L354 HydrophobicContact CG2-CG 4.49Å
333	L	95.6	Very high	90.9	Very high	18 Å²	18	33.6 Å²	33.6	9%	0.094	18%	0.18	C	C	.	.	H	α-helix	trans	-58.3	-49.8	171.2	178.5	67.3	0	0	0	111.5	Y329 M330 F335 L336 L337 V520 M524 L527	Y329-L333 WeakPolarHBondContact O-CB 3.44Å; Y329-L333 PolarHBondContact O-N 3.49Å; M330-L333 WeakPolarHBondContact O-CB 3.45Å; M330-L333 PolarHBondContact O-N 2.95Å; L333-F335 VanDerWaalsContact C-N 3.31Å; L333-F335 PolarHBondContact O-N 3.2Å; L333-L336 PolarHBondContact O-N 3.49Å; L333-L337 HydrophobicContact CD1-CD1 4.45Å; L333-L337 HydrophobicContact CG-CD1 4.17Å; L333-L337 WeakPolarHBondContact O-CG 3.38Å; L333-L337 PolarHBondContact O-N 3.23Å; L333-V520 HydrophobicContact CD1-CG1 4.01Å; L333-M524 HydrophobicContact CD1-CG 3.89Å; L333-M524 HydrophobicContact CD1-SD 3.78Å; L333-M524 HydrophobicContact CD2-SD 3.43Å; L333-M524 WeakPolarHBondContact CD2-SD 3.28Å; L333-M524 HydrophobicContact CG-SD 4.26Å; L333-L527 HydrophobicContact CD2-CD2 3.92Å
334	L	94.6	Very high	90.4	Very high	92 Å²	92	31.6 Å²	31.6	48%	0.482	17%	0.165	S	C	.	.	H	α-helix	trans	-62	-37.3	177	-69.1	171.3	0	0	0	112.7	M330 L337 S338 L353	M330-L334 WeakPolarHBondContact O-CG 3.1Å; M330-L334 PolarHBondContact O-N 3.48Å; L334-L337 PolarHBondContact O-N 3.04Å; L334-S338 PolarHBondContact O-N 3.16Å; L334-L353 HydrophobicContact CD1-CD2 4.08Å
335	F	94.6	Very high	90.1	Very high	1 Å²	1	37.7 Å²	37.7	0%	0.004	19%	0.188	C	C	.	.	H	α-helix	trans	-62	-45.3	173.1	171.7	-84.3	0	0	0	111.8	L267 V270 M271 L301 T331 V332 L333 L337 S338 H339 Y351 L354	L267-F335 HydrophobicContact CD1-CE1 4.34Å; V270-F335 HydrophobicContact CG1-CE1 4.04Å; M271-F335 HydrophobicContact SD-CZ 4.27Å; L301-F335 HydrophobicContact CD1-CE2 4.18Å; T331-F335 WeakPolarHBondContact O-CB 3.32Å; T331-F335 PolarHBondContact O-N 3.13Å; V332-F335 WeakPolarHBondContact O-CB 3.04Å; V332-F335 PolarHBondContact O-N 3.06Å; L333-F335 VanDerWaalsContact C-N 3.31Å; L333-F335 PolarHBondContact O-N 3.2Å; F335-L337 VanDerWaalsContact C-N 3.35Å; F335-L337 PolarHBondContact O-N 3.29Å; F335-S338 PolarHBondContact O-N 2.7Å; F335-S338 PolarHBondContact O-OG 3.35Å; F335-H339 AromaticContact CD1-CE1 3.75Å; F335-H339 AromaticContact CD2-CE1 3.89Å; F335-H339 AromaticContact CE1-CE1 3.46Å; F335-H339 VanDerWaalsContact CE1-CE1 3.46Å; F335-H339 WeakPolarHBondContact CE1-CE1 3.36Å; F335-H339 AromaticContact CE1-NE2 3.99Å; F335-H339 AromaticContact CE2-CE1 3.63Å; F335-H339 AromaticContact CG-CE1 3.95Å; F335-H339 AromaticContact CZ-CE1 3.4Å; F335-H339 VanDerWaalsContact CZ-CE1 3.4Å; F335-H339 WeakPolarHBondContact CZ-CE1 3.41Å; F335-H339 AromaticContact CZ-NE2 3.82Å; F335-H339 PolarHBondContact O-N 2.92Å; F335-H339 PolarHBondContact O-ND1 2.74Å; F335-Y351 HydrophobicContact CD2-CD2 4.07Å; F335-Y351 HydrophobicContact CD2-CE2 4.12Å; F335-Y351 HydrophobicContact CD2-CG 4.43Å; F335-Y351 AromaticContact CE2-CD1 3.85Å; F335-Y351 HydrophobicContact CE2-CD1 3.85Å; F335-Y351 AromaticContact CE2-CD2 3.63Å; F335-Y351 HydrophobicContact CE2-CD2 3.63Å; F335-Y351 AromaticContact CE2-CE1 3.63Å; F335-Y351 HydrophobicContact CE2-CE1 3.63Å; F335-Y351 AromaticContact CE2-CE2 3.41Å; F335-Y351 HydrophobicContact CE2-CE2 3.41Å; F335-Y351 VanDerWaalsContact CE2-CE2 3.41Å; F335-Y351 AromaticContact CE2-CG 3.86Å; F335-Y351 HydrophobicContact CE2-CG 3.86Å; F335-Y351 AromaticContact CE2-CZ 3.39Å; F335-Y351 AromaticContact CZ-CE1 3.98Å; F335-Y351 HydrophobicContact CZ-CE1 3.98Å; F335-Y351 AromaticContact CZ-CE2 3.98Å; F335-Y351 HydrophobicContact CZ-CE2 3.98Å; F335-Y351 AromaticContact CZ-CZ 3.6Å; F335-L354 HydrophobicContact CB-CD2 4.24Å; F335-L354 HydrophobicContact CD1-CD2 4.22Å; F335-L354 HydrophobicContact CD2-CB 4.28Å; F335-L354 HydrophobicContact CD2-CD2 3.52Å; F335-L354 HydrophobicContact CE1-CD2 4.43Å; F335-L354 HydrophobicContact CE2-CD2 3.74Å; F335-L354 HydrophobicContact CG-CD2 3.77Å; F335-L354 HydrophobicContact CZ-CD2 4.2Å
336	L	92.6	Very high	89.9	Confident	1 Å²	1	39.7 Å²	39.7	1%	0.005	20%	0.2	C	C	.	.	H	α-helix	trans	-66.5	-39.3	177.4	-64.8	160.3	0	0	0	111.5	V266 V270 V332 L333 S338 H339 L516 V520	V266-L336 HydrophobicContact CG1-CD1 3.6Å; V266-L336 HydrophobicContact CG1-CD2 3.48Å; V266-L336 VanDerWaalsContact CG1-CD2 3.48Å; V266-L336 HydrophobicContact CG1-CG 4.13Å; V270-L336 HydrophobicContact CG2-CD2 4.46Å; V332-L336 HydrophobicContact CG1-CD1 3.96Å; V332-L336 HydrophobicContact CG1-CG 4.28Å; V332-L336 WeakPolarHBondContact O-CD1 3.48Å; V332-L336 VanDerWaalsContact O-CG 3.26Å; V332-L336 WeakPolarHBondContact O-CG 3.29Å; V332-L336 PolarHBondContact O-N 2.9Å; L333-L336 PolarHBondContact O-N 3.49Å; L336-S338 VanDerWaalsContact C-N 3.31Å; L336-S338 PolarHBondContact O-N 3.06Å; L336-H339 PolarHBondContact O-N 3.3Å; L336-L516 HydrophobicContact CB-CD1 4.13Å; L336-L516 HydrophobicContact CD2-CD1 3.75Å; L336-V520 HydrophobicContact CB-CG2 3.75Å
337	L	91.9	Very high	89.6	Confident	71 Å²	71	38.8 Å²	38.8	37%	0.372	20%	0.195	S	C	.	.	H	α-helix	trans	-63.2	-34.9	173.9	-67.4	171.4	0	0	0	112.1	L333 L334 F335 H339 L340 V520	L333-L337 HydrophobicContact CD1-CD1 4.45Å; L333-L337 HydrophobicContact CG-CD1 4.17Å; L333-L337 WeakPolarHBondContact O-CG 3.38Å; L333-L337 PolarHBondContact O-N 3.23Å; L334-L337 PolarHBondContact O-N 3.04Å; F335-L337 VanDerWaalsContact C-N 3.35Å; F335-L337 PolarHBondContact O-N 3.29Å; L337-H339 VanDerWaalsContact C-N 3.28Å; L337-H339 PolarHBondContact O-N 3.04Å; L337-L340 HydrophobicContact CD2-CD1 3.79Å; L337-L340 WeakPolarHBondContact O-CB 3.11Å; L337-L340 PolarHBondContact O-N 3.22Å; L337-V520 HydrophobicContact CD2-CG1 4.21Å; L337-V520 HydrophobicContact CD2-CG2 4.15Å
338	S	90	Very high	89.4	Confident	15 Å²	15	40.4 Å²	40.4	11%	0.105	20%	0.197	C	C	.	.	H	α-helix	trans	-71.4	-20.2	175.6	75	0	0	0	0	113.8	L334 F335 L336 L340 Y341 A350	L334-S338 PolarHBondContact O-N 3.16Å; F335-S338 PolarHBondContact O-N 2.7Å; F335-S338 PolarHBondContact O-OG 3.35Å; L336-S338 VanDerWaalsContact C-N 3.31Å; L336-S338 PolarHBondContact O-N 3.06Å; S338-L340 VanDerWaalsContact C-N 3.32Å; S338-Y341 CarbonylContact O-C 3.43Å; S338-Y341 VanDerWaalsContact O-C 3.25Å; S338-Y341 PolarHBondContact O-N 3.2Å; S338-A350 WeakPolarHBondContact OG-CB 3.45Å
339	H	84.9	Confident	89.3	Confident	6 Å²	6	43.8 Å²	43.8	3%	0.028	22%	0.219	C	C	.	.	H	α-helix	trans	-78.3	-14.9	172.3	-68.9	63.5	0	0	0	112.8	W280 F335 L336 L337 Y341 Y351 L516	W280-H339 HydrophobicContact CB-CB 4.48Å; F335-H339 AromaticContact CD1-CE1 3.75Å; F335-H339 AromaticContact CD2-CE1 3.89Å; F335-H339 AromaticContact CE1-CE1 3.46Å; F335-H339 VanDerWaalsContact CE1-CE1 3.46Å; F335-H339 WeakPolarHBondContact CE1-CE1 3.36Å; F335-H339 AromaticContact CE1-NE2 3.99Å; F335-H339 AromaticContact CE2-CE1 3.63Å; F335-H339 AromaticContact CG-CE1 3.95Å; F335-H339 AromaticContact CZ-CE1 3.4Å; F335-H339 VanDerWaalsContact CZ-CE1 3.4Å; F335-H339 WeakPolarHBondContact CZ-CE1 3.41Å; F335-H339 AromaticContact CZ-NE2 3.82Å; F335-H339 PolarHBondContact O-N 2.92Å; F335-H339 PolarHBondContact O-ND1 2.74Å; L336-H339 PolarHBondContact O-N 3.3Å; L337-H339 VanDerWaalsContact C-N 3.28Å; L337-H339 PolarHBondContact O-N 3.04Å; H339-Y341 PolarHBondContact O-N 3.13Å; H339-Y351 AromaticContact CE1-CE2 3.35Å; H339-Y351 WeakPolarHBondContact CE1-CE2 3.48Å; H339-Y351 AromaticContact CE1-CZ 3.76Å; H339-Y351 PolarHBondContact CE1-OH 2.98Å; H339-Y351 AromaticContact NE2-CE2 3.52Å; H339-Y351 AromaticContact NE2-CZ 3.57Å; H339-Y351 PolarHBondContact NE2-OH 3.42Å; H339-L516 HydrophobicContact CB-CD1 4.21Å; H339-L516 HydrophobicContact CB-CD2 3.52Å
340	L	84.2	Confident	89.3	Confident	49 Å²	49	44.2 Å²	44.2	26%	0.257	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-25.1	170.5	-64.8	168.5	0	0	0	111.6	L337 S338 L516 W517	L337-L340 HydrophobicContact CD2-CD1 3.79Å; L337-L340 WeakPolarHBondContact O-CB 3.11Å; L337-L340 PolarHBondContact O-N 3.22Å; S338-L340 VanDerWaalsContact C-N 3.32Å; L340-L516 HydrophobicContact CD2-CD2 3.77Å; L340-L516 HydrophobicContact CD2-CG 4.01Å; L340-L516 HydrophobicContact CG-CD2 4Å; L340-L516 HydrophobicContact CG-CG 4.41Å; L340-W517 HydrophobicContact CD1-CE3 4.37Å; L340-W517 HydrophobicContact CD1-CH2 3.68Å; L340-W517 HydrophobicContact CD1-CZ2 3.87Å; L340-W517 HydrophobicContact CD1-CZ3 3.95Å; L340-W517 HydrophobicContact CD2-CD2 4.1Å; L340-W517 HydrophobicContact CD2-CG 4.45Å; L340-W517 HydrophobicContact CD2-CZ2 4.08Å
341	Y	80.6	Confident	89.2	Confident	171 Å²	171	40.2 Å²	40.2	67%	0.671	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	-130.3	75.5	173.8	-170.2	-98.5	0	0	0	109.6	S338 H339 S343 T346	S338-Y341 CarbonylContact O-C 3.43Å; S338-Y341 VanDerWaalsContact O-C 3.25Å; S338-Y341 PolarHBondContact O-N 3.2Å; H339-Y341 PolarHBondContact O-N 3.13Å; Y341-S343 PolarHBondContact O-N 2.91Å; Y341-T346 HydrophobicContact CD1-CG2 4.04Å; Y341-T346 PolarHBondContact O-OG1 3.17Å
342	A	75.4	Confident	89.2	Confident	18 Å²	18	42.6 Å²	42.6	15%	0.149	22%	0.215	C	C	.	.			trans	-77.3	43.5	-164.3	0	0	0	0	0	116.2	H281 H282 L347	H281-A342 PolarHBondContact ND1-O 3.05Å; H282-A342 PolarHBondContact N-O 2.94Å; A342-L347 HydrophobicContact CB-CD1 4.14Å; A342-L347 WeakPolarHBondContact O-CD1 3.32Å
343	S	81.1	Confident	89.3	Confident	13 Å²	13	45.6 Å²	45.6	9%	0.091	23%	0.231	C	C	.	.			trans	-77.5	155.5	169.1	173	0	0	0	0	111.2	E284 Y341 Y345 T346 L347	E284-S343 WeakPolarHBondContact OE1-CB 3.32Å; E284-S343 PolarHBondContact OE1-OG 2.93Å; Y341-S343 PolarHBondContact O-N 2.91Å; S343-Y345 PolarHBondContact O-N 3.1Å; S343-Y345 WeakPolarHBondContact OG-CD2 3.48Å; S343-T346 PolarHBondContact O-N 2.55Å; S343-T346 PolarHBondContact O-OG1 3.18Å; S343-L347 WeakPolarHBondContact O-CB 3.32Å; S343-L347 VanDerWaalsContact O-CG 3.27Å; S343-L347 WeakPolarHBondContact O-CG 3.33Å; S343-L347 PolarHBondContact O-N 3.06Å
344	I	80.8	Confident	89.3	Confident	23 Å²	23	44.8 Å²	44.8	12%	0.118	23%	0.227	C	C	.	.	H	α-helix	trans	-59.6	-32.3	179.5	-167.8	59.9	0	0	0	112.7	E284 W286 L287 V293 L297 T346 L348	E284-I344 HydrophobicContact CG-CG2 3.9Å; W286-I344 HydrophobicContact CZ2-CG2 4.17Å; L287-I344 HydrophobicContact CD2-CG1 4.47Å; V293-I344 HydrophobicContact CG1-CD1 4.28Å; L297-I344 HydrophobicContact CD2-CD1 4.26Å; I344-T346 PolarHBondContact O-N 3.38Å; I344-L348 HydrophobicContact CD1-CB 4.49Å; I344-L348 VanDerWaalsContact O-CB 3.31Å; I344-L348 WeakPolarHBondContact O-CB 3.48Å; I344-L348 PolarHBondContact O-N 3.35Å
345	Y	84.8	Confident	89.4	Confident	152 Å²	152	40.4 Å²	40.4	60%	0.596	20%	0.204	S	C	*	.	H	α-helix	trans	-70.7	-26.7	-177.9	-59.7	-72.7	0	0	0	114.1	W286 S343 P349	W286-Y345 HydrophobicContact CZ2-CE1 4.5Å; W286-Y345 HydrophobicContact CZ2-CE2 4.42Å; W286-Y345 AromaticContact CZ2-CZ 3.85Å; W286-Y345 VanDerWaalsContact CZ2-OH 3.27Å; W286-Y345 WeakPolarHBondContact CZ2-OH 3.45Å; S343-Y345 PolarHBondContact O-N 3.1Å; S343-Y345 WeakPolarHBondContact OG-CD2 3.48Å; Y345-P349 WeakPolarHBondContact O-CD 3.24Å; Y345-P349 VanDerWaalsContact O-CG 3.27Å; Y345-P349 WeakPolarHBondContact O-CG 3.41Å
346	T	89.2	Confident	89.5	Confident	49 Å²	49	44.5 Å²	44.5	30%	0.301	22%	0.224	S	C	.	.	H	α-helix	trans	-93.6	-37.6	176	49.4	0	0	0	0	111.6	Y341 S343 I344 A350	Y341-T346 HydrophobicContact CD1-CG2 4.04Å; Y341-T346 PolarHBondContact O-OG1 3.17Å; S343-T346 PolarHBondContact O-N 2.55Å; S343-T346 PolarHBondContact O-OG1 3.18Å; I344-T346 PolarHBondContact O-N 3.38Å; T346-A350 WeakPolarHBondContact O-CB 3.39Å
347	L	87.5	Confident	89.6	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-67.2	-53.8	178.9	-66.4	172.1	0	0	0	111.5	L297 A342 S343 A350 Y351	L297-L347 HydrophobicContact CD1-CB 4.06Å; L297-L347 HydrophobicContact CD1-CD1 4.16Å; A342-L347 HydrophobicContact CB-CD1 4.14Å; A342-L347 WeakPolarHBondContact O-CD1 3.32Å; S343-L347 WeakPolarHBondContact O-CB 3.32Å; S343-L347 VanDerWaalsContact O-CG 3.27Å; S343-L347 WeakPolarHBondContact O-CG 3.33Å; S343-L347 PolarHBondContact O-N 3.06Å; L347-A350 WeakPolarHBondContact O-CA 3.41Å; L347-A350 WeakPolarHBondContact O-CB 3.24Å; L347-A350 PolarHBondContact O-N 2.66Å; L347-Y351 HydrophobicContact CB-CD2 4.4Å; L347-Y351 HydrophobicContact CB-CE2 4.42Å; L347-Y351 HydrophobicContact CD2-CE2 4.15Å; L347-Y351 VanDerWaalsContact O-CD2 3.3Å; L347-Y351 WeakPolarHBondContact O-CD2 3.34Å; L347-Y351 PolarHBondContact O-N 3.44Å
348	L	90.8	Very high	89.8	Confident	73 Å²	73	43.5 Å²	43.5	38%	0.382	22%	0.22	S	C	.	.	H	α-helix	trans	-56.3	-48.6	-172.4	177.7	64.2	0	0	0	113.1	L297 I344 A350 Y351 L352	L297-L348 HydrophobicContact CD2-CB 4.2Å; L297-L348 HydrophobicContact CD2-CD1 4.03Å; I344-L348 HydrophobicContact CD1-CB 4.49Å; I344-L348 VanDerWaalsContact O-CB 3.31Å; I344-L348 WeakPolarHBondContact O-CB 3.48Å; I344-L348 PolarHBondContact O-N 3.35Å; L348-A350 VanDerWaalsContact C-N 3.32Å; L348-A350 PolarHBondContact O-N 3.45Å; L348-Y351 PolarHBondContact O-N 3.04Å; L348-L352 HydrophobicContact CD1-CD1 4.07Å; L348-L352 HydrophobicContact CD1-CG 4.24Å; L348-L352 HydrophobicContact CG-CD1 4.1Å; L348-L352 VanDerWaalsContact O-CG 3.26Å; L348-L352 WeakPolarHBondContact O-CG 3.47Å; L348-L352 PolarHBondContact O-N 3.32Å; L348-L352 VanDerWaalsContact O-N 3.15Å
349	P	94.5	Very high	89.9	Confident	73 Å²	73	42.8 Å²	42.8	47%	0.474	22%	0.215	S	C	.	.	H	α-helix	trans	-60.7	-37.8	174.5	-24.2	35.9	0	0	0	113.2	Y345 L352 L353	Y345-P349 WeakPolarHBondContact O-CD 3.24Å; Y345-P349 VanDerWaalsContact O-CG 3.27Å; Y345-P349 WeakPolarHBondContact O-CG 3.41Å; P349-L352 PolarHBondContact O-N 3.49Å; P349-L353 WeakPolarHBondContact O-CB 3.38Å; P349-L353 PolarHBondContact O-N 2.78Å
350	A	94.3	Very high	90.2	Very high	9 Å²	9	42.8 Å²	42.8	7%	0.074	22%	0.216	C	C	.	.	H	α-helix	trans	-68.5	-38.9	-179.4	0	0	0	0	0	113	S338 T346 L347 L348 L353 L354	S338-A350 WeakPolarHBondContact OG-CB 3.45Å; T346-A350 WeakPolarHBondContact O-CB 3.39Å; L347-A350 WeakPolarHBondContact O-CA 3.41Å; L347-A350 WeakPolarHBondContact O-CB 3.24Å; L347-A350 PolarHBondContact O-N 2.66Å; L348-A350 VanDerWaalsContact C-N 3.32Å; L348-A350 PolarHBondContact O-N 3.45Å; A350-L353 PolarHBondContact O-N 3.02Å; A350-L354 WeakPolarHBondContact O-CB 3.48Å; A350-L354 PolarHBondContact O-N 3.25Å
351	Y	95.3	Very high	90.6	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-66.2	-42.1	174.7	-85.2	-106	0	0	0	111.6	Q274 L297 L298 L301 F335 H339 L347 L348 L354 G355	Q274-Y351 WeakPolarHBondContact CG-OH 3.48Å; L297-Y351 VanDerWaalsContact C-CD1 3.44Å; L297-Y351 HydrophobicContact CB-CD1 3.68Å; L297-Y351 HydrophobicContact CB-CD2 4.3Å; L297-Y351 HydrophobicContact CB-CE1 3.76Å; L297-Y351 HydrophobicContact CB-CE2 4.37Å; L297-Y351 HydrophobicContact CB-CG 3.97Å; L297-Y351 HydrophobicContact CD1-CE2 4.29Å; L297-Y351 HydrophobicContact CD2-CD2 4.43Å; L297-Y351 HydrophobicContact CD2-CG 4.39Å; L297-Y351 VanDerWaalsContact O-CD1 3.26Å; L297-Y351 WeakPolarHBondContact O-CD1 3.39Å; L298-Y351 HydrophobicContact CD2-CE1 3.89Å; L298-Y351 HydrophobicContact CG-CE1 4.07Å; L301-Y351 HydrophobicContact CB-CD1 3.97Å; L301-Y351 HydrophobicContact CD1-CD1 3.69Å; L301-Y351 HydrophobicContact CD1-CE1 4.29Å; L301-Y351 HydrophobicContact CD1-CG 4.35Å; L301-Y351 WeakPolarHBondContact CG-O 3.4Å; F335-Y351 HydrophobicContact CD2-CD2 4.07Å; F335-Y351 HydrophobicContact CD2-CE2 4.12Å; F335-Y351 HydrophobicContact CD2-CG 4.43Å; F335-Y351 AromaticContact CE2-CD1 3.85Å; F335-Y351 HydrophobicContact CE2-CD1 3.85Å; F335-Y351 AromaticContact CE2-CD2 3.63Å; F335-Y351 HydrophobicContact CE2-CD2 3.63Å; F335-Y351 AromaticContact CE2-CE1 3.63Å; F335-Y351 HydrophobicContact CE2-CE1 3.63Å; F335-Y351 AromaticContact CE2-CE2 3.41Å; F335-Y351 HydrophobicContact CE2-CE2 3.41Å; F335-Y351 VanDerWaalsContact CE2-CE2 3.41Å; F335-Y351 AromaticContact CE2-CG 3.86Å; F335-Y351 HydrophobicContact CE2-CG 3.86Å; F335-Y351 AromaticContact CE2-CZ 3.39Å; F335-Y351 AromaticContact CZ-CE1 3.98Å; F335-Y351 HydrophobicContact CZ-CE1 3.98Å; F335-Y351 AromaticContact CZ-CE2 3.98Å; F335-Y351 HydrophobicContact CZ-CE2 3.98Å; F335-Y351 AromaticContact CZ-CZ 3.6Å; H339-Y351 AromaticContact CE1-CE2 3.35Å; H339-Y351 WeakPolarHBondContact CE1-CE2 3.48Å; H339-Y351 AromaticContact CE1-CZ 3.76Å; H339-Y351 PolarHBondContact CE1-OH 2.98Å; H339-Y351 AromaticContact NE2-CE2 3.52Å; H339-Y351 AromaticContact NE2-CZ 3.57Å; H339-Y351 PolarHBondContact NE2-OH 3.42Å; L347-Y351 HydrophobicContact CB-CD2 4.4Å; L347-Y351 HydrophobicContact CB-CE2 4.42Å; L347-Y351 HydrophobicContact CD2-CE2 4.15Å; L347-Y351 VanDerWaalsContact O-CD2 3.3Å; L347-Y351 WeakPolarHBondContact O-CD2 3.34Å; L347-Y351 PolarHBondContact O-N 3.44Å; L348-Y351 PolarHBondContact O-N 3.04Å; Y351-L354 PolarHBondContact O-N 3.47Å; Y351-G355 PolarHBondContact O-N 3.31Å
352	L	96.2	Very high	91.1	Very high	61 Å²	61	33.6 Å²	33.6	32%	0.319	18%	0.183	S	C	.	.	H	α-helix	trans	-64.5	-43.7	174.6	-63.4	169.7	0	0	0	111.6	A300 V304 L348 P349 G355 M356	A300-L352 HydrophobicContact CB-CD2 4.4Å; V304-L352 HydrophobicContact CG2-CD2 3.69Å; L348-L352 HydrophobicContact CD1-CD1 4.07Å; L348-L352 HydrophobicContact CD1-CG 4.24Å; L348-L352 HydrophobicContact CG-CD1 4.1Å; L348-L352 VanDerWaalsContact O-CG 3.26Å; L348-L352 WeakPolarHBondContact O-CG 3.47Å; L348-L352 PolarHBondContact O-N 3.32Å; L348-L352 VanDerWaalsContact O-N 3.15Å; P349-L352 PolarHBondContact O-N 3.49Å; L352-G355 PolarHBondContact O-N 3.15Å; L352-M356 WeakPolarHBondContact O-CG 3.35Å; L352-M356 PolarHBondContact O-N 2.97Å
353	L	96.4	Very high	91.7	Very high	63 Å²	63	32.8 Å²	32.8	33%	0.33	18%	0.176	S	C	.	.	H	α-helix	trans	-60.8	-43.8	177.2	-172.5	82.5	0	0	0	112	T331 L334 P349 A350 M356 T357	T331-L353 HydrophobicContact CG2-CD1 4.46Å; T331-L353 HydrophobicContact CG2-CD2 3.71Å; T331-L353 HydrophobicContact CG2-CG 3.65Å; L334-L353 HydrophobicContact CD1-CD2 4.08Å; P349-L353 WeakPolarHBondContact O-CB 3.38Å; P349-L353 PolarHBondContact O-N 2.78Å; A350-L353 PolarHBondContact O-N 3.02Å; L353-M356 HydrophobicContact CD1-CE 4.26Å; L353-M356 PolarHBondContact O-N 2.89Å; L353-T357 PolarHBondContact O-N 3.11Å; L353-T357 PolarHBondContact O-OG1 3.29Å
354	L	96.3	Very high	92.2	Very high	1 Å²	1	32.1 Å²	32.1	1%	0.005	17%	0.172	C	C	.	.	H	α-helix	trans	-66.9	-41.8	175	179.8	52.4	0	0	0	111.4	L267 L301 V332 F335 A350 Y351 M356 T357 L358	L267-L354 HydrophobicContact CD1-CD2 4.28Å; L301-L354 HydrophobicContact CD1-CB 4.21Å; L301-L354 HydrophobicContact CD1-CD2 3.83Å; L301-L354 HydrophobicContact CD1-CG 3.99Å; V332-L354 HydrophobicContact CG2-CD1 3.42Å; V332-L354 VanDerWaalsContact CG2-CD1 3.42Å; V332-L354 HydrophobicContact CG2-CD2 4.19Å; V332-L354 HydrophobicContact CG2-CG 4.49Å; F335-L354 HydrophobicContact CB-CD2 4.24Å; F335-L354 HydrophobicContact CD1-CD2 4.22Å; F335-L354 HydrophobicContact CD2-CB 4.28Å; F335-L354 HydrophobicContact CD2-CD2 3.52Å; F335-L354 HydrophobicContact CE1-CD2 4.43Å; F335-L354 HydrophobicContact CE2-CD2 3.74Å; F335-L354 HydrophobicContact CG-CD2 3.77Å; F335-L354 HydrophobicContact CZ-CD2 4.2Å; A350-L354 WeakPolarHBondContact O-CB 3.48Å; A350-L354 PolarHBondContact O-N 3.25Å; Y351-L354 PolarHBondContact O-N 3.47Å; L354-M356 VanDerWaalsContact C-N 3.3Å; L354-M356 PolarHBondContact O-N 3.32Å; L354-T357 PolarHBondContact O-N 3.11Å; L354-T357 PolarHBondContact O-OG1 3.45Å; L354-L358 VanDerWaalsContact O-CB 3.27Å; L354-L358 WeakPolarHBondContact O-CB 3.26Å; L354-L358 PolarHBondContact O-N 2.95Å
355	G	96.6	Very high	92.6	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-55.6	-43.4	173.8	0	0	0	0	0	112.6	L301 A305 Y351 L352 T357	L301-G355 VanDerWaalsContact O-CA 3.31Å; L301-G355 WeakPolarHBondContact O-CA 3.45Å; A305-G355 VanDerWaalsContact CA-O 3.26Å; A305-G355 WeakPolarHBondContact CA-O 3.44Å; A305-G355 WeakPolarHBondContact CB-O 3.31Å; Y351-G355 PolarHBondContact O-N 3.31Å; L352-G355 PolarHBondContact O-N 3.15Å; G355-T357 VanDerWaalsContact C-N 3.33Å; G355-T357 PolarHBondContact O-N 3.32Å
356	M	95.5	Very high	92.8	Very high	86 Å²	86	24.9 Å²	24.9	42%	0.424	14%	0.144	S	C	.	.	H	α-helix	trans	-63.2	-33	179.2	-73.8	-169.6	-71.8	0	0	114.3	V304 M308 L352 L353 L354	V304-M356 HydrophobicContact CG1-CB 4.46Å; V304-M356 HydrophobicContact CG1-CG 3.63Å; M308-M356 HydrophobicContact CE-CB 4.28Å; M308-M356 HydrophobicContact CE-CG 4.4Å; M308-M356 HydrophobicContact CG-CG 4.23Å; L352-M356 WeakPolarHBondContact O-CG 3.35Å; L352-M356 PolarHBondContact O-N 2.97Å; L353-M356 HydrophobicContact CD1-CE 4.26Å; L353-M356 PolarHBondContact O-N 2.89Å; L354-M356 VanDerWaalsContact C-N 3.3Å; L354-M356 PolarHBondContact O-N 3.32Å
357	T	95.8	Very high	92.7	Very high	29 Å²	29	23 Å²	23	18%	0.178	13%	0.133	C	C	.	.	H	α-helix	trans	-93.9	-28	-177.7	54.1	0	0	0	0	113.6	N328 T331 L353 L354 G355 S359 G360 S361	N328-T357 PolarHBondContact OD1-O 3.48Å; T331-T357 HydrophobicContact CG2-CG2 3.66Å; T331-T357 PolarHBondContact OG1-OG1 3.06Å; L353-T357 PolarHBondContact O-N 3.11Å; L353-T357 PolarHBondContact O-OG1 3.29Å; L354-T357 PolarHBondContact O-N 3.11Å; L354-T357 PolarHBondContact O-OG1 3.45Å; G355-T357 VanDerWaalsContact C-N 3.33Å; G355-T357 PolarHBondContact O-N 3.32Å; T357-S359 PolarHBondContact O-N 2.95Å; T357-G360 PolarHBondContact O-N 2.75Å; T357-G360 VanDerWaalsContact O-N 3.14Å; T357-S361 PolarHBondContact O-N 3.18Å; T357-S361 VanDerWaalsContact O-N 3.08Å
358	L	95.2	Very high	92.8	Very high	23 Å²	23	23.2 Å²	23.2	12%	0.12	13%	0.134	C	C	.	.	H	α-helix	trans	-51.6	-50	-175.5	-173.7	61.3	0	0	0	113.3	L301 F302 A305 N328 L354 G360 S361 A362 F693	L301-L358 HydrophobicContact CD2-CD2 3.96Å; F302-L358 HydrophobicContact CD1-CD2 4.28Å; F302-L358 HydrophobicContact CE1-CD2 3.95Å; A305-L358 HydrophobicContact CB-CB 4.36Å; A305-L358 HydrophobicContact CB-CD2 4.29Å; N328-L358 WeakPolarHBondContact OD1-CA 3.43Å; N328-L358 PolarHBondContact OD1-N 2.94Å; L354-L358 VanDerWaalsContact O-CB 3.27Å; L354-L358 WeakPolarHBondContact O-CB 3.26Å; L354-L358 PolarHBondContact O-N 2.95Å; L358-G360 PolarHBondContact O-N 2.92Å; L358-S361 PolarHBondContact O-N 3.07Å; L358-A362 WeakPolarHBondContact O-CB 3.34Å; L358-A362 PolarHBondContact O-N 3.39Å; L358-F693 HydrophobicContact CD2-CE1 3.73Å; L358-F693 HydrophobicContact CD2-CZ 3.8Å; L358-F693 HydrophobicContact CG-CE1 4.16Å; L358-F693 HydrophobicContact CG-CE2 4.47Å; L358-F693 HydrophobicContact CG-CZ 3.72Å
359	S	93	Very high	92.7	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-68.8	-34.1	-177.3	-165.3	0	0	0	0	113.5	A305 S309 T357 G363 L689	A305-S359 WeakPolarHBondContact O-CB 3.32Å; S309-S359 VanDerWaalsContact CA-OG 3.29Å; S309-S359 WeakPolarHBondContact CA-OG 3.43Å; T357-S359 PolarHBondContact O-N 2.95Å; S359-G363 PolarHBondContact O-N 3.02Å; S359-G363 VanDerWaalsContact O-N 3.1Å; S359-L689 WeakPolarHBondContact OG-CD2 3.49Å
360	G	90.8	Very high	92.3	Very high	5 Å²	5	17 Å²	17	5%	0.052	10%	0.097	C	C	.	.	H	α-helix	trans	-68.4	-38.4	176.3	0	0	0	0	0	112.4	T357 L358 S364	T357-G360 PolarHBondContact O-N 2.75Å; T357-G360 VanDerWaalsContact O-N 3.14Å; L358-G360 PolarHBondContact O-N 2.92Å; G360-S364 WeakPolarHBondContact O-CB 3.35Å; G360-S364 PolarHBondContact O-N 3.36Å; G360-S364 PolarHBondContact O-OG 2.92Å
361	S	92.8	Very high	91.9	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-65.9	-48.4	175.2	-166.9	0	0	0	0	112.1	N328 T357 L358 S364 K365	N328-S361 VanDerWaalsContact CB-CB 3.48Å; N328-S361 VanDerWaalsContact CG-CB 3.42Å; N328-S361 WeakPolarHBondContact OD1-CB 3.49Å; T357-S361 PolarHBondContact O-N 3.18Å; T357-S361 VanDerWaalsContact O-N 3.08Å; L358-S361 PolarHBondContact O-N 3.07Å; S361-S364 PolarHBondContact O-N 3.16Å; S361-K365 WeakPolarHBondContact O-CD 3.2Å; S361-K365 WeakPolarHBondContact O-CG 3.15Å; S361-K365 PolarHBondContact O-N 3.39Å; S361-K365 WeakPolarHBondContact OG-CE 3.3Å; S361-K365 PolarHBondContact OG-NZ 2.93Å
362	A	90.9	Very high	91.5	Very high	27 Å²	27	19.2 Å²	19.2	22%	0.223	11%	0.106	C	C	.	.	H	α-helix	trans	-63	-44.5	-179.3	0	0	0	0	0	112.6	L358 S364 K365 A366 L689	L358-A362 WeakPolarHBondContact O-CB 3.34Å; L358-A362 PolarHBondContact O-N 3.39Å; A362-S364 PolarHBondContact O-N 2.98Å; A362-K365 PolarHBondContact O-N 3.37Å; A362-A366 PolarHBondContact O-N 2.75Å; A362-L689 HydrophobicContact CB-CD1 4.44Å; A362-L689 HydrophobicContact CB-CD2 3.58Å
363	G	88.2	Confident	90.9	Very high	1 Å²	1	16.3 Å²	16.3	1%	0.01	9%	0.091	C	C	.	.	H	α-helix	trans	-61	-42.7	172.2	0	0	0	0	0	112.8	S359 K365 A366 A367	S359-G363 PolarHBondContact O-N 3.02Å; S359-G363 VanDerWaalsContact O-N 3.1Å; G363-K365 PolarHBondContact O-N 3.14Å; G363-A366 PolarHBondContact O-N 3.25Å; G363-A367 PolarHBondContact O-N 2.67Å
364	S	90.8	Very high	90.2	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-64	-38.6	178.7	-65.5	0	0	0	0	113	G360 S361 A362 A367 L368	G360-S364 WeakPolarHBondContact O-CB 3.35Å; G360-S364 PolarHBondContact O-N 3.36Å; G360-S364 PolarHBondContact O-OG 2.92Å; S361-S364 PolarHBondContact O-N 3.16Å; A362-S364 PolarHBondContact O-N 2.98Å; S364-A367 PolarHBondContact O-N 2.95Å; S364-L368 WeakPolarHBondContact O-CB 3.45Å; S364-L368 WeakPolarHBondContact O-CG 3.11Å; S364-L368 PolarHBondContact O-N 3.3Å
365	K	89.9	Confident	89.4	Confident	16 Å²	16	19.7 Å²	19.7	7%	0.07	11%	0.111	C	C	.	.	H	α-helix	trans	-61.5	-49.9	175.1	-75.8	154.5	174	159.2	0	111.5	I325 Y329 S361 A362 G363 A367 L368 I369 F413	I325-K365 HydrophobicContact CD1-CG 4.03Å; I325-K365 HydrophobicContact CG1-CG 4.4Å; Y329-K365 WeakPolarHBondContact OH-CE 3.15Å; Y329-K365 PolarHBondContact OH-NZ 3.39Å; S361-K365 WeakPolarHBondContact O-CD 3.2Å; S361-K365 WeakPolarHBondContact O-CG 3.15Å; S361-K365 PolarHBondContact O-N 3.39Å; S361-K365 WeakPolarHBondContact OG-CE 3.3Å; S361-K365 PolarHBondContact OG-NZ 2.93Å; A362-K365 PolarHBondContact O-N 3.37Å; G363-K365 PolarHBondContact O-N 3.14Å; K365-A367 PolarHBondContact O-N 3.4Å; K365-L368 PolarHBondContact O-N 3.02Å; K365-I369 WeakPolarHBondContact O-CG1 3.31Å; K365-I369 PolarHBondContact O-N 2.88Å; K365-I369 VanDerWaalsContact O-N 3.1Å; K365-F413 HydrophobicContact CB-CE1 4.39Å; K365-F413 HydrophobicContact CB-CZ 3.78Å; K365-F413 HydrophobicContact CD-CZ 4.02Å; K365-F413 HydrophobicContact CG-CE2 4.45Å; K365-F413 HydrophobicContact CG-CZ 3.88Å
366	A	87.8	Confident	88.7	Confident	7 Å²	7	20.6 Å²	20.6	6%	0.058	12%	0.115	C	C	.	.	H	α-helix	trans	-59.3	-44.5	177.3	0	0	0	0	0	112.2	A362 G363 I369 V370 V681 Q685	A362-A366 PolarHBondContact O-N 2.75Å; G363-A366 PolarHBondContact O-N 3.25Å; A366-I369 PolarHBondContact O-N 3.21Å; A366-V370 PolarHBondContact O-N 3.45Å; A366-V681 HydrophobicContact CB-CG1 4.4Å; A366-Q685 HydrophobicContact CB-CG 4.13Å
367	A	88.1	Confident	87.6	Confident	8 Å²	8	16.6 Å²	16.6	7%	0.066	10%	0.096	C	C	.	.	H	α-helix	trans	-62.3	-42.3	176.6	0	0	0	0	0	112.8	Y321 G363 S364 K365 V370 H371 T682	Y321-A367 HydrophobicContact CD1-CB 3.97Å; Y321-A367 HydrophobicContact CE1-CB 3.61Å; Y321-A367 HydrophobicContact CE2-CB 4.45Å; G363-A367 PolarHBondContact O-N 2.67Å; S364-A367 PolarHBondContact O-N 2.95Å; K365-A367 PolarHBondContact O-N 3.4Å; A367-V370 PolarHBondContact O-N 3.49Å; A367-H371 WeakPolarHBondContact O-CB 3.35Å; A367-H371 PolarHBondContact O-N 3.5Å; A367-T682 HydrophobicContact CB-CG2 3.72Å
368	L	88.8	Confident	85.9	Confident	6 Å²	6	18 Å²	18	3%	0.031	11%	0.107	C	C	.	.	H	α-helix	trans	-64.3	-38.8	177.9	-77.8	173	0	0	0	112.8	L256 Y321 I325 S364 K365 V370 H371 F372	L256-L368 HydrophobicContact CD2-CB 4.08Å; L256-L368 HydrophobicContact CD2-CD1 4.04Å; Y321-L368 HydrophobicContact CD2-CD2 4.22Å; Y321-L368 HydrophobicContact CG-CD2 4.5Å; Y321-L368 HydrophobicContact CG-CG 4.37Å; I325-L368 HydrophobicContact CD1-CD1 3.51Å; S364-L368 WeakPolarHBondContact O-CB 3.45Å; S364-L368 WeakPolarHBondContact O-CG 3.11Å; S364-L368 PolarHBondContact O-N 3.3Å; K365-L368 PolarHBondContact O-N 3.02Å; L368-V370 PolarHBondContact O-N 2.86Å; L368-H371 PolarHBondContact O-N 2.91Å; L368-F372 HydrophobicContact CB-CD2 4.3Å; L368-F372 HydrophobicContact CB-CE2 4.06Å; L368-F372 HydrophobicContact CD2-CE2 4.38Å; L368-F372 HydrophobicContact CD2-CZ 4.39Å; L368-F372 WeakPolarHBondContact O-CB 3.47Å; L368-F372 WeakPolarHBondContact O-CD2 3.38Å; L368-F372 VanDerWaalsContact O-CG 3.3Å; L368-F372 WeakPolarHBondContact O-CG 3.09Å; L368-F372 PolarHBondContact O-N 2.96Å
369	I	88.8	Confident	83.5	Confident	1 Å²	1	22.1 Å²	22.1	1%	0.005	14%	0.137	C	C	.	.	H	α-helix	trans	-59.1	-46.4	176.4	-67.4	162.7	0	0	0	110.7	F253 K365 A366 G373 L409 A410 F413	F253-I369 HydrophobicContact CE2-CG1 4.49Å; K365-I369 WeakPolarHBondContact O-CG1 3.31Å; K365-I369 PolarHBondContact O-N 2.88Å; K365-I369 VanDerWaalsContact O-N 3.1Å; A366-I369 PolarHBondContact O-N 3.21Å; I369-G373 PolarHBondContact O-N 3.31Å; I369-L409 HydrophobicContact CG2-CB 3.98Å; I369-A410 HydrophobicContact CG2-CB 4.18Å; I369-F413 HydrophobicContact CD1-CB 3.91Å; I369-F413 HydrophobicContact CD1-CD1 3.58Å; I369-F413 HydrophobicContact CD1-CD2 4.04Å; I369-F413 HydrophobicContact CD1-CE1 4.05Å; I369-F413 HydrophobicContact CD1-CE2 4.47Å; I369-F413 HydrophobicContact CD1-CG 3.56Å; I369-F413 HydrophobicContact CD1-CZ 4.46Å; I369-F413 HydrophobicContact CG1-CD2 4.46Å; I369-F413 HydrophobicContact CG1-CG 4.34Å
370	V	86.8	Confident	81	Confident	13 Å²	13	26.5 Å²	26.5	8%	0.079	17%	0.167	C	C	.	.	H	α-helix	trans	-69	-42.3	178.8	-178.7	0	0	0	0	111.3	A366 A367 L368 F372 G373 G374 V406 T674 V681	A366-V370 PolarHBondContact O-N 3.45Å; A367-V370 PolarHBondContact O-N 3.49Å; L368-V370 PolarHBondContact O-N 2.86Å; V370-F372 PolarHBondContact O-N 2.78Å; V370-G373 PolarHBondContact O-N 3.01Å; V370-G374 PolarHBondContact O-N 3.23Å; V370-V406 HydrophobicContact CG2-CG1 4.11Å; V370-T674 HydrophobicContact CG2-CG2 3.93Å; V370-V681 HydrophobicContact CB-CG2 4.06Å; V370-V681 HydrophobicContact CG1-CG2 3.98Å; V370-V681 HydrophobicContact CG2-CG1 4.25Å; V370-V681 HydrophobicContact CG2-CG2 3.88Å
371	H	85.1	Confident	78.2	Confident	55 Å²	55	33.8 Å²	33.8	26%	0.255	21%	0.205	S	C	.	.	H	α-helix	trans	-59.5	-45.6	174.8	162.5	-83.1	0	0	0	112.8	A367 L368 G373 G374 K375	A367-H371 WeakPolarHBondContact O-CB 3.35Å; A367-H371 PolarHBondContact O-N 3.5Å; L368-H371 PolarHBondContact O-N 2.91Å; H371-G373 VanDerWaalsContact C-N 3.34Å; H371-G374 PolarHBondContact O-N 3.47Å; H371-K375 WeakPolarHBondContact NE2-CE 3.25Å; H371-K375 PolarHBondContact O-N 3.38Å
372	F	86.8	Confident	75.5	Confident	1 Å²	1	39.5 Å²	39.5	0%	0.004	25%	0.245	C	C	.	.	H	α-helix	trans	-66.2	-37.9	175.8	-69	-47.6	0	0	0	111.5	V249 Q252 F253 L256 L368 V370 G374 K375 L376 L409	V249-F372 HydrophobicContact CG1-CB 4.01Å; V249-F372 HydrophobicContact CG1-CD1 3.76Å; V249-F372 HydrophobicContact CG1-CG 4.18Å; Q252-F372 HydrophobicContact CB-CE1 4.12Å; Q252-F372 HydrophobicContact CB-CZ 3.9Å; F253-F372 HydrophobicContact CB-CD2 4.37Å; F253-F372 HydrophobicContact CD2-CD2 4.14Å; L256-F372 HydrophobicContact CD2-CE2 4.01Å; L368-F372 HydrophobicContact CB-CD2 4.3Å; L368-F372 HydrophobicContact CB-CE2 4.06Å; L368-F372 HydrophobicContact CD2-CE2 4.38Å; L368-F372 HydrophobicContact CD2-CZ 4.39Å; L368-F372 WeakPolarHBondContact O-CB 3.47Å; L368-F372 WeakPolarHBondContact O-CD2 3.38Å; L368-F372 VanDerWaalsContact O-CG 3.3Å; L368-F372 WeakPolarHBondContact O-CG 3.09Å; L368-F372 PolarHBondContact O-N 2.96Å; V370-F372 PolarHBondContact O-N 2.78Å; F372-G374 VanDerWaalsContact C-N 3.35Å; F372-G374 PolarHBondContact O-N 3.38Å; F372-K375 PolarHBondContact O-N 3.02Å; F372-L376 WeakPolarHBondContact O-CG 3.41Å; F372-L376 PolarHBondContact O-N 3.37Å; F372-L376 VanDerWaalsContact O-N 3.08Å; F372-L409 HydrophobicContact CB-CD1 3.72Å
373	G	85.1	Confident	72.9	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-58.4	-45.8	171.8	0	0	0	0	0	111.9	I369 V370 H371 L376 S377	I369-G373 PolarHBondContact O-N 3.31Å; V370-G373 PolarHBondContact O-N 3.01Å; H371-G373 VanDerWaalsContact C-N 3.34Å; G373-L376 PolarHBondContact O-N 2.95Å; G373-S377 WeakPolarHBondContact O-CB 3.48Å; G373-S377 PolarHBondContact O-OG 2.96Å
374	G	80.6	Confident	70.3	Confident	27 Å²	27	55.1 Å²	55.1	28%	0.278	31%	0.312	S	S	.	.	H	α-helix	trans	-54.7	-56.4	172.1	0	0	0	0	0	112.6	V370 H371 F372 L376 S377	V370-G374 PolarHBondContact O-N 3.23Å; H371-G374 PolarHBondContact O-N 3.47Å; F372-G374 VanDerWaalsContact C-N 3.35Å; F372-G374 PolarHBondContact O-N 3.38Å; G374-L376 PolarHBondContact O-N 3.49Å; G374-L376 VanDerWaalsContact O-N 3.12Å; G374-S377 WeakPolarHBondContact O-CB 3.43Å; G374-S377 PolarHBondContact O-N 2.84Å
375	K	81.2	Confident	68	Low	109 Å²	109	60.3 Å²	60.3	47%	0.474	35%	0.349	S	S	.	.	H	α-helix	trans	-62.9	-20.3	-179.2	-68.7	-155.9	173.1	-169.6	0	114.6	V249 H371 F372 S377	V249-K375 HydrophobicContact CG2-CB 4.25Å; H371-K375 WeakPolarHBondContact NE2-CE 3.25Å; H371-K375 PolarHBondContact O-N 3.38Å; F372-K375 PolarHBondContact O-N 3.02Å; K375-S377 VanDerWaalsContact C-N 3.34Å
376	L	80.6	Confident	65.5	Low	18 Å²	18	67.8 Å²	67.8	9%	0.094	38%	0.384	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.3	1.9	173.3	-70.1	179.1	0	0	0	114.7	R246 V249 F372 G373 G374 K405 L409	R246-L376 HydrophobicContact CG-CD2 4.03Å; V249-L376 HydrophobicContact CB-CD2 4.2Å; V249-L376 HydrophobicContact CG1-CD1 4.1Å; V249-L376 HydrophobicContact CG1-CD2 3.9Å; V249-L376 HydrophobicContact CG1-CG 3.78Å; F372-L376 WeakPolarHBondContact O-CG 3.41Å; F372-L376 PolarHBondContact O-N 3.37Å; F372-L376 VanDerWaalsContact O-N 3.08Å; G373-L376 PolarHBondContact O-N 2.95Å; G374-L376 PolarHBondContact O-N 3.49Å; G374-L376 VanDerWaalsContact O-N 3.12Å; L376-K405 HydrophobicContact CB-CB 4.48Å; L376-K405 HydrophobicContact CB-CG 4.23Å; L376-K405 WeakPolarHBondContact O-CE 3.25Å; L376-L409 HydrophobicContact CD1-CD1 4.25Å; L376-L409 HydrophobicContact CD1-CD2 4.31Å
377	S	72.3	Confident	63.3	Low	3 Å²	3	70.4 Å²	70.4	2%	0.021	41%	0.406	C	S	.	.	S	Bend	trans	-118.8	4.3	-167.6	-55.2	0	0	0	0	115.1	G373 G374 K375 N401 R402 K405	G373-S377 WeakPolarHBondContact O-CB 3.48Å; G373-S377 PolarHBondContact O-OG 2.96Å; G374-S377 WeakPolarHBondContact O-CB 3.43Å; G374-S377 PolarHBondContact O-N 2.84Å; K375-S377 VanDerWaalsContact C-N 3.34Å; S377-N401 PolarHBondContact O-ND2 3.26Å; S377-N401 VanDerWaalsContact O-ND2 3.13Å; S377-R402 VanDerWaalsContact OG-CA 3.27Å; S377-R402 WeakPolarHBondContact OG-CA 3.33Å; S377-K405 WeakPolarHBondContact OG-CG 3.34Å
378	C	59.8	Low	61.4	Low	59 Å²	59	74.1 Å²	74.1	40%	0.399	44%	0.437	S	S	.	.			trans	72	153.4	-171.3	-53.9	0	0	0	0	114.1	H239 V241	H239-C378 PolarHBondContact O-SG 3.02Å; V241-C378 VanDerWaalsContact CG2-SG 3.56Å
379	S	45.9	Very low	59.5	Low	108 Å²	108	79.7 Å²	79.7	76%	0.755	47%	0.471	S	S	*	.			trans	-121.4	140.1	165.9	-167.5	0	0	0	0	106.1
380	C	39.4	Very low	57.8	Low	93 Å²	93	83.5 Å²	83.5	63%	0.628	49%	0.491	S	S	*	.			trans	-83.5	128.8	160.1	-70.8	0	0	0	0	107.6	M398	C380-M398 HydrophobicContact CB-CE 4.43Å; C380-M398 VanDerWaalsContact SG-CE 3.58Å
381	D	32.9	Very low	56.4	Low	158 Å²	158	86.3 Å²	86.3	85%	0.845	51%	0.508	S	S	*	.			trans	-75.6	135.8	154.6	-91.7	-48.4	0	0	0	108	Q383	D381-Q383 VanDerWaalsContact C-N 3.31Å; D381-Q383 PolarHBondContact O-N 2.84Å
382	S	34.9	Very low	54.9	Low	120 Å²	120	87 Å²	87	84%	0.839	51%	0.513	S	S	*	.	S	Bend	trans	-84.6	62.1	-163.2	41.6	0	0	0	0	113.5
383	Q	36.7	Very low	53.3	Low	177 Å²	177	92.9 Å²	92.9	83%	0.827	54%	0.541	S	S	*	.			trans	-136.3	80.9	172.8	-71.1	-165.9	-10.2	0	0	113.9	D381	D381-Q383 VanDerWaalsContact C-N 3.31Å; D381-Q383 PolarHBondContact O-N 2.84Å
384	Q	35.1	Very low	52.1	Low	178 Å²	178	97.1 Å²	97.1	83%	0.832	56%	0.56	S	S	*	*				-171.8	123.3	128.9	-146.9	83.9	53.2	0	0	110.2
385	S	41.7	Very low	51.1	Low	110 Å²	110	100.5 Å²	100.5	77%	0.769	57%	0.569	S	S	*	*			trans	-89.5	107.4	-178.3	-55.1	0	0	0	0	112.9
386	Q	37.7	Very low	50.1	Low	172 Å²	172	98.7 Å²	98.7	80%	0.804	56%	0.562	S	S	*	*			trans	-158	146.1	160.7	-127.1	96.8	77.5	0	0	113
387	A	41.1	Very low	49.2	Very low	62 Å²	62	103 Å²	103	51%	0.512	58%	0.58	S	S	.	*			trans	55.5	89.6	169.1	0	0	0	0	0	117.8	V389 D390 V391	A387-V389 PolarHBondContact O-N 2.94Å; A387-D390 PolarHBondContact O-N 3Å; A387-D390 VanDerWaalsContact O-N 3.13Å; A387-V391 PolarHBondContact O-N 3.37Å
388	A	49	Very low	48.6	Very low	87 Å²	87	106.1 Å²	106.1	72%	0.719	60%	0.595	S	S	*	*	H	α-helix	trans	-56.4	-20.3	179.9	0	0	0	0	0	116.2	L392	A388-L392 PolarHBondContact O-N 3.28Å
389	V	48.6	Very low	48.8	Very low	123 Å²	123	108.6 Å²	108.6	75%	0.745	60%	0.599	S	S	*	*	H	α-helix	trans	-79.8	-40	177.8	-176.9	0	0	0	0	112	A387 V391	A387-V389 PolarHBondContact O-N 2.94Å; V389-V391 VanDerWaalsContact C-N 3.35Å
390	D	52	Low	49.5	Very low	81 Å²	81	106 Å²	106	43%	0.433	58%	0.581	S	S	.	*	H	α-helix	trans	-69.8	-34.8	175.9	-87.8	8.8	0	0	0	110.2	R235 A387 H393 E394	R235-D390 IonicContact CZ-OD2 2.62Å; R235-D390 IonicContact NH2-OD2 2.75Å; R235-D390 PolarHBondContact NH2-OD2 3.15Å; A387-D390 PolarHBondContact O-N 3Å; A387-D390 VanDerWaalsContact O-N 3.13Å; D390-H393 PolarHBondContact O-N 2.98Å; D390-E394 PolarHBondContact O-N 3.41Å; D390-E394 VanDerWaalsContact O-N 3.1Å
391	V	57.1	Low	51.3	Low	72 Å²	72	104.2 Å²	104.2	44%	0.436	57%	0.565	S	S	.	*	H	α-helix	trans	-57.1	-52.4	175.3	174.2	0	0	0	0	111.4	A387 V389 H393 E394 E395	A387-V391 PolarHBondContact O-N 3.37Å; V389-V391 VanDerWaalsContact C-N 3.35Å; V391-H393 VanDerWaalsContact C-N 3.28Å; V391-H393 PolarHBondContact O-N 2.92Å; V391-E394 PolarHBondContact O-N 3.44Å; V391-E395 HydrophobicContact CG1-CG 4.4Å; V391-E395 WeakPolarHBondContact O-CG 3.33Å; V391-E395 PolarHBondContact O-N 2.88Å
392	L	54.3	Low	53.6	Low	69 Å²	69	99 Å²	99	36%	0.361	53%	0.533	S	S	.	.	H	α-helix	trans	-59.7	-37.6	-176.3	-161.9	72.5	0	0	0	112.6	A388 H396 L744	A388-L392 PolarHBondContact O-N 3.28Å; L392-H396 PolarHBondContact O-N 3.41Å; L392-L744 HydrophobicContact CD1-CD2 3.69Å; L392-L744 HydrophobicContact CD2-CB 4.25Å; L392-L744 HydrophobicContact CD2-CD2 3.68Å; L392-L744 HydrophobicContact CG-CD2 3.72Å
393	H	54.2	Low	55.7	Low	125 Å²	125	94.8 Å²	94.8	58%	0.579	50%	0.501	S	S	*	.	H	α-helix	trans	-72.3	-43	177.9	-171.3	78.6	0	0	0	112.5	D390 V391 H396 K397	D390-H393 PolarHBondContact O-N 2.98Å; V391-H393 VanDerWaalsContact C-N 3.28Å; V391-H393 PolarHBondContact O-N 2.92Å; H393-H396 PolarHBondContact O-N 3.39Å; H393-K397 VanDerWaalsContact O-CB 3.24Å; H393-K397 WeakPolarHBondContact O-CB 3.32Å; H393-K397 PolarHBondContact O-N 2.97Å
394	E	60.1	Low	57.9	Low	88 Å²	88	90.8 Å²	90.8	41%	0.411	48%	0.483	S	S	.	.	H	α-helix	trans	-68.1	-34.3	176.4	-71.3	-61.5	139.2	0	0	112.4	D390 V391 K397 M398	D390-E394 PolarHBondContact O-N 3.41Å; D390-E394 VanDerWaalsContact O-N 3.1Å; V391-E394 PolarHBondContact O-N 3.44Å; E394-K397 PolarHBondContact O-N 3.45Å; E394-K397 IonicContact OE1-NZ 2.94Å; E394-K397 PolarHBondContact OE1-NZ 3.42Å; E394-K397 WeakPolarHBondContact OE2-CD 3.46Å; E394-K397 IonicContact OE2-NZ 3.91Å; E394-K397 PolarHBondContact OE2-NZ 3.19Å; E394-M398 WeakPolarHBondContact O-CB 3.45Å; E394-M398 PolarHBondContact O-N 2.87Å
395	E	59.5	Low	60.3	Low	98 Å²	98	85.4 Å²	85.4	46%	0.458	46%	0.456	S	S	.	.	H	α-helix	trans	-59.9	-53	170.4	-77.1	-174.1	164	0	0	111.5	V391 K397 M398 F399	V391-E395 HydrophobicContact CG1-CG 4.4Å; V391-E395 WeakPolarHBondContact O-CG 3.33Å; V391-E395 PolarHBondContact O-N 2.88Å; E395-K397 VanDerWaalsContact C-N 3.26Å; E395-K397 PolarHBondContact O-N 3.03Å; E395-M398 WeakPolarHBondContact O-CA 3.42Å; E395-M398 WeakPolarHBondContact O-CB 3.31Å; E395-M398 PolarHBondContact O-N 2.88Å; E395-F399 HydrophobicContact CB-CE2 4.24Å; E395-F399 WeakPolarHBondContact O-CD2 3.46Å; E395-F399 PolarHBondContact O-N 3.39Å
396	H	59.3	Low	62.5	Low	71 Å²	71	80.2 Å²	80.2	33%	0.329	42%	0.42	S	S	.	.	H	α-helix	trans	-56.7	-41.7	178.9	-173.1	79.7	0	0	0	112.3	L392 H393 F399 C400 L741	L392-H396 PolarHBondContact O-N 3.41Å; H393-H396 PolarHBondContact O-N 3.39Å; H396-F399 PolarHBondContact O-N 3.36Å; H396-C400 WeakPolarHBondContact O-CB 3.5Å; H396-C400 PolarHBondContact O-N 3.49Å; H396-C400 PolarHBondContact O-SG 3.38Å; H396-L741 VanDerWaalsContact CE1-CD2 3.45Å; H396-L741 WeakPolarHBondContact CE1-CD2 3.36Å
397	K	61.2	Low	64.8	Low	109 Å²	109	76.2 Å²	76.2	47%	0.474	40%	0.398	S	S	.	.	H	α-helix	trans	-65.5	-37.4	175.7	179.4	179.4	165.4	-145.1	0	112.4	H393 E394 E395 C400 N401	H393-K397 VanDerWaalsContact O-CB 3.24Å; H393-K397 WeakPolarHBondContact O-CB 3.32Å; H393-K397 PolarHBondContact O-N 2.97Å; E394-K397 PolarHBondContact O-N 3.45Å; E394-K397 IonicContact OE1-NZ 2.94Å; E394-K397 PolarHBondContact OE1-NZ 3.42Å; E394-K397 WeakPolarHBondContact OE2-CD 3.46Å; E394-K397 IonicContact OE2-NZ 3.91Å; E394-K397 PolarHBondContact OE2-NZ 3.19Å; E395-K397 VanDerWaalsContact C-N 3.26Å; E395-K397 PolarHBondContact O-N 3.03Å; K397-C400 PolarHBondContact O-N 3.33Å; K397-N401 PolarHBondContact O-N 3.28Å
398	M	59.7	Low	67	Low	69 Å²	69	79.2 Å²	79.2	34%	0.34	40%	0.396	S	S	.	.	H	α-helix	trans	-65.9	-48	174.1	-167	-169.7	-56.4	0	0	111.6	C380 E394 E395 C400 N401 R402	C380-M398 HydrophobicContact CB-CE 4.43Å; C380-M398 VanDerWaalsContact SG-CE 3.58Å; E394-M398 WeakPolarHBondContact O-CB 3.45Å; E394-M398 PolarHBondContact O-N 2.87Å; E395-M398 WeakPolarHBondContact O-CA 3.42Å; E395-M398 WeakPolarHBondContact O-CB 3.31Å; E395-M398 PolarHBondContact O-N 2.88Å; M398-C400 VanDerWaalsContact C-N 3.32Å; M398-C400 PolarHBondContact O-N 2.89Å; M398-N401 PolarHBondContact O-N 3.33Å; M398-R402 WeakPolarHBondContact O-CB 3.44Å; M398-R402 PolarHBondContact O-N 3Å
399	F	63.4	Low	69	Low	111 Å²	111	75.2 Å²	75.2	49%	0.487	36%	0.362	S	S	.	.	H	α-helix	trans	-56.8	-46.5	174.2	-70.4	-63.3	0	0	0	111.2	E395 H396 N401 R402 D403	E395-F399 HydrophobicContact CB-CE2 4.24Å; E395-F399 WeakPolarHBondContact O-CD2 3.46Å; E395-F399 PolarHBondContact O-N 3.39Å; H396-F399 PolarHBondContact O-N 3.36Å; F399-N401 PolarHBondContact O-N 3.01Å; F399-R402 PolarHBondContact O-N 3.33Å; F399-D403 WeakPolarHBondContact O-CB 3.43Å; F399-D403 VanDerWaalsContact O-CG 3.29Å; F399-D403 PolarHBondContact O-N 2.88Å
400	C	61.8	Low	71	Confident	54 Å²	54	69.7 Å²	69.7	37%	0.365	33%	0.329	S	S	.	.	H	α-helix	trans	-61.2	-41.3	177.9	-82.5	0	0	0	0	113.6	H396 K397 M398 Q404	H396-C400 WeakPolarHBondContact O-CB 3.5Å; H396-C400 PolarHBondContact O-N 3.49Å; H396-C400 PolarHBondContact O-SG 3.38Å; K397-C400 PolarHBondContact O-N 3.33Å; M398-C400 VanDerWaalsContact C-N 3.32Å; M398-C400 PolarHBondContact O-N 2.89Å; C400-Q404 WeakPolarHBondContact O-CG 3.4Å; C400-Q404 PolarHBondContact O-N 2.93Å
401	N	77.8	Confident	72.7	Confident	55 Å²	55	68.7 Å²	68.7	29%	0.294	32%	0.32	S	S	.	.	H	α-helix	trans	-63.2	-47.1	173.2	178.1	38.6	0	0	0	111.2	S377 K397 M398 F399 Q404 K405	S377-N401 PolarHBondContact O-ND2 3.26Å; S377-N401 VanDerWaalsContact O-ND2 3.13Å; K397-N401 PolarHBondContact O-N 3.28Å; M398-N401 PolarHBondContact O-N 3.33Å; F399-N401 PolarHBondContact O-N 3.01Å; N401-Q404 WeakPolarHBondContact O-CB 3.49Å; N401-Q404 PolarHBondContact O-N 3.14Å; N401-K405 PolarHBondContact O-N 2.87Å; N401-K405 VanDerWaalsContact OD1-CE 3.28Å; N401-K405 WeakPolarHBondContact OD1-CE 3.44Å
402	R	80.3	Confident	74.4	Confident	48 Å²	48	72.4 Å²	72.4	18%	0.181	33%	0.326	C	S	.	.	H	α-helix	trans	-58	-51.3	-179.8	-173.9	-159.5	67.7	162.3	3.7	112.5	S377 M398 F399 Q404 K405 V406 S678	S377-R402 VanDerWaalsContact OG-CA 3.27Å; S377-R402 WeakPolarHBondContact OG-CA 3.33Å; M398-R402 WeakPolarHBondContact O-CB 3.44Å; M398-R402 PolarHBondContact O-N 3Å; F399-R402 PolarHBondContact O-N 3.33Å; R402-Q404 PolarHBondContact O-N 2.88Å; R402-K405 WeakPolarHBondContact O-CA 3.4Å; R402-K405 WeakPolarHBondContact O-CB 3.27Å; R402-K405 PolarHBondContact O-N 2.85Å; R402-V406 WeakPolarHBondContact O-CG2 3.48Å; R402-V406 PolarHBondContact O-N 3.11Å; R402-S678 VanDerWaalsContact CZ-OG 3.28Å; R402-S678 VanDerWaalsContact NH1-CB 3.32Å; R402-S678 PolarHBondContact NH1-OG 2.95Å; R402-S678 VanDerWaalsContact NH2-CB 3.3Å; R402-S678 PolarHBondContact NH2-OG 3.43Å
403	D	79.7	Confident	76.2	Confident	31 Å²	31	70 Å²	70	17%	0.166	31%	0.312	C	S	.	.	H	α-helix	trans	-64	-31.5	-179.4	-72.6	17.9	0	0	0	111.7	F399 R407 L675	F399-D403 WeakPolarHBondContact O-CB 3.43Å; F399-D403 VanDerWaalsContact O-CG 3.29Å; F399-D403 PolarHBondContact O-N 2.88Å; D403-R407 VanDerWaalsContact C-NH2 3.34Å; D403-R407 WeakPolarHBondContact O-CB 3.42Å; D403-R407 WeakPolarHBondContact O-CG 3.3Å; D403-R407 VanDerWaalsContact O-CZ 3.3Å; D403-R407 PolarHBondContact O-N 3.45Å; D403-R407 PolarHBondContact O-NE 2.93Å; D403-L675 HydrophobicContact CB-CD2 3.71Å
404	Q	83	Confident	77.9	Confident	94 Å²	94	64.6 Å²	64.6	44%	0.439	29%	0.287	S	S	.	.	H	α-helix	trans	-68.5	-34.2	169.5	-75.9	-170.7	38.6	0	0	113.7	C400 N401 R402 R408	C400-Q404 WeakPolarHBondContact O-CG 3.4Å; C400-Q404 PolarHBondContact O-N 2.93Å; N401-Q404 WeakPolarHBondContact O-CB 3.49Å; N401-Q404 PolarHBondContact O-N 3.14Å; R402-Q404 PolarHBondContact O-N 2.88Å; Q404-R408 WeakPolarHBondContact O-CD 3.23Å; Q404-R408 VanDerWaalsContact O-CG 3.24Å; Q404-R408 WeakPolarHBondContact O-CG 3.48Å; Q404-R408 PolarHBondContact O-N 3.37Å
405	K	85.8	Confident	79.5	Confident	65 Å²	65	61.2 Å²	61.2	28%	0.283	27%	0.273	S	S	.	.	H	α-helix	trans	-70.4	-47.2	173.5	-57.8	-50.2	-175.6	-173.9	0	110.9	L376 S377 N401 R402 R407 R408 L409	L376-K405 HydrophobicContact CB-CB 4.48Å; L376-K405 HydrophobicContact CB-CG 4.23Å; L376-K405 WeakPolarHBondContact O-CE 3.25Å; S377-K405 WeakPolarHBondContact OG-CG 3.34Å; N401-K405 PolarHBondContact O-N 2.87Å; N401-K405 VanDerWaalsContact OD1-CE 3.28Å; N401-K405 WeakPolarHBondContact OD1-CE 3.44Å; R402-K405 WeakPolarHBondContact O-CA 3.4Å; R402-K405 WeakPolarHBondContact O-CB 3.27Å; R402-K405 PolarHBondContact O-N 2.85Å; K405-R407 PolarHBondContact O-N 3.29Å; K405-R408 WeakPolarHBondContact O-CB 3.22Å; K405-R408 PolarHBondContact O-N 2.84Å; K405-L409 PolarHBondContact O-N 3.23Å
406	V	87.2	Confident	81.2	Confident	1 Å²	1	57.6 Å²	57.6	1%	0.006	26%	0.258	C	S	.	.	H	α-helix	trans	-55.8	-49	178.2	175.7	0	0	0	0	110.6	V370 R402 R408 L409 A410	V370-V406 HydrophobicContact CG2-CG1 4.11Å; R402-V406 WeakPolarHBondContact O-CG2 3.48Å; R402-V406 PolarHBondContact O-N 3.11Å; V406-R408 VanDerWaalsContact C-N 3.28Å; V406-R408 PolarHBondContact O-N 2.9Å; V406-L409 PolarHBondContact O-N 2.92Å; V406-A410 WeakPolarHBondContact O-CB 3.17Å; V406-A410 PolarHBondContact O-N 3.35Å
407	R	85.6	Confident	82.9	Confident	88 Å²	88	55.8 Å²	55.8	33%	0.332	25%	0.249	S	C	.	.	H	α-helix	trans	-57.5	-33.8	174.3	-80	179.2	-71.3	-100	3.3	114.2	D403 K405 R411 L675	D403-R407 VanDerWaalsContact C-NH2 3.34Å; D403-R407 WeakPolarHBondContact O-CB 3.42Å; D403-R407 WeakPolarHBondContact O-CG 3.3Å; D403-R407 VanDerWaalsContact O-CZ 3.3Å; D403-R407 PolarHBondContact O-N 3.45Å; D403-R407 PolarHBondContact O-NE 2.93Å; K405-R407 PolarHBondContact O-N 3.29Å; R407-R411 PolarHBondContact O-N 3.41Å; R407-R411 PolarHBondContact O-NH1 3.22Å; R407-R411 VanDerWaalsContact O-NH1 3.16Å; R407-L675 HydrophobicContact CG-CD1 4.01Å; R407-L675 HydrophobicContact CG-CD2 4.1Å; R407-L675 HydrophobicContact CG-CG 4.46Å; R407-L675 VanDerWaalsContact NH1-CD2 3.3Å
408	R	88.4	Confident	84.5	Confident	125 Å²	125	50.6 Å²	50.6	47%	0.472	23%	0.227	S	C	.	.	H	α-helix	trans	-72.9	-42.2	177.6	-71.1	168.6	-162.7	-128	7.4	111.4	Q404 K405 V406 W412	Q404-R408 WeakPolarHBondContact O-CD 3.23Å; Q404-R408 VanDerWaalsContact O-CG 3.24Å; Q404-R408 WeakPolarHBondContact O-CG 3.48Å; Q404-R408 PolarHBondContact O-N 3.37Å; K405-R408 WeakPolarHBondContact O-CB 3.22Å; K405-R408 PolarHBondContact O-N 2.84Å; V406-R408 VanDerWaalsContact C-N 3.28Å; V406-R408 PolarHBondContact O-N 2.9Å; R408-W412 PolarHBondContact O-N 3.09Å
409	L	90.7	Very high	86.2	Confident	3 Å²	3	51.7 Å²	51.7	2%	0.016	23%	0.234	C	C	.	.	H	α-helix	trans	-69.1	-45	177.3	-62.9	-178.5	0	0	0	111.6	W250 F253 I369 F372 L376 K405 V406 R411 W412 F413	W250-L409 HydrophobicContact CH2-CD2 4.18Å; W250-L409 HydrophobicContact CZ2-CD2 4.43Å; W250-L409 HydrophobicContact CZ3-CD2 4.49Å; F253-L409 HydrophobicContact CD1-CD2 3.78Å; F253-L409 HydrophobicContact CD2-CB 4.49Å; F253-L409 HydrophobicContact CD2-CD2 4.08Å; F253-L409 HydrophobicContact CE1-CD2 3.77Å; F253-L409 HydrophobicContact CE2-CB 3.87Å; F253-L409 HydrophobicContact CE2-CD2 4.07Å; F253-L409 HydrophobicContact CE2-CG 4.42Å; F253-L409 HydrophobicContact CG-CD2 3.95Å; F253-L409 HydrophobicContact CZ-CB 3.98Å; F253-L409 HydrophobicContact CZ-CD2 3.93Å; F253-L409 VanDerWaalsContact CZ-O 3.31Å; F253-L409 WeakPolarHBondContact CZ-O 3.29Å; I369-L409 HydrophobicContact CG2-CB 3.98Å; F372-L409 HydrophobicContact CB-CD1 3.72Å; L376-L409 HydrophobicContact CD1-CD1 4.25Å; L376-L409 HydrophobicContact CD1-CD2 4.31Å; K405-L409 PolarHBondContact O-N 3.23Å; V406-L409 PolarHBondContact O-N 2.92Å; L409-R411 VanDerWaalsContact C-N 3.27Å; L409-R411 PolarHBondContact O-N 3.42Å; L409-W412 PolarHBondContact O-N 3.03Å; L409-W412 VanDerWaalsContact O-N 3.15Å; L409-F413 WeakPolarHBondContact O-CB 3.39Å; L409-F413 PolarHBondContact O-N 3.46Å
410	A	89.3	Confident	87.7	Confident	7 Å²	7	46.6 Å²	46.6	6%	0.058	21%	0.213	C	C	.	.	H	α-helix	trans	-56.4	-40.9	176.3	0	0	0	0	0	112	I369 V406 R414 L670	I369-A410 HydrophobicContact CG2-CB 4.18Å; V406-A410 WeakPolarHBondContact O-CB 3.17Å; V406-A410 PolarHBondContact O-N 3.35Å; A410-R414 WeakPolarHBondContact O-CB 3.23Å; A410-R414 PolarHBondContact O-N 3.28Å; A410-L670 HydrophobicContact CB-CD2 4.08Å; A410-L670 HydrophobicContact CB-CG 4.35Å
411	R	89	Confident	89.3	Confident	60 Å²	60	44.6 Å²	44.6	23%	0.226	20%	0.198	C	C	.	.	H	α-helix	trans	-57.6	-56.4	170.7	-99.5	-162.3	-60.8	-73.4	17.9	113.1	R407 L409 F413 R414 V415 S612	R407-R411 PolarHBondContact O-N 3.41Å; R407-R411 PolarHBondContact O-NH1 3.22Å; R407-R411 VanDerWaalsContact O-NH1 3.16Å; L409-R411 VanDerWaalsContact C-N 3.27Å; L409-R411 PolarHBondContact O-N 3.42Å; R411-F413 PolarHBondContact O-N 3.1Å; R411-R414 PolarHBondContact O-N 2.61Å; R411-R414 VanDerWaalsContact O-N 3.13Å; R411-V415 WeakPolarHBondContact O-CB 3.33Å; R411-V415 WeakPolarHBondContact O-CG2 3.06Å; R411-V415 PolarHBondContact O-N 3.31Å; R411-S612 VanDerWaalsContact CD-CB 3.41Å; R411-S612 VanDerWaalsContact CG-OG 3.28Å; R411-S612 WeakPolarHBondContact CG-OG 3.41Å
412	W	91.3	Very high	90.1	Very high	149 Å²	149	42.7 Å²	42.7	56%	0.564	19%	0.188	S	C	*	.	H	α-helix	trans	-61	-34.3	-177	-78	119	0	0	0	112.2	F253 R408 L409 V415 S416	F253-W412 HydrophobicContact CE1-CB 3.84Å; F253-W412 HydrophobicContact CZ-CB 3.96Å; R408-W412 PolarHBondContact O-N 3.09Å; L409-W412 PolarHBondContact O-N 3.03Å; L409-W412 VanDerWaalsContact O-N 3.15Å; W412-V415 HydrophobicContact CE3-CG1 4.34Å; W412-S416 WeakPolarHBondContact O-CB 3.44Å; W412-S416 PolarHBondContact O-N 3.43Å
413	F	92.1	Very high	90.8	Very high	18 Å²	18	41.8 Å²	41.8	8%	0.079	19%	0.193	C	C	.	.	H	α-helix	trans	-66.5	-45.1	174.1	-169.4	-97.6	0	0	0	112.3	F253 L256 H260 K365 I369 L409 R411 S416 Q417	F253-F413 HydrophobicContact CE2-CB 4.49Å; F253-F413 HydrophobicContact CZ-CB 4.35Å; L256-F413 HydrophobicContact CG-CE2 4.27Å; H260-F413 HydrophobicContact CB-CE2 3.95Å; H260-F413 HydrophobicContact CB-CZ 4.16Å; H260-F413 AromaticContact CD2-CE1 3.35Å; H260-F413 WeakPolarHBondContact CD2-CE1 3.46Å; H260-F413 AromaticContact CD2-CE2 3.56Å; H260-F413 AromaticContact CD2-CZ 3.03Å; H260-F413 WeakPolarHBondContact CD2-CZ 3.49Å; H260-F413 AromaticContact CG-CE2 3.94Å; H260-F413 AromaticContact CG-CZ 3.64Å; H260-F413 AromaticContact NE2-CE1 3.58Å; H260-F413 AromaticContact NE2-CZ 3.58Å; K365-F413 HydrophobicContact CB-CE1 4.39Å; K365-F413 HydrophobicContact CB-CZ 3.78Å; K365-F413 HydrophobicContact CD-CZ 4.02Å; K365-F413 HydrophobicContact CG-CE2 4.45Å; K365-F413 HydrophobicContact CG-CZ 3.88Å; I369-F413 HydrophobicContact CD1-CB 3.91Å; I369-F413 HydrophobicContact CD1-CD1 3.58Å; I369-F413 HydrophobicContact CD1-CD2 4.04Å; I369-F413 HydrophobicContact CD1-CE1 4.05Å; I369-F413 HydrophobicContact CD1-CE2 4.47Å; I369-F413 HydrophobicContact CD1-CG 3.56Å; I369-F413 HydrophobicContact CD1-CZ 4.46Å; I369-F413 HydrophobicContact CG1-CD2 4.46Å; I369-F413 HydrophobicContact CG1-CG 4.34Å; L409-F413 WeakPolarHBondContact O-CB 3.39Å; L409-F413 PolarHBondContact O-N 3.46Å; R411-F413 PolarHBondContact O-N 3.1Å; F413-S416 WeakPolarHBondContact O-CB 3.19Å; F413-S416 PolarHBondContact O-N 3.01Å; F413-Q417 PolarHBondContact O-N 2.73Å; F413-Q417 VanDerWaalsContact O-N 3.12Å
414	R	91.8	Very high	91.3	Very high	12 Å²	12	40.3 Å²	40.3	5%	0.045	19%	0.186	C	C	.	.	H	α-helix	trans	-64.5	-45.3	175.6	-174.1	68.7	-134.5	-164.4	3.3	112.2	A410 R411 S416 Q417 D418 S608 E666	A410-R414 WeakPolarHBondContact O-CB 3.23Å; A410-R414 PolarHBondContact O-N 3.28Å; R411-R414 PolarHBondContact O-N 2.61Å; R411-R414 VanDerWaalsContact O-N 3.13Å; R414-S416 PolarHBondContact O-N 3.3Å; R414-Q417 VanDerWaalsContact CZ-CD 3.5Å; R414-Q417 WeakPolarHBondContact O-CA 3.41Å; R414-Q417 WeakPolarHBondContact O-CB 3.31Å; R414-Q417 PolarHBondContact O-N 2.87Å; R414-D418 IonicContact CZ-OD1 2.89Å; R414-D418 IonicContact NE-OD1 3.02Å; R414-D418 PolarHBondContact NE-OD1 3.34Å; R414-D418 IonicContact NE-OD2 3.61Å; R414-D418 IonicContact NH2-OD1 3.49Å; R414-D418 PolarHBondContact NH2-OD1 2.88Å; R414-D418 VanDerWaalsContact O-CG 3.23Å; R414-D418 PolarHBondContact O-N 2.97Å; R414-S608 VanDerWaalsContact CG-OG 3.25Å; R414-S608 WeakPolarHBondContact CG-OG 3.45Å; R414-E666 IonicContact NH1-OE1 3.34Å; R414-E666 IonicContact NH1-OE2 3.07Å; R414-E666 PolarHBondContact NH1-OE2 3.27Å
415	V	92.9	Very high	91.7	Very high	18 Å²	18	35.9 Å²	35.9	11%	0.109	17%	0.165	C	C	.	.	H	α-helix	trans	-53	-42	171.3	164.8	0	0	0	0	111.1	R411 W412 Q417 D418 L419 L605 C609	R411-V415 WeakPolarHBondContact O-CB 3.33Å; R411-V415 WeakPolarHBondContact O-CG2 3.06Å; R411-V415 PolarHBondContact O-N 3.31Å; W412-V415 HydrophobicContact CE3-CG1 4.34Å; V415-Q417 VanDerWaalsContact C-N 3.32Å; V415-Q417 PolarHBondContact O-N 3.47Å; V415-D418 PolarHBondContact O-N 3.19Å; V415-L419 HydrophobicContact CG1-CD1 3.75Å; V415-L419 HydrophobicContact CG1-CG 4.32Å; V415-L419 WeakPolarHBondContact O-CB 3.19Å; V415-L419 VanDerWaalsContact O-CG 3.28Å; V415-L419 WeakPolarHBondContact O-CG 3.25Å; V415-L419 PolarHBondContact O-N 3.36Å; V415-L605 HydrophobicContact CB-CD1 4.07Å; V415-L605 HydrophobicContact CG1-CD1 3.83Å; V415-L605 HydrophobicContact CG2-CD1 3.84Å; V415-C609 VanDerWaalsContact CG2-SG 3.59Å
416	S	94.5	Very high	91.9	Very high	21 Å²	21	36.6 Å²	36.6	15%	0.147	17%	0.171	C	C	.	.	H	α-helix	trans	-69.2	-27.5	177.7	-160	0	0	0	0	113.6	S257 G261 W412 F413 R414 G420	S257-S416 PolarHBondContact O-OG 2.9Å; G261-S416 WeakPolarHBondContact CA-O 3.48Å; W412-S416 WeakPolarHBondContact O-CB 3.44Å; W412-S416 PolarHBondContact O-N 3.43Å; F413-S416 WeakPolarHBondContact O-CB 3.19Å; F413-S416 PolarHBondContact O-N 3.01Å; R414-S416 PolarHBondContact O-N 3.3Å; S416-G420 PolarHBondContact O-N 3.1Å
417	Q	94.7	Very high	91.8	Very high	33 Å²	33	38 Å²	38	15%	0.154	18%	0.178	C	C	.	.	H	α-helix	trans	-72.2	-46.2	170.9	169.7	176.4	3.9	0	0	111.3	N264 F413 R414 V415 G420 L421	N264-Q417 WeakPolarHBondContact ND2-CA 3.28Å; N264-Q417 WeakPolarHBondContact ND2-CB 3.4Å; F413-Q417 PolarHBondContact O-N 2.73Å; F413-Q417 VanDerWaalsContact O-N 3.12Å; R414-Q417 VanDerWaalsContact CZ-CD 3.5Å; R414-Q417 WeakPolarHBondContact O-CA 3.41Å; R414-Q417 WeakPolarHBondContact O-CB 3.31Å; R414-Q417 PolarHBondContact O-N 2.87Å; V415-Q417 VanDerWaalsContact C-N 3.32Å; V415-Q417 PolarHBondContact O-N 3.47Å; Q417-G420 WeakPolarHBondContact O-CA 3.47Å; Q417-G420 PolarHBondContact O-N 3.45Å; Q417-L421 PolarHBondContact O-N 3.41Å; Q417-L421 VanDerWaalsContact O-N 3.07Å
418	D	94.8	Very high	91.7	Very high	1 Å²	1	34 Å²	34	1%	0.005	16%	0.164	C	C	.	.	H	α-helix	trans	-66.7	-42.2	-177.3	-56.7	-23.4	0	0	0	111.1	R414 V415 G420 L421 I422 L605 S608	R414-D418 IonicContact CZ-OD1 2.89Å; R414-D418 IonicContact NE-OD1 3.02Å; R414-D418 PolarHBondContact NE-OD1 3.34Å; R414-D418 IonicContact NE-OD2 3.61Å; R414-D418 IonicContact NH2-OD1 3.49Å; R414-D418 PolarHBondContact NH2-OD1 2.88Å; R414-D418 VanDerWaalsContact O-CG 3.23Å; R414-D418 PolarHBondContact O-N 2.97Å; V415-D418 PolarHBondContact O-N 3.19Å; D418-G420 VanDerWaalsContact C-N 3.25Å; D418-G420 PolarHBondContact O-N 2.87Å; D418-L421 PolarHBondContact O-N 2.86Å; D418-I422 WeakPolarHBondContact O-CG1 3.34Å; D418-I422 PolarHBondContact O-N 3.19Å; D418-I422 VanDerWaalsContact O-N 3.12Å; D418-L605 HydrophobicContact CB-CB 3.85Å; D418-L605 HydrophobicContact CB-CD1 4.22Å; D418-S608 WeakPolarHBondContact OD2-CB 3.47Å; D418-S608 PolarHBondContact OD2-OG 3.11Å
419	L	95.4	Very high	91.4	Very high	92 Å²	92	30 Å²	30	48%	0.482	16%	0.156	S	C	.	.	H	α-helix	trans	-62.6	-30.9	169.8	-72.8	172	0	0	0	112.9	V415 G423 L605	V415-L419 HydrophobicContact CG1-CD1 3.75Å; V415-L419 HydrophobicContact CG1-CG 4.32Å; V415-L419 WeakPolarHBondContact O-CB 3.19Å; V415-L419 VanDerWaalsContact O-CG 3.28Å; V415-L419 WeakPolarHBondContact O-CG 3.25Å; V415-L419 PolarHBondContact O-N 3.36Å; L419-G423 PolarHBondContact O-N 3.09Å; L419-L605 HydrophobicContact CD2-CD2 3.8Å; L419-L605 HydrophobicContact CG-CD2 4.28Å
420	G	95.4	Very high	90.8	Very high	4 Å²	4	34.4 Å²	34.4	4%	0.041	18%	0.178	C	C	.	.	H	α-helix	trans	-60.1	-56	171.8	0	0	0	0	0	110.8	G261 C265 S416 Q417 D418 I422 G423 G424	G261-G420 WeakPolarHBondContact O-CA 3.44Å; C265-G420 WeakPolarHBondContact CA-O 3.35Å; C265-G420 WeakPolarHBondContact CB-O 3.25Å; S416-G420 PolarHBondContact O-N 3.1Å; Q417-G420 WeakPolarHBondContact O-CA 3.47Å; Q417-G420 PolarHBondContact O-N 3.45Å; D418-G420 VanDerWaalsContact C-N 3.25Å; D418-G420 PolarHBondContact O-N 2.87Å; G420-I422 VanDerWaalsContact C-N 3.33Å; G420-I422 PolarHBondContact O-N 3.42Å; G420-G423 PolarHBondContact O-N 3.47Å; G420-G424 PolarHBondContact O-N 3.02Å
421	L	94.9	Very high	90.1	Very high	11 Å²	11	36.2 Å²	36.2	6%	0.058	19%	0.187	C	C	.	.	H	α-helix	trans	-52.8	-48.3	177.4	176.3	58.5	0	0	0	112.2	L268 Q417 D418 G424 A425 L597	L268-L421 HydrophobicContact CB-CD1 3.89Å; L268-L421 HydrophobicContact CD1-CB 3.99Å; L268-L421 HydrophobicContact CD1-CD1 4.4Å; Q417-L421 PolarHBondContact O-N 3.41Å; Q417-L421 VanDerWaalsContact O-N 3.07Å; D418-L421 PolarHBondContact O-N 2.86Å; L421-G424 PolarHBondContact O-N 3.26Å; L421-A425 VanDerWaalsContact O-CB 3.31Å; L421-A425 WeakPolarHBondContact O-CB 3.37Å; L421-A425 PolarHBondContact O-N 2.93Å; L421-L597 HydrophobicContact CD1-CB 4.33Å; L421-L597 HydrophobicContact CD1-CD2 4.41Å
422	I	95.8	Very high	89.1	Confident	16 Å²	16	35 Å²	35	8%	0.082	18%	0.184	C	C	.	.	H	α-helix	trans	-61.2	-50.7	180	-62	159.4	0	0	0	111	D418 G420 G424 A425 L426 L602 L605	D418-I422 WeakPolarHBondContact O-CG1 3.34Å; D418-I422 PolarHBondContact O-N 3.19Å; D418-I422 VanDerWaalsContact O-N 3.12Å; G420-I422 VanDerWaalsContact C-N 3.33Å; G420-I422 PolarHBondContact O-N 3.42Å; I422-G424 VanDerWaalsContact C-N 3.33Å; I422-G424 PolarHBondContact O-N 2.76Å; I422-A425 PolarHBondContact O-N 2.88Å; I422-L426 HydrophobicContact CG2-CD1 3.87Å; I422-L426 HydrophobicContact CG2-CG 4.45Å; I422-L426 WeakPolarHBondContact O-CB 3.46Å; I422-L426 WeakPolarHBondContact O-CG 3.35Å; I422-L426 PolarHBondContact O-N 2.94Å; I422-L602 HydrophobicContact CD1-CD2 3.95Å; I422-L602 HydrophobicContact CD1-CG 4.23Å; I422-L602 HydrophobicContact CG1-CG 4.43Å; I422-L605 HydrophobicContact CD1-CB 4.4Å; I422-L605 HydrophobicContact CD1-CD2 3.94Å
423	G	93.7	Very high	87.9	Confident	29 Å²	29	30.6 Å²	30.6	30%	0.299	18%	0.18	S	C	.	.	H	α-helix	trans	-63.9	-37.2	-179.3	0	0	0	0	0	113.1	L419 G420 L427	L419-G423 PolarHBondContact O-N 3.09Å; G420-G423 PolarHBondContact O-N 3.47Å; G423-L427 VanDerWaalsContact O-CB 3.32Å; G423-L427 WeakPolarHBondContact O-CB 3.46Å; G423-L427 PolarHBondContact O-N 2.66Å
424	G	91.3	Very high	86.5	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-69.5	-40.5	178.1	0	0	0	0	0	113.5	C265 P269 G420 L421 I422 L427 A428 Y519	C265-G424 WeakPolarHBondContact O-CA 3.34Å; C265-G424 WeakPolarHBondContact SG-CA 3.43Å; C265-G424 PolarHBondContact SG-N 3.14Å; P269-G424 VanDerWaalsContact CG-C 3.47Å; G420-G424 PolarHBondContact O-N 3.02Å; L421-G424 PolarHBondContact O-N 3.26Å; I422-G424 VanDerWaalsContact C-N 3.33Å; I422-G424 PolarHBondContact O-N 2.76Å; G424-L427 PolarHBondContact O-N 3.25Å; G424-A428 PolarHBondContact O-N 3.47Å; G424-Y519 PolarHBondContact O-OH 2.9Å
425	A	90.8	Very high	84.9	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-70.8	-42	175.6	0	0	0	0	0	111.8	L421 I422 L427 A428 S429 A594 L597 I598	L421-A425 VanDerWaalsContact O-CB 3.31Å; L421-A425 WeakPolarHBondContact O-CB 3.37Å; L421-A425 PolarHBondContact O-N 2.93Å; I422-A425 PolarHBondContact O-N 2.88Å; A425-L427 VanDerWaalsContact C-N 3.29Å; A425-L427 PolarHBondContact O-N 3.39Å; A425-A428 PolarHBondContact O-N 3.43Å; A425-S429 WeakPolarHBondContact O-CB 3.37Å; A425-S429 PolarHBondContact O-N 3.36Å; A425-A594 WeakPolarHBondContact O-CB 3.16Å; A425-L597 HydrophobicContact CB-CB 3.68Å; A425-I598 HydrophobicContact CB-CD1 4.49Å; A425-I598 HydrophobicContact CB-CG1 3.74Å
426	L	90.2	Very high	83.1	Confident	80 Å²	80	38.7 Å²	38.7	42%	0.419	23%	0.232	S	C	.	.	H	α-helix	trans	-55.6	-44.9	170.6	-78.6	167.6	0	0	0	111.5	I422 S429 I430 I598	I422-L426 HydrophobicContact CG2-CD1 3.87Å; I422-L426 HydrophobicContact CG2-CG 4.45Å; I422-L426 WeakPolarHBondContact O-CB 3.46Å; I422-L426 WeakPolarHBondContact O-CG 3.35Å; I422-L426 PolarHBondContact O-N 2.94Å; L426-S429 WeakPolarHBondContact O-CB 3.35Å; L426-S429 PolarHBondContact O-N 2.87Å; L426-I430 VanDerWaalsContact O-CG1 3.3Å; L426-I430 WeakPolarHBondContact O-CG1 3.33Å; L426-I430 PolarHBondContact O-N 3.44Å; L426-I598 HydrophobicContact CD2-CD1 3.62Å; L426-I598 HydrophobicContact CD2-CG1 4.35Å; L426-I598 HydrophobicContact CG-CD1 3.87Å; L426-I598 HydrophobicContact CG-CG1 4.14Å
427	L	86.4	Confident	80.9	Confident	30 Å²	30	41 Å²	41	16%	0.157	26%	0.26	C	S	.	.	H	α-helix	trans	-66.2	-40.4	-179.2	-174.1	58.9	0	0	0	112.8	G423 G424 A425 L431 L515 L518 Y519 F522	G423-L427 VanDerWaalsContact O-CB 3.32Å; G423-L427 WeakPolarHBondContact O-CB 3.46Å; G423-L427 PolarHBondContact O-N 2.66Å; G424-L427 PolarHBondContact O-N 3.25Å; A425-L427 VanDerWaalsContact C-N 3.29Å; A425-L427 PolarHBondContact O-N 3.39Å; L427-L431 HydrophobicContact CD1-CD1 4.02Å; L427-L431 HydrophobicContact CD1-CG 4.45Å; L427-L431 HydrophobicContact CG-CD1 4.24Å; L427-L431 PolarHBondContact O-N 3.06Å; L427-L431 VanDerWaalsContact O-N 3.08Å; L427-L515 HydrophobicContact CG-CD1 4.14Å; L427-L518 HydrophobicContact CD1-CD2 3.7Å; L427-L518 HydrophobicContact CD2-CD2 3.72Å; L427-L518 HydrophobicContact CD2-CG 4.02Å; L427-L518 HydrophobicContact CG-CD2 4.13Å; L427-Y519 HydrophobicContact CD2-CD1 4.45Å; L427-Y519 HydrophobicContact CD2-CE1 4.13Å; L427-F522 HydrophobicContact CD2-CD2 4.45Å; L427-F522 HydrophobicContact CD2-CE2 3.69Å; L427-F522 HydrophobicContact CD2-CZ 4.08Å
428	A	82.4	Confident	78.4	Confident	4 Å²	4	46 Å²	46	3%	0.033	29%	0.287	C	S	.	.	H	α-helix	trans	-63	-43.5	171.4	0	0	0	0	0	111.6	G424 A425 I430 L431 L432 L515	G424-A428 PolarHBondContact O-N 3.47Å; A425-A428 PolarHBondContact O-N 3.43Å; A428-I430 PolarHBondContact O-N 2.88Å; A428-L431 PolarHBondContact O-N 3.4Å; A428-L432 WeakPolarHBondContact O-CB 3.06Å; A428-L432 VanDerWaalsContact O-CG 3.27Å; A428-L432 WeakPolarHBondContact O-CG 3.41Å; A428-L432 PolarHBondContact O-N 3.15Å; A428-L515 HydrophobicContact CB-CD1 4.47Å; A428-L515 HydrophobicContact CB-CD2 4.03Å
429	S	82	Confident	75.6	Confident	42 Å²	42	54.5 Å²	54.5	29%	0.294	32%	0.324	S	S	.	.	H	α-helix	trans	-58.5	-46.4	177.9	-154.6	0	0	0	0	112.2	A425 L426 A433	A425-S429 WeakPolarHBondContact O-CB 3.37Å; A425-S429 PolarHBondContact O-N 3.36Å; L426-S429 WeakPolarHBondContact O-CB 3.35Å; L426-S429 PolarHBondContact O-N 2.87Å; S429-A433 VanDerWaalsContact O-CB 3.25Å; S429-A433 WeakPolarHBondContact O-CB 3.35Å; S429-A433 PolarHBondContact O-N 3.19Å
430	I	78.2	Confident	72.8	Confident	95 Å²	95	56.2 Å²	56.2	49%	0.487	34%	0.339	S	S	.	.	H	α-helix	trans	-67	-48.3	-178.6	-68.4	163.2	0	0	0	110.2	L426 A428 L432 A433 C434	L426-I430 VanDerWaalsContact O-CG1 3.3Å; L426-I430 WeakPolarHBondContact O-CG1 3.33Å; L426-I430 PolarHBondContact O-N 3.44Å; A428-I430 PolarHBondContact O-N 2.88Å; I430-L432 PolarHBondContact O-N 3.3Å; I430-A433 PolarHBondContact O-N 3.24Å; I430-C434 WeakPolarHBondContact O-CB 3.44Å; I430-C434 PolarHBondContact O-N 3.48Å; I430-C434 PolarHBondContact O-SG 3.44Å
431	L	74	Confident	70.1	Confident	46 Å²	46	59.9 Å²	59.9	24%	0.241	38%	0.376	C	S	.	.	H	α-helix	trans	-72.5	-27.1	-175.9	-75.3	171.8	0	0	0	114	L427 A428 S435 L515 L518	L427-L431 HydrophobicContact CD1-CD1 4.02Å; L427-L431 HydrophobicContact CD1-CG 4.45Å; L427-L431 HydrophobicContact CG-CD1 4.24Å; L427-L431 PolarHBondContact O-N 3.06Å; L427-L431 VanDerWaalsContact O-N 3.08Å; A428-L431 PolarHBondContact O-N 3.4Å; L431-S435 PolarHBondContact O-N 2.91Å; L431-L515 HydrophobicContact CB-CD1 4.45Å; L431-L515 HydrophobicContact CD1-CB 4.18Å; L431-L515 HydrophobicContact CD1-CD1 3.69Å; L431-L518 HydrophobicContact CD1-CD2 4.02Å
432	L	67.9	Low	67	Low	34 Å²	34	66.2 Å²	66.2	18%	0.178	41%	0.411	C	S	.	.	H	α-helix	trans	-70.4	-52.3	168.5	-69	169.5	0	0	0	110.6	A428 I430 C434 S435 D436 A511	A428-L432 WeakPolarHBondContact O-CB 3.06Å; A428-L432 VanDerWaalsContact O-CG 3.27Å; A428-L432 WeakPolarHBondContact O-CG 3.41Å; A428-L432 PolarHBondContact O-N 3.15Å; I430-L432 PolarHBondContact O-N 3.3Å; L432-C434 VanDerWaalsContact C-N 3.29Å; L432-C434 PolarHBondContact O-N 3.42Å; L432-S435 WeakPolarHBondContact O-CB 3.3Å; L432-S435 PolarHBondContact O-N 2.86Å; L432-D436 PolarHBondContact O-N 2.92Å; L432-A511 HydrophobicContact CD2-CB 4.2Å
433	A	66.7	Low	64.1	Low	57 Å²	57	71.7 Å²	71.7	47%	0.471	45%	0.449	S	S	.	.	H	α-helix	trans	-61.1	-33.3	-179.7	0	0	0	0	0	113.8	S429 I430 S435	S429-A433 VanDerWaalsContact O-CB 3.25Å; S429-A433 WeakPolarHBondContact O-CB 3.35Å; S429-A433 PolarHBondContact O-N 3.19Å; I430-A433 PolarHBondContact O-N 3.24Å; A433-S435 VanDerWaalsContact C-N 3.29Å; A433-S435 PolarHBondContact O-N 3.49Å
434	C	62.9	Low	61.3	Low	81 Å²	81	75.6 Å²	75.6	55%	0.547	47%	0.471	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-19.4	173.3	-71.3	0	0	0	0	113.7	I430 L432	I430-C434 WeakPolarHBondContact O-CB 3.44Å; I430-C434 PolarHBondContact O-N 3.48Å; I430-C434 PolarHBondContact O-SG 3.44Å; L432-C434 VanDerWaalsContact C-N 3.29Å; L432-C434 PolarHBondContact O-N 3.42Å
435	S	59.1	Low	58.6	Low	30 Å²	30	79.2 Å²	79.2	21%	0.21	51%	0.509	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.4	-25.2	177	-166.9	0	0	0	0	113.1	L431 L432 A433 G437 A511	L431-S435 PolarHBondContact O-N 2.91Å; L432-S435 WeakPolarHBondContact O-CB 3.3Å; L432-S435 PolarHBondContact O-N 2.86Å; A433-S435 VanDerWaalsContact C-N 3.29Å; A433-S435 PolarHBondContact O-N 3.49Å; S435-G437 PolarHBondContact O-N 2.96Å; S435-G437 VanDerWaalsContact O-N 3.1Å; S435-A511 VanDerWaalsContact CB-CB 3.42Å
436	D	54.9	Low	55.7	Low	107 Å²	107	86.3 Å²	86.3	57%	0.572	55%	0.546	S	S	*	.	S	Bend	trans	-78.8	20.1	176.1	-60.2	-27.2	0	0	0	112.1	L432 N438	L432-D436 PolarHBondContact O-N 2.92Å; D436-N438 PolarHBondContact O-N 3.2Å
437	G	46.8	Very low	53.3	Low	70 Å²	70	88.6 Å²	88.6	72%	0.722	56%	0.563	S	S	*	*	S	Bend	trans	68.8	-14.5	172	0	0	0	0	0	117.3	S435 F439	S435-G437 PolarHBondContact O-N 2.96Å; S435-G437 VanDerWaalsContact O-N 3.1Å; G437-F439 PolarHBondContact O-N 2.67Å
438	N	43.2	Very low	50.5	Low	136 Å²	136	96.3 Å²	96.3	73%	0.727	59%	0.591	S	S	*	*			trans	-94	61	-155.7	-143.9	1.3	0	0	0	114.1	D436	D436-N438 PolarHBondContact O-N 3.2Å
439	F	36.3	Very low	48.5	Very low	181 Å²	181	106 Å²	106	79%	0.794	63%	0.629	S	S	*	*			trans	-127.8	52.3	173.7	-153.3	-95.3	0	0	0	114	G437	G437-F439 PolarHBondContact O-N 2.67Å
440	T	36.2	Very low	45.9	Very low	127 Å²	127	106.4 Å²	106.4	78%	0.779	64%	0.639	S	S	*	*	S	Bend	trans	-94.2	127.8	147.2	44.4	0	0	0	0	107.9	D442	T440-D442 PolarHBondContact O-N 2.83Å
441	G	37.8	Very low	44.2	Very low	81 Å²	81	109.1 Å²	109.1	84%	0.835	65%	0.654	S	S	*	*	S	Bend	trans	-80	80	-162.4	0	0	0	0	0	114.9
442	D	29.7	Very low	42.1	Very low	145 Å²	145	115.1 Å²	115.1	78%	0.775	68%	0.681	S	S	*	*			trans	-139.8	117.5	164.2	-144.1	-22	0	0	0	112.1	T440 S444	T440-D442 PolarHBondContact O-N 2.83Å; D442-S444 PolarHBondContact O-N 3.13Å
443	C	36.2	Very low	40.8	Very low	130 Å²	130	119 Å²	119	88%	0.878	71%	0.711	S	S	*	*			trans	-99.7	61.7	-172.9	-75.2	0	0	0	0	111.3
444	S	34.2	Very low	38.9	Very low	111 Å²	111	126.4 Å²	126.4	78%	0.776	73%	0.727	S	S	*	*	S	Bend	trans	-150.5	73.4	176.1	-81	0	0	0	0	113.7	D442	D442-S444 PolarHBondContact O-N 3.13Å
445	G	35.7	Very low	37.5	Very low	76 Å²	76	127.3 Å²	127.3	78%	0.784	73%	0.732	S	S	*	*			trans	76.9	125.1	149.7	0	0	0	0	0	118.3
446	L	29.6	Very low	36.2	Very low	150 Å²	150	130.5 Å²	130.5	79%	0.785	75%	0.752	S	S	*	*			trans	-148.9	119.5	141	-159.5	64.4	0	0	0	111.3	Y448	L446-Y448 HydrophobicContact CD2-CD2 4.1Å
447	V	38.6	Very low	35.2	Very low	128 Å²	128	133.8 Å²	133.8	78%	0.776	76%	0.764	S	S	*	*			trans	-81.4	110.8	159.3	174	0	0	0	0	106.3	Y449	V447-Y449 HydrophobicContact CG1-CD2 4.48Å; V447-Y449 PolarHBondContact O-N 3.1Å
448	Y	28.8	Very low	34.7	Very low	192 Å²	192	136.6 Å²	136.6	75%	0.753	76%	0.762	S	S	*	*			trans	-83.7	98	-176.7	-164.1	-92.7	0	0	0	111.5	L446 G450	L446-Y448 HydrophobicContact CD2-CD2 4.1Å; Y448-G450 PolarHBondContact O-N 3.26Å
449	Y	39.4	Very low	34.4	Very low	208 Å²	208	139.8 Å²	139.8	82%	0.816	76%	0.764	S	S	*	*			trans	-80.5	106.5	165.6	-110.6	-84.4	0	0	0	109.3	V447	V447-Y449 HydrophobicContact CG1-CD2 4.48Å; V447-Y449 PolarHBondContact O-N 3.1Å
450	G	28.7	Very low	35	Very low	49 Å²	49	133.1 Å²	133.1	51%	0.505	74%	0.736	S	S	.	*			trans	-124.6	102.5	177.3	0	0	0	0	0	111.9	Y448	Y448-G450 PolarHBondContact O-N 3.26Å
451	N	41.3	Very low	35.9	Very low	153 Å²	153	129.9 Å²	129.9	82%	0.818	71%	0.711	S	S	*	*			trans	-92.2	96	172.7	-78.8	-11.2	0	0	0	110.4
452	E	31.1	Very low	37.3	Very low	172 Å²	172	127.6 Å²	127.6	80%	0.804	68%	0.678	S	S	*	*			trans	-138.6	144.3	158.4	-78.4	-150.6	170.4	0	0	112.4
453	S	40.2	Very low	39.2	Very low	116 Å²	116	122.9 Å²	122.9	81%	0.811	65%	0.653	S	S	*	*			trans	-108.2	93.7	-169.7	57.1	0	0	0	0	112.2
454	W	26.4	Very low	40.9	Very low	212 Å²	212	123.8 Å²	123.8	80%	0.803	64%	0.638	S	S	*	*			trans	-132.8	161.9	173.3	-83.1	96.7	0	0	0	110.3
455	P	33.4	Very low	42.9	Very low	99 Å²	99	121.3 Å²	121.3	64%	0.643	62%	0.616	S	S	*	*	S	Bend	trans	-64.3	160.9	-157.9	22.8	-32.7	0	0	0	114.7	Q457	P455-Q457 PolarHBondContact O-N 2.96Å
456	P	31.8	Very low	44.8	Very low	98 Å²	98	127 Å²	127	64%	0.636	62%	0.622	S	S	*	*			trans	-63.3	106.7	-147.3	23.6	-35.5	0	0	0	113.6	L458	P456-L458 PolarHBondContact O-N 2.99Å
457	Q	33.3	Very low	46.7	Very low	176 Å²	176	127.4 Å²	127.4	82%	0.822	62%	0.619	S	S	*	*			trans	-56.4	130.9	174.4	-65	177	-10.2	0	0	111	P455 R459	P455-Q457 PolarHBondContact O-N 2.96Å; Q457-R459 PolarHBondContact O-N 2.89Å
458	L	38	Very low	48.2	Very low	129 Å²	129	122.6 Å²	122.6	68%	0.675	60%	0.595	S	S	*	*			trans	39.3	61.5	156.1	-156.5	75.6	0	0	0	115.7	P456 D460	P456-L458 PolarHBondContact O-N 2.99Å; L458-D460 PolarHBondContact O-N 3.12Å; L458-D460 VanDerWaalsContact O-N 3.1Å
459	R	35.9	Very low	50.4	Low	203 Å²	203	118.1 Å²	118.1	77%	0.766	58%	0.584	S	S	*	*			trans	-54.4	118.7	178.1	-78.7	-165.2	176.9	-159.5	1.8	111.3	Q457	Q457-R459 PolarHBondContact O-N 2.89Å
460	D	48.4	Very low	52.3	Low	40 Å²	40	113.4 Å²	113.4	21%	0.214	57%	0.565	C	S	.	*			trans	-58.1	139	-173.8	-69.3	-58.9	0	0	0	113.9	L458 Y462 R464 R470	L458-D460 PolarHBondContact O-N 3.12Å; L458-D460 VanDerWaalsContact O-N 3.1Å; D460-Y462 HydrophobicContact CB-CD2 4.43Å; D460-Y462 PolarHBondContact O-N 3.29Å; D460-R464 IonicContact OD2-CZ 3.65Å; D460-R464 VanDerWaalsContact OD2-CZ 3.26Å; D460-R464 IonicContact OD2-NE 2.83Å; D460-R464 PolarHBondContact OD2-NE 2.9Å; D460-R464 IonicContact OD2-NH2 2.65Å; D460-R464 PolarHBondContact OD2-NH2 3.37Å; D460-R470 IonicContact OD1-CZ 2.66Å; D460-R470 IonicContact OD1-NE 3.17Å; D460-R470 PolarHBondContact OD1-NE 3.47Å; D460-R470 IonicContact OD1-NH2 3.1Å; D460-R470 PolarHBondContact OD1-NH2 3.35Å; D460-R470 IonicContact OD2-NE 2.67Å; D460-R470 PolarHBondContact OD2-NE 2.89Å; D460-R470 IonicContact OD2-NH2 2.72Å
461	F	55.4	Low	54.9	Low	59 Å²	59	113.2 Å²	113.2	26%	0.259	55%	0.552	S	S	.	*	S	Bend	trans	-81.8	4.1	162.8	-74.2	-77.3	0	0	0	113.5	P291 L479 I499 Y500	P291-F461 HydrophobicContact CG-CD1 4.33Å; F461-L479 HydrophobicContact CD1-CD1 4.26Å; F461-L479 WeakPolarHBondContact O-CD1 3.45Å; F461-I499 HydrophobicContact CE1-CD1 4.42Å; F461-I499 HydrophobicContact CE2-CB 4.31Å; F461-I499 HydrophobicContact CE2-CG2 3.69Å; F461-I499 HydrophobicContact CZ-CB 3.9Å; F461-I499 HydrophobicContact CZ-CD1 4.01Å; F461-I499 HydrophobicContact CZ-CG2 3.57Å; F461-Y500 AromaticContact CE2-CE2 3.94Å; F461-Y500 HydrophobicContact CE2-CE2 3.94Å; F461-Y500 HydrophobicContact CZ-CE2 4.29Å
462	Y	68	Low	57.1	Low	34 Å²	34	106.6 Å²	106.6	13%	0.133	52%	0.517	C	S	.	.	S	Bend	trans	-92.8	134.2	175.5	-60.4	-77.7	0	0	0	109.7	D460 M476 T585 C586	D460-Y462 HydrophobicContact CB-CD2 4.43Å; D460-Y462 PolarHBondContact O-N 3.29Å; Y462-M476 HydrophobicContact CD1-CE 3.73Å; Y462-M476 HydrophobicContact CD1-SD 4.26Å; Y462-M476 HydrophobicContact CE1-CE 3.86Å; Y462-M476 HydrophobicContact CE1-SD 4.33Å; Y462-T585 PolarHBondContact OH-OG1 3.5Å; Y462-C586 HydrophobicContact CD1-CB 3.94Å; Y462-C586 WeakPolarHBondContact CD1-SG 3.42Å; Y462-C586 HydrophobicContact CE1-CB 3.53Å
463	N	68.6	Low	59.8	Low	46 Å²	46	98.4 Å²	98.4	25%	0.246	48%	0.479	C	S	.	.			trans	-56.9	142.1	168.9	-59.6	-42.9	0	0	0	108.9	I471 C477 L479	N463-I471 HydrophobicContact CB-CB 4.33Å; N463-I471 HydrophobicContact CB-CD1 4.07Å; N463-I471 WeakPolarHBondContact O-CB 3.07Å; N463-I471 PolarHBondContact O-N 2.87Å; N463-C477 PolarHBondContact ND2-O 3.38Å; N463-L479 WeakPolarHBondContact OD1-CD2 3.35Å
464	R	72.5	Confident	62.1	Low	149 Å²	149	93.3 Å²	93.3	56%	0.562	44%	0.444	S	S	*	.	B	Isolated β-bridge	trans	-108.5	150.8	173.9	-74	174.3	169.6	-132.3	12.6	110.9	D460 G468 D469	D460-R464 IonicContact OD2-CZ 3.65Å; D460-R464 VanDerWaalsContact OD2-CZ 3.26Å; D460-R464 IonicContact OD2-NE 2.83Å; D460-R464 PolarHBondContact OD2-NE 2.9Å; D460-R464 IonicContact OD2-NH2 2.65Å; D460-R464 PolarHBondContact OD2-NH2 3.37Å; R464-G468 WeakPolarHBondContact CD-O 3.36Å; R464-G468 WeakPolarHBondContact CG-O 3.31Å; R464-G468 PolarHBondContact NE-O 3.27Å; R464-G468 PolarHBondContact NH1-O 3.22Å; R464-D469 CarbonylContact C-O 3.57Å; R464-D469 WeakPolarHBondContact CA-O 3.46Å; R464-D469 WeakPolarHBondContact CB-O 3.42Å
465	N	75.9	Confident	64.9	Low	59 Å²	59	87.4 Å²	87.4	32%	0.316	43%	0.429	S	S	.	.			trans	-76.7	177.8	172.4	73.1	7.4	0	0	0	110.7	H467 G468 D469 I471	N465-H467 PolarHBondContact O-N 2.97Å; N465-H467 VanDerWaalsContact O-N 3.15Å; N465-H467 WeakPolarHBondContact OD1-CA 3.41Å; N465-H467 WeakPolarHBondContact OD1-CB 3.37Å; N465-H467 PolarHBondContact OD1-N 3.12Å; N465-G468 PolarHBondContact O-N 3.46Å; N465-G468 VanDerWaalsContact O-N 3.1Å; N465-G468 PolarHBondContact OD1-N 3.27Å; N465-D469 PolarHBondContact N-O 2.93Å; N465-D469 PolarHBondContact ND2-OD2 3.02Å; N465-D469 PolarHBondContact OD1-N 2.79Å; N465-D469 PolarHBondContact OD1-OD2 3.14Å; N465-I471 HydrophobicContact CB-CD1 4.46Å; N465-I471 HydrophobicContact CB-CG1 4.23Å
466	E	75.6	Confident	67.3	Low	195 Å²	195	84 Å²	84	91%	0.911	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-17.1	178.1	-61.8	174.8	166.5	0	0	114
467	H	70.3	Confident	69.8	Low	159 Å²	159	81.5 Å²	81.5	74%	0.736	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.1	-10.8	179.7	-58.6	64	0	0	0	112.1	N465	N465-H467 PolarHBondContact O-N 2.97Å; N465-H467 VanDerWaalsContact O-N 3.15Å; N465-H467 WeakPolarHBondContact OD1-CA 3.41Å; N465-H467 WeakPolarHBondContact OD1-CB 3.37Å; N465-H467 PolarHBondContact OD1-N 3.12Å
468	G	68.6	Low	71.8	Confident	26 Å²	26	75.5 Å²	75.5	27%	0.268	37%	0.365	S	S	.	.	S	Bend	trans	100.6	-3.7	-178.9	0	0	0	0	0	115.5	R464 N465	R464-G468 WeakPolarHBondContact CD-O 3.36Å; R464-G468 WeakPolarHBondContact CG-O 3.31Å; R464-G468 PolarHBondContact NE-O 3.27Å; R464-G468 PolarHBondContact NH1-O 3.22Å; N465-G468 PolarHBondContact O-N 3.46Å; N465-G468 VanDerWaalsContact O-N 3.1Å; N465-G468 PolarHBondContact OD1-N 3.27Å
469	D	75.4	Confident	73	Confident	98 Å²	98	72.3 Å²	72.3	52%	0.524	35%	0.348	S	S	.	.			trans	-78.4	152	-178.8	-41.4	-61.7	0	0	0	112.2	R464 N465	R464-D469 CarbonylContact C-O 3.57Å; R464-D469 WeakPolarHBondContact CA-O 3.46Å; R464-D469 WeakPolarHBondContact CB-O 3.42Å; N465-D469 PolarHBondContact N-O 2.93Å; N465-D469 PolarHBondContact ND2-OD2 3.02Å; N465-D469 PolarHBondContact OD1-N 2.79Å; N465-D469 PolarHBondContact OD1-OD2 3.14Å
470	R	78.9	Confident	73.8	Confident	110 Å²	110	72.4 Å²	72.4	42%	0.415	35%	0.348	S	S	.	.	B	Isolated β-bridge	trans	-68.8	134.4	176.6	-64.2	179.9	-178.8	144.3	-1	111.7	D460 C472	D460-R470 IonicContact OD1-CZ 2.66Å; D460-R470 IonicContact OD1-NE 3.17Å; D460-R470 PolarHBondContact OD1-NE 3.47Å; D460-R470 IonicContact OD1-NH2 3.1Å; D460-R470 PolarHBondContact OD1-NH2 3.35Å; D460-R470 IonicContact OD2-NE 2.67Å; D460-R470 PolarHBondContact OD2-NE 2.89Å; D460-R470 IonicContact OD2-NH2 2.72Å; R470-C472 PolarHBondContact O-N 3.39Å
471	I	83.5	Confident	73.8	Confident	45 Å²	45	75.6 Å²	75.6	23%	0.231	37%	0.369	C	S	.	.			trans	-85.1	102	173.3	-59.4	176	0	0	0	108.7	N463 N465 D475	N463-I471 HydrophobicContact CB-CB 4.33Å; N463-I471 HydrophobicContact CB-CD1 4.07Å; N463-I471 WeakPolarHBondContact O-CB 3.07Å; N463-I471 PolarHBondContact O-N 2.87Å; N465-I471 HydrophobicContact CB-CD1 4.46Å; N465-I471 HydrophobicContact CB-CG1 4.23Å; I471-D475 HydrophobicContact CG2-CB 3.57Å
472	C	87.1	Confident	73	Confident	13 Å²	13	78.2 Å²	78.2	9%	0.088	38%	0.382	C	S	.	.			trans	-110.9	161.8	-177.9	-55.6	0	0	0	0	112.3	R470 C586 P643	R470-C472 PolarHBondContact O-N 3.39Å; C472-C586 WeakPolarHBondContact CA-SG 3.28Å; C472-C586 HydrophobicContact CB-CB 3.67Å; C472-C586 WeakPolarHBondContact CB-SG 3.33Å; C472-C586 WeakPolarHBondContact SG-CB 3.44Å; C472-C586 CovalentContact SG-SG 2.03Å; C472-C586 PolarHBondContact SG-SG 2.89Å; C472-P643 HydrophobicContact CB-CG 3.73Å
473	G	88.4	Confident	71.9	Confident	0 Å²	0	79.4 Å²	79.4	0%	0	40%	0.396	C	S	.	.	G	3₁₀ helix	trans	79.3	-148.2	177.7	0	0	0	0	0	114.2	D475 M476 A582 F583	G473-D475 PolarHBondContact O-N 3.31Å; G473-D475 VanDerWaalsContact O-N 3.11Å; G473-M476 VanDerWaalsContact O-CB 3.24Å; G473-M476 WeakPolarHBondContact O-CB 3.4Å; G473-M476 PolarHBondContact O-N 3.03Å; G473-A582 PolarHBondContact N-O 3.45Å; G473-F583 VanDerWaalsContact CA-CE1 3.5Å
474	A	88.5	Confident	70.9	Confident	10 Å²	10	81.6 Å²	81.6	8%	0.083	41%	0.406	C	S	.	.	G	3₁₀ helix	trans	-60.5	-22	-174.6	0	0	0	0	0	114.6	M476 S709 I712	A474-M476 VanDerWaalsContact C-N 3.25Å; A474-M476 PolarHBondContact O-N 3.48Å; A474-S709 WeakPolarHBondContact O-CB 3.16Å; A474-S709 PolarHBondContact O-N 3.46Å; A474-I712 HydrophobicContact CB-CD1 3.78Å
475	D	85.4	Confident	69.4	Low	88 Å²	88	79.7 Å²	79.7	47%	0.471	41%	0.407	S	S	.	.	G	3₁₀ helix	trans	-75.2	-10	175.1	-63.1	-34.4	0	0	0	113.2	I471 G473 C477 K642	I471-D475 HydrophobicContact CG2-CB 3.57Å; G473-D475 PolarHBondContact O-N 3.31Å; G473-D475 VanDerWaalsContact O-N 3.11Å; D475-C477 PolarHBondContact O-N 2.93Å; D475-K642 IonicContact OD2-NZ 3.56Å; D475-K642 PolarHBondContact OD2-NZ 3.27Å
476	M	84.8	Confident	67.6	Low	27 Å²	27	82.1 Å²	82.1	13%	0.133	42%	0.416	C	S	.	.			trans	-69.1	124	-177.1	-170.2	175.6	177.1	0	0	111.3	Y462 G473 A474 R581 A582 E708	Y462-M476 HydrophobicContact CD1-CE 3.73Å; Y462-M476 HydrophobicContact CD1-SD 4.26Å; Y462-M476 HydrophobicContact CE1-CE 3.86Å; Y462-M476 HydrophobicContact CE1-SD 4.33Å; G473-M476 VanDerWaalsContact O-CB 3.24Å; G473-M476 WeakPolarHBondContact O-CB 3.4Å; G473-M476 PolarHBondContact O-N 3.03Å; A474-M476 VanDerWaalsContact C-N 3.25Å; A474-M476 PolarHBondContact O-N 3.48Å; M476-R581 HydrophobicContact CE-CG 4.5Å; M476-A582 HydrophobicContact CB-CB 4.24Å; M476-A582 HydrophobicContact SD-CB 3.69Å; M476-E708 HydrophobicContact CB-CB 4.31Å; M476-E708 WeakPolarHBondContact O-CB 3.3Å; M476-E708 PolarHBondContact O-N 3.36Å
477	C	83.6	Confident	66.2	Low	45 Å²	45	75.4 Å²	75.4	30%	0.304	39%	0.394	S	S	.	.			trans	-121.8	148.2	173.8	-77.4	0	0	0	0	110.5	N463 D475 C707	N463-C477 PolarHBondContact ND2-O 3.38Å; D475-C477 PolarHBondContact O-N 2.93Å; C477-C707 HydrophobicContact CB-CB 4.11Å; C477-C707 WeakPolarHBondContact CB-SG 3.35Å; C477-C707 WeakPolarHBondContact SG-CB 3.23Å; C477-C707 CovalentContact SG-SG 2.04Å; C477-C707 PolarHBondContact SG-SG 3.5Å
478	P	74.3	Confident	65	Low	51 Å²	51	69.3 Å²	69.3	33%	0.331	37%	0.374	S	S	.	.			trans	-63.8	143	175.9	27.9	-35.4	0	0	0	111.6	R480 G704	P478-R480 PolarHBondContact O-N 3.44Å; P478-G704 VanDerWaalsContact CB-O 3.25Å; P478-G704 WeakPolarHBondContact CB-O 3.35Å
479	L	63.4	Low	63.5	Low	61 Å²	61	78.7 Å²	78.7	32%	0.319	40%	0.402	S	S	.	.			trans	-60.7	118	174.2	-77.3	162.7	0	0	0	110.1	F461 N463 V481 I484	F461-L479 HydrophobicContact CD1-CD1 4.26Å; F461-L479 WeakPolarHBondContact O-CD1 3.45Å; N463-L479 WeakPolarHBondContact OD1-CD2 3.35Å; L479-V481 PolarHBondContact O-N 3Å; L479-I484 HydrophobicContact CB-CD1 4.14Å; L479-I484 HydrophobicContact CD1-CD1 4.33Å
480	R	53.3	Low	62	Low	205 Å²	205	78 Å²	78	77%	0.774	41%	0.41	S	S	*	.			trans	-67.9	105.6	175.3	-178	-176.8	-73.6	168.5	-2.8	108.8	P478 Q482 S483	P478-R480 PolarHBondContact O-N 3.44Å; R480-Q482 HydrophobicContact CG-CB 3.98Å; R480-Q482 PolarHBondContact O-N 3.32Å; R480-S483 PolarHBondContact O-N 3.44Å; R480-S483 PolarHBondContact O-OG 3.02Å; R480-S483 VanDerWaalsContact O-OG 3.09Å
481	V	48	Very low	60.3	Low	108 Å²	108	78.6 Å²	78.6	66%	0.655	42%	0.421	S	S	*	.	H	α-helix	trans	-41	-36.2	-174.3	-179.7	0	0	0	0	114.5	L479 S483 I484 L485	L479-V481 PolarHBondContact O-N 3Å; V481-S483 VanDerWaalsContact C-N 3.31Å; V481-S483 PolarHBondContact O-N 3.45Å; V481-I484 PolarHBondContact O-N 3.28Å; V481-I484 VanDerWaalsContact O-N 3.13Å; V481-L485 PolarHBondContact O-N 3Å; V481-L485 VanDerWaalsContact O-N 3.15Å
482	Q	39.9	Very low	58.2	Low	113 Å²	113	80 Å²	80	53%	0.528	45%	0.447	S	S	.	.	H	α-helix	trans	-40.7	-51.5	170.6	-163.6	71.9	28.7	0	0	113.8	R480 I484 L485 E486	R480-Q482 HydrophobicContact CG-CB 3.98Å; R480-Q482 PolarHBondContact O-N 3.32Å; Q482-I484 VanDerWaalsContact C-N 3.35Å; Q482-I484 PolarHBondContact O-N 2.99Å; Q482-L485 PolarHBondContact O-N 3.02Å; Q482-E486 WeakPolarHBondContact CG-OE1 3.33Å; Q482-E486 PolarHBondContact NE2-OE1 3.35Å; Q482-E486 WeakPolarHBondContact O-CB 3.45Å; Q482-E486 WeakPolarHBondContact O-CG 3.28Å; Q482-E486 PolarHBondContact O-N 3.3Å
483	S	42.9	Very low	55.9	Low	60 Å²	60	82.9 Å²	82.9	42%	0.42	47%	0.467	S	S	.	.	H	α-helix	trans	-72.3	-26.8	-174.7	62	0	0	0	0	113.4	R480 V481 A487	R480-S483 PolarHBondContact O-N 3.44Å; R480-S483 PolarHBondContact O-OG 3.02Å; R480-S483 VanDerWaalsContact O-OG 3.09Å; V481-S483 VanDerWaalsContact C-N 3.31Å; V481-S483 PolarHBondContact O-N 3.45Å; S483-A487 WeakPolarHBondContact O-CB 3.38Å; S483-A487 PolarHBondContact O-N 2.96Å
484	I	47.7	Very low	53.7	Low	91 Å²	91	88 Å²	88	47%	0.467	50%	0.502	S	S	.	.	H	α-helix	trans	-71.5	-39.8	174.2	-56.5	177.3	0	0	0	109.6	L479 V481 Q482 G488	L479-I484 HydrophobicContact CB-CD1 4.14Å; L479-I484 HydrophobicContact CD1-CD1 4.33Å; V481-I484 PolarHBondContact O-N 3.28Å; V481-I484 VanDerWaalsContact O-N 3.13Å; Q482-I484 VanDerWaalsContact C-N 3.35Å; Q482-I484 PolarHBondContact O-N 2.99Å; I484-G488 PolarHBondContact O-N 2.94Å; I484-G488 VanDerWaalsContact O-N 3.07Å
485	L	42.2	Very low	51.5	Low	109 Å²	109	95.3 Å²	95.3	57%	0.571	54%	0.538	S	S	*	.	H	α-helix	trans	-69.5	-45.3	179	-146	74.7	0	0	0	111.5	V481 Q482 G488 W489	V481-L485 PolarHBondContact O-N 3Å; V481-L485 VanDerWaalsContact O-N 3.15Å; Q482-L485 PolarHBondContact O-N 3.02Å; L485-G488 PolarHBondContact O-N 3.45Å; L485-W489 PolarHBondContact O-N 3.34Å
486	E	38.8	Very low	49.4	Very low	111 Å²	111	94.9 Å²	94.9	52%	0.519	54%	0.54	S	S	.	.	H	α-helix	trans	-63.9	-43.8	177.1	-73	165.8	179.1	0	0	111.9	Q482 G488 W489 A490	Q482-E486 WeakPolarHBondContact CG-OE1 3.33Å; Q482-E486 PolarHBondContact NE2-OE1 3.35Å; Q482-E486 WeakPolarHBondContact O-CB 3.45Å; Q482-E486 WeakPolarHBondContact O-CG 3.28Å; Q482-E486 PolarHBondContact O-N 3.3Å; E486-G488 VanDerWaalsContact C-N 3.31Å; E486-G488 PolarHBondContact O-N 3Å; E486-W489 PolarHBondContact O-N 3.02Å; E486-A490 WeakPolarHBondContact O-CB 3.46Å; E486-A490 PolarHBondContact O-N 3.38Å
487	A	46.2	Very low	47.1	Very low	54 Å²	54	97.7 Å²	97.7	45%	0.446	56%	0.563	S	S	.	*	H	α-helix	trans	-66.7	-30.1	175.9	0	0	0	0	0	113.4	S483 N491	S483-A487 WeakPolarHBondContact O-CB 3.38Å; S483-A487 PolarHBondContact O-N 2.96Å; A487-N491 PolarHBondContact O-ND2 3.07Å
488	G	44.4	Very low	45.1	Very low	30 Å²	30	96.6 Å²	96.6	31%	0.309	56%	0.556	S	S	.	*	H	α-helix	trans	-70.7	-45.8	173.3	0	0	0	0	0	112.5	I484 L485 E486	I484-G488 PolarHBondContact O-N 2.94Å; I484-G488 VanDerWaalsContact O-N 3.07Å; L485-G488 PolarHBondContact O-N 3.45Å; E486-G488 VanDerWaalsContact C-N 3.31Å; E486-G488 PolarHBondContact O-N 3Å
489	W	37.4	Very low	43.5	Very low	224 Å²	224	97.9 Å²	97.9	85%	0.848	56%	0.559	S	S	*	*	H	α-helix	trans	-69.2	-33.4	-179.5	-80.6	42.6	0	0	0	112.9	L485 E486 N491	L485-W489 PolarHBondContact O-N 3.34Å; E486-W489 PolarHBondContact O-N 3.02Å; W489-N491 VanDerWaalsContact C-N 3.29Å; W489-N491 PolarHBondContact O-N 2.92Å
490	A	43.4	Very low	42.4	Very low	84 Å²	84	98 Å²	98	69%	0.694	56%	0.555	S	S	*	*	H	α-helix	trans	-67.4	-23.4	-179.4	0	0	0	0	0	114.7	E486	E486-A490 WeakPolarHBondContact O-CB 3.46Å; E486-A490 PolarHBondContact O-N 3.38Å
491	N	43.5	Very low	41.5	Very low	122 Å²	122	89.5 Å²	89.5	65%	0.652	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.8	-3.8	-170.3	-71.7	-66.2	0	0	0	114.9	A487 W489 S493	A487-N491 PolarHBondContact O-ND2 3.07Å; W489-N491 VanDerWaalsContact C-N 3.29Å; W489-N491 PolarHBondContact O-N 2.92Å; N491-S493 PolarHBondContact O-N 3.48Å
492	G	38.2	Very low	40.9	Very low	75 Å²	75	86.6 Å²	86.6	77%	0.773	52%	0.521	S	S	*	.			trans	64.5	-1.1	178	0	0	0	0	0	116
493	S	39.9	Very low	40.9	Very low	73 Å²	73	84.4 Å²	84.4	51%	0.51	51%	0.51	S	S	.	.	P	Polyproline II helix	trans	-65.6	137.4	174.9	53.1	0	0	0	0	110.8	N491	N491-S493 PolarHBondContact O-N 3.48Å
494	S	41.2	Very low	40.7	Very low	106 Å²	106	82.8 Å²	82.8	74%	0.741	50%	0.496	S	S	*	.	P	Polyproline II helix	trans	-50.5	143.6	166	42.7	0	0	0	0	110.7	P496	S494-P496 WeakPolarHBondContact O-CD 3.26Å; S494-P496 VanDerWaalsContact O-N 3.1Å
495	I	43.2	Very low	40.3	Very low	164 Å²	164	86.1 Å²	86.1	84%	0.841	51%	0.51	S	S	*	.	P	Polyproline II helix	trans	-55.1	120.3	172.3	-58.7	173.4	0	0	0	106.6	S497	I495-S497 PolarHBondContact O-N 3.35Å
496	P	41.7	Very low	40.3	Very low	79 Å²	79	82.9 Å²	82.9	51%	0.513	50%	0.497	S	S	.	.	P	Polyproline II helix	trans	-63.5	129.4	-173.3	22.9	-32.7	0	0	0	110	S494 I499	S494-P496 WeakPolarHBondContact O-CD 3.26Å; S494-P496 VanDerWaalsContact O-N 3.1Å; P496-I499 HydrophobicContact CB-CG1 4.44Å; P496-I499 HydrophobicContact CG-CD1 4.27Å; P496-I499 HydrophobicContact CG-CG1 3.9Å
497	S	36.8	Very low	40.4	Very low	86 Å²	86	84.8 Å²	84.8	60%	0.601	51%	0.505	S	S	*	.	S	Bend	trans	-49.7	144.1	165.5	46.5	0	0	0	0	109.2	I495 I499	I495-S497 PolarHBondContact O-N 3.35Å; S497-I499 PolarHBondContact O-N 3.48Å
498	S	40.6	Very low	40.4	Very low	22 Å²	22	83.9 Å²	83.9	15%	0.154	50%	0.495	C	S	.	.			trans	-30.4	119.5	-152.5	69.8	0	0	0	0	114.4	Y500 A501	S498-Y500 PolarHBondContact O-N 3.33Å; S498-A501 WeakPolarHBondContact O-CA 3.35Å; S498-A501 WeakPolarHBondContact O-CB 3.48Å; S498-A501 PolarHBondContact O-N 3.2Å
499	I	41.7	Very low	40.8	Very low	78 Å²	78	88.9 Å²	88.9	40%	0.4	50%	0.504	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-16.6	-169.7	-58.6	164.9	0	0	0	113.6	F461 P496 S497 A501	F461-I499 HydrophobicContact CE1-CD1 4.42Å; F461-I499 HydrophobicContact CE2-CB 4.31Å; F461-I499 HydrophobicContact CE2-CG2 3.69Å; F461-I499 HydrophobicContact CZ-CB 3.9Å; F461-I499 HydrophobicContact CZ-CD1 4.01Å; F461-I499 HydrophobicContact CZ-CG2 3.57Å; P496-I499 HydrophobicContact CB-CG1 4.44Å; P496-I499 HydrophobicContact CG-CD1 4.27Å; P496-I499 HydrophobicContact CG-CG1 3.9Å; S497-I499 PolarHBondContact O-N 3.48Å; I499-A501 VanDerWaalsContact C-N 3.33Å
500	Y	39.8	Very low	41.8	Very low	63 Å²	63	82.7 Å²	82.7	25%	0.247	49%	0.491	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.3	2.6	170.4	-72.7	-87.4	0	0	0	114.6	P291 F461 S498 G502 F503 I504	P291-Y500 HydrophobicContact CB-CE2 4.14Å; P291-Y500 VanDerWaalsContact CB-OH 3.3Å; P291-Y500 WeakPolarHBondContact CB-OH 3.42Å; F461-Y500 AromaticContact CE2-CE2 3.94Å; F461-Y500 HydrophobicContact CE2-CE2 3.94Å; F461-Y500 HydrophobicContact CZ-CE2 4.29Å; S498-Y500 PolarHBondContact O-N 3.33Å; Y500-G502 PolarHBondContact O-N 3.31Å; Y500-F503 CarbonylContact O-C 3.54Å; Y500-F503 WeakPolarHBondContact O-CA 3.36Å; Y500-F503 WeakPolarHBondContact O-CB 3.34Å; Y500-F503 PolarHBondContact O-N 3.42Å; Y500-I504 WeakPolarHBondContact O-CB 3.37Å; Y500-I504 VanDerWaalsContact O-CG1 3.32Å; Y500-I504 WeakPolarHBondContact O-CG1 3.47Å; Y500-I504 PolarHBondContact O-N 2.87Å
501	A	34.5	Very low	42.8	Very low	27 Å²	27	78.9 Å²	78.9	22%	0.223	46%	0.46	C	S	.	.	H	α-helix	trans	-51.2	-51.4	-173.9	0	0	0	0	0	111.9	S498 I499 F503 I504 E505	S498-A501 WeakPolarHBondContact O-CA 3.35Å; S498-A501 WeakPolarHBondContact O-CB 3.48Å; S498-A501 PolarHBondContact O-N 3.2Å; I499-A501 VanDerWaalsContact C-N 3.33Å; A501-F503 VanDerWaalsContact C-N 3.27Å; A501-F503 PolarHBondContact O-N 3.49Å; A501-I504 CarbonylContact O-C 3.33Å; A501-I504 WeakPolarHBondContact O-CA 3.35Å; A501-I504 WeakPolarHBondContact O-CB 3.41Å; A501-I504 PolarHBondContact O-N 2.9Å; A501-E505 WeakPolarHBondContact O-CB 3.03Å; A501-E505 WeakPolarHBondContact O-CG 3.48Å; A501-E505 PolarHBondContact O-N 2.88Å
502	G	34.8	Very low	43.9	Very low	47 Å²	47	73.6 Å²	73.6	49%	0.485	43%	0.434	S	S	.	.	H	α-helix	trans	-58.5	-33.2	176.4	0	0	0	0	0	114.4	Y500 S506	Y500-G502 PolarHBondContact O-N 3.31Å; G502-S506 WeakPolarHBondContact O-CB 3.39Å; G502-S506 PolarHBondContact O-N 3.42Å; G502-S506 PolarHBondContact O-OG 3.49Å
503	F	39.2	Very low	45.7	Very low	68 Å²	68	74.6 Å²	74.6	30%	0.298	42%	0.419	S	S	.	.	H	α-helix	trans	-76	-35.5	173.3	-176.8	-105.3	0	0	0	112	Y500 A501 E505 S506 P508	Y500-F503 CarbonylContact O-C 3.54Å; Y500-F503 WeakPolarHBondContact O-CA 3.36Å; Y500-F503 WeakPolarHBondContact O-CB 3.34Å; Y500-F503 PolarHBondContact O-N 3.42Å; A501-F503 VanDerWaalsContact C-N 3.27Å; A501-F503 PolarHBondContact O-N 3.49Å; F503-E505 VanDerWaalsContact C-N 3.31Å; F503-S506 WeakPolarHBondContact CA-OG 3.42Å; F503-S506 PolarHBondContact O-N 3.11Å; F503-S506 PolarHBondContact O-OG 3.21Å; F503-P508 HydrophobicContact CE2-CG 4.35Å
504	I	40.3	Very low	47.6	Very low	25 Å²	25	73.9 Å²	73.9	13%	0.128	41%	0.414	C	S	.	.	H	α-helix	trans	-74.7	-19.3	177.9	-70.6	171.1	0	0	0	111.9	Y500 A501 R509	Y500-I504 WeakPolarHBondContact O-CB 3.37Å; Y500-I504 VanDerWaalsContact O-CG1 3.32Å; Y500-I504 WeakPolarHBondContact O-CG1 3.47Å; Y500-I504 PolarHBondContact O-N 2.87Å; A501-I504 CarbonylContact O-C 3.33Å; A501-I504 WeakPolarHBondContact O-CA 3.35Å; A501-I504 WeakPolarHBondContact O-CB 3.41Å; A501-I504 PolarHBondContact O-N 2.9Å; I504-R509 VanDerWaalsContact CG2-NH1 3.26Å; I504-R509 WeakPolarHBondContact O-CD 3.29Å; I504-R509 PolarHBondContact O-NH1 3.42Å
505	E	38.6	Very low	49.5	Very low	162 Å²	162	69 Å²	69	76%	0.757	38%	0.379	S	S	*	.	H	α-helix	trans	-101.2	-18.8	174.7	-68	175.7	129.9	0	0	112.5	A501 F503	A501-E505 WeakPolarHBondContact O-CB 3.03Å; A501-E505 WeakPolarHBondContact O-CG 3.48Å; A501-E505 PolarHBondContact O-N 2.88Å; F503-E505 VanDerWaalsContact C-N 3.31Å
506	S	42.2	Very low	51.5	Low	41 Å²	41	61.3 Å²	61.3	29%	0.287	34%	0.34	S	S	.	.	S	Bend	trans	-74.2	153.2	178.2	67.7	0	0	0	0	114.8	G502 F503 P508 R509	G502-S506 WeakPolarHBondContact O-CB 3.39Å; G502-S506 PolarHBondContact O-N 3.42Å; G502-S506 PolarHBondContact O-OG 3.49Å; F503-S506 WeakPolarHBondContact CA-OG 3.42Å; F503-S506 PolarHBondContact O-N 3.11Å; F503-S506 PolarHBondContact O-OG 3.21Å; S506-P508 VanDerWaalsContact C-CD 3.42Å; S506-P508 WeakPolarHBondContact OG-CG 3.39Å; S506-R509 WeakPolarHBondContact O-CB 3.49Å; S506-R509 PolarHBondContact O-N 3.28Å; S506-R509 VanDerWaalsContact O-N 3.08Å
507	E	40	Very low	53.7	Low	151 Å²	151	64.2 Å²	64.2	71%	0.706	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-45.6	-39.9	179.2	-60.8	-177.4	120.4	0	0	116.5	R509 V510	E507-R509 PolarHBondContact O-N 3.35Å; E507-V510 VanDerWaalsContact O-CB 3.29Å; E507-V510 WeakPolarHBondContact O-CB 3.29Å; E507-V510 PolarHBondContact O-N 3.49Å
508	P	48.1	Very low	56.2	Low	35 Å²	35	62.6 Å²	62.6	23%	0.227	33%	0.325	C	S	.	.	H	α-helix	trans	-58.5	-13.3	177	19.3	-34	0	0	0	115.5	F503 S506 V510 A511 G512	F503-P508 HydrophobicContact CE2-CG 4.35Å; S506-P508 VanDerWaalsContact C-CD 3.42Å; S506-P508 WeakPolarHBondContact OG-CG 3.39Å; P508-V510 VanDerWaalsContact C-N 3.28Å; P508-V510 PolarHBondContact O-N 3.01Å; P508-A511 VanDerWaalsContact O-CB 3.28Å; P508-A511 WeakPolarHBondContact O-CB 3.45Å; P508-A511 PolarHBondContact O-N 3.24Å; P508-G512 PolarHBondContact O-N 3.36Å
509	R	52	Low	58.6	Low	134 Å²	134	61.5 Å²	61.5	51%	0.506	32%	0.318	S	S	.	.	H	α-helix	trans	-64.7	-32.7	168.1	-169.3	171.4	-179.3	-163	1.8	112.3	I504 S506 E507 G512 Q513	I504-R509 VanDerWaalsContact CG2-NH1 3.26Å; I504-R509 WeakPolarHBondContact O-CD 3.29Å; I504-R509 PolarHBondContact O-NH1 3.42Å; S506-R509 WeakPolarHBondContact O-CB 3.49Å; S506-R509 PolarHBondContact O-N 3.28Å; S506-R509 VanDerWaalsContact O-N 3.08Å; E507-R509 PolarHBondContact O-N 3.35Å; R509-G512 PolarHBondContact O-N 3.47Å; R509-Q513 WeakPolarHBondContact O-CB 3.07Å; R509-Q513 PolarHBondContact O-N 3.1Å
510	V	59.3	Low	61.1	Low	94 Å²	94	58.5 Å²	58.5	57%	0.57	30%	0.303	S	S	*	.	H	α-helix	trans	-65.9	-39.9	172.2	-174.4	0	0	0	0	110.4	E507 P508 Q513 S514	E507-V510 VanDerWaalsContact O-CB 3.29Å; E507-V510 WeakPolarHBondContact O-CB 3.29Å; E507-V510 PolarHBondContact O-N 3.49Å; P508-V510 VanDerWaalsContact C-N 3.28Å; P508-V510 PolarHBondContact O-N 3.01Å; V510-Q513 PolarHBondContact O-N 3.27Å; V510-S514 VanDerWaalsContact O-CB 3.28Å; V510-S514 WeakPolarHBondContact O-CB 3.37Å; V510-S514 PolarHBondContact O-N 3.4Å; V510-S514 PolarHBondContact O-OG 2.91Å
511	A	62.5	Low	63.7	Low	5 Å²	5	60.2 Å²	60.2	4%	0.041	32%	0.316	C	S	.	.	H	α-helix	trans	-59.5	-52.6	172.8	0	0	0	0	0	111.6	L432 S435 P508 Q513 S514 L515	L432-A511 HydrophobicContact CD2-CB 4.2Å; S435-A511 VanDerWaalsContact CB-CB 3.42Å; P508-A511 VanDerWaalsContact O-CB 3.28Å; P508-A511 WeakPolarHBondContact O-CB 3.45Å; P508-A511 PolarHBondContact O-N 3.24Å; A511-Q513 VanDerWaalsContact C-N 3.3Å; A511-Q513 PolarHBondContact O-N 3.05Å; A511-S514 PolarHBondContact O-N 3.12Å; A511-L515 VanDerWaalsContact O-CB 3.31Å; A511-L515 WeakPolarHBondContact O-CB 3.28Å; A511-L515 PolarHBondContact O-N 3.03Å
512	G	68.3	Low	66.6	Low	11 Å²	11	61.6 Å²	61.6	11%	0.113	32%	0.317	C	S	.	.	H	α-helix	trans	-62.5	-33.6	-178.7	0	0	0	0	0	113.5	W280 P508 R509 L516	W280-G512 PolarHBondContact NE1-O 3.44Å; P508-G512 PolarHBondContact O-N 3.36Å; R509-G512 PolarHBondContact O-N 3.47Å; G512-L516 WeakPolarHBondContact O-CB 3.29Å; G512-L516 PolarHBondContact O-N 3.29Å
513	Q	75.8	Confident	69.4	Low	96 Å²	96	59.3 Å²	59.3	45%	0.449	29%	0.294	S	S	.	.	H	α-helix	trans	-76.5	-39.3	175.2	-168.6	172.6	5.9	0	0	112.3	R509 V510 A511 L516 W517	R509-Q513 WeakPolarHBondContact O-CB 3.07Å; R509-Q513 PolarHBondContact O-N 3.1Å; V510-Q513 PolarHBondContact O-N 3.27Å; A511-Q513 VanDerWaalsContact C-N 3.3Å; A511-Q513 PolarHBondContact O-N 3.05Å; Q513-L516 PolarHBondContact O-N 3.28Å; Q513-W517 VanDerWaalsContact O-CD1 3.26Å; Q513-W517 PolarHBondContact O-N 3.44Å
514	S	78.4	Confident	72.1	Confident	58 Å²	58	60.1 Å²	60.1	41%	0.406	30%	0.299	S	S	.	.	H	α-helix	trans	-65.7	-42.9	176.1	-60.3	0	0	0	0	112	V510 A511 L516 W517 L518	V510-S514 VanDerWaalsContact O-CB 3.28Å; V510-S514 WeakPolarHBondContact O-CB 3.37Å; V510-S514 PolarHBondContact O-N 3.4Å; V510-S514 PolarHBondContact O-OG 2.91Å; A511-S514 PolarHBondContact O-N 3.12Å; S514-L516 VanDerWaalsContact C-N 3.32Å; S514-L516 PolarHBondContact O-N 3.41Å; S514-W517 PolarHBondContact O-N 3.5Å; S514-L518 PolarHBondContact O-N 3.38Å; S514-L518 VanDerWaalsContact O-N 3.15Å
515	L	81.8	Confident	74.8	Confident	3 Å²	3	61.8 Å²	61.8	2%	0.016	31%	0.31	C	S	.	.	H	α-helix	trans	-58.7	-43.4	172.3	-178.8	65.3	0	0	0	111.2	W280 L427 A428 L431 A511 L518 Y519	W280-L515 HydrophobicContact CZ2-CD2 4.47Å; L427-L515 HydrophobicContact CG-CD1 4.14Å; A428-L515 HydrophobicContact CB-CD1 4.47Å; A428-L515 HydrophobicContact CB-CD2 4.03Å; L431-L515 HydrophobicContact CB-CD1 4.45Å; L431-L515 HydrophobicContact CD1-CB 4.18Å; L431-L515 HydrophobicContact CD1-CD1 3.69Å; A511-L515 VanDerWaalsContact O-CB 3.31Å; A511-L515 WeakPolarHBondContact O-CB 3.28Å; A511-L515 PolarHBondContact O-N 3.03Å; L515-L518 PolarHBondContact O-N 3.27Å; L515-Y519 HydrophobicContact CD1-CD1 4.39Å; L515-Y519 HydrophobicContact CD1-CE1 3.8Å; L515-Y519 HydrophobicContact CD1-CE2 3.99Å; L515-Y519 HydrophobicContact CD2-CE2 3.92Å; L515-Y519 HydrophobicContact CG-CD2 4.11Å; L515-Y519 HydrophobicContact CG-CE1 4.33Å; L515-Y519 HydrophobicContact CG-CE2 3.62Å; L515-Y519 WeakPolarHBondContact O-CB 3.17Å; L515-Y519 PolarHBondContact O-N 3.43Å
516	L	84.5	Confident	77.5	Confident	3 Å²	3	54 Å²	54	2%	0.016	27%	0.274	C	S	.	.	H	α-helix	trans	-66.4	-38.3	179.2	-175.9	58.7	0	0	0	112.9	L336 H339 L340 G512 Q513 S514 L518 Y519 V520	L336-L516 HydrophobicContact CB-CD1 4.13Å; L336-L516 HydrophobicContact CD2-CD1 3.75Å; H339-L516 HydrophobicContact CB-CD1 4.21Å; H339-L516 HydrophobicContact CB-CD2 3.52Å; L340-L516 HydrophobicContact CD2-CD2 3.77Å; L340-L516 HydrophobicContact CD2-CG 4.01Å; L340-L516 HydrophobicContact CG-CD2 4Å; L340-L516 HydrophobicContact CG-CG 4.41Å; G512-L516 WeakPolarHBondContact O-CB 3.29Å; G512-L516 PolarHBondContact O-N 3.29Å; Q513-L516 PolarHBondContact O-N 3.28Å; S514-L516 VanDerWaalsContact C-N 3.32Å; S514-L516 PolarHBondContact O-N 3.41Å; L516-L518 PolarHBondContact O-N 2.91Å; L516-Y519 WeakPolarHBondContact O-CB 3.3Å; L516-Y519 PolarHBondContact O-N 2.97Å; L516-V520 WeakPolarHBondContact O-CG2 3.47Å; L516-V520 PolarHBondContact O-N 3.26Å
517	W	89.3	Confident	80	Confident	140 Å²	140	52.5 Å²	52.5	53%	0.53	26%	0.263	S	S	.	.	H	α-helix	trans	-62.4	-40.4	172.5	-81.8	119.3	0	0	0	112.7	L340 Q513 S514 V520 L521	L340-W517 HydrophobicContact CD1-CE3 4.37Å; L340-W517 HydrophobicContact CD1-CH2 3.68Å; L340-W517 HydrophobicContact CD1-CZ2 3.87Å; L340-W517 HydrophobicContact CD1-CZ3 3.95Å; L340-W517 HydrophobicContact CD2-CD2 4.1Å; L340-W517 HydrophobicContact CD2-CG 4.45Å; L340-W517 HydrophobicContact CD2-CZ2 4.08Å; Q513-W517 VanDerWaalsContact O-CD1 3.26Å; Q513-W517 PolarHBondContact O-N 3.44Å; S514-W517 PolarHBondContact O-N 3.5Å; W517-V520 WeakPolarHBondContact O-CB 3.38Å; W517-V520 PolarHBondContact O-N 3.06Å; W517-L521 PolarHBondContact O-N 2.89Å
518	L	88.8	Confident	82.5	Confident	51 Å²	51	48.8 Å²	48.8	27%	0.267	25%	0.25	S	S	.	.	H	α-helix	trans	-69.9	-34	176.4	-174.2	52.4	0	0	0	112.1	L427 L431 S514 L515 L516 L521 F522	L427-L518 HydrophobicContact CD1-CD2 3.7Å; L427-L518 HydrophobicContact CD2-CD2 3.72Å; L427-L518 HydrophobicContact CD2-CG 4.02Å; L427-L518 HydrophobicContact CG-CD2 4.13Å; L431-L518 HydrophobicContact CD1-CD2 4.02Å; S514-L518 PolarHBondContact O-N 3.38Å; S514-L518 VanDerWaalsContact O-N 3.15Å; L515-L518 PolarHBondContact O-N 3.27Å; L516-L518 PolarHBondContact O-N 2.91Å; L518-L521 HydrophobicContact CD1-CB 4.45Å; L518-L521 HydrophobicContact CD1-CD2 3.94Å; L518-L521 WeakPolarHBondContact O-CB 3.39Å; L518-L521 PolarHBondContact O-N 3.33Å; L518-F522 HydrophobicContact CD1-CD1 4.35Å; L518-F522 HydrophobicContact CD1-CE1 3.94Å; L518-F522 HydrophobicContact CD1-CZ 4.44Å; L518-F522 HydrophobicContact CG-CE1 4.47Å; L518-F522 PolarHBondContact O-N 2.87Å
519	Y	91.3	Very high	84.7	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-64.6	-37.8	169.3	-74.6	-14.4	0	0	0	112.9	V266 P269 V270 G424 L427 L515 L516 L521 F522 S523	V266-Y519 HydrophobicContact CB-CD1 4.31Å; V266-Y519 HydrophobicContact CB-CG 4.3Å; V266-Y519 HydrophobicContact CG1-CD1 4.32Å; V266-Y519 HydrophobicContact CG1-CD2 4.17Å; V266-Y519 HydrophobicContact CG1-CG 3.8Å; V266-Y519 HydrophobicContact CG2-CD1 3.84Å; V266-Y519 HydrophobicContact CG2-CG 4.07Å; V266-Y519 WeakPolarHBondContact CG2-O 3.39Å; P269-Y519 WeakPolarHBondContact CB-OH 3.3Å; V270-Y519 HydrophobicContact CG2-CD2 3.53Å; V270-Y519 HydrophobicContact CG2-CE2 3.44Å; V270-Y519 VanDerWaalsContact CG2-CE2 3.44Å; G424-Y519 PolarHBondContact O-OH 2.9Å; L427-Y519 HydrophobicContact CD2-CD1 4.45Å; L427-Y519 HydrophobicContact CD2-CE1 4.13Å; L515-Y519 HydrophobicContact CD1-CD1 4.39Å; L515-Y519 HydrophobicContact CD1-CE1 3.8Å; L515-Y519 HydrophobicContact CD1-CE2 3.99Å; L515-Y519 HydrophobicContact CD2-CE2 3.92Å; L515-Y519 HydrophobicContact CG-CD2 4.11Å; L515-Y519 HydrophobicContact CG-CE1 4.33Å; L515-Y519 HydrophobicContact CG-CE2 3.62Å; L515-Y519 WeakPolarHBondContact O-CB 3.17Å; L515-Y519 PolarHBondContact O-N 3.43Å; L516-Y519 WeakPolarHBondContact O-CB 3.3Å; L516-Y519 PolarHBondContact O-N 2.97Å; Y519-L521 VanDerWaalsContact C-N 3.35Å; Y519-F522 PolarHBondContact O-N 3.19Å; Y519-S523 WeakPolarHBondContact O-CB 3.32Å; Y519-S523 PolarHBondContact O-N 3.07Å
520	V	94.1	Very high	86.5	Confident	14 Å²	14	42.1 Å²	42.1	9%	0.085	22%	0.223	C	C	.	.	H	α-helix	trans	-60.3	-43.4	170.4	167.3	0	0	0	0	110.8	L333 L336 L337 L516 W517 S523 M524	L333-V520 HydrophobicContact CD1-CG1 4.01Å; L336-V520 HydrophobicContact CB-CG2 3.75Å; L337-V520 HydrophobicContact CD2-CG1 4.21Å; L337-V520 HydrophobicContact CD2-CG2 4.15Å; L516-V520 WeakPolarHBondContact O-CG2 3.47Å; L516-V520 PolarHBondContact O-N 3.26Å; W517-V520 WeakPolarHBondContact O-CB 3.38Å; W517-V520 PolarHBondContact O-N 3.06Å; V520-S523 WeakPolarHBondContact O-CB 3.38Å; V520-S523 PolarHBondContact O-N 3.33Å; V520-M524 WeakPolarHBondContact O-CG 3.34Å; V520-M524 PolarHBondContact O-N 3.25Å
521	L	94.1	Very high	88	Confident	100 Å²	100	41 Å²	41	52%	0.524	21%	0.213	S	C	.	.	H	α-helix	trans	-59.8	-47.1	175.7	-177.9	66.6	0	0	0	112.2	W517 L518 Y519 S523 M524 V525	W517-L521 PolarHBondContact O-N 2.89Å; L518-L521 HydrophobicContact CD1-CB 4.45Å; L518-L521 HydrophobicContact CD1-CD2 3.94Å; L518-L521 WeakPolarHBondContact O-CB 3.39Å; L518-L521 PolarHBondContact O-N 3.33Å; Y519-L521 VanDerWaalsContact C-N 3.35Å; L521-S523 VanDerWaalsContact C-N 3.3Å; L521-S523 PolarHBondContact O-N 2.82Å; L521-M524 WeakPolarHBondContact O-CB 3.12Å; L521-M524 PolarHBondContact O-N 2.91Å; L521-V525 WeakPolarHBondContact O-CG2 3.11Å; L521-V525 PolarHBondContact O-N 3.43Å
522	F	94.8	Very high	89.1	Confident	55 Å²	55	45.9 Å²	45.9	24%	0.241	24%	0.238	C	C	.	.	H	α-helix	trans	-64.9	-34.6	177.7	-75.7	8.6	0	0	0	112.3	L262 V266 L427 L518 Y519 V525 S526	L262-F522 HydrophobicContact CD2-CD2 4.44Å; L262-F522 HydrophobicContact CD2-CG 4.4Å; V266-F522 HydrophobicContact CG2-CB 3.69Å; V266-F522 HydrophobicContact CG2-CD2 4.44Å; L427-F522 HydrophobicContact CD2-CD2 4.45Å; L427-F522 HydrophobicContact CD2-CE2 3.69Å; L427-F522 HydrophobicContact CD2-CZ 4.08Å; L518-F522 HydrophobicContact CD1-CD1 4.35Å; L518-F522 HydrophobicContact CD1-CE1 3.94Å; L518-F522 HydrophobicContact CD1-CZ 4.44Å; L518-F522 HydrophobicContact CG-CE1 4.47Å; L518-F522 PolarHBondContact O-N 2.87Å; Y519-F522 PolarHBondContact O-N 3.19Å; F522-V525 PolarHBondContact O-N 3.07Å; F522-S526 WeakPolarHBondContact O-CB 3.43Å; F522-S526 PolarHBondContact O-N 3.32Å
523	S	94.9	Very high	89.7	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-65.1	-42	173.2	-165.2	0	0	0	0	112	Y519 V520 L521 V525 S526 L527	Y519-S523 WeakPolarHBondContact O-CB 3.32Å; Y519-S523 PolarHBondContact O-N 3.07Å; V520-S523 WeakPolarHBondContact O-CB 3.38Å; V520-S523 PolarHBondContact O-N 3.33Å; L521-S523 VanDerWaalsContact C-N 3.3Å; L521-S523 PolarHBondContact O-N 2.82Å; S523-V525 PolarHBondContact O-N 3.36Å; S523-S526 WeakPolarHBondContact O-CB 3.4Å; S523-S526 PolarHBondContact O-N 2.93Å; S523-L527 WeakPolarHBondContact O-CB 3.39Å; S523-L527 PolarHBondContact O-N 3.21Å
524	M	95.8	Very high	89.8	Confident	84 Å²	84	43.6 Å²	43.6	41%	0.414	23%	0.228	S	C	.	.	H	α-helix	trans	-61.7	-40.5	173.8	-73.1	-66.2	-74.2	0	0	113	L333 V520 L521 L527 T528	L333-M524 HydrophobicContact CD1-CG 3.89Å; L333-M524 HydrophobicContact CD1-SD 3.78Å; L333-M524 HydrophobicContact CD2-SD 3.43Å; L333-M524 WeakPolarHBondContact CD2-SD 3.28Å; L333-M524 HydrophobicContact CG-SD 4.26Å; V520-M524 WeakPolarHBondContact O-CG 3.34Å; V520-M524 PolarHBondContact O-N 3.25Å; L521-M524 WeakPolarHBondContact O-CB 3.12Å; L521-M524 PolarHBondContact O-N 2.91Å; M524-L527 PolarHBondContact O-N 2.99Å; M524-L527 HydrophobicContact SD-CD2 4.37Å; M524-T528 WeakPolarHBondContact O-CG2 3.44Å; M524-T528 PolarHBondContact O-N 2.94Å; M524-T528 PolarHBondContact O-OG1 3.01Å
525	V	96.1	Very high	89.3	Confident	60 Å²	60	46.3 Å²	46.3	36%	0.364	24%	0.242	S	C	.	.	H	α-helix	trans	-66.6	-41.1	174.2	178.8	0	0	0	0	111.1	L262 L521 F522 S523 L527 T528 L529	L262-V525 HydrophobicContact CD1-CB 4.16Å; L262-V525 HydrophobicContact CD1-CG1 3.62Å; L521-V525 WeakPolarHBondContact O-CG2 3.11Å; L521-V525 PolarHBondContact O-N 3.43Å; F522-V525 PolarHBondContact O-N 3.07Å; S523-V525 PolarHBondContact O-N 3.36Å; V525-L527 PolarHBondContact O-N 2.92Å; V525-T528 WeakPolarHBondContact CA-OG1 3.47Å; V525-T528 PolarHBondContact O-OG1 3.45Å; V525-L529 HydrophobicContact CG1-CD1 4.07Å; V525-L529 HydrophobicContact CG1-CG 4.48Å; V525-L529 WeakPolarHBondContact O-CB 3.03Å; V525-L529 VanDerWaalsContact O-CG 3.26Å; V525-L529 WeakPolarHBondContact O-CG 3.15Å; V525-L529 PolarHBondContact O-N 2.96Å
526	S	94.9	Very high	88.4	Confident	0 Å²	0	48 Å²	48	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-63.3	-40.5	175.3	-176.3	0	0	0	0	113	A259 Y329 F522 S523 S530	A259-S526 PolarHBondContact O-OG 3.43Å; Y329-S526 VanDerWaalsContact CD2-OG 3.3Å; Y329-S526 WeakPolarHBondContact CD2-OG 3.47Å; Y329-S526 VanDerWaalsContact CE2-OG 3.26Å; Y329-S526 WeakPolarHBondContact CE2-OG 3.36Å; F522-S526 WeakPolarHBondContact O-CB 3.43Å; F522-S526 PolarHBondContact O-N 3.32Å; S523-S526 WeakPolarHBondContact O-CB 3.4Å; S523-S526 PolarHBondContact O-N 2.93Å; S526-S530 WeakPolarHBondContact O-CB 3.15Å; S526-S530 PolarHBondContact O-N 2.91Å; S526-S530 VanDerWaalsContact O-N 3.11Å; S526-S530 PolarHBondContact O-OG 3.07Å
527	L	94.9	Very high	87.2	Confident	8 Å²	8	51.2 Å²	51.2	4%	0.042	26%	0.264	C	S	.	.	H	α-helix	trans	-64.1	-50.4	176.3	174	62.5	0	0	0	111.8	V326 M330 L333 S523 M524 V525 S530 L531	V326-L527 HydrophobicContact CG1-CD1 4.21Å; M330-L527 HydrophobicContact CE-CD1 4.21Å; M330-L527 HydrophobicContact CE-CD2 3.99Å; M330-L527 HydrophobicContact CG-CD1 3.82Å; M330-L527 HydrophobicContact CG-CD2 4.49Å; M330-L527 HydrophobicContact SD-CD1 3.91Å; M330-L527 HydrophobicContact SD-CD2 3.52Å; M330-L527 VanDerWaalsContact SD-CD2 3.52Å; M330-L527 HydrophobicContact SD-CG 4.37Å; L333-L527 HydrophobicContact CD2-CD2 3.92Å; S523-L527 WeakPolarHBondContact O-CB 3.39Å; S523-L527 PolarHBondContact O-N 3.21Å; M524-L527 PolarHBondContact O-N 2.99Å; M524-L527 HydrophobicContact SD-CD2 4.37Å; V525-L527 PolarHBondContact O-N 2.92Å; L527-S530 WeakPolarHBondContact O-CA 3.4Å; L527-S530 WeakPolarHBondContact O-CB 3.33Å; L527-S530 PolarHBondContact O-N 2.79Å; L527-L531 HydrophobicContact CD1-CD1 4.32Å; L527-L531 HydrophobicContact CD1-CG 4.39Å; L527-L531 HydrophobicContact CG-CD1 4.19Å; L527-L531 WeakPolarHBondContact O-CG 3.32Å; L527-L531 PolarHBondContact O-N 2.96Å
528	T	93.9	Very high	84.8	Confident	73 Å²	73	51 Å²	51	45%	0.448	28%	0.278	S	S	.	.	H	α-helix	trans	-62.6	-43.9	179.2	48.4	0	0	0	0	112	M524 V525 S530 L531 L532	M524-T528 WeakPolarHBondContact O-CG2 3.44Å; M524-T528 PolarHBondContact O-N 2.94Å; M524-T528 PolarHBondContact O-OG1 3.01Å; V525-T528 WeakPolarHBondContact CA-OG1 3.47Å; V525-T528 PolarHBondContact O-OG1 3.45Å; T528-S530 PolarHBondContact O-N 2.79Å; T528-L531 PolarHBondContact O-N 2.85Å; T528-L532 WeakPolarHBondContact O-CG 3.2Å; T528-L532 PolarHBondContact O-N 2.65Å; T528-L532 VanDerWaalsContact O-N 3.11Å
529	L	92.9	Very high	82.5	Confident	28 Å²	28	57 Å²	57	15%	0.147	31%	0.305	C	S	.	.	H	α-helix	trans	-56.8	-32.8	171.2	-74.7	171.7	0	0	0	112.9	L258 A259 L262 V525 I533	L258-L529 HydrophobicContact CB-CD1 4.38Å; L258-L529 HydrophobicContact CD2-CD1 3.79Å; L258-L529 HydrophobicContact CG-CD1 3.84Å; A259-L529 HydrophobicContact CB-CB 3.88Å; A259-L529 HydrophobicContact CB-CD1 4.28Å; L262-L529 HydrophobicContact CD1-CD1 4.01Å; V525-L529 HydrophobicContact CG1-CD1 4.07Å; V525-L529 HydrophobicContact CG1-CG 4.48Å; V525-L529 WeakPolarHBondContact O-CB 3.03Å; V525-L529 VanDerWaalsContact O-CG 3.26Å; V525-L529 WeakPolarHBondContact O-CG 3.15Å; V525-L529 PolarHBondContact O-N 2.96Å; L529-I533 WeakPolarHBondContact O-CG1 3.17Å
530	S	90.1	Very high	80	Confident	2 Å²	2	61.3 Å²	61.3	1%	0.014	34%	0.341	C	S	.	.	H	α-helix	trans	-81.6	-34	179.8	-60.4	0	0	0	0	113.4	Y329 S526 L527 T528 L532 I533 V534	Y329-S530 WeakPolarHBondContact CD2-OG 3.43Å; Y329-S530 WeakPolarHBondContact CE2-OG 3.43Å; S526-S530 WeakPolarHBondContact O-CB 3.15Å; S526-S530 PolarHBondContact O-N 2.91Å; S526-S530 VanDerWaalsContact O-N 3.11Å; S526-S530 PolarHBondContact O-OG 3.07Å; L527-S530 WeakPolarHBondContact O-CA 3.4Å; L527-S530 WeakPolarHBondContact O-CB 3.33Å; L527-S530 PolarHBondContact O-N 2.79Å; T528-S530 PolarHBondContact O-N 2.79Å; S530-L532 VanDerWaalsContact C-N 3.31Å; S530-L532 PolarHBondContact O-N 3.1Å; S530-I533 WeakPolarHBondContact O-CB 3.31Å; S530-I533 PolarHBondContact O-N 3.38Å; S530-V534 PolarHBondContact O-N 3.5Å
531	L	90.3	Very high	77.7	Confident	69 Å²	69	65.7 Å²	65.7	36%	0.361	36%	0.363	S	S	.	.	H	α-helix	trans	-60.8	-41.7	170.4	-73	166.1	0	0	0	110.9	V326 L527 T528 I533 V534 V535	V326-L531 HydrophobicContact CG1-CD2 3.64Å; V326-L531 HydrophobicContact CG1-CG 4.28Å; V326-L531 HydrophobicContact CG2-CD2 4.28Å; L527-L531 HydrophobicContact CD1-CD1 4.32Å; L527-L531 HydrophobicContact CD1-CG 4.39Å; L527-L531 HydrophobicContact CG-CD1 4.19Å; L527-L531 WeakPolarHBondContact O-CG 3.32Å; L527-L531 PolarHBondContact O-N 2.96Å; T528-L531 PolarHBondContact O-N 2.85Å; L531-I533 PolarHBondContact O-N 3.2Å; L531-V534 PolarHBondContact O-N 3.06Å; L531-V535 WeakPolarHBondContact O-CG2 3.23Å; L531-V535 PolarHBondContact O-N 3Å
532	L	86.4	Confident	75	Confident	109 Å²	109	63.8 Å²	63.8	57%	0.571	37%	0.367	S	S	*	.	H	α-helix	trans	-57.7	-34	174.4	-68.5	173.2	0	0	0	113.1	T528 S530 V534 D536	T528-L532 WeakPolarHBondContact O-CG 3.2Å; T528-L532 PolarHBondContact O-N 2.65Å; T528-L532 VanDerWaalsContact O-N 3.11Å; S530-L532 VanDerWaalsContact C-N 3.31Å; S530-L532 PolarHBondContact O-N 3.1Å; L532-V534 VanDerWaalsContact C-N 3.33Å; L532-D536 VanDerWaalsContact O-CB 3.27Å; L532-D536 WeakPolarHBondContact O-CB 3.47Å; L532-D536 PolarHBondContact O-N 3.45Å
533	I	81	Confident	72.3	Confident	15 Å²	15	66.6 Å²	66.6	8%	0.077	39%	0.394	C	S	.	.	H	α-helix	trans	-70	-31.2	177.4	-61.3	163.8	0	0	0	111.7	C255 L256 L529 S530 L531	C255-I533 HydrophobicContact CB-CD1 3.91Å; C255-I533 HydrophobicContact CB-CG1 3.86Å; L256-I533 HydrophobicContact CB-CD1 3.89Å; L256-I533 HydrophobicContact CD1-CD1 4.4Å; L529-I533 WeakPolarHBondContact O-CG1 3.17Å; S530-I533 WeakPolarHBondContact O-CB 3.31Å; S530-I533 PolarHBondContact O-N 3.38Å; L531-I533 PolarHBondContact O-N 3.2Å
534	V	78.3	Confident	69.5	Low	44 Å²	44	71.9 Å²	71.9	27%	0.267	43%	0.431	S	S	.	.	H	α-helix	trans	-80.5	-46.2	178.8	177.9	0	0	0	0	111.4	V326 S530 L531 L532 D536 K537	V326-V534 HydrophobicContact CG2-CG2 3.6Å; S530-V534 PolarHBondContact O-N 3.5Å; L531-V534 PolarHBondContact O-N 3.06Å; L532-V534 VanDerWaalsContact C-N 3.33Å; V534-D536 PolarHBondContact O-N 3.34Å; V534-K537 CarbonylContact O-C 3.38Å; V534-K537 PolarHBondContact O-N 2.95Å
535	V	66.8	Low	66.6	Low	114 Å²	114	78.3 Å²	78.3	69%	0.691	45%	0.45	S	S	*	.	H	α-helix	trans	-57.2	-36.7	177.1	173.5	0	0	0	0	111.4	L531 K537	L531-V535 WeakPolarHBondContact O-CG2 3.23Å; L531-V535 PolarHBondContact O-N 3Å; V535-K537 PolarHBondContact O-N 3.33Å
536	D	63.8	Low	64.2	Low	38 Å²	38	78.4 Å²	78.4	20%	0.203	45%	0.452	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.7	7.9	178.2	-157.5	26	0	0	0	113.7	K248 R251 Q252 L532 V534	K248-D536 VanDerWaalsContact CE-CG 3.47Å; K248-D536 WeakPolarHBondContact CE-O 3.39Å; K248-D536 VanDerWaalsContact CE-OD1 3.28Å; K248-D536 WeakPolarHBondContact CE-OD1 3.45Å; K248-D536 WeakPolarHBondContact CE-OD2 3.24Å; K248-D536 VanDerWaalsContact NZ-CG 3.26Å; K248-D536 PolarHBondContact NZ-O 2.99Å; K248-D536 IonicContact NZ-OD1 3.69Å; K248-D536 PolarHBondContact NZ-OD1 3.31Å; K248-D536 IonicContact NZ-OD2 2.71Å; R251-D536 IonicContact CZ-OD2 3.62Å; R251-D536 IonicContact NE-OD2 3.58Å; R251-D536 IonicContact NH2-OD1 3.47Å; R251-D536 PolarHBondContact NH2-OD1 2.99Å; R251-D536 VanDerWaalsContact NH2-OD1 3.1Å; R251-D536 IonicContact NH2-OD2 3.27Å; R251-D536 PolarHBondContact NH2-OD2 2.62Å; Q252-D536 VanDerWaalsContact NE2-CG 3.3Å; Q252-D536 PolarHBondContact NE2-O 2.91Å; Q252-D536 PolarHBondContact NE2-OD2 3.45Å; L532-D536 VanDerWaalsContact O-CB 3.27Å; L532-D536 WeakPolarHBondContact O-CB 3.47Å; L532-D536 PolarHBondContact O-N 3.45Å; V534-D536 PolarHBondContact O-N 3.34Å
537	K	57.8	Low	61.5	Low	71 Å²	71	86.9 Å²	86.9	31%	0.309	49%	0.492	S	S	.	.			trans	-150.1	81.6	177.7	-70.7	-172.9	-178.7	174.5	0	114.4	V534 V535	V534-K537 CarbonylContact O-C 3.38Å; V534-K537 PolarHBondContact O-N 2.95Å; V535-K537 PolarHBondContact O-N 3.33Å
538	V	40.9	Very low	58.9	Low	136 Å²	136	98 Å²	98	82%	0.824	53%	0.533	S	S	*	.	S	Bend	trans	-89.4	-14.8	165.3	172.4	0	0	0	0	113.1
539	Q	38.5	Very low	56.4	Low	177 Å²	177	98.2 Å²	98.2	83%	0.827	54%	0.537	S	S	*	.	S	Bend	trans	-126.9	147.2	-172.1	-72.6	175.9	-19.4	0	0	114.8
540	A	40.6	Very low	54.2	Low	90 Å²	90	107.8 Å²	107.8	74%	0.744	57%	0.572	S	S	*	*			trans	58.2	70.3	163.4	0	0	0	0	0	117.9
541	I	45.3	Very low	52.6	Low	107 Å²	107	111 Å²	111	55%	0.549	59%	0.588	S	S	.	*			trans	-105.2	91	131.7	-60.4	-179.1	0	0	0	106.1	Y321	Y321-I541 HydrophobicContact CD2-CD1 4.17Å; Y321-I541 HydrophobicContact CE2-CD1 4.37Å
542	G	37.2	Very low	51	Low	60 Å²	60	112.6 Å²	112.6	62%	0.619	60%	0.601	S	S	*	*			trans	-63.1	142.5	174.9	0	0	0	0	0	110.6	S544	G542-S544 VanDerWaalsContact C-N 3.29Å; G542-S544 PolarHBondContact O-N 3.11Å
543	S	36.8	Very low	50	Low	114 Å²	114	109.9 Å²	109.9	80%	0.797	59%	0.591	S	S	*	*			trans	-70.3	85.4	174.8	-177.5	0	0	0	0	110.2	R545	S543-R545 PolarHBondContact O-N 2.85Å
544	S	37.5	Very low	49.8	Very low	111 Å²	111	110.5 Å²	110.5	78%	0.776	59%	0.594	S	S	*	*			trans	-66.4	83.2	153.2	55.3	0	0	0	0	107.1	G542 P546	G542-S544 VanDerWaalsContact C-N 3.29Å; G542-S544 PolarHBondContact O-N 3.11Å; S544-P546 WeakPolarHBondContact O-CD 3.37Å
545	R	35.5	Very low	49.8	Very low	218 Å²	218	112.8 Å²	112.8	82%	0.823	61%	0.609	S	S	*	*			trans	-52.5	107.4	176.9	175.4	-179	-179.8	169.5	-1.8	108.1	S543 E547	S543-R545 PolarHBondContact O-N 2.85Å; R545-E547 PolarHBondContact O-N 2.75Å
546	P	44.7	Very low	50.6	Low	63 Å²	63	110.5 Å²	110.5	41%	0.409	59%	0.592	S	S	.	*			trans	-65.4	130.3	175.5	28.1	-32.3	0	0	0	107.4	S544	S544-P546 WeakPolarHBondContact O-CD 3.37Å
547	E	38.2	Very low	51.6	Low	178 Å²	178	108.8 Å²	108.8	83%	0.832	58%	0.583	S	S	*	*			trans	-60	143.3	168.1	-70.7	-167.2	104.7	0	0	109.2	R545 S549	R545-E547 PolarHBondContact O-N 2.75Å; E547-S549 PolarHBondContact O-N 2.69Å
548	R	40.9	Very low	53	Low	241 Å²	241	107.2 Å²	107.2	91%	0.909	58%	0.578	S	S	*	*			trans	-82.2	49.1	-172.8	-163.8	-174.4	173.4	-179	-3.6	111.2	R550	R548-R550 PolarHBondContact O-N 2.99Å
549	S	41.3	Very low	55.4	Low	77 Å²	77	106.3 Å²	106.3	54%	0.538	57%	0.568	S	S	.	*			trans	-69.9	121.8	166.9	-165.2	0	0	0	0	108.9	E547 D551	E547-S549 PolarHBondContact O-N 2.69Å; S549-D551 VanDerWaalsContact CB-OD1 3.24Å; S549-D551 WeakPolarHBondContact CB-OD1 3.4Å; S549-D551 PolarHBondContact O-N 2.66Å; S549-D551 PolarHBondContact OG-OD1 2.71Å
550	R	47	Very low	57.9	Low	230 Å²	230	99.7 Å²	99.7	87%	0.868	54%	0.537	S	S	*	.			trans	-84.8	74.8	166.2	-102.7	-178.8	161.3	174.9	-8.1	107.2	R548 V552	R548-R550 PolarHBondContact O-N 2.99Å; R550-V552 PolarHBondContact O-N 2.83Å; R550-V552 VanDerWaalsContact O-N 3.13Å
551	D	55.3	Low	60.4	Low	68 Å²	68	95.4 Å²	95.4	36%	0.364	50%	0.501	S	S	.	.			trans	-60.7	117.3	-180	-72.2	-11.2	0	0	0	110	S549 S553 I554	S549-D551 VanDerWaalsContact CB-OD1 3.24Å; S549-D551 WeakPolarHBondContact CB-OD1 3.4Å; S549-D551 PolarHBondContact O-N 2.66Å; S549-D551 PolarHBondContact OG-OD1 2.71Å; D551-S553 PolarHBondContact O-N 3.49Å; D551-S553 VanDerWaalsContact O-N 3.1Å; D551-I554 HydrophobicContact CB-CD1 4.34Å; D551-I554 HydrophobicContact CB-CG1 4.37Å; D551-I554 WeakPolarHBondContact O-CB 3.31Å; D551-I554 PolarHBondContact O-N 2.9Å
552	V	57.3	Low	62.8	Low	104 Å²	104	90.4 Å²	90.4	63%	0.63	48%	0.476	S	S	*	.	H	α-helix	trans	-54.6	-33.5	-178.2	-179.4	0	0	0	0	111.4	R550 I554 T555 D556	R550-V552 PolarHBondContact O-N 2.83Å; R550-V552 VanDerWaalsContact O-N 3.13Å; V552-I554 PolarHBondContact O-N 3.43Å; V552-I554 VanDerWaalsContact O-N 3.16Å; V552-T555 WeakPolarHBondContact O-CB 3.35Å; V552-T555 PolarHBondContact O-N 3.13Å; V552-D556 PolarHBondContact O-N 3.49Å
553	S	65.3	Low	65.6	Low	51 Å²	51	89.6 Å²	89.6	36%	0.357	46%	0.46	S	S	.	.	H	α-helix	trans	-56.1	-27.7	174.8	-170.7	0	0	0	0	114.4	D551 T557	D551-S553 PolarHBondContact O-N 3.49Å; D551-S553 VanDerWaalsContact O-N 3.1Å; S553-T557 WeakPolarHBondContact O-CB 3.44Å; S553-T557 PolarHBondContact O-N 3.34Å; S553-T557 VanDerWaalsContact O-N 3.17Å; S553-T557 PolarHBondContact O-OG1 2.83Å
554	I	76	Confident	68.5	Low	29 Å²	29	84.2 Å²	84.2	15%	0.149	42%	0.422	C	S	.	.	H	α-helix	trans	-72	-49.4	174.4	-67.8	175.7	0	0	0	109.3	D551 V552 D556 T557 L558 H680 V684	D551-I554 HydrophobicContact CB-CD1 4.34Å; D551-I554 HydrophobicContact CB-CG1 4.37Å; D551-I554 WeakPolarHBondContact O-CB 3.31Å; D551-I554 PolarHBondContact O-N 2.9Å; V552-I554 PolarHBondContact O-N 3.43Å; V552-I554 VanDerWaalsContact O-N 3.16Å; I554-D556 PolarHBondContact O-N 2.87Å; I554-T557 WeakPolarHBondContact O-CB 3.48Å; I554-T557 PolarHBondContact O-N 3.37Å; I554-L558 HydrophobicContact CG2-CD1 4.12Å; I554-L558 WeakPolarHBondContact O-CG 3.46Å; I554-L558 PolarHBondContact O-N 2.61Å; I554-H680 HydrophobicContact CD1-CB 4.14Å; I554-V684 HydrophobicContact CG1-CG2 4.36Å; I554-V684 HydrophobicContact CG2-CG2 4.16Å
555	T	79.7	Confident	71.3	Confident	92 Å²	92	79 Å²	79	56%	0.564	39%	0.386	S	S	*	.	H	α-helix	trans	-59.6	-44.7	178.5	-52.3	0	0	0	0	111.6	V552 T557 L558 L559	V552-T555 WeakPolarHBondContact O-CB 3.35Å; V552-T555 PolarHBondContact O-N 3.13Å; T555-T557 PolarHBondContact O-N 3.05Å; T555-L558 PolarHBondContact O-N 3.33Å; T555-L559 PolarHBondContact O-N 2.86Å
556	D	82.7	Confident	74.3	Confident	65 Å²	65	71.3 Å²	71.3	35%	0.348	36%	0.357	S	S	.	.	H	α-helix	trans	-58.9	-47.6	175.3	-73.1	-18.4	0	0	0	111.6	V552 I554 L558 L559 F560	V552-D556 PolarHBondContact O-N 3.49Å; I554-D556 PolarHBondContact O-N 2.87Å; D556-L558 VanDerWaalsContact C-N 3.26Å; D556-L558 PolarHBondContact O-N 3.42Å; D556-L559 PolarHBondContact O-N 3.36Å; D556-F560 WeakPolarHBondContact O-CD2 3.43Å; D556-F560 PolarHBondContact O-N 3.22Å
557	T	85.8	Confident	76.8	Confident	2 Å²	2	68.3 Å²	68.3	1%	0.012	34%	0.338	C	S	.	.	H	α-helix	trans	-56.4	-42.2	177.6	-63.3	0	0	0	0	111.4	S553 I554 T555 A561 L672 H677 V684 L729	S553-T557 WeakPolarHBondContact O-CB 3.44Å; S553-T557 PolarHBondContact O-N 3.34Å; S553-T557 VanDerWaalsContact O-N 3.17Å; S553-T557 PolarHBondContact O-OG1 2.83Å; I554-T557 WeakPolarHBondContact O-CB 3.48Å; I554-T557 PolarHBondContact O-N 3.37Å; T555-T557 PolarHBondContact O-N 3.05Å; T557-A561 VanDerWaalsContact O-CB 3.24Å; T557-A561 WeakPolarHBondContact O-CB 3.38Å; T557-A561 PolarHBondContact O-N 3.29Å; T557-L672 HydrophobicContact CG2-CD2 4.16Å; T557-H677 VanDerWaalsContact CG2-CE1 3.48Å; T557-H677 WeakPolarHBondContact CG2-CE1 3.34Å; T557-H677 PolarHBondContact OG1-CE1 3.43Å; T557-V684 HydrophobicContact CG2-CG1 4.1Å; T557-L729 HydrophobicContact CG2-CD2 4.21Å
558	L	87.3	Confident	79.6	Confident	39 Å²	39	59.8 Å²	59.8	20%	0.204	30%	0.298	C	S	.	.	H	α-helix	trans	-71.1	-37.6	179.8	-63.2	175.8	0	0	0	112.5	I554 T555 D556 F560 G562 V684 P687 L688	I554-L558 HydrophobicContact CG2-CD1 4.12Å; I554-L558 WeakPolarHBondContact O-CG 3.46Å; I554-L558 PolarHBondContact O-N 2.61Å; T555-L558 PolarHBondContact O-N 3.33Å; D556-L558 VanDerWaalsContact C-N 3.26Å; D556-L558 PolarHBondContact O-N 3.42Å; L558-F560 PolarHBondContact O-N 3.28Å; L558-G562 VanDerWaalsContact O-CA 3.25Å; L558-G562 WeakPolarHBondContact O-CA 3.22Å; L558-G562 PolarHBondContact O-N 2.61Å; L558-V684 HydrophobicContact CD2-CG1 4.16Å; L558-P687 HydrophobicContact CD1-CB 3.99Å; L558-P687 HydrophobicContact CD1-CG 3.49Å; L558-P687 VanDerWaalsContact CD1-CG 3.49Å; L558-P687 HydrophobicContact CD2-CB 4.11Å; L558-P687 HydrophobicContact CD2-CG 3.62Å; L558-P687 HydrophobicContact CG-CG 4.21Å; L558-L688 HydrophobicContact CD2-CD1 4.46Å; L558-L688 HydrophobicContact CD2-CD2 3.79Å; L558-L688 HydrophobicContact CD2-CG 3.68Å
559	L	89.8	Confident	82.3	Confident	117 Å²	117	48.3 Å²	48.3	61%	0.613	26%	0.255	S	S	*	.	H	α-helix	trans	-62.6	-41.4	175.8	-177.3	63	0	0	0	111.9	T555 D556 P563	T555-L559 PolarHBondContact O-N 2.86Å; D556-L559 PolarHBondContact O-N 3.36Å; L559-P563 VanDerWaalsContact O-CD 3.29Å; L559-P563 WeakPolarHBondContact O-CD 3.41Å
560	F	92.6	Very high	84.9	Confident	38 Å²	38	44.8 Å²	44.8	17%	0.167	23%	0.23	C	C	.	.	H	α-helix	trans	-88.5	-30.7	-177.1	-67.2	-67.5	0	0	0	114.9	D556 L558 P725 Y726 L729	D556-F560 WeakPolarHBondContact O-CD2 3.43Å; D556-F560 PolarHBondContact O-N 3.22Å; L558-F560 PolarHBondContact O-N 3.28Å; F560-P725 HydrophobicContact CB-CB 4.45Å; F560-P725 HydrophobicContact CD1-CB 4.03Å; F560-P725 CarbonylContact O-C 3.45Å; F560-P725 WeakPolarHBondContact O-CB 3.38Å; F560-Y726 WeakPolarHBondContact O-CA 3.38Å; F560-Y726 PolarHBondContact O-N 2.99Å; F560-L729 HydrophobicContact CB-CB 3.68Å; F560-L729 HydrophobicContact CB-CD1 4.43Å; F560-L729 HydrophobicContact CB-CD2 4.16Å; F560-L729 HydrophobicContact CB-CG 4.31Å; F560-L729 HydrophobicContact CD2-CD1 4.47Å; F560-L729 HydrophobicContact CG-CB 4.32Å
561	A	93.3	Very high	87.3	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-96.4	-19.1	178.6	0	0	0	0	0	114	T557 L564 A565 L672 L688 Y726 L729	T557-A561 VanDerWaalsContact O-CB 3.24Å; T557-A561 WeakPolarHBondContact O-CB 3.38Å; T557-A561 PolarHBondContact O-N 3.29Å; A561-L564 PolarHBondContact O-N 2.83Å; A561-A565 PolarHBondContact O-N 3.19Å; A561-L672 HydrophobicContact CB-CD2 3.55Å; A561-L688 HydrophobicContact CB-CD2 4Å; A561-Y726 HydrophobicContact CB-CD2 4.29Å; A561-L729 HydrophobicContact CB-CD2 3.89Å
562	G	94.9	Very high	89.2	Confident	2 Å²	2	31.5 Å²	31.5	2%	0.021	18%	0.176	C	C	.	.	H	α-helix	trans	-57.8	-46	179.1	0	0	0	0	0	114.6	L558 L564 A565 Y566	L558-G562 VanDerWaalsContact O-CA 3.25Å; L558-G562 WeakPolarHBondContact O-CA 3.22Å; L558-G562 PolarHBondContact O-N 2.61Å; G562-L564 VanDerWaalsContact C-N 3.29Å; G562-L564 PolarHBondContact O-N 2.87Å; G562-A565 PolarHBondContact O-N 3.24Å; G562-A565 VanDerWaalsContact O-N 3.14Å; G562-Y566 PolarHBondContact O-N 2.83Å
563	P	96.7	Very high	91	Very high	43 Å²	43	26.6 Å²	26.6	28%	0.279	15%	0.146	S	C	.	.	H	α-helix	trans	-57.2	-38.5	175.3	-29.3	37.8	0	0	0	113.5	L559 Y566 F567 S722	L559-P563 VanDerWaalsContact O-CD 3.29Å; L559-P563 WeakPolarHBondContact O-CD 3.41Å; P563-Y566 PolarHBondContact O-N 3.35Å; P563-F567 PolarHBondContact O-N 3.04Å; P563-S722 VanDerWaalsContact C-CB 3.44Å; P563-S722 WeakPolarHBondContact O-CB 3.43Å
564	L	96.3	Very high	92.5	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-71.6	-38.6	176.1	-176.9	63.9	0	0	0	111.7	A561 G562 Y566 F567 V568 W665 L669 V723 Y726	A561-L564 PolarHBondContact O-N 2.83Å; G562-L564 VanDerWaalsContact C-N 3.29Å; G562-L564 PolarHBondContact O-N 2.87Å; L564-Y566 VanDerWaalsContact C-N 3.29Å; L564-Y566 PolarHBondContact O-N 3.45Å; L564-F567 HydrophobicContact CD1-CD1 4.17Å; L564-F567 PolarHBondContact O-N 3.04Å; L564-V568 HydrophobicContact CD1-CG2 4.34Å; L564-V568 HydrophobicContact CG-CG2 4.43Å; L564-V568 VanDerWaalsContact O-CG2 3.29Å; L564-V568 WeakPolarHBondContact O-CG2 3.41Å; L564-V568 PolarHBondContact O-N 3.21Å; L564-W665 HydrophobicContact CD1-CD2 4.14Å; L564-W665 HydrophobicContact CD1-CE3 3.98Å; L564-W665 HydrophobicContact CD1-CZ3 4.43Å; L564-W665 HydrophobicContact CD2-CE3 4.09Å; L564-L669 HydrophobicContact CD2-CD2 4.14Å; L564-L669 HydrophobicContact CD2-CG 4.3Å; L564-L669 HydrophobicContact CG-CD1 4.47Å; L564-L669 HydrophobicContact CG-CD2 4.39Å; L564-V723 HydrophobicContact CD1-CG2 4.42Å; L564-Y726 HydrophobicContact CD2-CD1 3.32Å; L564-Y726 HydrophobicContact CD2-CD2 4.11Å; L564-Y726 HydrophobicContact CD2-CE1 3.82Å; L564-Y726 HydrophobicContact CD2-CG 3.49Å; L564-Y726 VanDerWaalsContact CD2-CG 3.49Å
565	A	96.8	Very high	93.4	Very high	3 Å²	3	22.8 Å²	22.8	3%	0.025	12%	0.122	C	C	.	.	H	α-helix	trans	-62.1	-37.8	174.3	0	0	0	0	0	112	A561 G562 G569 L669 L688 R692	A561-A565 PolarHBondContact O-N 3.19Å; G562-A565 PolarHBondContact O-N 3.24Å; G562-A565 VanDerWaalsContact O-N 3.14Å; A565-G569 PolarHBondContact O-N 3.39Å; A565-L669 HydrophobicContact CB-CD1 4.44Å; A565-L688 HydrophobicContact CB-CB 4.16Å; A565-L688 HydrophobicContact CB-CD2 4.16Å; A565-L688 WeakPolarHBondContact CB-O 3.47Å; A565-R692 WeakPolarHBondContact O-CA 3.27Å; A565-R692 VanDerWaalsContact O-CB 3.22Å; A565-R692 WeakPolarHBondContact O-CB 3.04Å; A565-R692 WeakPolarHBondContact O-CG 3.41Å
566	Y	97.8	Very high	93.9	Very high	55 Å²	55	19.5 Å²	19.5	22%	0.216	10%	0.1	C	C	.	.	H	α-helix	trans	-63.3	-49.2	171.5	-179.2	-91.8	0	0	0	112.2	G562 P563 L564 V568 G569 T570 L691 L694 L698 L718	G562-Y566 PolarHBondContact O-N 2.83Å; P563-Y566 PolarHBondContact O-N 3.35Å; L564-Y566 VanDerWaalsContact C-N 3.29Å; L564-Y566 PolarHBondContact O-N 3.45Å; Y566-V568 PolarHBondContact O-N 3.1Å; Y566-G569 VanDerWaalsContact O-CA 3.29Å; Y566-G569 WeakPolarHBondContact O-CA 3.34Å; Y566-G569 PolarHBondContact O-N 2.93Å; Y566-T570 HydrophobicContact CD1-CG2 4.1Å; Y566-T570 HydrophobicContact CE1-CG2 3.55Å; Y566-T570 PolarHBondContact O-N 3.14Å; Y566-L691 WeakPolarHBondContact CD2-O 3.41Å; Y566-L694 HydrophobicContact CD2-CB 4.45Å; Y566-L694 HydrophobicContact CD2-CD2 4.44Å; Y566-L694 HydrophobicContact CD2-CG 4.49Å; Y566-L694 HydrophobicContact CE2-CB 4.42Å; Y566-L694 HydrophobicContact CE2-CD2 4.24Å; Y566-L694 HydrophobicContact CE2-CG 4.09Å; Y566-L698 HydrophobicContact CE2-CD1 4.23Å; Y566-L718 HydrophobicContact CD1-CD2 4.09Å; Y566-L718 HydrophobicContact CE1-CD1 3.91Å; Y566-L718 HydrophobicContact CE1-CD2 3.79Å
567	F	97.7	Very high	94.2	Very high	0 Å²	0	16.4 Å²	16.4	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-58.1	-43.7	177.8	172.4	-96.5	0	0	0	112.8	P563 L564 G569 T570 E571 H631 W665 L715 L718 L719	P563-F567 PolarHBondContact O-N 3.04Å; L564-F567 HydrophobicContact CD1-CD1 4.17Å; L564-F567 PolarHBondContact O-N 3.04Å; F567-G569 PolarHBondContact O-N 3.01Å; F567-T570 WeakPolarHBondContact CA-OG1 3.47Å; F567-T570 PolarHBondContact O-N 3.44Å; F567-T570 VanDerWaalsContact O-N 3.09Å; F567-T570 PolarHBondContact O-OG1 3.48Å; F567-E571 HydrophobicContact CE1-CB 4.28Å; F567-E571 HydrophobicContact CZ-CB 4.17Å; F567-E571 PolarHBondContact O-N 2.84Å; F567-H631 AromaticContact CZ-CE1 3.83Å; F567-H631 AromaticContact CZ-NE2 3.61Å; F567-W665 AromaticContact CE1-NE1 3.84Å; F567-L715 HydrophobicContact CE2-CD2 4.24Å; F567-L718 HydrophobicContact CD2-CB 3.85Å; F567-L719 HydrophobicContact CD1-CD1 4.4Å; F567-L719 HydrophobicContact CD2-CB 4.27Å; F567-L719 HydrophobicContact CE1-CD1 3.8Å; F567-L719 HydrophobicContact CE2-CB 3.73Å; F567-L719 HydrophobicContact CE2-CD1 4.28Å; F567-L719 HydrophobicContact CZ-CB 4Å; F567-L719 HydrophobicContact CZ-CD1 3.73Å; F567-L719 HydrophobicContact CZ-CG 4.37Å
568	V	97.3	Very high	94.5	Very high	0 Å²	0	16.4 Å²	16.4	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-64.1	-23.1	174.5	174	0	0	0	0	111.8	L564 Y566 Q572 W665 L669	L564-V568 HydrophobicContact CD1-CG2 4.34Å; L564-V568 HydrophobicContact CG-CG2 4.43Å; L564-V568 VanDerWaalsContact O-CG2 3.29Å; L564-V568 WeakPolarHBondContact O-CG2 3.41Å; L564-V568 PolarHBondContact O-N 3.21Å; Y566-V568 PolarHBondContact O-N 3.1Å; V568-Q572 WeakPolarHBondContact O-CB 3.5Å; V568-Q572 WeakPolarHBondContact O-CG 3.49Å; V568-W665 HydrophobicContact CG2-CB 3.47Å; V568-W665 VanDerWaalsContact CG2-CB 3.47Å; V568-W665 HydrophobicContact CG2-CG 4.11Å; V568-L669 HydrophobicContact CB-CD1 4.33Å; V568-L669 HydrophobicContact CG2-CD1 3.96Å
569	G	97.1	Very high	94.8	Very high	0 Å²	0	14.5 Å²	14.5	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-71.3	-50.7	168	0	0	0	0	0	112.7	A565 Y566 F567 Q572 A573 R692 L696	A565-G569 PolarHBondContact O-N 3.39Å; Y566-G569 VanDerWaalsContact O-CA 3.29Å; Y566-G569 WeakPolarHBondContact O-CA 3.34Å; Y566-G569 PolarHBondContact O-N 2.93Å; F567-G569 PolarHBondContact O-N 3.01Å; G569-Q572 PolarHBondContact O-N 3.13Å; G569-A573 PolarHBondContact O-N 3.15Å; G569-R692 VanDerWaalsContact CA-O 3.29Å; G569-R692 WeakPolarHBondContact CA-O 3.48Å; G569-L696 WeakPolarHBondContact O-CD2 3.34Å; G569-L696 WeakPolarHBondContact O-CG 3.4Å
570	T	96.8	Very high	94.8	Very high	3 Å²	3	9 Å²	9	2%	0.018	5%	0.045	C	C	.	.	H	α-helix	trans	-65.4	-40.9	-179.2	55.8	0	0	0	0	112.3	Y566 F567 Q572 A573 Y574 T699 L715 L718	Y566-T570 HydrophobicContact CD1-CG2 4.1Å; Y566-T570 HydrophobicContact CE1-CG2 3.55Å; Y566-T570 PolarHBondContact O-N 3.14Å; F567-T570 WeakPolarHBondContact CA-OG1 3.47Å; F567-T570 PolarHBondContact O-N 3.44Å; F567-T570 VanDerWaalsContact O-N 3.09Å; F567-T570 PolarHBondContact O-OG1 3.48Å; T570-Q572 VanDerWaalsContact C-N 3.25Å; T570-Q572 PolarHBondContact O-N 2.82Å; T570-A573 PolarHBondContact O-N 3.27Å; T570-Y574 WeakPolarHBondContact O-CB 3.41Å; T570-Y574 PolarHBondContact O-N 3.45Å; T570-T699 WeakPolarHBondContact CA-OG1 3.24Å; T570-T699 WeakPolarHBondContact CB-OG1 3.45Å; T570-T699 WeakPolarHBondContact CG2-OG1 3.41Å; T570-L715 WeakPolarHBondContact OG1-CD2 3.41Å; T570-L718 HydrophobicContact CG2-CD1 4.08Å
571	E	95.9	Very high	94.5	Very high	0 Å²	0	8 Å²	8	0%	0	4%	0.04	C	C	.	.	H	α-helix	trans	-62.7	-33.3	178.9	91.6	-177.5	149.3	0	0	111.9	F567 M575 H631 W658	F567-E571 HydrophobicContact CE1-CB 4.28Å; F567-E571 HydrophobicContact CZ-CB 4.17Å; F567-E571 PolarHBondContact O-N 2.84Å; E571-M575 WeakPolarHBondContact O-CB 3.36Å; E571-M575 PolarHBondContact O-N 2.69Å; E571-M575 VanDerWaalsContact O-N 3.11Å; E571-H631 IonicContact OE2-CE1 2.72Å; E571-H631 PolarHBondContact OE2-CE1 3.38Å; E571-H631 IonicContact OE2-ND1 3.62Å; E571-H631 PolarHBondContact OE2-ND1 3.22Å; E571-W658 HydrophobicContact CB-CZ2 3.76Å; E571-W658 VanDerWaalsContact O-CZ2 3.25Å; E571-W658 WeakPolarHBondContact O-CZ2 3.15Å; E571-W658 PolarHBondContact O-NE1 3.38Å
572	Q	95.8	Very high	94.2	Very high	19 Å²	19	8.1 Å²	8.1	9%	0.089	4%	0.041	C	C	.	.	H	α-helix	trans	-79.5	-38.5	-177.7	-73.8	175.7	12.5	0	0	112.6	V568 G569 T570 M575 M576 N662 E666 R692 L696	V568-Q572 WeakPolarHBondContact O-CB 3.5Å; V568-Q572 WeakPolarHBondContact O-CG 3.49Å; G569-Q572 PolarHBondContact O-N 3.13Å; T570-Q572 VanDerWaalsContact C-N 3.25Å; T570-Q572 PolarHBondContact O-N 2.82Å; Q572-M575 PolarHBondContact O-N 3.47Å; Q572-M576 HydrophobicContact CB-CE 4.27Å; Q572-M576 WeakPolarHBondContact O-CB 3.43Å; Q572-M576 VanDerWaalsContact O-CE 3.3Å; Q572-M576 WeakPolarHBondContact O-CE 3.24Å; Q572-M576 WeakPolarHBondContact O-CG 3.44Å; Q572-M576 PolarHBondContact O-N 2.94Å; Q572-N662 PolarHBondContact NE2-OD1 3.26Å; Q572-E666 PolarHBondContact NE2-OE1 3.35Å; Q572-R692 VanDerWaalsContact CD-NH2 3.34Å; Q572-R692 VanDerWaalsContact OE1-CZ 3.24Å; Q572-L696 HydrophobicContact CB-CD2 3.88Å
573	A	96	Very high	94	Very high	0 Å²	0	8 Å²	8	0%	0	4%	0.04	C	C	.	.	H	α-helix	trans	-67.4	-41.4	173.4	0	0	0	0	0	111.4	G569 T570 M575 M576 G577 L696 T699 F700	G569-A573 PolarHBondContact O-N 3.15Å; T570-A573 PolarHBondContact O-N 3.27Å; A573-M575 VanDerWaalsContact C-N 3.33Å; A573-M575 PolarHBondContact O-N 3.4Å; A573-M576 PolarHBondContact O-N 3.37Å; A573-G577 PolarHBondContact O-N 2.99Å; A573-L696 HydrophobicContact CB-CD2 3.92Å; A573-L696 WeakPolarHBondContact CB-O 3.25Å; A573-T699 HydrophobicContact CB-CG2 3.74Å; A573-F700 HydrophobicContact CB-CD2 3.59Å; A573-F700 HydrophobicContact CB-CE1 4.5Å; A573-F700 HydrophobicContact CB-CE2 3.54Å; A573-F700 HydrophobicContact CB-CG 4.11Å; A573-F700 HydrophobicContact CB-CZ 4.03Å
574	Y	95.6	Very high	93.6	Very high	1 Å²	1	6 Å²	6	0%	0.004	3%	0.027	C	C	.	.	H	α-helix	trans	-56.9	-46.7	174	-177.9	-94.8	0	0	0	111.8	T570 M576 D578 F579 L638 W658 E708 K711 I712 L715	T570-Y574 WeakPolarHBondContact O-CB 3.41Å; T570-Y574 PolarHBondContact O-N 3.45Å; Y574-M576 PolarHBondContact O-N 3.13Å; Y574-D578 WeakPolarHBondContact CA-OD2 3.03Å; Y574-D578 HydrophobicContact CD2-CB 3.45Å; Y574-D578 VanDerWaalsContact CD2-CB 3.45Å; Y574-D578 HydrophobicContact CE2-CB 3.57Å; Y574-D578 HydrophobicContact CG-CB 4.1Å; Y574-D578 WeakPolarHBondContact O-CB 3.33Å; Y574-D578 PolarHBondContact O-N 3.21Å; Y574-F579 HydrophobicContact CD1-CB 4.4Å; Y574-F579 HydrophobicContact CE1-CB 4.09Å; Y574-F579 PolarHBondContact O-N 3.45Å; Y574-L638 HydrophobicContact CE1-CD1 4.48Å; Y574-W658 AromaticContact CD1-CH2 3.47Å; Y574-W658 HydrophobicContact CD1-CH2 3.47Å; Y574-W658 VanDerWaalsContact CD1-CH2 3.47Å; Y574-W658 AromaticContact CD1-CZ2 3.82Å; Y574-W658 HydrophobicContact CD1-CZ2 3.82Å; Y574-W658 HydrophobicContact CD1-CZ3 4.21Å; Y574-W658 AromaticContact CE1-CH2 3.9Å; Y574-W658 HydrophobicContact CE1-CH2 3.9Å; Y574-W658 HydrophobicContact CE1-CZ3 4.24Å; Y574-W658 HydrophobicContact CG-CH2 4.47Å; Y574-E708 WeakPolarHBondContact CE2-OE1 3.43Å; Y574-E708 PolarHBondContact OH-OE1 3.03Å; Y574-K711 HydrophobicContact CD2-CB 4.3Å; Y574-K711 HydrophobicContact CE2-CB 4.09Å; Y574-I712 HydrophobicContact CE2-CG1 4.25Å; Y574-I712 WeakPolarHBondContact OH-CG1 3.33Å; Y574-L715 HydrophobicContact CD1-CD1 3.76Å; Y574-L715 HydrophobicContact CD2-CD1 3.65Å; Y574-L715 HydrophobicContact CE1-CD1 4.27Å; Y574-L715 HydrophobicContact CE2-CD1 4.18Å; Y574-L715 HydrophobicContact CG-CD1 3.44Å; Y574-L715 VanDerWaalsContact CG-CD1 3.44Å
575	M	94.8	Very high	92.9	Very high	0 Å²	0	6.2 Å²	6.2	0%	0	3%	0.028	C	C	.	.	H	α-helix	trans	-67.5	-34.2	177.8	-171.1	63.9	-164.5	0	0	113.6	E571 Q572 A573 F579 L580 M600 A655 W658	E571-M575 WeakPolarHBondContact O-CB 3.36Å; E571-M575 PolarHBondContact O-N 2.69Å; E571-M575 VanDerWaalsContact O-N 3.11Å; Q572-M575 PolarHBondContact O-N 3.47Å; A573-M575 VanDerWaalsContact C-N 3.33Å; A573-M575 PolarHBondContact O-N 3.4Å; M575-F579 HydrophobicContact CE-CD1 3.54Å; M575-F579 HydrophobicContact CE-CE1 3.66Å; M575-F579 HydrophobicContact SD-CB 4.21Å; M575-F579 HydrophobicContact SD-CD1 3.51Å; M575-F579 VanDerWaalsContact SD-CD1 3.51Å; M575-F579 HydrophobicContact SD-CE1 4.12Å; M575-F579 HydrophobicContact SD-CG 3.95Å; M575-L580 WeakPolarHBondContact O-CG 3.36Å; M575-M600 HydrophobicContact CE-SD 3.93Å; M575-M600 HydrophobicContact CG-CE 3.84Å; M575-M600 HydrophobicContact CG-SD 3.64Å; M575-A655 HydrophobicContact CE-CB 3.59Å; M575-W658 HydrophobicContact CB-CZ2 4.49Å; M575-W658 HydrophobicContact CG-CG 4.17Å; M575-W658 HydrophobicContact SD-CB 4.08Å; M575-W658 HydrophobicContact SD-CD2 4.07Å; M575-W658 HydrophobicContact SD-CG 3.75Å
576	M	91.4	Very high	92.2	Very high	23 Å²	23	6.2 Å²	6.2	11%	0.113	3%	0.028	C	C	.	.	H	α-helix	trans	-84.4	-23.1	-178.9	-73.1	-174.2	-64.6	0	0	114	A272 Q572 A573 Y574 L696 F700	A272-M576 CarbonylContact C-O 3.6Å; A272-M576 WeakPolarHBondContact CA-O 3.3Å; A272-M576 HydrophobicContact CB-CB 4.29Å; A272-M576 HydrophobicContact CB-CG 4.29Å; Q572-M576 HydrophobicContact CB-CE 4.27Å; Q572-M576 WeakPolarHBondContact O-CB 3.43Å; Q572-M576 VanDerWaalsContact O-CE 3.3Å; Q572-M576 WeakPolarHBondContact O-CE 3.24Å; Q572-M576 WeakPolarHBondContact O-CG 3.44Å; Q572-M576 PolarHBondContact O-N 2.94Å; A573-M576 PolarHBondContact O-N 3.37Å; Y574-M576 PolarHBondContact O-N 3.13Å; M576-L696 HydrophobicContact CE-CD2 3.88Å; M576-F700 HydrophobicContact CB-CZ 3.95Å; M576-F700 HydrophobicContact CE-CE2 4.25Å; M576-F700 HydrophobicContact CE-CZ 4.21Å
577	G	89.2	Confident	91.6	Very high	0 Å²	0	5 Å²	5	0%	0	3%	0.028	C	C	.	.	T	Hydrogen-bonded Turn	trans	-113.6	-76.5	177.9	0	0	0	0	0	112	G275 S276 A573 L580 R581	G275-G577 VanDerWaalsContact O-CA 3.3Å; G275-G577 WeakPolarHBondContact O-CA 3.29Å; S276-G577 WeakPolarHBondContact CB-O 3.23Å; A573-G577 PolarHBondContact O-N 2.99Å; G577-L580 PolarHBondContact O-N 2.84Å; G577-R581 WeakPolarHBondContact O-CB 3.48Å; G577-R581 PolarHBondContact O-N 3.32Å
578	D	90.9	Very high	90.5	Very high	1 Å²	1	6.8 Å²	6.8	1%	0.005	4%	0.037	C	C	.	.	H	α-helix	trans	-55.8	-56.9	-169.2	-59.5	-60.9	0	0	0	113.4	Y574 L580 R581 A582 H703 K711	Y574-D578 WeakPolarHBondContact CA-OD2 3.03Å; Y574-D578 HydrophobicContact CD2-CB 3.45Å; Y574-D578 VanDerWaalsContact CD2-CB 3.45Å; Y574-D578 HydrophobicContact CE2-CB 3.57Å; Y574-D578 HydrophobicContact CG-CB 4.1Å; Y574-D578 WeakPolarHBondContact O-CB 3.33Å; Y574-D578 PolarHBondContact O-N 3.21Å; D578-L580 PolarHBondContact O-N 3.03Å; D578-R581 PolarHBondContact O-N 3.36Å; D578-A582 WeakPolarHBondContact O-CB 3.34Å; D578-A582 PolarHBondContact O-N 2.83Å; D578-H703 PolarHBondContact N-CE1 3.46Å; D578-H703 WeakPolarHBondContact OD1-CA 3.43Å; D578-H703 IonicContact OD1-CE1 3.26Å; D578-H703 IonicContact OD1-CG 3.93Å; D578-H703 IonicContact OD1-ND1 2.69Å; D578-H703 PolarHBondContact OD1-ND1 3.08Å; D578-K711 HydrophobicContact CB-CD 4.36Å; D578-K711 WeakPolarHBondContact OD1-CD 3.48Å; D578-K711 WeakPolarHBondContact OD1-CE 3.47Å; D578-K711 IonicContact OD1-NZ 3.1Å; D578-K711 PolarHBondContact OD1-NZ 2.85Å
579	F	93.2	Very high	89.4	Confident	0 Å²	0	8.1 Å²	8.1	0%	0	5%	0.051	C	C	.	.	H	α-helix	trans	-59.9	-45.1	-177.9	173.3	-101.5	0	0	0	112.6	Y574 M575 R581 F583 V584 L638 I654 A655	Y574-F579 HydrophobicContact CD1-CB 4.4Å; Y574-F579 HydrophobicContact CE1-CB 4.09Å; Y574-F579 PolarHBondContact O-N 3.45Å; M575-F579 HydrophobicContact CE-CD1 3.54Å; M575-F579 HydrophobicContact CE-CE1 3.66Å; M575-F579 HydrophobicContact SD-CB 4.21Å; M575-F579 HydrophobicContact SD-CD1 3.51Å; M575-F579 VanDerWaalsContact SD-CD1 3.51Å; M575-F579 HydrophobicContact SD-CE1 4.12Å; M575-F579 HydrophobicContact SD-CG 3.95Å; F579-R581 VanDerWaalsContact C-N 3.32Å; F579-R581 PolarHBondContact O-N 3.3Å; F579-F583 HydrophobicContact CD2-CB 4.01Å; F579-F583 AromaticContact CD2-CD2 3.73Å; F579-F583 HydrophobicContact CD2-CD2 3.73Å; F579-F583 HydrophobicContact CD2-CE2 4.4Å; F579-F583 AromaticContact CD2-CG 3.92Å; F579-F583 HydrophobicContact CD2-CG 3.92Å; F579-F583 HydrophobicContact CE2-CB 3.86Å; F579-F583 HydrophobicContact CE2-CD2 4.29Å; F579-F583 AromaticContact CE2-CG 3.99Å; F579-F583 HydrophobicContact CE2-CG 3.99Å; F579-F583 WeakPolarHBondContact O-CB 3.48Å; F579-F583 PolarHBondContact O-N 3.48Å; F579-V584 HydrophobicContact CD1-CG2 4.28Å; F579-V584 HydrophobicContact CE1-CG2 3.69Å; F579-V584 HydrophobicContact CZ-CG2 4.05Å; F579-V584 PolarHBondContact O-N 3.17Å; F579-L638 HydrophobicContact CD2-CD2 3.87Å; F579-L638 HydrophobicContact CE2-CD2 3.85Å; F579-I654 HydrophobicContact CE2-CG2 3.71Å; F579-I654 HydrophobicContact CZ-CB 4.47Å; F579-I654 HydrophobicContact CZ-CG2 3.91Å; F579-A655 HydrophobicContact CE1-CB 4.25Å
580	L	90.2	Very high	88.2	Confident	0 Å²	0	11 Å²	11	0%	0	7%	0.065	C	C	.	.	I	π-helix	trans	-66	-35.4	179.7	-72	174.9	0	0	0	111.8	A272 M575 G577 D578 V584 T585 I593 A596 L597	A272-L580 HydrophobicContact CB-CD1 3.89Å; M575-L580 WeakPolarHBondContact O-CG 3.36Å; G577-L580 PolarHBondContact O-N 2.84Å; D578-L580 PolarHBondContact O-N 3.03Å; L580-V584 HydrophobicContact CD2-CB 4.32Å; L580-V584 HydrophobicContact CD2-CG2 4Å; L580-T585 WeakPolarHBondContact O-CG2 3.41Å; L580-T585 PolarHBondContact O-N 3.2Å; L580-T585 PolarHBondContact O-OG1 3.14Å; L580-I593 HydrophobicContact CD1-CG2 3.97Å; L580-I593 HydrophobicContact CD2-CG1 4.46Å; L580-I593 HydrophobicContact CD2-CG2 4.05Å; L580-A596 HydrophobicContact CD2-CB 4.14Å; L580-L597 HydrophobicContact CD1-CD2 4.22Å
581	R	86.1	Confident	86.9	Confident	19 Å²	19	12.6 Å²	12.6	7%	0.072	8%	0.082	C	C	.	.	I	π-helix	trans	-73.5	-56.7	176.7	-173.1	169.6	-171.2	62.2	-4.7	112.4	S276 E292 M476 G577 D578 F579 T585 C586 H703	S276-R581 WeakPolarHBondContact O-CB 3.37Å; S276-R581 WeakPolarHBondContact O-CD 3.39Å; S276-R581 WeakPolarHBondContact O-CG 3.48Å; S276-R581 PolarHBondContact O-NH1 3.22Å; E292-R581 IonicContact OE1-CZ 3.75Å; E292-R581 VanDerWaalsContact OE1-CZ 3.27Å; E292-R581 IonicContact OE1-NE 2.94Å; E292-R581 PolarHBondContact OE1-NE 2.7Å; E292-R581 VanDerWaalsContact OE1-NE 3.07Å; E292-R581 IonicContact OE1-NH2 3.87Å; E292-R581 PolarHBondContact OE1-NH2 2.86Å; E292-R581 IonicContact OE2-CZ 3.11Å; E292-R581 IonicContact OE2-NE 2.73Å; E292-R581 PolarHBondContact OE2-NE 3.08Å; E292-R581 IonicContact OE2-NH2 2.79Å; M476-R581 HydrophobicContact CE-CG 4.5Å; G577-R581 WeakPolarHBondContact O-CB 3.48Å; G577-R581 PolarHBondContact O-N 3.32Å; D578-R581 PolarHBondContact O-N 3.36Å; F579-R581 VanDerWaalsContact C-N 3.32Å; F579-R581 PolarHBondContact O-N 3.3Å; R581-T585 WeakPolarHBondContact CA-OG1 3.38Å; R581-T585 PolarHBondContact O-OG1 3.01Å; R581-T585 VanDerWaalsContact O-OG1 3.07Å; R581-C586 PolarHBondContact O-N 2.96Å; R581-H703 VanDerWaalsContact CD-CE1 3.48Å; R581-H703 WeakPolarHBondContact CD-CE1 3.44Å; R581-H703 WeakPolarHBondContact CD-NE2 3.49Å
582	A	87.6	Confident	86.1	Confident	2 Å²	2	16.7 Å²	16.7	2%	0.017	10%	0.102	C	C	.	.	I	π-helix	trans	-77.6	-35.7	-168.1	0	0	0	0	0	113.3	G473 M476 D578 C586 E708	G473-A582 PolarHBondContact N-O 3.45Å; M476-A582 HydrophobicContact CB-CB 4.24Å; M476-A582 HydrophobicContact SD-CB 3.69Å; D578-A582 WeakPolarHBondContact O-CB 3.34Å; D578-A582 PolarHBondContact O-N 2.83Å; A582-C586 WeakPolarHBondContact O-CB 3.3Å; A582-E708 HydrophobicContact CB-CG 4.02Å
583	F	89.9	Confident	85.5	Confident	0 Å²	0	15.9 Å²	15.9	0%	0	10%	0.099	C	C	.	.	I	π-helix	trans	-97.9	-62.3	179.5	-61.9	-102.9	0	0	0	110.4	G473 F579 S587 L638 W641 P643 F651 E708 I712	G473-F583 VanDerWaalsContact CA-CE1 3.5Å; F579-F583 HydrophobicContact CD2-CB 4.01Å; F579-F583 AromaticContact CD2-CD2 3.73Å; F579-F583 HydrophobicContact CD2-CD2 3.73Å; F579-F583 HydrophobicContact CD2-CE2 4.4Å; F579-F583 AromaticContact CD2-CG 3.92Å; F579-F583 HydrophobicContact CD2-CG 3.92Å; F579-F583 HydrophobicContact CE2-CB 3.86Å; F579-F583 HydrophobicContact CE2-CD2 4.29Å; F579-F583 AromaticContact CE2-CG 3.99Å; F579-F583 HydrophobicContact CE2-CG 3.99Å; F579-F583 WeakPolarHBondContact O-CB 3.48Å; F579-F583 PolarHBondContact O-N 3.48Å; F583-S587 PolarHBondContact O-OG 3.31Å; F583-L638 HydrophobicContact CD1-CD2 4.24Å; F583-L638 HydrophobicContact CE1-CD2 3.81Å; F583-L638 HydrophobicContact CE2-CD2 4.18Å; F583-L638 HydrophobicContact CZ-CD2 3.78Å; F583-W641 AromaticContact CD1-CE3 3.89Å; F583-W641 HydrophobicContact CD1-CE3 3.89Å; F583-W641 AromaticContact CD1-CZ3 3.75Å; F583-W641 HydrophobicContact CD1-CZ3 3.75Å; F583-W641 HydrophobicContact CE1-CE3 4.12Å; F583-W641 HydrophobicContact CE1-CZ3 4.44Å; F583-P643 HydrophobicContact CD1-CB 4.37Å; F583-P643 HydrophobicContact CD1-CG 4.05Å; F583-F651 HydrophobicContact CB-CD1 4.4Å; F583-F651 HydrophobicContact CB-CE1 4.34Å; F583-F651 WeakPolarHBondContact O-CE1 3.43Å; F583-E708 HydrophobicContact CE2-CG 4.11Å; F583-I712 HydrophobicContact CZ-CD1 4.27Å
584	V	88.5	Confident	85	Confident	1 Å²	1	16.1 Å²	16.1	1%	0.006	10%	0.101	C	C	.	.	I	π-helix	trans	-69.9	-60.3	-169.2	-174.7	0	0	0	0	112.5	F579 L580 C586 S587 L588 G589 M592 A596 F651	F579-V584 HydrophobicContact CD1-CG2 4.28Å; F579-V584 HydrophobicContact CE1-CG2 3.69Å; F579-V584 HydrophobicContact CZ-CG2 4.05Å; F579-V584 PolarHBondContact O-N 3.17Å; L580-V584 HydrophobicContact CD2-CB 4.32Å; L580-V584 HydrophobicContact CD2-CG2 4Å; V584-C586 PolarHBondContact O-N 3.43Å; V584-S587 PolarHBondContact O-N 3.23Å; V584-L588 WeakPolarHBondContact O-CA 3.43Å; V584-L588 WeakPolarHBondContact O-CB 3.5Å; V584-L588 PolarHBondContact O-N 3.15Å; V584-G589 PolarHBondContact O-N 3.38Å; V584-M592 HydrophobicContact CG1-CB 4.35Å; V584-A596 HydrophobicContact CG2-CB 4.41Å; V584-F651 HydrophobicContact CG2-CD1 4.25Å
585	T	82.9	Confident	84.5	Confident	4 Å²	4	17.2 Å²	17.2	3%	0.025	11%	0.112	C	C	.	.	I	π-helix	trans	-73.3	-26.9	-173.1	56.8	0	0	0	0	114.6	N277 Y462 L580 R581 S587 G589 I590 I593	N277-T585 VanDerWaalsContact ND2-CG2 3.33Å; N277-T585 WeakPolarHBondContact ND2-CG2 3.46Å; N277-T585 PolarHBondContact ND2-OG1 3.11Å; Y462-T585 PolarHBondContact OH-OG1 3.5Å; L580-T585 WeakPolarHBondContact O-CG2 3.41Å; L580-T585 PolarHBondContact O-N 3.2Å; L580-T585 PolarHBondContact O-OG1 3.14Å; R581-T585 WeakPolarHBondContact CA-OG1 3.38Å; R581-T585 PolarHBondContact O-OG1 3.01Å; R581-T585 VanDerWaalsContact O-OG1 3.07Å; T585-S587 VanDerWaalsContact C-N 3.31Å; T585-S587 PolarHBondContact O-N 3.1Å; T585-G589 WeakPolarHBondContact O-CA 3.38Å; T585-G589 PolarHBondContact O-N 3.41Å; T585-I590 HydrophobicContact CG2-CB 4.47Å; T585-I590 HydrophobicContact CG2-CG1 4Å; T585-I593 HydrophobicContact CG2-CD1 3.52Å; T585-I593 HydrophobicContact CG2-CG1 3.6Å
586	C	81.5	Confident	84.3	Confident	2 Å²	2	17.2 Å²	17.2	1%	0.014	11%	0.112	C	C	.	.	H	α-helix	trans	-63.1	-37.4	176.3	-171.4	0	0	0	0	112.4	Y462 C472 R581 A582 V584	Y462-C586 HydrophobicContact CD1-CB 3.94Å; Y462-C586 WeakPolarHBondContact CD1-SG 3.42Å; Y462-C586 HydrophobicContact CE1-CB 3.53Å; C472-C586 WeakPolarHBondContact CA-SG 3.28Å; C472-C586 HydrophobicContact CB-CB 3.67Å; C472-C586 WeakPolarHBondContact CB-SG 3.33Å; C472-C586 WeakPolarHBondContact SG-CB 3.44Å; C472-C586 CovalentContact SG-SG 2.03Å; C472-C586 PolarHBondContact SG-SG 2.89Å; R581-C586 PolarHBondContact O-N 2.96Å; A582-C586 WeakPolarHBondContact O-CB 3.3Å; V584-C586 PolarHBondContact O-N 3.43Å
587	S	84.3	Confident	84.3	Confident	31 Å²	31	16.4 Å²	16.4	22%	0.217	11%	0.108	C	C	.	.	H	α-helix	trans	-107	-38.8	-173.6	62.7	0	0	0	0	114.9	F583 V584 T585 F651	F583-S587 PolarHBondContact O-OG 3.31Å; V584-S587 PolarHBondContact O-N 3.23Å; T585-S587 VanDerWaalsContact C-N 3.31Å; T585-S587 PolarHBondContact O-N 3.1Å; S587-F651 WeakPolarHBondContact OG-CE1 3.29Å; S587-F651 WeakPolarHBondContact OG-CZ 3.42Å
588	L	76.1	Confident	84.6	Confident	37 Å²	37	17.8 Å²	17.8	19%	0.194	12%	0.115	C	C	.	.	H	α-helix	trans	-110.4	-5	-176.5	-60.3	-179.5	0	0	0	114	V584 M592 F651	V584-L588 WeakPolarHBondContact O-CA 3.43Å; V584-L588 WeakPolarHBondContact O-CB 3.5Å; V584-L588 PolarHBondContact O-N 3.15Å; L588-M592 HydrophobicContact CB-CB 3.91Å; L588-M592 HydrophobicContact CB-CG 4Å; L588-M592 HydrophobicContact CD1-CB 4.45Å; L588-M592 WeakPolarHBondContact O-CG 3.03Å; L588-F651 HydrophobicContact CD1-CB 4.16Å; L588-F651 HydrophobicContact CD1-CD1 4.16Å; L588-F651 HydrophobicContact CD1-CD2 3.63Å; L588-F651 HydrophobicContact CD1-CE1 4.48Å; L588-F651 HydrophobicContact CD1-CE2 3.98Å; L588-F651 HydrophobicContact CD1-CG 3.71Å; L588-F651 HydrophobicContact CD1-CZ 4.38Å; L588-F651 HydrophobicContact CD2-CE2 4.41Å; L588-F651 HydrophobicContact CG-CD2 4.33Å; L588-F651 HydrophobicContact CG-CE2 4.18Å; L588-F651 HydrophobicContact CG-CZ 4.27Å
589	G	73.3	Confident	84.7	Confident	28 Å²	28	18.5 Å²	18.5	29%	0.289	12%	0.122	S	C	.	.			trans	76.9	176.8	-178.5	0	0	0	0	0	115.2	V584 T585	V584-G589 PolarHBondContact O-N 3.38Å; T585-G589 WeakPolarHBondContact O-CA 3.38Å; T585-G589 PolarHBondContact O-N 3.41Å
590	I	71.6	Confident	84.7	Confident	60 Å²	60	19 Å²	19	31%	0.308	13%	0.125	S	C	.	.	G	3₁₀ helix	trans	-70.1	-37.5	-169.1	-64.9	171.3	0	0	0	112.6	T585 M592 I593	T585-I590 HydrophobicContact CG2-CB 4.47Å; T585-I590 HydrophobicContact CG2-CG1 4Å; I590-M592 PolarHBondContact O-N 3.42Å; I590-M592 VanDerWaalsContact O-N 3.14Å; I590-I593 HydrophobicContact CG2-CD1 4.05Å; I590-I593 WeakPolarHBondContact O-CB 3.49Å; I590-I593 WeakPolarHBondContact O-CD1 3.34Å; I590-I593 VanDerWaalsContact O-CG1 3.27Å; I590-I593 WeakPolarHBondContact O-CG1 3.41Å; I590-I593 PolarHBondContact O-N 3.47Å
591	G	69.6	Low	85	Confident	36 Å²	36	19 Å²	19	37%	0.371	13%	0.125	S	C	.	.	G	3₁₀ helix	trans	-57.9	-30.8	-178.7	0	0	0	0	0	113.8	I593	G591-I593 VanDerWaalsContact C-N 3.34Å; G591-I593 PolarHBondContact O-N 3.48Å
592	M	79.8	Confident	85.5	Confident	86 Å²	86	22 Å²	22	42%	0.424	14%	0.142	S	C	.	.	G	3₁₀ helix	trans	-80.8	-8.4	-175.5	-59.5	-51.9	-117.7	0	0	114.6	V584 L588 I590 A594 G595 A596 Y652	V584-M592 HydrophobicContact CG1-CB 4.35Å; L588-M592 HydrophobicContact CB-CB 3.91Å; L588-M592 HydrophobicContact CB-CG 4Å; L588-M592 HydrophobicContact CD1-CB 4.45Å; L588-M592 WeakPolarHBondContact O-CG 3.03Å; I590-M592 PolarHBondContact O-N 3.42Å; I590-M592 VanDerWaalsContact O-N 3.14Å; M592-A594 PolarHBondContact O-N 3.06Å; M592-G595 PolarHBondContact O-N 3.14Å; M592-A596 PolarHBondContact O-N 3.45Å; M592-Y652 WeakPolarHBondContact CE-OH 3.38Å
593	I	83.3	Confident	85.9	Confident	3 Å²	3	25.7 Å²	25.7	2%	0.015	16%	0.16	C	C	.	.	H	α-helix	trans	-51.8	-44	172.4	-68.8	171.5	0	0	0	111	L273 L580 T585 I590 G591 G595 A596 L597	L273-I593 HydrophobicContact CD2-CD1 3.66Å; L273-I593 HydrophobicContact CD2-CG2 4.2Å; L580-I593 HydrophobicContact CD1-CG2 3.97Å; L580-I593 HydrophobicContact CD2-CG1 4.46Å; L580-I593 HydrophobicContact CD2-CG2 4.05Å; T585-I593 HydrophobicContact CG2-CD1 3.52Å; T585-I593 HydrophobicContact CG2-CG1 3.6Å; I590-I593 HydrophobicContact CG2-CD1 4.05Å; I590-I593 WeakPolarHBondContact O-CB 3.49Å; I590-I593 WeakPolarHBondContact O-CD1 3.34Å; I590-I593 VanDerWaalsContact O-CG1 3.27Å; I590-I593 WeakPolarHBondContact O-CG1 3.41Å; I590-I593 PolarHBondContact O-N 3.47Å; G591-I593 VanDerWaalsContact C-N 3.34Å; G591-I593 PolarHBondContact O-N 3.48Å; I593-G595 VanDerWaalsContact C-N 3.33Å; I593-G595 PolarHBondContact O-N 3.25Å; I593-A596 PolarHBondContact O-N 3.23Å; I593-L597 HydrophobicContact CG2-CD1 3.9Å; I593-L597 HydrophobicContact CG2-CG 4.28Å; I593-L597 PolarHBondContact O-N 3.5Å; I593-L597 VanDerWaalsContact O-N 3.1Å
594	A	85.1	Confident	86.1	Confident	5 Å²	5	25.9 Å²	25.9	4%	0.041	16%	0.16	C	C	.	.	H	α-helix	trans	-62.2	-40.3	-174.3	0	0	0	0	0	112.2	A425 M592 A596 L597 I598	A425-A594 WeakPolarHBondContact O-CB 3.16Å; M592-A594 PolarHBondContact O-N 3.06Å; A594-A596 VanDerWaalsContact C-N 3.34Å; A594-A596 PolarHBondContact O-N 2.88Å; A594-L597 PolarHBondContact O-N 3.28Å; A594-I598 WeakPolarHBondContact O-CD1 3.44Å; A594-I598 VanDerWaalsContact O-CG1 3.23Å; A594-I598 WeakPolarHBondContact O-CG1 3.23Å; A594-I598 PolarHBondContact O-N 3.27Å
595	G	85.6	Confident	86.4	Confident	23 Å²	23	27.2 Å²	27.2	24%	0.237	17%	0.168	C	C	.	.	H	α-helix	trans	-61.6	-39.5	175.8	0	0	0	0	0	113	M592 I593 I598 G599	M592-G595 PolarHBondContact O-N 3.14Å; I593-G595 VanDerWaalsContact C-N 3.33Å; I593-G595 PolarHBondContact O-N 3.25Å; G595-I598 PolarHBondContact O-N 3.42Å; G595-G599 PolarHBondContact O-N 3.45Å
596	A	90.3	Very high	87	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-65	-43.3	175.7	0	0	0	0	0	111.7	L580 V584 M592 I593 A594 G599 M600 A655	L580-A596 HydrophobicContact CD2-CB 4.14Å; V584-A596 HydrophobicContact CG2-CB 4.41Å; M592-A596 PolarHBondContact O-N 3.45Å; I593-A596 PolarHBondContact O-N 3.23Å; A594-A596 VanDerWaalsContact C-N 3.34Å; A594-A596 PolarHBondContact O-N 2.88Å; A596-G599 PolarHBondContact O-N 3.36Å; A596-M600 WeakPolarHBondContact O-CB 3.47Å; A596-M600 PolarHBondContact O-N 2.99Å; A596-A655 HydrophobicContact CB-CB 3.96Å; A596-A655 WeakPolarHBondContact O-CB 3.47Å
597	L	92	Very high	87.5	Confident	6 Å²	6	32.2 Å²	32.2	3%	0.031	19%	0.194	C	C	.	.	H	α-helix	trans	-65.7	-35.4	175.9	-67.1	177.6	0	0	0	112.8	A272 L421 A425 L580 I593 A594 G601	A272-L597 HydrophobicContact CB-CD1 4.02Å; A272-L597 HydrophobicContact CB-CD2 4.32Å; L421-L597 HydrophobicContact CD1-CB 4.33Å; L421-L597 HydrophobicContact CD1-CD2 4.41Å; A425-L597 HydrophobicContact CB-CB 3.68Å; L580-L597 HydrophobicContact CD1-CD2 4.22Å; I593-L597 HydrophobicContact CG2-CD1 3.9Å; I593-L597 HydrophobicContact CG2-CG 4.28Å; I593-L597 PolarHBondContact O-N 3.5Å; I593-L597 VanDerWaalsContact O-N 3.1Å; A594-L597 PolarHBondContact O-N 3.28Å; L597-G601 PolarHBondContact O-N 3.05Å
598	I	94.1	Very high	87.8	Confident	30 Å²	30	30.8 Å²	30.8	15%	0.154	18%	0.184	C	C	.	.	H	α-helix	trans	-64.7	-49.9	173.4	-68.8	160.2	0	0	0	110.5	A425 L426 A594 G595 M600 G601 L602	A425-I598 HydrophobicContact CB-CD1 4.49Å; A425-I598 HydrophobicContact CB-CG1 3.74Å; L426-I598 HydrophobicContact CD2-CD1 3.62Å; L426-I598 HydrophobicContact CD2-CG1 4.35Å; L426-I598 HydrophobicContact CG-CD1 3.87Å; L426-I598 HydrophobicContact CG-CG1 4.14Å; A594-I598 WeakPolarHBondContact O-CD1 3.44Å; A594-I598 VanDerWaalsContact O-CG1 3.23Å; A594-I598 WeakPolarHBondContact O-CG1 3.23Å; A594-I598 PolarHBondContact O-N 3.27Å; G595-I598 PolarHBondContact O-N 3.42Å; I598-M600 VanDerWaalsContact C-N 3.35Å; I598-M600 PolarHBondContact O-N 2.82Å; I598-G601 PolarHBondContact O-N 3.24Å; I598-L602 HydrophobicContact CG2-CD1 3.73Å; I598-L602 HydrophobicContact CG2-CG 4.29Å; I598-L602 WeakPolarHBondContact O-CB 3.27Å; I598-L602 VanDerWaalsContact O-CG 3.31Å; I598-L602 WeakPolarHBondContact O-CG 3.4Å; I598-L602 PolarHBondContact O-N 2.87Å
599	G	93.3	Very high	88.3	Confident	15 Å²	15	31.1 Å²	31.1	16%	0.155	19%	0.189	C	C	.	.	H	α-helix	trans	-59.3	-44.1	178.1	0	0	0	0	0	112.7	G595 A596 M603	G595-G599 PolarHBondContact O-N 3.45Å; A596-G599 PolarHBondContact O-N 3.36Å; G599-M603 PolarHBondContact O-N 2.67Å
600	M	94.7	Very high	89.1	Confident	12 Å²	12	33.2 Å²	33.2	6%	0.059	20%	0.196	C	C	.	.	H	α-helix	trans	-58.7	-50.8	173	-176.2	-171.4	176.1	0	0	111.8	M575 A596 I598 L602 M603 Q604 A655 G659 N662	M575-M600 HydrophobicContact CE-SD 3.93Å; M575-M600 HydrophobicContact CG-CE 3.84Å; M575-M600 HydrophobicContact CG-SD 3.64Å; A596-M600 WeakPolarHBondContact O-CB 3.47Å; A596-M600 PolarHBondContact O-N 2.99Å; I598-M600 VanDerWaalsContact C-N 3.35Å; I598-M600 PolarHBondContact O-N 2.82Å; M600-L602 PolarHBondContact O-N 3.45Å; M600-M603 PolarHBondContact O-N 2.94Å; M600-Q604 WeakPolarHBondContact O-CB 3.49Å; M600-Q604 PolarHBondContact O-N 3.47Å; M600-A655 WeakPolarHBondContact CA-O 3.12Å; M600-A655 WeakPolarHBondContact CB-O 3.4Å; M600-G659 WeakPolarHBondContact O-CA 3.31Å; M600-N662 WeakPolarHBondContact CE-ND2 3.25Å
601	G	95.2	Very high	89.8	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-63.6	-40.6	-178.9	0	0	0	0	0	113.5	L597 I598 Q604 L605	L597-G601 PolarHBondContact O-N 3.05Å; I598-G601 PolarHBondContact O-N 3.24Å; G601-Q604 PolarHBondContact O-N 3.01Å; G601-L605 WeakPolarHBondContact O-CB 3.46Å; G601-L605 PolarHBondContact O-N 3.23Å
602	L	96.3	Very high	90.1	Very high	80 Å²	80	30.1 Å²	30.1	42%	0.419	17%	0.173	S	C	.	.	H	α-helix	trans	-61.9	-48.9	177.4	-75.3	169.2	0	0	0	111.8	I422 I598 M600 L605 I606	I422-L602 HydrophobicContact CD1-CD2 3.95Å; I422-L602 HydrophobicContact CD1-CG 4.23Å; I422-L602 HydrophobicContact CG1-CG 4.43Å; I598-L602 HydrophobicContact CG2-CD1 3.73Å; I598-L602 HydrophobicContact CG2-CG 4.29Å; I598-L602 WeakPolarHBondContact O-CB 3.27Å; I598-L602 VanDerWaalsContact O-CG 3.31Å; I598-L602 WeakPolarHBondContact O-CG 3.4Å; I598-L602 PolarHBondContact O-N 2.87Å; M600-L602 PolarHBondContact O-N 3.45Å; L602-L605 PolarHBondContact O-N 2.96Å; L602-I606 WeakPolarHBondContact O-CD1 3.4Å; L602-I606 VanDerWaalsContact O-CG1 3.28Å; L602-I606 WeakPolarHBondContact O-CG1 3.05Å; L602-I606 PolarHBondContact O-N 3.32Å
603	M	95.9	Very high	90.1	Very high	81 Å²	81	30.3 Å²	30.3	40%	0.399	17%	0.174	S	C	.	.	H	α-helix	trans	-68.4	-36.2	177.4	-71.4	-54.5	178.2	0	0	112.5	G599 M600 L605 I606 V607 A656 A660	G599-M603 PolarHBondContact O-N 2.67Å; M600-M603 PolarHBondContact O-N 2.94Å; M603-L605 VanDerWaalsContact C-N 3.35Å; M603-L605 PolarHBondContact O-N 3.05Å; M603-I606 PolarHBondContact O-N 3.39Å; M603-I606 HydrophobicContact SD-CD1 4.05Å; M603-V607 WeakPolarHBondContact O-CG2 3.48Å; M603-V607 PolarHBondContact O-N 3.11Å; M603-A656 WeakPolarHBondContact CB-O 3.48Å; M603-A656 HydrophobicContact CE-CB 4.41Å; M603-A656 HydrophobicContact CG-CB 3.62Å; M603-A656 WeakPolarHBondContact CG-O 3.2Å; M603-A660 HydrophobicContact CB-CB 4.24Å
604	Q	95.1	Very high	90	Very high	3 Å²	3	33.9 Å²	33.9	1%	0.014	19%	0.193	C	C	.	.	H	α-helix	trans	-62.1	-43.6	175.1	-169.4	152.3	29.6	0	0	111.2	M600 G601 V607 S608 G659 N662	M600-Q604 WeakPolarHBondContact O-CB 3.49Å; M600-Q604 PolarHBondContact O-N 3.47Å; G601-Q604 PolarHBondContact O-N 3.01Å; Q604-V607 PolarHBondContact O-N 3.49Å; Q604-S608 VanDerWaalsContact O-CB 3.31Å; Q604-S608 WeakPolarHBondContact O-CB 3.44Å; Q604-S608 PolarHBondContact O-N 3.25Å; Q604-S608 PolarHBondContact O-OG 3.35Å; Q604-G659 WeakPolarHBondContact CA-O 3.42Å; Q604-G659 WeakPolarHBondContact CB-O 3.43Å; Q604-N662 VanDerWaalsContact NE2-C 3.27Å; Q604-N662 PolarHBondContact NE2-ND2 3.37Å; Q604-N662 PolarHBondContact NE2-OD1 3.28Å; Q604-N662 PolarHBondContact OE1-ND2 2.9Å; Q604-N662 VanDerWaalsContact OE1-ND2 3.14Å
605	L	94.6	Very high	89.8	Confident	30 Å²	30	35.7 Å²	35.7	16%	0.157	20%	0.202	C	C	.	.	H	α-helix	trans	-59.3	-46.4	173.8	175.5	60.8	0	0	0	112.4	V415 D418 L419 I422 G601 L602 M603 S608 C609	V415-L605 HydrophobicContact CB-CD1 4.07Å; V415-L605 HydrophobicContact CG1-CD1 3.83Å; V415-L605 HydrophobicContact CG2-CD1 3.84Å; D418-L605 HydrophobicContact CB-CB 3.85Å; D418-L605 HydrophobicContact CB-CD1 4.22Å; L419-L605 HydrophobicContact CD2-CD2 3.8Å; L419-L605 HydrophobicContact CG-CD2 4.28Å; I422-L605 HydrophobicContact CD1-CB 4.4Å; I422-L605 HydrophobicContact CD1-CD2 3.94Å; G601-L605 WeakPolarHBondContact O-CB 3.46Å; G601-L605 PolarHBondContact O-N 3.23Å; L602-L605 PolarHBondContact O-N 2.96Å; M603-L605 VanDerWaalsContact C-N 3.35Å; M603-L605 PolarHBondContact O-N 3.05Å; L605-S608 PolarHBondContact O-N 3.5Å; L605-C609 PolarHBondContact O-N 3.26Å; L605-C609 VanDerWaalsContact O-N 3.12Å; L605-C609 PolarHBondContact O-SG 2.89Å
606	I	94.8	Very high	89.5	Confident	89 Å²	89	42.4 Å²	42.4	46%	0.456	22%	0.22	S	C	.	.	H	α-helix	trans	-61.8	-45.4	178.8	-70	163.6	0	0	0	110.6	L602 M603 C609 T610	L602-I606 WeakPolarHBondContact O-CD1 3.4Å; L602-I606 VanDerWaalsContact O-CG1 3.28Å; L602-I606 WeakPolarHBondContact O-CG1 3.05Å; L602-I606 PolarHBondContact O-N 3.32Å; M603-I606 PolarHBondContact O-N 3.39Å; M603-I606 HydrophobicContact SD-CD1 4.05Å; I606-C609 PolarHBondContact O-N 3.04Å; I606-T610 HydrophobicContact CG2-CG2 4.33Å; I606-T610 WeakPolarHBondContact O-CB 3.44Å; I606-T610 WeakPolarHBondContact O-CG2 3.21Å; I606-T610 PolarHBondContact O-N 3.38Å; I606-T610 PolarHBondContact O-OG1 3.24Å
607	V	93.2	Very high	89.1	Confident	21 Å²	21	49.7 Å²	49.7	13%	0.127	25%	0.253	C	S	.	.	H	α-helix	trans	-67.5	-46.2	178	171.2	0	0	0	0	111.9	M603 Q604 C609 T610 L611 A660 M664	M603-V607 WeakPolarHBondContact O-CG2 3.48Å; M603-V607 PolarHBondContact O-N 3.11Å; Q604-V607 PolarHBondContact O-N 3.49Å; V607-C609 PolarHBondContact O-N 3.02Å; V607-C609 VanDerWaalsContact O-N 3.16Å; V607-T610 WeakPolarHBondContact CA-OG1 3.44Å; V607-T610 PolarHBondContact O-N 3.22Å; V607-T610 PolarHBondContact O-OG1 3.26Å; V607-L611 HydrophobicContact CG1-CB 4.25Å; V607-L611 WeakPolarHBondContact O-CB 3.42Å; V607-L611 PolarHBondContact O-N 3.18Å; V607-A660 HydrophobicContact CG2-CB 3.83Å; V607-M664 HydrophobicContact CG1-CB 4.44Å; V607-M664 HydrophobicContact CG1-CG 3.57Å
608	S	89.2	Confident	88.9	Confident	2 Å²	2	51.7 Å²	51.7	1%	0.014	27%	0.266	C	S	.	.	H	α-helix	trans	-50.7	-40.5	174.9	-71.2	0	0	0	0	112.1	R414 D418 Q604 L605 S612	R414-S608 VanDerWaalsContact CG-OG 3.25Å; R414-S608 WeakPolarHBondContact CG-OG 3.45Å; D418-S608 WeakPolarHBondContact OD2-CB 3.47Å; D418-S608 PolarHBondContact OD2-OG 3.11Å; Q604-S608 VanDerWaalsContact O-CB 3.31Å; Q604-S608 WeakPolarHBondContact O-CB 3.44Å; Q604-S608 PolarHBondContact O-N 3.25Å; Q604-S608 PolarHBondContact O-OG 3.35Å; L605-S608 PolarHBondContact O-N 3.5Å; S608-S612 VanDerWaalsContact O-CB 3.29Å; S608-S612 WeakPolarHBondContact O-CB 3.12Å; S608-S612 PolarHBondContact O-OG 2.95Å
609	C	87.8	Confident	88.6	Confident	44 Å²	44	57.1 Å²	57.1	30%	0.297	29%	0.289	S	S	.	.	H	α-helix	trans	-75.8	-52.8	178	-66.8	0	0	0	0	113.1	V415 L605 I606 V607	V415-C609 VanDerWaalsContact CG2-SG 3.59Å; L605-C609 PolarHBondContact O-N 3.26Å; L605-C609 VanDerWaalsContact O-N 3.12Å; L605-C609 PolarHBondContact O-SG 2.89Å; I606-C609 PolarHBondContact O-N 3.04Å; V607-C609 PolarHBondContact O-N 3.02Å; V607-C609 VanDerWaalsContact O-N 3.16Å
610	T	89.8	Confident	88.4	Confident	71 Å²	71	57.7 Å²	57.7	44%	0.436	29%	0.286	S	S	.	.	H	α-helix	trans	-71.3	-45.3	-173.4	52.3	0	0	0	0	112.4	I606 V607 S612 M613 L614	I606-T610 HydrophobicContact CG2-CG2 4.33Å; I606-T610 WeakPolarHBondContact O-CB 3.44Å; I606-T610 WeakPolarHBondContact O-CG2 3.21Å; I606-T610 PolarHBondContact O-N 3.38Å; I606-T610 PolarHBondContact O-OG1 3.24Å; V607-T610 WeakPolarHBondContact CA-OG1 3.44Å; V607-T610 PolarHBondContact O-N 3.22Å; V607-T610 PolarHBondContact O-OG1 3.26Å; T610-S612 VanDerWaalsContact C-N 3.31Å; T610-S612 PolarHBondContact O-N 3.04Å; T610-M613 CarbonylContact O-C 3.37Å; T610-M613 WeakPolarHBondContact O-CA 3.26Å; T610-M613 WeakPolarHBondContact O-CB 3.3Å; T610-M613 PolarHBondContact O-N 2.04Å; T610-L614 PolarHBondContact O-N 3.15Å
611	L	85.5	Confident	88.2	Confident	10 Å²	10	59.1 Å²	59.1	5%	0.052	29%	0.293	C	S	.	.	H	α-helix	trans	-63.4	-39.7	-177.7	-165.8	75	0	0	0	111.9	V607 M613 L614 L615 V623 M664 T667	V607-L611 HydrophobicContact CG1-CB 4.25Å; V607-L611 WeakPolarHBondContact O-CB 3.42Å; V607-L611 PolarHBondContact O-N 3.18Å; L611-M613 PolarHBondContact O-N 2.95Å; L611-M613 VanDerWaalsContact O-N 3.16Å; L611-L614 HydrophobicContact CD1-CD2 4.01Å; L611-L614 PolarHBondContact O-N 3.04Å; L611-L614 VanDerWaalsContact O-N 3.13Å; L611-L615 HydrophobicContact CD2-CD1 4.37Å; L611-L615 HydrophobicContact CG-CD1 4.1Å; L611-L615 HydrophobicContact CG-CG 4.32Å; L611-L615 WeakPolarHBondContact O-CB 3.13Å; L611-L615 VanDerWaalsContact O-CG 3.3Å; L611-L615 WeakPolarHBondContact O-CG 3.08Å; L611-L615 PolarHBondContact O-N 3.1Å; L611-V623 HydrophobicContact CD1-CB 4.36Å; L611-V623 HydrophobicContact CD1-CG1 3.45Å; L611-V623 VanDerWaalsContact CD1-CG1 3.45Å; L611-V623 HydrophobicContact CD1-CG2 3.94Å; L611-V623 HydrophobicContact CD2-CG1 3.99Å; L611-V623 HydrophobicContact CG-CG1 4.19Å; L611-M664 HydrophobicContact CD2-CB 4.22Å; L611-M664 HydrophobicContact CD2-CG 4.13Å; L611-T667 HydrophobicContact CD2-CG2 3.99Å
612	S	77.4	Confident	88	Confident	22 Å²	22	62.9 Å²	62.9	15%	0.154	32%	0.316	C	S	.	.	H	α-helix	trans	-60.4	-19.2	172.3	-75.4	0	0	0	0	114.5	R411 S608 T610	R411-S612 VanDerWaalsContact CD-CB 3.41Å; R411-S612 VanDerWaalsContact CG-OG 3.28Å; R411-S612 WeakPolarHBondContact CG-OG 3.41Å; S608-S612 VanDerWaalsContact O-CB 3.29Å; S608-S612 WeakPolarHBondContact O-CB 3.12Å; S608-S612 PolarHBondContact O-OG 2.95Å; T610-S612 VanDerWaalsContact C-N 3.31Å; T610-S612 PolarHBondContact O-N 3.04Å
613	M	79.4	Confident	87.8	Confident	90 Å²	90	59.4 Å²	59.4	44%	0.443	30%	0.298	S	S	.	.	H	α-helix	trans	-93.4	-39.1	171.1	-68.3	-165	-69.5	0	0	112	T610 L611 R616	T610-M613 CarbonylContact O-C 3.37Å; T610-M613 WeakPolarHBondContact O-CA 3.26Å; T610-M613 WeakPolarHBondContact O-CB 3.3Å; T610-M613 PolarHBondContact O-N 2.04Å; L611-M613 PolarHBondContact O-N 2.95Å; L611-M613 VanDerWaalsContact O-N 3.16Å; M613-R616 WeakPolarHBondContact O-CB 3.28Å; M613-R616 PolarHBondContact O-N 2.84Å; M613-R616 PolarHBondContact O-NE 3.17Å
614	L	81.8	Confident	87.8	Confident	78 Å²	78	55.6 Å²	55.6	41%	0.408	28%	0.279	S	S	.	.	H	α-helix	trans	-61.9	-40.7	179.4	-168.8	69.1	0	0	0	112.3	T610 L611 R616 H617 V618 V623	T610-L614 PolarHBondContact O-N 3.15Å; L611-L614 HydrophobicContact CD1-CD2 4.01Å; L611-L614 PolarHBondContact O-N 3.04Å; L611-L614 VanDerWaalsContact O-N 3.13Å; L614-R616 PolarHBondContact O-N 2.91Å; L614-H617 PolarHBondContact O-N 2.88Å; L614-V618 HydrophobicContact CD1-CB 4.48Å; L614-V618 HydrophobicContact CD1-CG2 3.61Å; L614-V618 HydrophobicContact CG-CB 4.15Å; L614-V618 HydrophobicContact CG-CG2 3.82Å; L614-V618 PolarHBondContact O-N 3.01Å; L614-V623 HydrophobicContact CD2-CG2 4.32Å
615	L	80.3	Confident	87.7	Confident	42 Å²	42	59.4 Å²	59.4	22%	0.22	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	4.1	176	-72.8	167.3	0	0	0	114.8	L611 R620 V623 T667	L611-L615 HydrophobicContact CD2-CD1 4.37Å; L611-L615 HydrophobicContact CG-CD1 4.1Å; L611-L615 HydrophobicContact CG-CG 4.32Å; L611-L615 WeakPolarHBondContact O-CB 3.13Å; L611-L615 VanDerWaalsContact O-CG 3.3Å; L611-L615 WeakPolarHBondContact O-CG 3.08Å; L611-L615 PolarHBondContact O-N 3.1Å; L615-R620 HydrophobicContact CD2-CB 4.23Å; L615-R620 HydrophobicContact CD2-CG 4.33Å; L615-V623 HydrophobicContact CD2-CG2 4.05Å; L615-T667 HydrophobicContact CD1-CG2 4.45Å
616	R	78.2	Confident	87.7	Confident	165 Å²	165	60.6 Å²	60.6	62%	0.623	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.2	-19.3	167.8	-59.6	178.5	-65.4	178.1	-0.8	113.5	M613 L614	M613-R616 WeakPolarHBondContact O-CB 3.28Å; M613-R616 PolarHBondContact O-N 2.84Å; M613-R616 PolarHBondContact O-NE 3.17Å; L614-R616 PolarHBondContact O-N 2.91Å
617	H	82.8	Confident	87.7	Confident	152 Å²	152	56.4 Å²	56.4	70%	0.704	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122.9	-27.5	-172	-56.5	-78.3	0	0	0	112.4	L614	L614-H617 PolarHBondContact O-N 2.88Å
618	V	87.1	Confident	87.8	Confident	48 Å²	48	57.4 Å²	57.4	29%	0.291	30%	0.295	S	S	.	.	S	Bend	trans	-108.2	137.8	-179.6	-178.2	0	0	0	0	110.3	L614 V622 V623	L614-V618 HydrophobicContact CD1-CB 4.48Å; L614-V618 HydrophobicContact CD1-CG2 3.61Å; L614-V618 HydrophobicContact CG-CB 4.15Å; L614-V618 HydrophobicContact CG-CG2 3.82Å; L614-V618 PolarHBondContact O-N 3.01Å; V618-V622 HydrophobicContact CG1-CB 3.84Å; V618-V622 HydrophobicContact CG1-CG1 4.08Å; V618-V622 HydrophobicContact CG1-CG2 4.41Å; V618-V623 HydrophobicContact CG1-CG2 4.46Å
619	K	87.9	Confident	88.2	Confident	145 Å²	145	63.6 Å²	63.6	63%	0.63	32%	0.322	S	S	*	.			trans	-61.5	138.5	175	-61.6	175.5	-176.5	170.3	0	110.2	I621 V622	K619-I621 VanDerWaalsContact C-N 3.25Å; K619-I621 HydrophobicContact CB-CG2 4.15Å; K619-I621 PolarHBondContact O-N 3.07Å; K619-V622 HydrophobicContact CB-CG2 4.35Å; K619-V622 PolarHBondContact O-N 3.04Å; K619-V622 VanDerWaalsContact O-N 3.07Å
620	R	88.5	Confident	88.5	Confident	27 Å²	27	65.8 Å²	65.8	10%	0.102	33%	0.327	C	S	.	.	H	α-helix	trans	-59.4	-35.8	-173.7	178.1	170.1	-76	-125.9	-21.7	112.9	L615 V622 V623 I624 L668 S671 Y726 E730	L615-R620 HydrophobicContact CD2-CB 4.23Å; L615-R620 HydrophobicContact CD2-CG 4.33Å; R620-V622 VanDerWaalsContact C-N 3.26Å; R620-V622 PolarHBondContact O-N 3.3Å; R620-V623 WeakPolarHBondContact O-CB 3.47Å; R620-V623 PolarHBondContact O-N 3.36Å; R620-V623 VanDerWaalsContact O-N 3.17Å; R620-I624 HydrophobicContact CG-CD1 3.91Å; R620-I624 HydrophobicContact CG-CG1 4.38Å; R620-I624 WeakPolarHBondContact O-CG1 3.41Å; R620-I624 PolarHBondContact O-N 2.69Å; R620-I624 VanDerWaalsContact O-N 3.15Å; R620-L668 HydrophobicContact CG-CD2 3.89Å; R620-L668 PolarHBondContact NH1-O 3.25Å; R620-L668 VanDerWaalsContact NH1-O 3.16Å; R620-S671 PolarHBondContact NH2-OG 3.17Å; R620-Y726 PolarHBondContact NH1-OH 3.03Å; R620-E730 VanDerWaalsContact CD-OE1 3.29Å; R620-E730 WeakPolarHBondContact CD-OE1 3.39Å; R620-E730 VanDerWaalsContact CD-OE2 3.3Å; R620-E730 WeakPolarHBondContact CD-OE2 3.49Å; R620-E730 HydrophobicContact CG-CB 4.48Å; R620-E730 HydrophobicContact CG-CG 4.4Å; R620-E730 IonicContact CZ-OE1 3.65Å; R620-E730 IonicContact NE-OE1 3.64Å; R620-E730 IonicContact NE-OE2 2.69Å; R620-E730 IonicContact NH1-OE1 2.71Å; R620-E730 PolarHBondContact NH1-OE1 2.71Å
621	I	90.5	Very high	88.9	Confident	41 Å²	41	62.4 Å²	62.4	21%	0.21	31%	0.306	C	S	.	.	H	α-helix	trans	-58.4	-33.2	178	-171	58.9	0	0	0	113.7	K619 I624 L625 A727 I731	K619-I621 VanDerWaalsContact C-N 3.25Å; K619-I621 HydrophobicContact CB-CG2 4.15Å; K619-I621 PolarHBondContact O-N 3.07Å; I621-I624 PolarHBondContact O-N 2.97Å; I621-L625 HydrophobicContact CG1-CD1 4.28Å; I621-L625 WeakPolarHBondContact O-CG 3.25Å; I621-L625 PolarHBondContact O-N 3.48Å; I621-A727 HydrophobicContact CD1-CB 3.77Å; I621-I731 HydrophobicContact CD1-CD1 3.92Å; I621-I731 HydrophobicContact CD1-CG1 4.28Å; I621-I731 HydrophobicContact CG1-CD1 4.25Å; I621-I731 HydrophobicContact CG1-CG1 4.46Å
622	V	92.4	Very high	89.4	Confident	79 Å²	79	62.9 Å²	62.9	48%	0.479	31%	0.31	S	S	.	.	H	α-helix	trans	-68.9	-38.5	179.3	-179.4	0	0	0	0	110.8	V618 K619 R620 A626	V618-V622 HydrophobicContact CG1-CB 3.84Å; V618-V622 HydrophobicContact CG1-CG1 4.08Å; V618-V622 HydrophobicContact CG1-CG2 4.41Å; K619-V622 HydrophobicContact CB-CG2 4.35Å; K619-V622 PolarHBondContact O-N 3.04Å; K619-V622 VanDerWaalsContact O-N 3.07Å; R620-V622 VanDerWaalsContact C-N 3.26Å; R620-V622 PolarHBondContact O-N 3.3Å; V622-A626 WeakPolarHBondContact O-CB 3.39Å; V622-A626 PolarHBondContact O-N 3.02Å
623	V	92.5	Very high	90.2	Very high	8 Å²	8	65.7 Å²	65.7	5%	0.048	33%	0.329	C	S	.	.	H	α-helix	trans	-63.9	-43.7	174.2	172.6	0	0	0	0	111	L611 L614 L615 V618 R620 A626 G627 L668	L611-V623 HydrophobicContact CD1-CB 4.36Å; L611-V623 HydrophobicContact CD1-CG1 3.45Å; L611-V623 VanDerWaalsContact CD1-CG1 3.45Å; L611-V623 HydrophobicContact CD1-CG2 3.94Å; L611-V623 HydrophobicContact CD2-CG1 3.99Å; L611-V623 HydrophobicContact CG-CG1 4.19Å; L614-V623 HydrophobicContact CD2-CG2 4.32Å; L615-V623 HydrophobicContact CD2-CG2 4.05Å; V618-V623 HydrophobicContact CG1-CG2 4.46Å; R620-V623 WeakPolarHBondContact O-CB 3.47Å; R620-V623 PolarHBondContact O-N 3.36Å; R620-V623 VanDerWaalsContact O-N 3.17Å; V623-A626 PolarHBondContact O-N 3.28Å; V623-G627 PolarHBondContact O-N 2.97Å; V623-L668 HydrophobicContact CG1-CD1 4.35Å; V623-L668 HydrophobicContact CG1-CD2 4.39Å
624	I	94.2	Very high	91	Very high	0 Å²	0	62 Å²	62	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-62.7	-44.5	-179.9	-65.6	168.8	0	0	0	110.9	R620 I621 G627 F628 W665 L668 V723 Y726 A727 E730	R620-I624 HydrophobicContact CG-CD1 3.91Å; R620-I624 HydrophobicContact CG-CG1 4.38Å; R620-I624 WeakPolarHBondContact O-CG1 3.41Å; R620-I624 PolarHBondContact O-N 2.69Å; R620-I624 VanDerWaalsContact O-N 3.15Å; I621-I624 PolarHBondContact O-N 2.97Å; I624-G627 PolarHBondContact O-N 2.85Å; I624-F628 WeakPolarHBondContact O-CB 3.3Å; I624-F628 PolarHBondContact O-N 3.27Å; I624-W665 HydrophobicContact CG2-CZ3 4.42Å; I624-L668 HydrophobicContact CG1-CD1 4.03Å; I624-L668 HydrophobicContact CG1-CD2 4.19Å; I624-V723 HydrophobicContact CG2-CG1 3.51Å; I624-Y726 HydrophobicContact CD1-CD1 3.86Å; I624-Y726 HydrophobicContact CD1-CE1 3.47Å; I624-Y726 VanDerWaalsContact CD1-CE1 3.47Å; I624-Y726 HydrophobicContact CG1-CD1 4.29Å; I624-Y726 HydrophobicContact CG1-CE1 3.86Å; I624-Y726 HydrophobicContact CG2-CD1 4.49Å; I624-A727 HydrophobicContact CG2-CB 4.15Å; I624-E730 HydrophobicContact CD1-CB 4.23Å; I624-E730 HydrophobicContact CD1-CG 4.15Å
625	L	94.3	Very high	91.6	Very high	83 Å²	83	58.3 Å²	58.3	44%	0.435	29%	0.291	S	S	.	.	H	α-helix	trans	-65.5	-42.9	176.8	-68.8	170.9	0	0	0	112.1	I621 F628 F629	I621-L625 HydrophobicContact CG1-CD1 4.28Å; I621-L625 WeakPolarHBondContact O-CG 3.25Å; I621-L625 PolarHBondContact O-N 3.48Å; L625-F628 PolarHBondContact O-N 3.4Å; L625-F629 WeakPolarHBondContact O-CD2 3.49Å; L625-F629 PolarHBondContact O-N 3.21Å
626	A	94.2	Very high	92.2	Very high	56 Å²	56	61.1 Å²	61.1	46%	0.463	31%	0.306	S	S	.	.	H	α-helix	trans	-61.2	-44.7	176	0	0	0	0	0	112	V622 V623 F628 F629 F630	V622-A626 WeakPolarHBondContact O-CB 3.39Å; V622-A626 PolarHBondContact O-N 3.02Å; V623-A626 PolarHBondContact O-N 3.28Å; A626-F628 PolarHBondContact O-N 2.88Å; A626-F629 PolarHBondContact O-N 2.79Å; A626-F630 VanDerWaalsContact O-CB 3.27Å; A626-F630 WeakPolarHBondContact O-CB 3.45Å; A626-F630 PolarHBondContact O-N 2.8Å
627	G	94.2	Very high	92.9	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-63	-39.3	175.8	0	0	0	0	0	113.2	V623 I624 H631	V623-G627 PolarHBondContact O-N 2.97Å; I624-G627 PolarHBondContact O-N 2.85Å; G627-H631 VanDerWaalsContact O-CB 3.31Å; G627-H631 WeakPolarHBondContact O-CB 3.45Å; G627-H631 PolarHBondContact O-N 3Å
628	F	96.3	Very high	93.4	Very high	42 Å²	42	48.1 Å²	48.1	18%	0.184	26%	0.26	C	S	.	.	H	α-helix	trans	-61.1	-52.8	175	173.3	-103.3	0	0	0	112.6	I624 L625 A626 S632 L719 V720 V723	I624-F628 WeakPolarHBondContact O-CB 3.3Å; I624-F628 PolarHBondContact O-N 3.27Å; L625-F628 PolarHBondContact O-N 3.4Å; A626-F628 PolarHBondContact O-N 2.88Å; F628-S632 VanDerWaalsContact O-CB 3.26Å; F628-S632 WeakPolarHBondContact O-CB 3.32Å; F628-S632 PolarHBondContact O-N 3.47Å; F628-S632 PolarHBondContact O-OG 3.4Å; F628-L719 HydrophobicContact CD2-CD1 4.34Å; F628-L719 HydrophobicContact CD2-CD2 4.29Å; F628-L719 HydrophobicContact CD2-CG 3.95Å; F628-L719 HydrophobicContact CE2-CD2 4.41Å; F628-L719 HydrophobicContact CE2-CG 4.09Å; F628-V720 HydrophobicContact CE2-CG2 4.07Å; F628-V720 HydrophobicContact CZ-CG2 4.17Å; F628-V723 HydrophobicContact CB-CG1 4.21Å; F628-V723 HydrophobicContact CD2-CB 4.13Å; F628-V723 HydrophobicContact CD2-CG1 4.36Å; F628-V723 HydrophobicContact CD2-CG2 4.13Å
629	F	96.1	Very high	93.6	Very high	133 Å²	133	48.4 Å²	48.4	58%	0.583	26%	0.264	S	S	*	.	H	α-helix	trans	-66.3	-39.5	-179.3	-70.7	-62.2	0	0	0	112.2	L625 A626 S632 C633	L625-F629 WeakPolarHBondContact O-CD2 3.49Å; L625-F629 PolarHBondContact O-N 3.21Å; A626-F629 PolarHBondContact O-N 2.79Å; F629-S632 PolarHBondContact O-N 2.84Å; F629-C633 WeakPolarHBondContact O-CB 3.45Å; F629-C633 PolarHBondContact O-N 2.85Å
630	F	95.9	Very high	93.7	Very high	90 Å²	90	46.1 Å²	46.1	40%	0.395	27%	0.267	S	S	.	.	H	α-helix	trans	-67.2	-46.1	179.1	-174.2	-117.2	0	0	0	112.2	A626 C633 L634 A660 C661 M664	A626-F630 VanDerWaalsContact O-CB 3.27Å; A626-F630 WeakPolarHBondContact O-CB 3.45Å; A626-F630 PolarHBondContact O-N 2.8Å; F630-C633 PolarHBondContact O-N 3.37Å; F630-L634 PolarHBondContact O-N 3.33Å; F630-A660 HydrophobicContact CE1-CB 4.36Å; F630-C661 WeakPolarHBondContact CD1-SG 3.38Å; F630-M664 HydrophobicContact CD1-CE 4.25Å
631	H	96.8	Very high	93.8	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-67.5	-37.5	175.9	-164.5	116	0	0	0	111.5	F567 E571 G627 C633 L634 L635 C661 W665 L719	F567-H631 AromaticContact CZ-CE1 3.83Å; F567-H631 AromaticContact CZ-NE2 3.61Å; E571-H631 IonicContact OE2-CE1 2.72Å; E571-H631 PolarHBondContact OE2-CE1 3.38Å; E571-H631 IonicContact OE2-ND1 3.62Å; E571-H631 PolarHBondContact OE2-ND1 3.22Å; G627-H631 VanDerWaalsContact O-CB 3.31Å; G627-H631 WeakPolarHBondContact O-CB 3.45Å; G627-H631 PolarHBondContact O-N 3Å; H631-C633 VanDerWaalsContact C-N 3.32Å; H631-C633 PolarHBondContact O-N 3.34Å; H631-L634 WeakPolarHBondContact O-CB 3.26Å; H631-L634 PolarHBondContact O-N 2.03Å; H631-L634 VanDerWaalsContact O-N 3.15Å; H631-L635 VanDerWaalsContact CD2-CD1 3.48Å; H631-L635 WeakPolarHBondContact CD2-CD1 3.49Å; H631-L635 PolarHBondContact O-N 2.83Å; H631-C661 HydrophobicContact CB-CB 4.34Å; H631-C661 WeakPolarHBondContact ND1-CB 3.4Å; H631-W665 AromaticContact ND1-NE1 3.93Å; H631-L719 HydrophobicContact CB-CD2 4.09Å
632	S	95.8	Very high	93.6	Very high	20 Å²	20	51.6 Å²	51.6	14%	0.14	29%	0.289	C	S	.	.	H	α-helix	trans	-59.8	-42.8	174.1	-59.3	0	0	0	0	111.7	F628 F629 L634 L635 L636 L719	F628-S632 VanDerWaalsContact O-CB 3.26Å; F628-S632 WeakPolarHBondContact O-CB 3.32Å; F628-S632 PolarHBondContact O-N 3.47Å; F628-S632 PolarHBondContact O-OG 3.4Å; F629-S632 PolarHBondContact O-N 2.84Å; S632-L634 VanDerWaalsContact C-N 3.33Å; S632-L634 PolarHBondContact O-N 3.07Å; S632-L635 PolarHBondContact O-N 2.98Å; S632-L636 WeakPolarHBondContact O-CG 3.07Å; S632-L636 PolarHBondContact O-N 3.36Å; S632-L719 WeakPolarHBondContact OG-CD2 3.41Å
633	C	95.4	Very high	93.4	Very high	81 Å²	81	48.6 Å²	48.6	55%	0.547	27%	0.271	S	S	.	.	H	α-helix	trans	-63.9	-37.4	175.1	-168.2	0	0	0	0	112.3	F629 F630 H631 L636 A637	F629-C633 WeakPolarHBondContact O-CB 3.45Å; F629-C633 PolarHBondContact O-N 2.85Å; F630-C633 PolarHBondContact O-N 3.37Å; H631-C633 VanDerWaalsContact C-N 3.32Å; H631-C633 PolarHBondContact O-N 3.34Å; C633-L636 PolarHBondContact O-N 2.95Å; C633-A637 WeakPolarHBondContact O-CB 3.44Å; C633-A637 PolarHBondContact O-N 3.37Å
634	L	95.9	Very high	92.9	Very high	12 Å²	12	50.1 Å²	50.1	6%	0.063	28%	0.282	C	S	.	.	H	α-helix	trans	-66.3	-41.4	177.6	-173.5	62.1	0	0	0	112.2	F630 H631 S632 A637 L638 I654 W658	F630-L634 PolarHBondContact O-N 3.33Å; H631-L634 WeakPolarHBondContact O-CB 3.26Å; H631-L634 PolarHBondContact O-N 2.03Å; H631-L634 VanDerWaalsContact O-N 3.15Å; S632-L634 VanDerWaalsContact C-N 3.33Å; S632-L634 PolarHBondContact O-N 3.07Å; L634-A637 PolarHBondContact O-N 2.89Å; L634-L638 PolarHBondContact O-N 3.49Å; L634-I654 HydrophobicContact CD1-CG2 4.15Å; L634-W658 HydrophobicContact CD2-CB 4.05Å; L634-W658 HydrophobicContact CD2-CD2 4.3Å; L634-W658 HydrophobicContact CD2-CE3 3.69Å; L634-W658 HydrophobicContact CD2-CG 4.5Å; L634-W658 HydrophobicContact CG-CE3 4.21Å
635	L	95.1	Very high	92.2	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-68.3	-38	175	-69	173	0	0	0	112.3	H631 S632 A637 L638 S639 W658 L715 V716 L719	H631-L635 VanDerWaalsContact CD2-CD1 3.48Å; H631-L635 WeakPolarHBondContact CD2-CD1 3.49Å; H631-L635 PolarHBondContact O-N 2.83Å; S632-L635 PolarHBondContact O-N 2.98Å; L635-A637 VanDerWaalsContact C-N 3.33Å; L635-L638 PolarHBondContact O-N 3.47Å; L635-S639 PolarHBondContact O-N 3.33Å; L635-W658 HydrophobicContact CD2-CH2 3.83Å; L635-W658 HydrophobicContact CD2-CZ3 3.8Å; L635-L715 HydrophobicContact CD1-CB 4.1Å; L635-L715 HydrophobicContact CD2-CB 4.09Å; L635-L715 HydrophobicContact CD2-CD1 4.29Å; L635-V716 HydrophobicContact CB-CG2 3.6Å; L635-V716 HydrophobicContact CD1-CB 4.42Å; L635-V716 HydrophobicContact CD1-CG2 3.7Å; L635-V716 HydrophobicContact CG-CG2 4.25Å; L635-L719 HydrophobicContact CD1-CD2 4.26Å
636	L	92.8	Very high	91.6	Very high	101 Å²	101	55.7 Å²	55.7	53%	0.529	32%	0.317	S	S	.	.	H	α-helix	trans	-67.4	-32.3	174	-71.7	170.9	0	0	0	112.5	S632 C633 S639 S640	S632-L636 WeakPolarHBondContact O-CG 3.07Å; S632-L636 PolarHBondContact O-N 3.36Å; C633-L636 PolarHBondContact O-N 2.95Å; L636-S639 PolarHBondContact O-OG 3.43Å; L636-S639 VanDerWaalsContact O-OG 3.06Å; L636-S640 VanDerWaalsContact O-CB 3.32Å; L636-S640 WeakPolarHBondContact O-CB 3.45Å; L636-S640 PolarHBondContact O-N 2.99Å; L636-S640 PolarHBondContact O-OG 3.35Å
637	A	93	Very high	91.1	Very high	44 Å²	44	57.1 Å²	57.1	36%	0.364	32%	0.317	S	S	.	.	H	α-helix	trans	-65.4	-48.5	169.9	0	0	0	0	0	110.6	C633 L634 L635 S639 S640 W641	C633-A637 WeakPolarHBondContact O-CB 3.44Å; C633-A637 PolarHBondContact O-N 3.37Å; L634-A637 PolarHBondContact O-N 2.89Å; L635-A637 VanDerWaalsContact C-N 3.33Å; A637-S639 VanDerWaalsContact C-N 3.32Å; A637-S639 PolarHBondContact O-N 3.42Å; A637-S640 PolarHBondContact O-N 3.07Å; A637-S640 VanDerWaalsContact O-N 3.11Å; A637-W641 WeakPolarHBondContact O-CB 3.1Å; A637-W641 PolarHBondContact O-N 3.17Å
638	L	92.2	Very high	90.6	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-61.1	-33.4	177.7	-79.8	164.2	0	0	0	114.2	Y574 F579 F583 L634 L635 S640 I654 W658 I712	Y574-L638 HydrophobicContact CE1-CD1 4.48Å; F579-L638 HydrophobicContact CD2-CD2 3.87Å; F579-L638 HydrophobicContact CE2-CD2 3.85Å; F583-L638 HydrophobicContact CD1-CD2 4.24Å; F583-L638 HydrophobicContact CE1-CD2 3.81Å; F583-L638 HydrophobicContact CE2-CD2 4.18Å; F583-L638 HydrophobicContact CZ-CD2 3.78Å; L634-L638 PolarHBondContact O-N 3.49Å; L635-L638 PolarHBondContact O-N 3.47Å; L638-S640 VanDerWaalsContact C-N 3.32Å; L638-I654 HydrophobicContact CD1-CG2 4.41Å; L638-I654 HydrophobicContact CD2-CG2 3.93Å; L638-I654 HydrophobicContact CG-CG2 4.24Å; L638-W658 HydrophobicContact CD1-CE3 3.95Å; L638-W658 HydrophobicContact CD1-CZ3 3.48Å; L638-W658 VanDerWaalsContact CD1-CZ3 3.48Å; L638-I712 HydrophobicContact CB-CD1 4.44Å
639	S	91.7	Very high	90.2	Very high	54 Å²	54	60.6 Å²	60.6	38%	0.378	35%	0.351	S	S	.	.	H	α-helix	trans	-76.1	-18.4	175.9	67.2	0	0	0	0	114.1	L635 L636 A637	L635-S639 PolarHBondContact O-N 3.33Å; L636-S639 PolarHBondContact O-OG 3.43Å; L636-S639 VanDerWaalsContact O-OG 3.06Å; A637-S639 VanDerWaalsContact C-N 3.32Å; A637-S639 PolarHBondContact O-N 3.42Å
640	S	89.8	Confident	89.9	Confident	98 Å²	98	57.5 Å²	57.5	69%	0.685	34%	0.339	S	S	*	.	H	α-helix	trans	-114.6	-17.5	-170.3	-45.2	0	0	0	0	113.3	L636 A637 L638	L636-S640 VanDerWaalsContact O-CB 3.32Å; L636-S640 WeakPolarHBondContact O-CB 3.45Å; L636-S640 PolarHBondContact O-N 2.99Å; L636-S640 PolarHBondContact O-OG 3.35Å; A637-S640 PolarHBondContact O-N 3.07Å; A637-S640 VanDerWaalsContact O-N 3.11Å; L638-S640 VanDerWaalsContact C-N 3.32Å
641	W	90.6	Very high	89.7	Confident	43 Å²	43	53.2 Å²	53.2	16%	0.163	32%	0.321	C	S	.	.			trans	-89.2	126.5	-178.9	176.8	57.6	0	0	0	111.4	F583 A637 P643 L650 F651 I654	F583-W641 AromaticContact CD1-CE3 3.89Å; F583-W641 HydrophobicContact CD1-CE3 3.89Å; F583-W641 AromaticContact CD1-CZ3 3.75Å; F583-W641 HydrophobicContact CD1-CZ3 3.75Å; F583-W641 HydrophobicContact CE1-CE3 4.12Å; F583-W641 HydrophobicContact CE1-CZ3 4.44Å; A637-W641 WeakPolarHBondContact O-CB 3.1Å; A637-W641 PolarHBondContact O-N 3.17Å; W641-P643 HydrophobicContact CE3-CB 4.47Å; W641-P643 HydrophobicContact CH2-CB 3.9Å; W641-P643 HydrophobicContact CZ2-CB 4.11Å; W641-P643 HydrophobicContact CZ3-CB 4.07Å; W641-L650 HydrophobicContact CH2-CB 4.07Å; W641-L650 HydrophobicContact CZ2-CB 3.66Å; W641-L650 HydrophobicContact CZ2-CD1 3.95Å; W641-L650 HydrophobicContact CZ2-CG 4.45Å; W641-F651 AromaticContact CH2-CD1 3.65Å; W641-F651 HydrophobicContact CH2-CD1 3.65Å; W641-F651 AromaticContact CH2-CD2 3.83Å; W641-F651 HydrophobicContact CH2-CD2 3.83Å; W641-F651 AromaticContact CH2-CE1 3.5Å; W641-F651 HydrophobicContact CH2-CE1 3.5Å; W641-F651 VanDerWaalsContact CH2-CE1 3.5Å; W641-F651 AromaticContact CH2-CE2 3.71Å; W641-F651 HydrophobicContact CH2-CE2 3.71Å; W641-F651 AromaticContact CH2-CG 3.82Å; W641-F651 HydrophobicContact CH2-CG 3.82Å; W641-F651 AromaticContact CH2-CZ 3.54Å; W641-F651 HydrophobicContact CH2-CZ 3.54Å; W641-F651 HydrophobicContact CZ2-CD2 4.31Å; W641-F651 HydrophobicContact CZ2-CE1 4.37Å; W641-F651 AromaticContact CZ2-CE2 3.94Å; W641-F651 HydrophobicContact CZ2-CE2 3.94Å; W641-F651 AromaticContact CZ2-CZ 3.97Å; W641-F651 HydrophobicContact CZ2-CZ 3.97Å; W641-F651 HydrophobicContact CZ3-CD1 4.21Å; W641-F651 HydrophobicContact CZ3-CE1 4.15Å; W641-I654 HydrophobicContact CD2-CD1 4.2Å; W641-I654 HydrophobicContact CE3-CD1 3.53Å; W641-I654 HydrophobicContact CH2-CD1 4.14Å; W641-I654 HydrophobicContact CZ3-CD1 3.49Å; W641-I654 VanDerWaalsContact CZ3-CD1 3.49Å
642	K	87.4	Confident	89.5	Confident	139 Å²	139	56.2 Å²	56.2	60%	0.604	33%	0.332	S	S	*	.			trans	-92.9	115.6	170.3	-157.6	-178.2	-166.2	77.6	0	108.5	D475 S644	D475-K642 IonicContact OD2-NZ 3.56Å; D475-K642 PolarHBondContact OD2-NZ 3.27Å; K642-S644 PolarHBondContact O-N 3.49Å
643	P	86.3	Confident	89.4	Confident	16 Å²	16	59.3 Å²	59.3	10%	0.104	35%	0.35	C	S	.	.			trans	-69.3	131.7	-178.3	26.4	-33.1	0	0	0	111.5	C472 F583 W641 F651	C472-P643 HydrophobicContact CB-CG 3.73Å; F583-P643 HydrophobicContact CD1-CB 4.37Å; F583-P643 HydrophobicContact CD1-CG 4.05Å; W641-P643 HydrophobicContact CE3-CB 4.47Å; W641-P643 HydrophobicContact CH2-CB 3.9Å; W641-P643 HydrophobicContact CZ2-CB 4.11Å; W641-P643 HydrophobicContact CZ3-CB 4.07Å; P643-F651 HydrophobicContact CB-CE1 3.66Å; P643-F651 HydrophobicContact CB-CZ 3.62Å
644	S	83.4	Confident	89.4	Confident	41 Å²	41	56.2 Å²	56.2	29%	0.287	33%	0.328	S	S	.	.			trans	-120.8	152.8	169.6	-177.2	0	0	0	0	109.7	K642 D646 F651	K642-S644 PolarHBondContact O-N 3.49Å; S644-D646 PolarHBondContact O-N 3.12Å; S644-F651 VanDerWaalsContact O-CE2 3.28Å; S644-F651 WeakPolarHBondContact O-CE2 3.47Å; S644-F651 WeakPolarHBondContact O-CZ 3.42Å
645	S	79.6	Confident	89.3	Confident	65 Å²	65	55.6 Å²	55.6	46%	0.455	33%	0.325	S	S	.	.	S	Bend	trans	-57.5	-36.2	173.1	42.1	0	0	0	0	112.7	D647 S648	S645-D647 VanDerWaalsContact C-N 3.34Å; S645-D647 PolarHBondContact O-N 3.06Å; S645-S648 PolarHBondContact O-N 2.72Å
646	D	81.9	Confident	89.4	Confident	134 Å²	134	56.2 Å²	56.2	72%	0.717	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.8	-33.2	-166.1	-47.5	-20.5	0	0	0	110.8	S644 S648	S644-D646 PolarHBondContact O-N 3.12Å; D646-S648 PolarHBondContact O-N 2.89Å
647	D	82	Confident	89.5	Confident	87 Å²	87	52.7 Å²	52.7	47%	0.465	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.2	34.9	175	-72.6	-45	0	0	0	113	S645 A649 L650	S645-D647 VanDerWaalsContact C-N 3.34Å; S645-D647 PolarHBondContact O-N 3.06Å; D647-A649 PolarHBondContact O-N 3.4Å; D647-L650 HydrophobicContact CB-CD1 3.82Å; D647-L650 HydrophobicContact CB-CG 4.13Å; D647-L650 WeakPolarHBondContact O-CB 3.38Å; D647-L650 PolarHBondContact O-N 2.98Å
648	S	83.8	Confident	89.7	Confident	52 Å²	52	50.6 Å²	50.6	36%	0.364	30%	0.296	S	S	.	.	H	α-helix	trans	-48	-27.6	-177.3	60.1	0	0	0	0	115.2	S645 D646 L650 F651 Y652	S645-S648 PolarHBondContact O-N 2.72Å; D646-S648 PolarHBondContact O-N 2.89Å; S648-L650 VanDerWaalsContact C-N 3.35Å; S648-L650 PolarHBondContact O-N 2.93Å; S648-F651 WeakPolarHBondContact O-CD2 3.44Å; S648-Y652 VanDerWaalsContact O-CD2 3.25Å; S648-Y652 WeakPolarHBondContact O-CD2 3.4Å; S648-Y652 WeakPolarHBondContact O-CE2 3.44Å
649	A	88.7	Confident	89.9	Confident	63 Å²	63	50.6 Å²	50.6	52%	0.521	30%	0.296	S	S	.	.	H	α-helix	trans	-62.9	-33.9	174.8	0	0	0	0	0	114.1	D647 F651 Y652 V653	D647-A649 PolarHBondContact O-N 3.4Å; A649-F651 PolarHBondContact O-N 3.22Å; A649-Y652 PolarHBondContact O-N 3.39Å; A649-V653 WeakPolarHBondContact O-CG2 3.33Å; A649-V653 PolarHBondContact O-N 3.35Å; A649-V653 VanDerWaalsContact O-N 3.15Å
650	L	90.3	Very high	90.1	Very high	67 Å²	67	48.7 Å²	48.7	35%	0.351	28%	0.284	S	S	.	.	H	α-helix	trans	-65.9	-36.9	-173.8	-67.4	-177.8	0	0	0	112.5	W641 D647 S648 Y652 V653 I654	W641-L650 HydrophobicContact CH2-CB 4.07Å; W641-L650 HydrophobicContact CZ2-CB 3.66Å; W641-L650 HydrophobicContact CZ2-CD1 3.95Å; W641-L650 HydrophobicContact CZ2-CG 4.45Å; D647-L650 HydrophobicContact CB-CD1 3.82Å; D647-L650 HydrophobicContact CB-CG 4.13Å; D647-L650 WeakPolarHBondContact O-CB 3.38Å; D647-L650 PolarHBondContact O-N 2.98Å; S648-L650 VanDerWaalsContact C-N 3.35Å; S648-L650 PolarHBondContact O-N 2.93Å; L650-Y652 VanDerWaalsContact C-N 3.29Å; L650-Y652 PolarHBondContact O-N 2.92Å; L650-V653 PolarHBondContact O-N 3.15Å; L650-I654 WeakPolarHBondContact O-CB 3.41Å; L650-I654 VanDerWaalsContact O-CG1 3.28Å; L650-I654 WeakPolarHBondContact O-CG1 3.35Å; L650-I654 PolarHBondContact O-N 2.73Å
651	F	90.8	Very high	90.4	Very high	0 Å²	0	44 Å²	44	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-56.9	-43.5	177	-58.3	-97.2	0	0	0	111.6	F583 V584 S587 L588 W641 P643 S644 S648 A649 A655	F583-F651 HydrophobicContact CB-CD1 4.4Å; F583-F651 HydrophobicContact CB-CE1 4.34Å; F583-F651 WeakPolarHBondContact O-CE1 3.43Å; V584-F651 HydrophobicContact CG2-CD1 4.25Å; S587-F651 WeakPolarHBondContact OG-CE1 3.29Å; S587-F651 WeakPolarHBondContact OG-CZ 3.42Å; L588-F651 HydrophobicContact CD1-CB 4.16Å; L588-F651 HydrophobicContact CD1-CD1 4.16Å; L588-F651 HydrophobicContact CD1-CD2 3.63Å; L588-F651 HydrophobicContact CD1-CE1 4.48Å; L588-F651 HydrophobicContact CD1-CE2 3.98Å; L588-F651 HydrophobicContact CD1-CG 3.71Å; L588-F651 HydrophobicContact CD1-CZ 4.38Å; L588-F651 HydrophobicContact CD2-CE2 4.41Å; L588-F651 HydrophobicContact CG-CD2 4.33Å; L588-F651 HydrophobicContact CG-CE2 4.18Å; L588-F651 HydrophobicContact CG-CZ 4.27Å; W641-F651 AromaticContact CH2-CD1 3.65Å; W641-F651 HydrophobicContact CH2-CD1 3.65Å; W641-F651 AromaticContact CH2-CD2 3.83Å; W641-F651 HydrophobicContact CH2-CD2 3.83Å; W641-F651 AromaticContact CH2-CE1 3.5Å; W641-F651 HydrophobicContact CH2-CE1 3.5Å; W641-F651 VanDerWaalsContact CH2-CE1 3.5Å; W641-F651 AromaticContact CH2-CE2 3.71Å; W641-F651 HydrophobicContact CH2-CE2 3.71Å; W641-F651 AromaticContact CH2-CG 3.82Å; W641-F651 HydrophobicContact CH2-CG 3.82Å; W641-F651 AromaticContact CH2-CZ 3.54Å; W641-F651 HydrophobicContact CH2-CZ 3.54Å; W641-F651 HydrophobicContact CZ2-CD2 4.31Å; W641-F651 HydrophobicContact CZ2-CE1 4.37Å; W641-F651 AromaticContact CZ2-CE2 3.94Å; W641-F651 HydrophobicContact CZ2-CE2 3.94Å; W641-F651 AromaticContact CZ2-CZ 3.97Å; W641-F651 HydrophobicContact CZ2-CZ 3.97Å; W641-F651 HydrophobicContact CZ3-CD1 4.21Å; W641-F651 HydrophobicContact CZ3-CE1 4.15Å; P643-F651 HydrophobicContact CB-CE1 3.66Å; P643-F651 HydrophobicContact CB-CZ 3.62Å; S644-F651 VanDerWaalsContact O-CE2 3.28Å; S644-F651 WeakPolarHBondContact O-CE2 3.47Å; S644-F651 WeakPolarHBondContact O-CZ 3.42Å; S648-F651 WeakPolarHBondContact O-CD2 3.44Å; A649-F651 PolarHBondContact O-N 3.22Å; F651-A655 WeakPolarHBondContact O-CB 3.41Å; F651-A655 PolarHBondContact O-N 3.42Å
652	Y	92.3	Very high	90.6	Very high	63 Å²	63	42.2 Å²	42.2	25%	0.247	25%	0.245	C	C	.	.	H	α-helix	trans	-72	-38.6	178	-55	-60.2	0	0	0	112.3	M592 S648 A649 L650 A655 A656	M592-Y652 WeakPolarHBondContact CE-OH 3.38Å; S648-Y652 VanDerWaalsContact O-CD2 3.25Å; S648-Y652 WeakPolarHBondContact O-CD2 3.4Å; S648-Y652 WeakPolarHBondContact O-CE2 3.44Å; A649-Y652 PolarHBondContact O-N 3.39Å; L650-Y652 VanDerWaalsContact C-N 3.29Å; L650-Y652 PolarHBondContact O-N 2.92Å; Y652-A655 PolarHBondContact O-N 2.91Å; Y652-A656 WeakPolarHBondContact O-CB 3.09Å; Y652-A656 PolarHBondContact O-N 2.88Å
653	V	94.7	Very high	90.9	Very high	85 Å²	85	35.6 Å²	35.6	52%	0.515	22%	0.216	S	C	.	.	H	α-helix	trans	-65.3	-39.6	176.4	173.2	0	0	0	0	111.7	A649 L650 S657	A649-V653 WeakPolarHBondContact O-CG2 3.33Å; A649-V653 PolarHBondContact O-N 3.35Å; A649-V653 VanDerWaalsContact O-N 3.15Å; L650-V653 PolarHBondContact O-N 3.15Å; V653-S657 WeakPolarHBondContact O-CB 3.34Å; V653-S657 PolarHBondContact O-N 3.46Å; V653-S657 PolarHBondContact O-OG 3.5Å
654	I	94.4	Very high	91.3	Very high	16 Å²	16	36 Å²	36	8%	0.082	22%	0.217	C	C	.	.	H	α-helix	trans	-66.4	-49.3	175.5	-70.8	166.5	0	0	0	110.3	F579 L634 L638 W641 L650 A656 S657 W658	F579-I654 HydrophobicContact CE2-CG2 3.71Å; F579-I654 HydrophobicContact CZ-CB 4.47Å; F579-I654 HydrophobicContact CZ-CG2 3.91Å; L634-I654 HydrophobicContact CD1-CG2 4.15Å; L638-I654 HydrophobicContact CD1-CG2 4.41Å; L638-I654 HydrophobicContact CD2-CG2 3.93Å; L638-I654 HydrophobicContact CG-CG2 4.24Å; W641-I654 HydrophobicContact CD2-CD1 4.2Å; W641-I654 HydrophobicContact CE3-CD1 3.53Å; W641-I654 HydrophobicContact CH2-CD1 4.14Å; W641-I654 HydrophobicContact CZ3-CD1 3.49Å; W641-I654 VanDerWaalsContact CZ3-CD1 3.49Å; L650-I654 WeakPolarHBondContact O-CB 3.41Å; L650-I654 VanDerWaalsContact O-CG1 3.28Å; L650-I654 WeakPolarHBondContact O-CG1 3.35Å; L650-I654 PolarHBondContact O-N 2.73Å; I654-A656 VanDerWaalsContact C-N 3.34Å; I654-A656 PolarHBondContact O-N 3.37Å; I654-S657 PolarHBondContact O-N 3.28Å; I654-W658 PolarHBondContact O-N 3.4Å
655	A	94.9	Very high	91.8	Very high	0 Å²	0	34 Å²	34	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-61.1	-40.7	177.4	0	0	0	0	0	112.7	M575 F579 A596 M600 F651 Y652 W658 G659	M575-A655 HydrophobicContact CE-CB 3.59Å; F579-A655 HydrophobicContact CE1-CB 4.25Å; A596-A655 HydrophobicContact CB-CB 3.96Å; A596-A655 WeakPolarHBondContact O-CB 3.47Å; M600-A655 WeakPolarHBondContact CA-O 3.12Å; M600-A655 WeakPolarHBondContact CB-O 3.4Å; F651-A655 WeakPolarHBondContact O-CB 3.41Å; F651-A655 PolarHBondContact O-N 3.42Å; Y652-A655 PolarHBondContact O-N 2.91Å; A655-W658 PolarHBondContact O-N 3.35Å; A655-G659 PolarHBondContact O-N 3.41Å
656	A	96.4	Very high	92.4	Very high	13 Å²	13	31.9 Å²	31.9	11%	0.107	19%	0.186	C	C	.	.	H	α-helix	trans	-62.4	-44.4	173.5	0	0	0	0	0	112	M603 Y652 I654 W658 G659 A660	M603-A656 WeakPolarHBondContact CB-O 3.48Å; M603-A656 HydrophobicContact CE-CB 4.41Å; M603-A656 HydrophobicContact CG-CB 3.62Å; M603-A656 WeakPolarHBondContact CG-O 3.2Å; Y652-A656 WeakPolarHBondContact O-CB 3.09Å; Y652-A656 PolarHBondContact O-N 2.88Å; I654-A656 VanDerWaalsContact C-N 3.34Å; I654-A656 PolarHBondContact O-N 3.37Å; A656-W658 VanDerWaalsContact C-N 3.32Å; A656-W658 PolarHBondContact O-N 2.92Å; A656-G659 PolarHBondContact O-N 3.06Å; A656-A660 PolarHBondContact O-N 3.39Å
657	S	96.2	Very high	92.8	Very high	26 Å²	26	25.8 Å²	25.8	18%	0.182	15%	0.154	C	C	.	.	H	α-helix	trans	-64.3	-36.1	175.8	-60	0	0	0	0	112.4	V653 I654 A660 C661	V653-S657 WeakPolarHBondContact O-CB 3.34Å; V653-S657 PolarHBondContact O-N 3.46Å; V653-S657 PolarHBondContact O-OG 3.5Å; I654-S657 PolarHBondContact O-N 3.28Å; S657-A660 WeakPolarHBondContact O-CB 3.26Å; S657-A660 PolarHBondContact O-N 2.97Å; S657-C661 PolarHBondContact O-N 2.91Å; S657-C661 PolarHBondContact O-SG 2.9Å
658	W	96.1	Very high	93.3	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-66.1	-43.9	173.3	-160.2	-76.7	0	0	0	111.6	E571 Y574 M575 L634 L635 L638 I654 A655 A656 A660 C661 N662 L715	E571-W658 HydrophobicContact CB-CZ2 3.76Å; E571-W658 VanDerWaalsContact O-CZ2 3.25Å; E571-W658 WeakPolarHBondContact O-CZ2 3.15Å; E571-W658 PolarHBondContact O-NE1 3.38Å; Y574-W658 AromaticContact CD1-CH2 3.47Å; Y574-W658 HydrophobicContact CD1-CH2 3.47Å; Y574-W658 VanDerWaalsContact CD1-CH2 3.47Å; Y574-W658 AromaticContact CD1-CZ2 3.82Å; Y574-W658 HydrophobicContact CD1-CZ2 3.82Å; Y574-W658 HydrophobicContact CD1-CZ3 4.21Å; Y574-W658 AromaticContact CE1-CH2 3.9Å; Y574-W658 HydrophobicContact CE1-CH2 3.9Å; Y574-W658 HydrophobicContact CE1-CZ3 4.24Å; Y574-W658 HydrophobicContact CG-CH2 4.47Å; M575-W658 HydrophobicContact CB-CZ2 4.49Å; M575-W658 HydrophobicContact CG-CG 4.17Å; M575-W658 HydrophobicContact SD-CB 4.08Å; M575-W658 HydrophobicContact SD-CD2 4.07Å; M575-W658 HydrophobicContact SD-CG 3.75Å; L634-W658 HydrophobicContact CD2-CB 4.05Å; L634-W658 HydrophobicContact CD2-CD2 4.3Å; L634-W658 HydrophobicContact CD2-CE3 3.69Å; L634-W658 HydrophobicContact CD2-CG 4.5Å; L634-W658 HydrophobicContact CG-CE3 4.21Å; L635-W658 HydrophobicContact CD2-CH2 3.83Å; L635-W658 HydrophobicContact CD2-CZ3 3.8Å; L638-W658 HydrophobicContact CD1-CE3 3.95Å; L638-W658 HydrophobicContact CD1-CZ3 3.48Å; L638-W658 VanDerWaalsContact CD1-CZ3 3.48Å; I654-W658 PolarHBondContact O-N 3.4Å; A655-W658 PolarHBondContact O-N 3.35Å; A656-W658 VanDerWaalsContact C-N 3.32Å; A656-W658 PolarHBondContact O-N 2.92Å; W658-A660 VanDerWaalsContact C-N 3.29Å; W658-A660 PolarHBondContact O-N 3.36Å; W658-C661 PolarHBondContact O-N 3.38Å; W658-C661 VanDerWaalsContact O-N 3.16Å; W658-N662 VanDerWaalsContact O-CB 3.31Å; W658-N662 WeakPolarHBondContact O-CB 3.44Å; W658-N662 PolarHBondContact O-N 2.99Å; W658-L715 HydrophobicContact CH2-CD1 4.23Å
659	G	96.3	Very high	93.6	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-56.8	-41.7	173.2	0	0	0	0	0	112.8	M600 Q604 A655 A656 G663	M600-G659 WeakPolarHBondContact O-CA 3.31Å; Q604-G659 WeakPolarHBondContact CA-O 3.42Å; Q604-G659 WeakPolarHBondContact CB-O 3.43Å; A655-G659 PolarHBondContact O-N 3.41Å; A656-G659 PolarHBondContact O-N 3.06Å; G659-G663 PolarHBondContact O-N 2.99Å
660	A	96.1	Very high	93.6	Very high	14 Å²	14	18.9 Å²	18.9	12%	0.116	10%	0.104	C	C	.	.	H	α-helix	trans	-61.9	-46.7	173.4	0	0	0	0	0	112.4	M603 V607 F630 A656 S657 W658 G663 M664	M603-A660 HydrophobicContact CB-CB 4.24Å; V607-A660 HydrophobicContact CG2-CB 3.83Å; F630-A660 HydrophobicContact CE1-CB 4.36Å; A656-A660 PolarHBondContact O-N 3.39Å; S657-A660 WeakPolarHBondContact O-CB 3.26Å; S657-A660 PolarHBondContact O-N 2.97Å; W658-A660 VanDerWaalsContact C-N 3.29Å; W658-A660 PolarHBondContact O-N 3.36Å; A660-G663 PolarHBondContact O-N 3.47Å; A660-M664 WeakPolarHBondContact O-CG 3.47Å; A660-M664 PolarHBondContact O-N 3.48Å; A660-M664 VanDerWaalsContact O-N 3.14Å
661	C	95.6	Very high	93.4	Very high	0 Å²	0	16.5 Å²	16.5	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-61.1	-51.9	177.4	-64.3	0	0	0	0	112.4	F630 H631 S657 W658 G663 M664 W665	F630-C661 WeakPolarHBondContact CD1-SG 3.38Å; H631-C661 HydrophobicContact CB-CB 4.34Å; H631-C661 WeakPolarHBondContact ND1-CB 3.4Å; S657-C661 PolarHBondContact O-N 2.91Å; S657-C661 PolarHBondContact O-SG 2.9Å; W658-C661 PolarHBondContact O-N 3.38Å; W658-C661 VanDerWaalsContact O-N 3.16Å; C661-G663 VanDerWaalsContact C-N 3.25Å; C661-G663 PolarHBondContact O-N 2.83Å; C661-M664 WeakPolarHBondContact O-CA 3.4Å; C661-M664 WeakPolarHBondContact O-CB 3.33Å; C661-M664 PolarHBondContact O-N 3.32Å; C661-W665 PolarHBondContact O-N 3.08Å; C661-W665 VanDerWaalsContact O-N 3.11Å
662	N	95.2	Very high	93.3	Very high	6 Å²	6	16.6 Å²	16.6	3%	0.032	9%	0.093	C	C	.	.	H	α-helix	trans	-56.9	-40.9	177.9	-173.2	15.8	0	0	0	110.8	Q572 M600 Q604 W658 M664 W665 E666	Q572-N662 PolarHBondContact NE2-OD1 3.26Å; M600-N662 WeakPolarHBondContact CE-ND2 3.25Å; Q604-N662 VanDerWaalsContact NE2-C 3.27Å; Q604-N662 PolarHBondContact NE2-ND2 3.37Å; Q604-N662 PolarHBondContact NE2-OD1 3.28Å; Q604-N662 PolarHBondContact OE1-ND2 2.9Å; Q604-N662 VanDerWaalsContact OE1-ND2 3.14Å; W658-N662 VanDerWaalsContact O-CB 3.31Å; W658-N662 WeakPolarHBondContact O-CB 3.44Å; W658-N662 PolarHBondContact O-N 2.99Å; N662-M664 VanDerWaalsContact C-N 3.31Å; N662-M664 PolarHBondContact O-N 3.46Å; N662-W665 PolarHBondContact O-N 3.38Å; N662-E666 WeakPolarHBondContact O-CB 3.41Å; N662-E666 WeakPolarHBondContact O-CG 3.4Å; N662-E666 PolarHBondContact O-N 3.21Å
663	G	94	Very high	93	Very high	0 Å²	0	13.6 Å²	13.6	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-59.7	-34.8	173.1	0	0	0	0	0	114.3	G659 A660 C661 T667	G659-G663 PolarHBondContact O-N 2.99Å; A660-G663 PolarHBondContact O-N 3.47Å; C661-G663 VanDerWaalsContact C-N 3.25Å; C661-G663 PolarHBondContact O-N 2.83Å; G663-T667 VanDerWaalsContact O-CB 3.24Å; G663-T667 WeakPolarHBondContact O-CB 3.41Å; G663-T667 PolarHBondContact O-N 3.48Å; G663-T667 PolarHBondContact O-OG1 2.93Å
664	M	93.9	Very high	92.3	Very high	24 Å²	24	9.7 Å²	9.7	12%	0.118	6%	0.058	C	C	.	.	H	α-helix	trans	-69.9	-53.7	175	-66.8	-170.4	-80	0	0	111.7	V607 L611 F630 A660 C661 N662 E666 T667 L668	V607-M664 HydrophobicContact CG1-CB 4.44Å; V607-M664 HydrophobicContact CG1-CG 3.57Å; L611-M664 HydrophobicContact CD2-CB 4.22Å; L611-M664 HydrophobicContact CD2-CG 4.13Å; F630-M664 HydrophobicContact CD1-CE 4.25Å; A660-M664 WeakPolarHBondContact O-CG 3.47Å; A660-M664 PolarHBondContact O-N 3.48Å; A660-M664 VanDerWaalsContact O-N 3.14Å; C661-M664 WeakPolarHBondContact O-CA 3.4Å; C661-M664 WeakPolarHBondContact O-CB 3.33Å; C661-M664 PolarHBondContact O-N 3.32Å; N662-M664 VanDerWaalsContact C-N 3.31Å; N662-M664 PolarHBondContact O-N 3.46Å; M664-E666 PolarHBondContact O-N 3.31Å; M664-T667 PolarHBondContact O-N 3.43Å; M664-L668 WeakPolarHBondContact O-CB 3.49Å; M664-L668 VanDerWaalsContact O-CG 3.26Å; M664-L668 WeakPolarHBondContact O-CG 3.48Å; M664-L668 PolarHBondContact O-N 3.23Å
665	W	94.7	Very high	91.5	Very high	0 Å²	0	10 Å²	10	0%	0	6%	0.059	C	C	.	.	H	α-helix	trans	-63.6	-41.8	-176.2	-57.3	133	0	0	0	112.5	L564 F567 V568 I624 H631 C661 N662 L668 L669 L719 V723	L564-W665 HydrophobicContact CD1-CD2 4.14Å; L564-W665 HydrophobicContact CD1-CE3 3.98Å; L564-W665 HydrophobicContact CD1-CZ3 4.43Å; L564-W665 HydrophobicContact CD2-CE3 4.09Å; F567-W665 AromaticContact CE1-NE1 3.84Å; V568-W665 HydrophobicContact CG2-CB 3.47Å; V568-W665 VanDerWaalsContact CG2-CB 3.47Å; V568-W665 HydrophobicContact CG2-CG 4.11Å; I624-W665 HydrophobicContact CG2-CZ3 4.42Å; H631-W665 AromaticContact ND1-NE1 3.93Å; C661-W665 PolarHBondContact O-N 3.08Å; C661-W665 VanDerWaalsContact O-N 3.11Å; N662-W665 PolarHBondContact O-N 3.38Å; W665-L668 HydrophobicContact CE3-CD1 3.78Å; W665-L668 HydrophobicContact CZ3-CD1 4.03Å; W665-L668 PolarHBondContact O-N 3.02Å; W665-L669 WeakPolarHBondContact O-CG 3.42Å; W665-L669 PolarHBondContact O-N 2.95Å; W665-L719 HydrophobicContact CZ2-CD1 3.95Å; W665-V723 HydrophobicContact CH2-CG1 4.36Å; W665-V723 HydrophobicContact CH2-CG2 3.63Å; W665-V723 HydrophobicContact CZ2-CG2 4.1Å; W665-V723 HydrophobicContact CZ3-CG2 4.15Å
666	E	92	Very high	90.6	Very high	19 Å²	19	12 Å²	12	9%	0.089	7%	0.07	C	C	.	.	H	α-helix	trans	-57.1	-50.3	172.1	-76.4	-76.3	163.8	0	0	112.4	R414 Q572 N662 M664 L668 L669 L670 R692	R414-E666 IonicContact NH1-OE1 3.34Å; R414-E666 IonicContact NH1-OE2 3.07Å; R414-E666 PolarHBondContact NH1-OE2 3.27Å; Q572-E666 PolarHBondContact NE2-OE1 3.35Å; N662-E666 WeakPolarHBondContact O-CB 3.41Å; N662-E666 WeakPolarHBondContact O-CG 3.4Å; N662-E666 PolarHBondContact O-N 3.21Å; M664-E666 PolarHBondContact O-N 3.31Å; E666-L668 VanDerWaalsContact C-N 3.29Å; E666-L668 PolarHBondContact O-N 2.85Å; E666-L669 PolarHBondContact O-N 2.99Å; E666-L670 WeakPolarHBondContact O-CB 2.97Å; E666-L670 PolarHBondContact O-N 2.9Å; E666-R692 IonicContact OE1-CZ 2.78Å; E666-R692 IonicContact OE1-NH1 3.79Å; E666-R692 PolarHBondContact OE1-NH1 2.91Å; E666-R692 IonicContact OE1-NH2 3.2Å; E666-R692 PolarHBondContact OE1-NH2 2.9Å; E666-R692 IonicContact OE2-NH1 3.77Å
667	T	90.4	Very high	89.5	Confident	7 Å²	7	12 Å²	12	4%	0.043	7%	0.068	C	C	.	.	H	α-helix	trans	-65	-34.9	-179.6	-62.2	0	0	0	0	111.7	L611 L615 G663 M664 S671	L611-T667 HydrophobicContact CD2-CG2 3.99Å; L615-T667 HydrophobicContact CD1-CG2 4.45Å; G663-T667 VanDerWaalsContact O-CB 3.24Å; G663-T667 WeakPolarHBondContact O-CB 3.41Å; G663-T667 PolarHBondContact O-N 3.48Å; G663-T667 PolarHBondContact O-OG1 2.93Å; M664-T667 PolarHBondContact O-N 3.43Å; T667-S671 VanDerWaalsContact O-CB 3.22Å; T667-S671 WeakPolarHBondContact O-CB 3.4Å; T667-S671 PolarHBondContact O-N 3.05Å; T667-S671 VanDerWaalsContact O-N 3.08Å; T667-S671 PolarHBondContact O-OG 3.26Å
668	L	91.7	Very high	88.3	Confident	0 Å²	0	12 Å²	12	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-66.9	-53.2	176.9	-77.3	167.1	0	0	0	111.8	R620 V623 I624 M664 W665 E666 S671 L672 Y726	R620-L668 HydrophobicContact CG-CD2 3.89Å; R620-L668 PolarHBondContact NH1-O 3.25Å; R620-L668 VanDerWaalsContact NH1-O 3.16Å; V623-L668 HydrophobicContact CG1-CD1 4.35Å; V623-L668 HydrophobicContact CG1-CD2 4.39Å; I624-L668 HydrophobicContact CG1-CD1 4.03Å; I624-L668 HydrophobicContact CG1-CD2 4.19Å; M664-L668 WeakPolarHBondContact O-CB 3.49Å; M664-L668 VanDerWaalsContact O-CG 3.26Å; M664-L668 WeakPolarHBondContact O-CG 3.48Å; M664-L668 PolarHBondContact O-N 3.23Å; W665-L668 HydrophobicContact CE3-CD1 3.78Å; W665-L668 HydrophobicContact CZ3-CD1 4.03Å; W665-L668 PolarHBondContact O-N 3.02Å; E666-L668 VanDerWaalsContact C-N 3.29Å; E666-L668 PolarHBondContact O-N 2.85Å; L668-S671 WeakPolarHBondContact O-CB 3.27Å; L668-S671 PolarHBondContact O-N 3.42Å; L668-L672 PolarHBondContact O-N 2.88Å; L668-Y726 HydrophobicContact CB-CE1 4.1Å; L668-Y726 HydrophobicContact CD1-CE1 4.27Å; L668-Y726 HydrophobicContact CD2-CE1 4.43Å
669	L	91.3	Very high	87	Confident	20 Å²	20	16.7 Å²	16.7	11%	0.105	10%	0.1	C	C	.	.	H	α-helix	trans	-63	-47.1	178	-72.7	172.9	0	0	0	112.2	L564 A565 V568 W665 E666 S671 L672 V673	L564-L669 HydrophobicContact CD2-CD2 4.14Å; L564-L669 HydrophobicContact CD2-CG 4.3Å; L564-L669 HydrophobicContact CG-CD1 4.47Å; L564-L669 HydrophobicContact CG-CD2 4.39Å; A565-L669 HydrophobicContact CB-CD1 4.44Å; V568-L669 HydrophobicContact CB-CD1 4.33Å; V568-L669 HydrophobicContact CG2-CD1 3.96Å; W665-L669 WeakPolarHBondContact O-CG 3.42Å; W665-L669 PolarHBondContact O-N 2.95Å; E666-L669 PolarHBondContact O-N 2.99Å; L669-S671 VanDerWaalsContact C-N 3.25Å; L669-S671 PolarHBondContact O-N 3.46Å; L669-L672 WeakPolarHBondContact O-CB 3.42Å; L669-L672 PolarHBondContact O-N 3.06Å; L669-L672 VanDerWaalsContact O-N 3.11Å; L669-V673 PolarHBondContact O-N 2.93Å; L669-V673 VanDerWaalsContact O-N 3.11Å
670	L	88.8	Confident	86.1	Confident	37 Å²	37	18.8 Å²	18.8	19%	0.194	11%	0.11	C	C	.	.	H	α-helix	trans	-59.7	-38.4	177.1	-178.8	61.7	0	0	0	111.3	A410 E666 T674	A410-L670 HydrophobicContact CB-CD2 4.08Å; A410-L670 HydrophobicContact CB-CG 4.35Å; E666-L670 WeakPolarHBondContact O-CB 2.97Å; E666-L670 PolarHBondContact O-N 2.9Å; L670-T674 HydrophobicContact CD1-CG2 3.79Å; L670-T674 HydrophobicContact CG-CG2 4.42Å; L670-T674 WeakPolarHBondContact O-CB 3.45Å; L670-T674 VanDerWaalsContact O-CG2 3.3Å; L670-T674 WeakPolarHBondContact O-CG2 3.26Å; L670-T674 PolarHBondContact O-N 3.02Å; L670-T674 PolarHBondContact O-OG1 2.73Å
671	S	86.6	Confident	85.6	Confident	17 Å²	17	18.5 Å²	18.5	12%	0.119	11%	0.107	C	C	.	.	H	α-helix	trans	-67.2	-41	174.1	-64.2	0	0	0	0	112.9	R620 T667 L668 L669 L675	R620-S671 PolarHBondContact NH2-OG 3.17Å; T667-S671 VanDerWaalsContact O-CB 3.22Å; T667-S671 WeakPolarHBondContact O-CB 3.4Å; T667-S671 PolarHBondContact O-N 3.05Å; T667-S671 VanDerWaalsContact O-N 3.08Å; T667-S671 PolarHBondContact O-OG 3.26Å; L668-S671 WeakPolarHBondContact O-CB 3.27Å; L668-S671 PolarHBondContact O-N 3.42Å; L669-S671 VanDerWaalsContact C-N 3.25Å; L669-S671 PolarHBondContact O-N 3.46Å; S671-L675 VanDerWaalsContact O-CB 3.22Å; S671-L675 WeakPolarHBondContact O-CB 3.41Å; S671-L675 WeakPolarHBondContact O-CG 3.32Å; S671-L675 PolarHBondContact O-N 3.48Å
672	L	87.3	Confident	85	Confident	1 Å²	1	19.2 Å²	19.2	1%	0.005	11%	0.111	C	C	.	.	I	π-helix	trans	-57.6	-52.7	178.5	172.3	69	0	0	0	110.1	T557 A561 L668 L669 N676 Y726 L729 L733	T557-L672 HydrophobicContact CG2-CD2 4.16Å; A561-L672 HydrophobicContact CB-CD2 3.55Å; L668-L672 PolarHBondContact O-N 2.88Å; L669-L672 WeakPolarHBondContact O-CB 3.42Å; L669-L672 PolarHBondContact O-N 3.06Å; L669-L672 VanDerWaalsContact O-N 3.11Å; L672-N676 HydrophobicContact CD1-CB 4.34Å; L672-N676 VanDerWaalsContact O-CB 3.23Å; L672-N676 WeakPolarHBondContact O-CB 3.25Å; L672-N676 PolarHBondContact O-N 3.21Å; L672-Y726 HydrophobicContact CD2-CE2 4.14Å; L672-L729 HydrophobicContact CD1-CD2 4.11Å; L672-L729 HydrophobicContact CD2-CD2 3.88Å; L672-L733 HydrophobicContact CD1-CD1 3.47Å; L672-L733 VanDerWaalsContact CD1-CD1 3.47Å
673	V	86.3	Confident	84.6	Confident	1 Å²	1	21.4 Å²	21.4	1%	0.006	12%	0.121	C	C	.	.	I	π-helix	trans	-68.4	-50.7	-175.4	177.6	0	0	0	0	111.7	L669 L675 H677 V681 V684 Q685 L688	L669-V673 PolarHBondContact O-N 2.93Å; L669-V673 VanDerWaalsContact O-N 3.11Å; V673-L675 VanDerWaalsContact C-N 3.27Å; V673-L675 PolarHBondContact O-N 3.33Å; V673-H677 PolarHBondContact O-N 3.02Å; V673-V681 HydrophobicContact CG1-CG1 4.1Å; V673-V684 HydrophobicContact CG2-CG1 4.24Å; V673-Q685 HydrophobicContact CG1-CB 4.07Å; V673-L688 HydrophobicContact CG2-CD1 3.65Å
674	T	80.9	Confident	84.3	Confident	3 Å²	3	21.4 Å²	21.4	2%	0.018	12%	0.121	C	C	.	.	I	π-helix	trans	-71.4	-19.4	-172.9	59	0	0	0	0	114.2	V370 L670	V370-T674 HydrophobicContact CG2-CG2 3.93Å; L670-T674 HydrophobicContact CD1-CG2 3.79Å; L670-T674 HydrophobicContact CG-CG2 4.42Å; L670-T674 WeakPolarHBondContact O-CB 3.45Å; L670-T674 VanDerWaalsContact O-CG2 3.3Å; L670-T674 WeakPolarHBondContact O-CG2 3.26Å; L670-T674 PolarHBondContact O-N 3.02Å; L670-T674 PolarHBondContact O-OG1 2.73Å
675	L	77.3	Confident	84.1	Confident	21 Å²	21	21.9 Å²	21.9	11%	0.11	12%	0.124	C	C	.	.	I	π-helix	trans	-104.2	-54.6	-179.8	-62.5	172.1	0	0	0	112.8	D403 R407 S671 V673 H677	D403-L675 HydrophobicContact CB-CD2 3.71Å; R407-L675 HydrophobicContact CG-CD1 4.01Å; R407-L675 HydrophobicContact CG-CD2 4.1Å; R407-L675 HydrophobicContact CG-CG 4.46Å; R407-L675 VanDerWaalsContact NH1-CD2 3.3Å; S671-L675 VanDerWaalsContact O-CB 3.22Å; S671-L675 WeakPolarHBondContact O-CB 3.41Å; S671-L675 WeakPolarHBondContact O-CG 3.32Å; S671-L675 PolarHBondContact O-N 3.48Å; V673-L675 VanDerWaalsContact C-N 3.27Å; V673-L675 PolarHBondContact O-N 3.33Å; L675-H677 PolarHBondContact O-N 3.5Å
676	N	76.2	Confident	84	Confident	43 Å²	43	22 Å²	22	23%	0.23	12%	0.124	C	C	.	.	I	π-helix	trans	-72.6	-34.7	-170.7	-152.4	81.4	0	0	0	112.2	L672 L733 R737	L672-N676 HydrophobicContact CD1-CB 4.34Å; L672-N676 VanDerWaalsContact O-CB 3.23Å; L672-N676 WeakPolarHBondContact O-CB 3.25Å; L672-N676 PolarHBondContact O-N 3.21Å; N676-L733 HydrophobicContact CB-CD1 4.46Å; N676-L733 WeakPolarHBondContact ND2-CD2 3.41Å; N676-R737 PolarHBondContact OD1-NH2 3.45Å
677	H	73.7	Confident	84	Confident	14 Å²	14	22.2 Å²	22.2	7%	0.065	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-115.8	39.3	-174.9	-59.4	106.8	0	0	0	112	T557 V673 L675 S679 H680 V681 V684	T557-H677 VanDerWaalsContact CG2-CE1 3.48Å; T557-H677 WeakPolarHBondContact CG2-CE1 3.34Å; T557-H677 PolarHBondContact OG1-CE1 3.43Å; V673-H677 PolarHBondContact O-N 3.02Å; L675-H677 PolarHBondContact O-N 3.5Å; H677-S679 PolarHBondContact O-N 2.71Å; H677-H680 CarbonylContact O-C 3.36Å; H677-H680 PolarHBondContact O-N 3Å; H677-V681 WeakPolarHBondContact O-CA 3.48Å; H677-V681 VanDerWaalsContact O-CG2 3.26Å; H677-V681 WeakPolarHBondContact O-CG2 3.39Å; H677-V681 PolarHBondContact O-N 3.36Å; H677-V684 HydrophobicContact CB-CB 4.31Å; H677-V684 HydrophobicContact CB-CG2 3.77Å
678	S	69.8	Low	84.2	Confident	26 Å²	26	22.2 Å²	22.2	18%	0.182	13%	0.127	C	C	.	.	S	Bend	trans	-54	-21.6	-176.4	61.9	0	0	0	0	116.5	R402 V681	R402-S678 VanDerWaalsContact CZ-OG 3.28Å; R402-S678 VanDerWaalsContact NH1-CB 3.32Å; R402-S678 PolarHBondContact NH1-OG 2.95Å; R402-S678 VanDerWaalsContact NH2-CB 3.3Å; R402-S678 PolarHBondContact NH2-OG 3.43Å; S678-V681 WeakPolarHBondContact O-CG2 3.47Å
679	S	68.6	Low	84.4	Confident	97 Å²	97	22.8 Å²	22.8	68%	0.678	13%	0.13	S	C	*	.	S	Bend	trans	-91.3	-37.3	171.7	39.5	0	0	0	0	113.2	H677	H677-S679 PolarHBondContact O-N 2.71Å
680	H	79	Confident	84.6	Confident	44 Å²	44	22.6 Å²	22.6	20%	0.204	13%	0.131	C	C	.	.	S	Bend	trans	-106.6	30.5	-175.1	-64.1	-86.4	0	0	0	113	I554 H677 T682 E683 V684	I554-H680 HydrophobicContact CD1-CB 4.14Å; H677-H680 CarbonylContact O-C 3.36Å; H677-H680 PolarHBondContact O-N 3Å; H680-T682 VanDerWaalsContact C-N 3.3Å; H680-T682 PolarHBondContact O-N 3.13Å; H680-E683 HydrophobicContact CB-CB 4.41Å; H680-E683 IonicContact CE1-OE2 2.61Å; H680-E683 IonicContact CG-OE2 3.94Å; H680-E683 IonicContact ND1-OE2 2.68Å; H680-E683 PolarHBondContact ND1-OE2 3.35Å; H680-E683 PolarHBondContact O-N 3.35Å; H680-V684 PolarHBondContact O-N 2.93Å; H680-V684 VanDerWaalsContact O-N 3.1Å
681	V	84.4	Confident	85	Confident	8 Å²	8	23.8 Å²	23.8	5%	0.048	14%	0.138	C	C	.	.	H	α-helix	trans	-50.9	-47.4	-172.2	-179.3	0	0	0	0	112	A366 V370 V673 H677 S678 E683 Q685	A366-V681 HydrophobicContact CB-CG1 4.4Å; V370-V681 HydrophobicContact CB-CG2 4.06Å; V370-V681 HydrophobicContact CG1-CG2 3.98Å; V370-V681 HydrophobicContact CG2-CG1 4.25Å; V370-V681 HydrophobicContact CG2-CG2 3.88Å; V673-V681 HydrophobicContact CG1-CG1 4.1Å; H677-V681 WeakPolarHBondContact O-CA 3.48Å; H677-V681 VanDerWaalsContact O-CG2 3.26Å; H677-V681 WeakPolarHBondContact O-CG2 3.39Å; H677-V681 PolarHBondContact O-N 3.36Å; S678-V681 WeakPolarHBondContact O-CG2 3.47Å; V681-E683 VanDerWaalsContact C-N 3.33Å; V681-E683 PolarHBondContact O-N 3.08Å; V681-Q685 WeakPolarHBondContact O-CB 3.4Å; V681-Q685 PolarHBondContact O-N 3.27Å
682	T	84.1	Confident	85.5	Confident	15 Å²	15	25 Å²	25	9%	0.092	14%	0.139	C	C	.	.	H	α-helix	trans	-71.3	-26.5	-178.1	47.9	0	0	0	0	113.4	M316 Y321 A367 H680 A686	M316-T682 HydrophobicContact CE-CG2 3.87Å; M316-T682 HydrophobicContact SD-CG2 3.7Å; Y321-T682 HydrophobicContact CE1-CG2 4.07Å; A367-T682 HydrophobicContact CB-CG2 3.72Å; H680-T682 VanDerWaalsContact C-N 3.3Å; H680-T682 PolarHBondContact O-N 3.13Å; T682-A686 VanDerWaalsContact O-CB 3.28Å; T682-A686 WeakPolarHBondContact O-CB 3.48Å; T682-A686 PolarHBondContact O-N 3.15Å
683	E	86.2	Confident	86	Confident	52 Å²	52	25.4 Å²	25.4	24%	0.243	14%	0.141	C	C	.	.	H	α-helix	trans	-85.4	-25.1	-175.9	-57.9	-177.3	145.9	0	0	111.6	I313 K317 H680 V681 P687	I313-E683 HydrophobicContact CG2-CG 4.34Å; K317-E683 IonicContact NZ-OE1 3.38Å; K317-E683 PolarHBondContact NZ-OE1 3.4Å; H680-E683 HydrophobicContact CB-CB 4.41Å; H680-E683 IonicContact CE1-OE2 2.61Å; H680-E683 IonicContact CG-OE2 3.94Å; H680-E683 IonicContact ND1-OE2 2.68Å; H680-E683 PolarHBondContact ND1-OE2 3.35Å; H680-E683 PolarHBondContact O-N 3.35Å; V681-E683 VanDerWaalsContact C-N 3.33Å; V681-E683 PolarHBondContact O-N 3.08Å; E683-P687 VanDerWaalsContact O-CD 3.23Å; E683-P687 WeakPolarHBondContact O-CD 3.43Å; E683-P687 WeakPolarHBondContact O-CG 3.27Å
684	V	88.1	Confident	86.5	Confident	0 Å²	0	28.2 Å²	28.2	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-88.8	-42.5	168.7	-179.2	0	0	0	0	111.9	I554 T557 L558 V673 H677 H680 A686 P687 L688	I554-V684 HydrophobicContact CG1-CG2 4.36Å; I554-V684 HydrophobicContact CG2-CG2 4.16Å; T557-V684 HydrophobicContact CG2-CG1 4.1Å; L558-V684 HydrophobicContact CD2-CG1 4.16Å; V673-V684 HydrophobicContact CG2-CG1 4.24Å; H677-V684 HydrophobicContact CB-CB 4.31Å; H677-V684 HydrophobicContact CB-CG2 3.77Å; H680-V684 PolarHBondContact O-N 2.93Å; H680-V684 VanDerWaalsContact O-N 3.1Å; V684-A686 PolarHBondContact O-N 3.35Å; V684-P687 WeakPolarHBondContact O-CD 3.38Å; V684-L688 HydrophobicContact CG1-CD1 3.89Å; V684-L688 WeakPolarHBondContact O-CG 3.47Å; V684-L688 PolarHBondContact O-N 3.02Å
685	Q	89.6	Confident	87.3	Confident	35 Å²	35	28.1 Å²	28.1	16%	0.164	16%	0.155	C	C	.	.	H	α-helix	trans	-63	-42.9	-177.2	-178.1	62.5	24.9	0	0	112.5	A366 V673 V681 L688 L689	A366-Q685 HydrophobicContact CB-CG 4.13Å; V673-Q685 HydrophobicContact CG1-CB 4.07Å; V681-Q685 WeakPolarHBondContact O-CB 3.4Å; V681-Q685 PolarHBondContact O-N 3.27Å; Q685-L688 PolarHBondContact O-N 3.46Å; Q685-L689 WeakPolarHBondContact O-CB 3.42Å; Q685-L689 PolarHBondContact O-N 2.69Å
686	A	91.7	Very high	88.2	Confident	1 Å²	1	27.3 Å²	27.3	1%	0.008	15%	0.151	C	C	.	.	H	α-helix	trans	-59.6	-53	-175.1	0	0	0	0	0	113.6	I313 T682 V684 L689 A690	I313-A686 HydrophobicContact CD1-CB 3.78Å; I313-A686 HydrophobicContact CG1-CB 3.59Å; T682-A686 VanDerWaalsContact O-CB 3.28Å; T682-A686 WeakPolarHBondContact O-CB 3.48Å; T682-A686 PolarHBondContact O-N 3.15Å; V684-A686 PolarHBondContact O-N 3.35Å; A686-L689 PolarHBondContact O-N 2.72Å; A686-A690 PolarHBondContact O-N 3.05Å
687	P	93.1	Very high	89.2	Confident	25 Å²	25	25.2 Å²	25.2	16%	0.162	14%	0.14	C	C	.	.	H	α-helix	trans	-66.9	-33.1	176.4	21.9	-32	0	0	0	114.6	L310 L558 E683 V684 L689 A690 L691	L310-P687 HydrophobicContact CD2-CB 4.25Å; L558-P687 HydrophobicContact CD1-CB 3.99Å; L558-P687 HydrophobicContact CD1-CG 3.49Å; L558-P687 VanDerWaalsContact CD1-CG 3.49Å; L558-P687 HydrophobicContact CD2-CB 4.11Å; L558-P687 HydrophobicContact CD2-CG 3.62Å; L558-P687 HydrophobicContact CG-CG 4.21Å; E683-P687 VanDerWaalsContact O-CD 3.23Å; E683-P687 WeakPolarHBondContact O-CD 3.43Å; E683-P687 WeakPolarHBondContact O-CG 3.27Å; V684-P687 WeakPolarHBondContact O-CD 3.38Å; P687-L689 VanDerWaalsContact C-N 3.35Å; P687-A690 VanDerWaalsContact O-CB 3.29Å; P687-A690 WeakPolarHBondContact O-CB 3.35Å; P687-A690 PolarHBondContact O-N 3.43Å; P687-L691 PolarHBondContact O-N 3.43Å
688	L	94.1	Very high	90.3	Very high	7 Å²	7	28.3 Å²	28.3	4%	0.037	16%	0.157	C	C	.	.	H	α-helix	trans	-64.9	-42	172.1	-67.7	177.5	0	0	0	111.3	L558 A561 A565 V673 V684 Q685 A690 L691 R692	L558-L688 HydrophobicContact CD2-CD1 4.46Å; L558-L688 HydrophobicContact CD2-CD2 3.79Å; L558-L688 HydrophobicContact CD2-CG 3.68Å; A561-L688 HydrophobicContact CB-CD2 4Å; A565-L688 HydrophobicContact CB-CB 4.16Å; A565-L688 HydrophobicContact CB-CD2 4.16Å; A565-L688 WeakPolarHBondContact CB-O 3.47Å; V673-L688 HydrophobicContact CG2-CD1 3.65Å; V684-L688 HydrophobicContact CG1-CD1 3.89Å; V684-L688 WeakPolarHBondContact O-CG 3.47Å; V684-L688 PolarHBondContact O-N 3.02Å; Q685-L688 PolarHBondContact O-N 3.46Å; L688-A690 VanDerWaalsContact C-N 3.31Å; L688-A690 PolarHBondContact O-N 2.8Å; L688-L691 PolarHBondContact O-N 2.98Å; L688-R692 PolarHBondContact O-N 2.94Å; L688-R692 VanDerWaalsContact O-N 3.07Å
689	L	94.6	Very high	91.5	Very high	12 Å²	12	28.2 Å²	28.2	6%	0.063	16%	0.155	C	C	.	.	H	α-helix	trans	-65.8	-33.5	175.6	-175.8	65.1	0	0	0	112	S359 A362 Q685 A686 P687 R692 F693	S359-L689 WeakPolarHBondContact OG-CD2 3.49Å; A362-L689 HydrophobicContact CB-CD1 4.44Å; A362-L689 HydrophobicContact CB-CD2 3.58Å; Q685-L689 WeakPolarHBondContact O-CB 3.42Å; Q685-L689 PolarHBondContact O-N 2.69Å; A686-L689 PolarHBondContact O-N 2.72Å; P687-L689 VanDerWaalsContact C-N 3.35Å; L689-R692 PolarHBondContact O-N 3.47Å; L689-F693 HydrophobicContact CD1-CD2 4.18Å; L689-F693 HydrophobicContact CD1-CE1 4.06Å; L689-F693 HydrophobicContact CD1-CE2 3.63Å; L689-F693 HydrophobicContact CD1-CZ 3.55Å; L689-F693 HydrophobicContact CD2-CE2 3.7Å; L689-F693 HydrophobicContact CD2-CZ 4.14Å; L689-F693 HydrophobicContact CG-CD2 3.83Å; L689-F693 HydrophobicContact CG-CE2 3.38Å; L689-F693 HydrophobicContact CG-CZ 3.86Å; L689-F693 WeakPolarHBondContact O-CD2 3.47Å; L689-F693 WeakPolarHBondContact O-CG 3.35Å; L689-F693 PolarHBondContact O-N 3.09Å
690	A	96.4	Very high	92.7	Very high	16 Å²	16	23.6 Å²	23.6	13%	0.132	12%	0.123	C	C	.	.	H	α-helix	trans	-58	-50.4	172.6	0	0	0	0	0	111.7	S309 A686 P687 L688 R692 F693 L694	S309-A690 WeakPolarHBondContact OG-CB 3.44Å; A686-A690 PolarHBondContact O-N 3.05Å; P687-A690 VanDerWaalsContact O-CB 3.29Å; P687-A690 WeakPolarHBondContact O-CB 3.35Å; P687-A690 PolarHBondContact O-N 3.43Å; L688-A690 VanDerWaalsContact C-N 3.31Å; L688-A690 PolarHBondContact O-N 2.8Å; A690-R692 VanDerWaalsContact C-N 3.33Å; A690-R692 PolarHBondContact O-N 2.86Å; A690-F693 PolarHBondContact O-N 3.22Å; A690-L694 WeakPolarHBondContact O-CB 3.08Å; A690-L694 PolarHBondContact O-N 3.49Å
691	L	96.8	Very high	93.3	Very high	62 Å²	62	23 Å²	23	33%	0.325	13%	0.126	S	C	.	.	H	α-helix	trans	-64.7	-38.3	179.3	-69.1	170.9	0	0	0	111.6	Y566 P687 L688 L694 G695	Y566-L691 WeakPolarHBondContact CD2-O 3.41Å; P687-L691 PolarHBondContact O-N 3.43Å; L688-L691 PolarHBondContact O-N 2.98Å; L691-L694 WeakPolarHBondContact O-CB 3.18Å; L691-L694 PolarHBondContact O-N 2.95Å; L691-G695 PolarHBondContact O-N 3.49Å
692	R	97.4	Very high	93.4	Very high	41 Å²	41	23.3 Å²	23.3	16%	0.155	13%	0.13	C	C	.	.	H	α-helix	trans	-64.6	-44.5	174.2	-171.9	-124.8	-173.8	86.7	-16.9	112.8	A565 G569 Q572 E666 L688 L689 A690 L694 G695 L696	A565-R692 WeakPolarHBondContact O-CA 3.27Å; A565-R692 VanDerWaalsContact O-CB 3.22Å; A565-R692 WeakPolarHBondContact O-CB 3.04Å; A565-R692 WeakPolarHBondContact O-CG 3.41Å; G569-R692 VanDerWaalsContact CA-O 3.29Å; G569-R692 WeakPolarHBondContact CA-O 3.48Å; Q572-R692 VanDerWaalsContact CD-NH2 3.34Å; Q572-R692 VanDerWaalsContact OE1-CZ 3.24Å; E666-R692 IonicContact OE1-CZ 2.78Å; E666-R692 IonicContact OE1-NH1 3.79Å; E666-R692 PolarHBondContact OE1-NH1 2.91Å; E666-R692 IonicContact OE1-NH2 3.2Å; E666-R692 PolarHBondContact OE1-NH2 2.9Å; E666-R692 IonicContact OE2-NH1 3.77Å; L688-R692 PolarHBondContact O-N 2.94Å; L688-R692 VanDerWaalsContact O-N 3.07Å; L689-R692 PolarHBondContact O-N 3.47Å; A690-R692 VanDerWaalsContact C-N 3.33Å; A690-R692 PolarHBondContact O-N 2.86Å; R692-L694 VanDerWaalsContact C-N 3.32Å; R692-G695 PolarHBondContact O-N 2.71Å; R692-L696 HydrophobicContact CG-CD1 4.43Å; R692-L696 WeakPolarHBondContact O-CG 3.46Å; R692-L696 PolarHBondContact O-N 3.27Å
693	F	97.7	Very high	93.5	Very high	10 Å²	10	23 Å²	23	4%	0.044	13%	0.127	C	C	.	.	H	α-helix	trans	-67.9	-31.9	174.4	-69.8	-37.6	0	0	0	112.6	F302 A305 A306 L358 L689 A690 L696 G697	F302-F693 AromaticContact CD1-CD1 3.62Å; F302-F693 HydrophobicContact CD1-CD1 3.62Å; F302-F693 HydrophobicContact CD1-CE1 4.16Å; F302-F693 HydrophobicContact CD1-CG 4.41Å; F302-F693 AromaticContact CE1-CD1 3.99Å; F302-F693 HydrophobicContact CE1-CD1 3.99Å; F302-F693 HydrophobicContact CE1-CE1 4.13Å; A305-F693 HydrophobicContact CB-CB 4.33Å; A305-F693 HydrophobicContact CB-CD1 4.39Å; A305-F693 HydrophobicContact CB-CD2 3.58Å; A305-F693 HydrophobicContact CB-CE2 3.86Å; A305-F693 HydrophobicContact CB-CG 3.88Å; A305-F693 HydrophobicContact CB-CZ 4.41Å; A306-F693 HydrophobicContact CB-CB 3.82Å; L358-F693 HydrophobicContact CD2-CE1 3.73Å; L358-F693 HydrophobicContact CD2-CZ 3.8Å; L358-F693 HydrophobicContact CG-CE1 4.16Å; L358-F693 HydrophobicContact CG-CE2 4.47Å; L358-F693 HydrophobicContact CG-CZ 3.72Å; L689-F693 HydrophobicContact CD1-CD2 4.18Å; L689-F693 HydrophobicContact CD1-CE1 4.06Å; L689-F693 HydrophobicContact CD1-CE2 3.63Å; L689-F693 HydrophobicContact CD1-CZ 3.55Å; L689-F693 HydrophobicContact CD2-CE2 3.7Å; L689-F693 HydrophobicContact CD2-CZ 4.14Å; L689-F693 HydrophobicContact CG-CD2 3.83Å; L689-F693 HydrophobicContact CG-CE2 3.38Å; L689-F693 HydrophobicContact CG-CZ 3.86Å; L689-F693 WeakPolarHBondContact O-CD2 3.47Å; L689-F693 WeakPolarHBondContact O-CG 3.35Å; L689-F693 PolarHBondContact O-N 3.09Å; A690-F693 PolarHBondContact O-N 3.22Å; F693-L696 HydrophobicContact CD1-CD1 3.84Å; F693-L696 HydrophobicContact CE1-CD1 4.44Å; F693-L696 PolarHBondContact O-N 2.9Å; F693-G697 PolarHBondContact O-N 3.33Å
694	L	97.7	Very high	93.1	Very high	61 Å²	61	21.4 Å²	21.4	32%	0.319	13%	0.125	S	C	.	.	H	α-helix	trans	-63.4	-44.6	171.9	-174.7	66.8	0	0	0	111.3	L303 A306 Y566 A690 L691 R692 G697 L698	L303-L694 HydrophobicContact CD2-CD1 3.91Å; A306-L694 HydrophobicContact CB-CB 4.32Å; Y566-L694 HydrophobicContact CD2-CB 4.45Å; Y566-L694 HydrophobicContact CD2-CD2 4.44Å; Y566-L694 HydrophobicContact CD2-CG 4.49Å; Y566-L694 HydrophobicContact CE2-CB 4.42Å; Y566-L694 HydrophobicContact CE2-CD2 4.24Å; Y566-L694 HydrophobicContact CE2-CG 4.09Å; A690-L694 WeakPolarHBondContact O-CB 3.08Å; A690-L694 PolarHBondContact O-N 3.49Å; L691-L694 WeakPolarHBondContact O-CB 3.18Å; L691-L694 PolarHBondContact O-N 2.95Å; R692-L694 VanDerWaalsContact C-N 3.32Å; L694-G697 PolarHBondContact O-N 3.49Å; L694-L698 HydrophobicContact CD1-CD1 3.98Å; L694-L698 HydrophobicContact CD1-CG 4.16Å; L694-L698 HydrophobicContact CG-CD1 3.91Å; L694-L698 HydrophobicContact CG-CG 4.41Å; L694-L698 WeakPolarHBondContact O-CB 3.18Å; L694-L698 WeakPolarHBondContact O-CG 3.43Å; L694-L698 PolarHBondContact O-N 3.21Å
695	G	97.2	Very high	92.8	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-61.9	-44.5	175.4	0	0	0	0	0	113.1	L691 R692 T699	L691-G695 PolarHBondContact O-N 3.49Å; R692-G695 PolarHBondContact O-N 2.71Å; G695-T699 WeakPolarHBondContact O-CB 3.48Å; G695-T699 PolarHBondContact O-N 2.92Å; G695-T699 VanDerWaalsContact O-N 3.13Å; G695-T699 PolarHBondContact O-OG1 3.28Å
696	L	96.8	Very high	92.6	Very high	4 Å²	4	30.8 Å²	30.8	2%	0.021	17%	0.169	C	C	.	.	H	α-helix	trans	-57.5	-52.1	172.3	-76.6	156.8	0	0	0	110.9	F302 G569 Q572 A573 M576 R692 F693 L698 T699 F700	F302-L696 HydrophobicContact CB-CB 4.15Å; F302-L696 HydrophobicContact CD1-CB 4.06Å; F302-L696 HydrophobicContact CD1-CD1 3.99Å; F302-L696 HydrophobicContact CD2-CB 3.89Å; F302-L696 HydrophobicContact CE1-CB 4.42Å; F302-L696 HydrophobicContact CE1-CD1 3.79Å; F302-L696 HydrophobicContact CE2-CB 4.27Å; F302-L696 HydrophobicContact CE2-CD2 4.42Å; F302-L696 HydrophobicContact CG-CB 3.77Å; F302-L696 HydrophobicContact CZ-CD1 4.18Å; F302-L696 HydrophobicContact CZ-CD2 4.34Å; G569-L696 WeakPolarHBondContact O-CD2 3.34Å; G569-L696 WeakPolarHBondContact O-CG 3.4Å; Q572-L696 HydrophobicContact CB-CD2 3.88Å; A573-L696 HydrophobicContact CB-CD2 3.92Å; A573-L696 WeakPolarHBondContact CB-O 3.25Å; M576-L696 HydrophobicContact CE-CD2 3.88Å; R692-L696 HydrophobicContact CG-CD1 4.43Å; R692-L696 WeakPolarHBondContact O-CG 3.46Å; R692-L696 PolarHBondContact O-N 3.27Å; F693-L696 HydrophobicContact CD1-CD1 3.84Å; F693-L696 HydrophobicContact CE1-CD1 4.44Å; F693-L696 PolarHBondContact O-N 2.9Å; L696-L698 PolarHBondContact O-N 3.22Å; L696-T699 PolarHBondContact O-N 2.94Å; L696-F700 HydrophobicContact CD2-CE2 4.36Å; L696-F700 VanDerWaalsContact O-CD2 3.24Å; L696-F700 WeakPolarHBondContact O-CD2 3.43Å; L696-F700 PolarHBondContact O-N 3.42Å
697	G	96.5	Very high	92.4	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-64.8	-40.1	-175.6	0	0	0	0	0	114	S299 F693 L694 A701	S299-G697 WeakPolarHBondContact CB-O 3.35Å; S299-G697 PolarHBondContact OG-O 3.35Å; F693-G697 PolarHBondContact O-N 3.33Å; L694-G697 PolarHBondContact O-N 3.49Å; G697-A701 WeakPolarHBondContact O-CB 3.38Å; G697-A701 PolarHBondContact O-N 3.45Å
698	L	95.8	Very high	92.3	Very high	79 Å²	79	31.4 Å²	31.4	41%	0.414	17%	0.173	S	C	.	.	H	α-helix	trans	-73.6	-33.5	178.7	-69.7	176.3	0	0	0	112.9	L303 Y566 L694 L696 A701 G702	L303-L698 HydrophobicContact CD2-CD2 4.48Å; Y566-L698 HydrophobicContact CE2-CD1 4.23Å; L694-L698 HydrophobicContact CD1-CD1 3.98Å; L694-L698 HydrophobicContact CD1-CG 4.16Å; L694-L698 HydrophobicContact CG-CD1 3.91Å; L694-L698 HydrophobicContact CG-CG 4.41Å; L694-L698 WeakPolarHBondContact O-CB 3.18Å; L694-L698 WeakPolarHBondContact O-CG 3.43Å; L694-L698 PolarHBondContact O-N 3.21Å; L696-L698 PolarHBondContact O-N 3.22Å; L698-A701 WeakPolarHBondContact O-CB 3.48Å; L698-A701 PolarHBondContact O-N 3.23Å; L698-G702 PolarHBondContact O-N 3.47Å
699	T	95.3	Very high	92.1	Very high	23 Å²	23	33.1 Å²	33.1	14%	0.141	19%	0.185	C	C	.	.	H	α-helix	trans	-70.6	-45.7	175.7	-53.3	0	0	0	0	110.6	T570 A573 G695 L696 A701 G702 H703	T570-T699 WeakPolarHBondContact CA-OG1 3.24Å; T570-T699 WeakPolarHBondContact CB-OG1 3.45Å; T570-T699 WeakPolarHBondContact CG2-OG1 3.41Å; A573-T699 HydrophobicContact CB-CG2 3.74Å; G695-T699 WeakPolarHBondContact O-CB 3.48Å; G695-T699 PolarHBondContact O-N 2.92Å; G695-T699 VanDerWaalsContact O-N 3.13Å; G695-T699 PolarHBondContact O-OG1 3.28Å; L696-T699 PolarHBondContact O-N 2.94Å; T699-A701 PolarHBondContact O-N 2.98Å; T699-G702 PolarHBondContact O-N 2.95Å; T699-H703 PolarHBondContact O-N 2.87Å
700	F	93.8	Very high	92	Very high	1 Å²	1	38 Å²	38	0%	0.004	21%	0.21	C	C	.	.	H	α-helix	trans	-62.2	-29.1	171.9	-79.5	-58.7	0	0	0	113.2	L298 F302 A573 M576 L696	L298-F700 HydrophobicContact CB-CB 4.41Å; L298-F700 HydrophobicContact CB-CD1 4.27Å; L298-F700 HydrophobicContact CB-CD2 4.1Å; L298-F700 HydrophobicContact CB-CE2 4.44Å; L298-F700 HydrophobicContact CB-CG 4.02Å; L298-F700 HydrophobicContact CD1-CD1 4.21Å; L298-F700 HydrophobicContact CD1-CE1 3.9Å; L298-F700 HydrophobicContact CD1-CZ 4.16Å; F302-F700 AromaticContact CD2-CD2 3.79Å; F302-F700 HydrophobicContact CD2-CD2 3.79Å; F302-F700 HydrophobicContact CD2-CE2 4.01Å; F302-F700 AromaticContact CE2-CD2 3.86Å; F302-F700 HydrophobicContact CE2-CD2 3.86Å; F302-F700 AromaticContact CE2-CE2 3.58Å; F302-F700 HydrophobicContact CE2-CE2 3.58Å; A573-F700 HydrophobicContact CB-CD2 3.59Å; A573-F700 HydrophobicContact CB-CE1 4.5Å; A573-F700 HydrophobicContact CB-CE2 3.54Å; A573-F700 HydrophobicContact CB-CG 4.11Å; A573-F700 HydrophobicContact CB-CZ 4.03Å; M576-F700 HydrophobicContact CB-CZ 3.95Å; M576-F700 HydrophobicContact CE-CE2 4.25Å; M576-F700 HydrophobicContact CE-CZ 4.21Å; L696-F700 HydrophobicContact CD2-CE2 4.36Å; L696-F700 VanDerWaalsContact O-CD2 3.24Å; L696-F700 WeakPolarHBondContact O-CD2 3.43Å; L696-F700 PolarHBondContact O-N 3.42Å
701	A	91.6	Very high	91.8	Very high	32 Å²	32	38.4 Å²	38.4	26%	0.264	21%	0.208	S	C	.	.	H	α-helix	trans	-67	-35.9	170.1	0	0	0	0	0	112.4	S299 G697 L698 T699 F705	S299-A701 WeakPolarHBondContact OG-CB 3.3Å; G697-A701 WeakPolarHBondContact O-CB 3.38Å; G697-A701 PolarHBondContact O-N 3.45Å; L698-A701 WeakPolarHBondContact O-CB 3.48Å; L698-A701 PolarHBondContact O-N 3.23Å; T699-A701 PolarHBondContact O-N 2.98Å; A701-F705 WeakPolarHBondContact O-CD2 3.31Å; A701-F705 WeakPolarHBondContact O-CE2 3.26Å
702	G	87.9	Confident	91.7	Very high	13 Å²	13	35.5 Å²	35.5	13%	0.134	19%	0.193	C	C	.	.	H	α-helix	trans	-81.1	-16.5	-178.7	0	0	0	0	0	115.2	L698 T699 G704 F705 L706	L698-G702 PolarHBondContact O-N 3.47Å; T699-G702 PolarHBondContact O-N 2.95Å; G702-G704 VanDerWaalsContact C-N 3.32Å; G702-G704 PolarHBondContact O-N 3.35Å; G702-G704 VanDerWaalsContact O-N 3.17Å; G702-F705 PolarHBondContact O-N 3.28Å; G702-L706 PolarHBondContact O-N 3.15Å; G702-L706 VanDerWaalsContact O-N 3.17Å
703	H	85.5	Confident	91.6	Very high	10 Å²	10	38.2 Å²	38.2	5%	0.046	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-42.9	-53.1	-173.4	-172.9	59.9	0	0	0	113.6	G275 E292 S295 D578 R581 T699 K711	G275-H703 PolarHBondContact O-NE2 3.45Å; E292-H703 IonicContact OE2-CD2 3.79Å; E292-H703 PolarHBondContact OE2-CD2 3.24Å; E292-H703 IonicContact OE2-NE2 3.92Å; S295-H703 PolarHBondContact OG-CD2 2.92Å; D578-H703 PolarHBondContact N-CE1 3.46Å; D578-H703 WeakPolarHBondContact OD1-CA 3.43Å; D578-H703 IonicContact OD1-CE1 3.26Å; D578-H703 IonicContact OD1-CG 3.93Å; D578-H703 IonicContact OD1-ND1 2.69Å; D578-H703 PolarHBondContact OD1-ND1 3.08Å; R581-H703 VanDerWaalsContact CD-CE1 3.48Å; R581-H703 WeakPolarHBondContact CD-CE1 3.44Å; R581-H703 WeakPolarHBondContact CD-NE2 3.49Å; T699-H703 PolarHBondContact O-N 2.87Å; H703-K711 PolarHBondContact O-NZ 3.05Å
704	G	76.6	Confident	91.5	Very high	18 Å²	18	40 Å²	40	19%	0.186	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.4	1	-177.4	0	0	0	0	0	117	P478 G702	P478-G704 VanDerWaalsContact CB-O 3.25Å; P478-G704 WeakPolarHBondContact CB-O 3.35Å; G702-G704 VanDerWaalsContact C-N 3.32Å; G702-G704 PolarHBondContact O-N 3.35Å; G702-G704 VanDerWaalsContact O-N 3.17Å
705	F	81.9	Confident	91.4	Very high	139 Å²	139	37.3 Å²	37.3	61%	0.61	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-122	-17.4	-168.8	-60	-94.6	0	0	0	114	L296 A701 G702	L296-F705 HydrophobicContact CD2-CE2 4.06Å; L296-F705 HydrophobicContact CD2-CZ 4.44Å; A701-F705 WeakPolarHBondContact O-CD2 3.31Å; A701-F705 WeakPolarHBondContact O-CE2 3.26Å; G702-F705 PolarHBondContact O-N 3.28Å
706	L	86	Confident	91.4	Very high	92 Å²	92	39.4 Å²	39.4	48%	0.482	23%	0.225	S	C	.	.	S	Bend	trans	-116.3	144.3	-178.7	-59.3	177.4	0	0	0	110.6	G702 K711	G702-L706 PolarHBondContact O-N 3.15Å; G702-L706 VanDerWaalsContact O-N 3.17Å; L706-K711 HydrophobicContact CB-CG 4.16Å; L706-K711 WeakPolarHBondContact O-CE 3.45Å
707	C	88.8	Confident	91.3	Very high	36 Å²	36	42.9 Å²	42.9	24%	0.243	25%	0.246	C	C	.	.			trans	-65	147.1	167.6	-64.3	0	0	0	0	111.1	C477 S709 M710 K711	C477-C707 HydrophobicContact CB-CB 4.11Å; C477-C707 WeakPolarHBondContact CB-SG 3.35Å; C477-C707 WeakPolarHBondContact SG-CB 3.23Å; C477-C707 CovalentContact SG-SG 2.04Å; C477-C707 PolarHBondContact SG-SG 3.5Å; C707-S709 PolarHBondContact O-N 3.3Å; C707-M710 HydrophobicContact CB-CG 4.37Å; C707-M710 WeakPolarHBondContact O-CB 3.4Å; C707-M710 PolarHBondContact O-N 2.89Å; C707-K711 PolarHBondContact O-N 3.09Å
708	E	90.3	Very high	91.3	Very high	4 Å²	4	45.1 Å²	45.1	2%	0.019	26%	0.258	C	S	.	.	H	α-helix	trans	-62.5	-44.4	-171.9	-167.3	64.1	-168.6	0	0	112.7	M476 Y574 A582 F583 M710 K711 I712	M476-E708 HydrophobicContact CB-CB 4.31Å; M476-E708 WeakPolarHBondContact O-CB 3.3Å; M476-E708 PolarHBondContact O-N 3.36Å; Y574-E708 WeakPolarHBondContact CE2-OE1 3.43Å; Y574-E708 PolarHBondContact OH-OE1 3.03Å; A582-E708 HydrophobicContact CB-CG 4.02Å; F583-E708 HydrophobicContact CE2-CG 4.11Å; E708-M710 PolarHBondContact O-N 3.1Å; E708-K711 WeakPolarHBondContact O-CB 3.37Å; E708-K711 PolarHBondContact O-N 3.26Å; E708-K711 WeakPolarHBondContact OE2-CD 3.36Å; E708-K711 WeakPolarHBondContact OE2-CE 3.26Å; E708-K711 IonicContact OE2-NZ 2.61Å; E708-K711 PolarHBondContact OE2-NZ 3.37Å; E708-I712 HydrophobicContact CG-CD1 4.32Å; E708-I712 WeakPolarHBondContact O-CG1 3.46Å; E708-I712 PolarHBondContact O-N 3.41Å
709	S	90.3	Very high	91.4	Very high	42 Å²	42	41.3 Å²	41.3	29%	0.294	24%	0.238	S	C	.	.	H	α-helix	trans	-48.3	-41.4	170.2	49.6	0	0	0	0	113.7	A474 C707 I712 I713	A474-S709 WeakPolarHBondContact O-CB 3.16Å; A474-S709 PolarHBondContact O-N 3.46Å; C707-S709 PolarHBondContact O-N 3.3Å; S709-I712 PolarHBondContact O-N 3.05Å; S709-I713 WeakPolarHBondContact O-CD1 3.31Å; S709-I713 VanDerWaalsContact O-CG1 3.26Å; S709-I713 WeakPolarHBondContact O-CG1 3.28Å; S709-I713 PolarHBondContact O-N 3.26Å
710	M	91.4	Very high	91.4	Very high	116 Å²	116	43.8 Å²	43.8	57%	0.571	25%	0.253	S	S	*	.	H	α-helix	trans	-70.9	-33.9	179	-60.3	-65.3	167.3	0	0	112.2	C707 E708 A714	C707-M710 HydrophobicContact CB-CG 4.37Å; C707-M710 WeakPolarHBondContact O-CB 3.4Å; C707-M710 PolarHBondContact O-N 2.89Å; E708-M710 PolarHBondContact O-N 3.1Å; M710-A714 WeakPolarHBondContact O-CB 3.46Å; M710-A714 PolarHBondContact O-N 2.98Å
711	K	93.6	Very high	91.6	Very high	24 Å²	24	48.6 Å²	48.6	10%	0.104	28%	0.277	C	S	.	.	H	α-helix	trans	-67.5	-43	174.4	-54.7	176.8	-156.1	157.7	0	110.9	Y574 D578 H703 L706 C707 E708 A714 L715	Y574-K711 HydrophobicContact CD2-CB 4.3Å; Y574-K711 HydrophobicContact CE2-CB 4.09Å; D578-K711 HydrophobicContact CB-CD 4.36Å; D578-K711 WeakPolarHBondContact OD1-CD 3.48Å; D578-K711 WeakPolarHBondContact OD1-CE 3.47Å; D578-K711 IonicContact OD1-NZ 3.1Å; D578-K711 PolarHBondContact OD1-NZ 2.85Å; H703-K711 PolarHBondContact O-NZ 3.05Å; L706-K711 HydrophobicContact CB-CG 4.16Å; L706-K711 WeakPolarHBondContact O-CE 3.45Å; C707-K711 PolarHBondContact O-N 3.09Å; E708-K711 WeakPolarHBondContact O-CB 3.37Å; E708-K711 PolarHBondContact O-N 3.26Å; E708-K711 WeakPolarHBondContact OE2-CD 3.36Å; E708-K711 WeakPolarHBondContact OE2-CE 3.26Å; E708-K711 IonicContact OE2-NZ 2.61Å; E708-K711 PolarHBondContact OE2-NZ 3.37Å; K711-A714 PolarHBondContact O-N 3.06Å; K711-L715 WeakPolarHBondContact O-CG 3.2Å; K711-L715 PolarHBondContact O-N 2.9Å
712	I	94.5	Very high	91.8	Very high	1 Å²	1	47.2 Å²	47.2	1%	0.005	27%	0.266	C	S	.	.	H	α-helix	trans	-63.1	-46.2	177.3	-60.8	163.7	0	0	0	110.5	A474 Y574 F583 L638 E708 S709 A714 L715 V716	A474-I712 HydrophobicContact CB-CD1 3.78Å; Y574-I712 HydrophobicContact CE2-CG1 4.25Å; Y574-I712 WeakPolarHBondContact OH-CG1 3.33Å; F583-I712 HydrophobicContact CZ-CD1 4.27Å; L638-I712 HydrophobicContact CB-CD1 4.44Å; E708-I712 HydrophobicContact CG-CD1 4.32Å; E708-I712 WeakPolarHBondContact O-CG1 3.46Å; E708-I712 PolarHBondContact O-N 3.41Å; S709-I712 PolarHBondContact O-N 3.05Å; I712-A714 VanDerWaalsContact C-N 3.33Å; I712-A714 PolarHBondContact O-N 3.1Å; I712-L715 PolarHBondContact O-N 3.17Å; I712-V716 WeakPolarHBondContact O-CG2 3.48Å; I712-V716 PolarHBondContact O-N 3.4Å
713	I	94.2	Very high	92.2	Very high	97 Å²	97	46.9 Å²	46.9	50%	0.497	26%	0.261	S	S	.	.	H	α-helix	trans	-59.6	-43.6	175.4	-68.7	164.4	0	0	0	110.9	S709 L715 V716 V717	S709-I713 WeakPolarHBondContact O-CD1 3.31Å; S709-I713 VanDerWaalsContact O-CG1 3.26Å; S709-I713 WeakPolarHBondContact O-CG1 3.28Å; S709-I713 PolarHBondContact O-N 3.26Å; I713-L715 VanDerWaalsContact C-N 3.35Å; I713-L715 PolarHBondContact O-N 3.36Å; I713-V716 PolarHBondContact O-N 2.97Å; I713-V717 WeakPolarHBondContact O-CG2 3.3Å; I713-V717 PolarHBondContact O-N 3Å
714	A	95.1	Very high	92.6	Very high	47 Å²	47	49.7 Å²	49.7	39%	0.388	28%	0.28	S	S	.	.	H	α-helix	trans	-61.1	-40.7	176.1	0	0	0	0	0	112.4	M710 K711 I712 V717 L718	M710-A714 WeakPolarHBondContact O-CB 3.46Å; M710-A714 PolarHBondContact O-N 2.98Å; K711-A714 PolarHBondContact O-N 3.06Å; I712-A714 VanDerWaalsContact C-N 3.33Å; I712-A714 PolarHBondContact O-N 3.1Å; A714-V717 PolarHBondContact O-N 3.42Å; A714-L718 WeakPolarHBondContact O-CB 3.43Å; A714-L718 VanDerWaalsContact O-CG 3.23Å; A714-L718 WeakPolarHBondContact O-CG 3.44Å; A714-L718 PolarHBondContact O-N 3.17Å
715	L	96.1	Very high	93.5	Very high	6 Å²	6	50.4 Å²	50.4	3%	0.031	28%	0.282	C	S	.	.	H	α-helix	trans	-64.2	-40.9	175.1	-74.7	170.5	0	0	0	112.7	F567 T570 Y574 L635 W658 K711 I712 I713 L718 L719	F567-L715 HydrophobicContact CE2-CD2 4.24Å; T570-L715 WeakPolarHBondContact OG1-CD2 3.41Å; Y574-L715 HydrophobicContact CD1-CD1 3.76Å; Y574-L715 HydrophobicContact CD2-CD1 3.65Å; Y574-L715 HydrophobicContact CE1-CD1 4.27Å; Y574-L715 HydrophobicContact CE2-CD1 4.18Å; Y574-L715 HydrophobicContact CG-CD1 3.44Å; Y574-L715 VanDerWaalsContact CG-CD1 3.44Å; L635-L715 HydrophobicContact CD1-CB 4.1Å; L635-L715 HydrophobicContact CD2-CB 4.09Å; L635-L715 HydrophobicContact CD2-CD1 4.29Å; W658-L715 HydrophobicContact CH2-CD1 4.23Å; K711-L715 WeakPolarHBondContact O-CG 3.2Å; K711-L715 PolarHBondContact O-N 2.9Å; I712-L715 PolarHBondContact O-N 3.17Å; I713-L715 VanDerWaalsContact C-N 3.35Å; I713-L715 PolarHBondContact O-N 3.36Å; L715-L718 PolarHBondContact O-N 3.42Å; L715-L719 WeakPolarHBondContact O-CB 3.31Å; L715-L719 PolarHBondContact O-N 3.43Å
716	V	96.5	Very high	94.1	Very high	44 Å²	44	43.8 Å²	43.8	27%	0.267	25%	0.253	S	S	.	.	H	α-helix	trans	-60.7	-46.3	174.8	174.4	0	0	0	0	110.6	L635 I712 I713 L718 L719 V720	L635-V716 HydrophobicContact CB-CG2 3.6Å; L635-V716 HydrophobicContact CD1-CB 4.42Å; L635-V716 HydrophobicContact CD1-CG2 3.7Å; L635-V716 HydrophobicContact CG-CG2 4.25Å; I712-V716 WeakPolarHBondContact O-CG2 3.48Å; I712-V716 PolarHBondContact O-N 3.4Å; I713-V716 PolarHBondContact O-N 2.97Å; V716-L718 PolarHBondContact O-N 2.92Å; V716-L719 PolarHBondContact O-N 3.31Å; V716-V720 WeakPolarHBondContact O-CG2 3.45Å; V716-V720 PolarHBondContact O-N 2.88Å
717	V	96.4	Very high	94.5	Very high	77 Å²	77	40 Å²	40	47%	0.467	23%	0.234	S	C	.	.	H	α-helix	trans	-62.7	-43.2	177.5	171.9	0	0	0	0	111.3	I713 A714 V720 I721	I713-V717 WeakPolarHBondContact O-CG2 3.3Å; I713-V717 PolarHBondContact O-N 3Å; A714-V717 PolarHBondContact O-N 3.42Å; V717-V720 PolarHBondContact O-N 3.42Å; V717-I721 HydrophobicContact CG1-CD1 3.68Å; V717-I721 HydrophobicContact CG1-CG1 4.47Å; V717-I721 WeakPolarHBondContact O-CB 3.43Å; V717-I721 VanDerWaalsContact O-CG1 3.3Å; V717-I721 WeakPolarHBondContact O-CG1 3.37Å; V717-I721 PolarHBondContact O-N 3.5Å
718	L	96.7	Very high	94.7	Very high	46 Å²	46	41 Å²	41	24%	0.241	24%	0.24	C	C	.	.	H	α-helix	trans	-65.8	-36.8	177.1	-71.9	169.1	0	0	0	112.7	Y566 F567 T570 A714 L715 V716 I721 S722	Y566-L718 HydrophobicContact CD1-CD2 4.09Å; Y566-L718 HydrophobicContact CE1-CD1 3.91Å; Y566-L718 HydrophobicContact CE1-CD2 3.79Å; F567-L718 HydrophobicContact CD2-CB 3.85Å; T570-L718 HydrophobicContact CG2-CD1 4.08Å; A714-L718 WeakPolarHBondContact O-CB 3.43Å; A714-L718 VanDerWaalsContact O-CG 3.23Å; A714-L718 WeakPolarHBondContact O-CG 3.44Å; A714-L718 PolarHBondContact O-N 3.17Å; L715-L718 PolarHBondContact O-N 3.42Å; V716-L718 PolarHBondContact O-N 2.92Å; L718-I721 PolarHBondContact O-N 3.21Å; L718-S722 WeakPolarHBondContact O-CB 3.19Å; L718-S722 PolarHBondContact O-N 3.43Å; L718-S722 PolarHBondContact O-OG 2.95Å
719	L	96.6	Very high	94.8	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-62.5	-47.2	173.9	179.8	66.8	0	0	0	111.1	F567 F628 H631 S632 L635 W665 L715 V716 I721 S722 V723	F567-L719 HydrophobicContact CD1-CD1 4.4Å; F567-L719 HydrophobicContact CD2-CB 4.27Å; F567-L719 HydrophobicContact CE1-CD1 3.8Å; F567-L719 HydrophobicContact CE2-CB 3.73Å; F567-L719 HydrophobicContact CE2-CD1 4.28Å; F567-L719 HydrophobicContact CZ-CB 4Å; F567-L719 HydrophobicContact CZ-CD1 3.73Å; F567-L719 HydrophobicContact CZ-CG 4.37Å; F628-L719 HydrophobicContact CD2-CD1 4.34Å; F628-L719 HydrophobicContact CD2-CD2 4.29Å; F628-L719 HydrophobicContact CD2-CG 3.95Å; F628-L719 HydrophobicContact CE2-CD2 4.41Å; F628-L719 HydrophobicContact CE2-CG 4.09Å; H631-L719 HydrophobicContact CB-CD2 4.09Å; S632-L719 WeakPolarHBondContact OG-CD2 3.41Å; L635-L719 HydrophobicContact CD1-CD2 4.26Å; W665-L719 HydrophobicContact CZ2-CD1 3.95Å; L715-L719 WeakPolarHBondContact O-CB 3.31Å; L715-L719 PolarHBondContact O-N 3.43Å; V716-L719 PolarHBondContact O-N 3.31Å; L719-I721 PolarHBondContact O-N 3.45Å; L719-S722 PolarHBondContact O-N 2.83Å; L719-S722 PolarHBondContact O-OG 3.08Å; L719-V723 HydrophobicContact CD1-CG2 3.77Å; L719-V723 WeakPolarHBondContact O-CG2 3.26Å; L719-V723 PolarHBondContact O-N 3.49Å
720	V	96.5	Very high	94.8	Very high	74 Å²	74	39.3 Å²	39.3	45%	0.448	23%	0.227	S	C	.	.	H	α-helix	trans	-64.5	-37.2	178.8	172.9	0	0	0	0	112.1	F628 V716 V717 P724	F628-V720 HydrophobicContact CE2-CG2 4.07Å; F628-V720 HydrophobicContact CZ-CG2 4.17Å; V716-V720 WeakPolarHBondContact O-CG2 3.45Å; V716-V720 PolarHBondContact O-N 2.88Å; V717-V720 PolarHBondContact O-N 3.42Å; V720-P724 WeakPolarHBondContact O-CD 3.27Å; V720-P724 VanDerWaalsContact O-CG 3.32Å; V720-P724 WeakPolarHBondContact O-CG 3.43Å
721	I	96.4	Very high	94.8	Very high	103 Å²	103	38.2 Å²	38.2	53%	0.528	22%	0.223	S	C	.	.	H	α-helix	trans	-74.6	-35.8	176.9	-69	170.4	0	0	0	111.9	V717 L718 L719 P725	V717-I721 HydrophobicContact CG1-CD1 3.68Å; V717-I721 HydrophobicContact CG1-CG1 4.47Å; V717-I721 WeakPolarHBondContact O-CB 3.43Å; V717-I721 VanDerWaalsContact O-CG1 3.3Å; V717-I721 WeakPolarHBondContact O-CG1 3.37Å; V717-I721 PolarHBondContact O-N 3.5Å; L718-I721 PolarHBondContact O-N 3.21Å; L719-I721 PolarHBondContact O-N 3.45Å; I721-P725 WeakPolarHBondContact O-CD 3.46Å; I721-P725 VanDerWaalsContact O-CG 3.32Å; I721-P725 WeakPolarHBondContact O-CG 3.5Å
722	S	96.3	Very high	94.6	Very high	2 Å²	2	43 Å²	43	1%	0.014	24%	0.24	C	C	.	.	H	α-helix	trans	-86	-33	-168.3	61.1	0	0	0	0	115.5	P563 L718 L719	P563-S722 VanDerWaalsContact C-CB 3.44Å; P563-S722 WeakPolarHBondContact O-CB 3.43Å; L718-S722 WeakPolarHBondContact O-CB 3.19Å; L718-S722 PolarHBondContact O-N 3.43Å; L718-S722 PolarHBondContact O-OG 2.95Å; L719-S722 PolarHBondContact O-N 2.83Å; L719-S722 PolarHBondContact O-OG 3.08Å
723	V	96.2	Very high	94.2	Very high	6 Å²	6	43.2 Å²	43.2	4%	0.036	24%	0.241	C	C	.	.	H	α-helix	trans	-74	-44.1	-175.5	176.3	0	0	0	0	114	L564 I624 F628 W665 L719 Y726 A727	L564-V723 HydrophobicContact CD1-CG2 4.42Å; I624-V723 HydrophobicContact CG2-CG1 3.51Å; F628-V723 HydrophobicContact CB-CG1 4.21Å; F628-V723 HydrophobicContact CD2-CB 4.13Å; F628-V723 HydrophobicContact CD2-CG1 4.36Å; F628-V723 HydrophobicContact CD2-CG2 4.13Å; W665-V723 HydrophobicContact CH2-CG1 4.36Å; W665-V723 HydrophobicContact CH2-CG2 3.63Å; W665-V723 HydrophobicContact CZ2-CG2 4.1Å; W665-V723 HydrophobicContact CZ3-CG2 4.15Å; L719-V723 HydrophobicContact CD1-CG2 3.77Å; L719-V723 WeakPolarHBondContact O-CG2 3.26Å; L719-V723 PolarHBondContact O-N 3.49Å; V723-Y726 PolarHBondContact O-N 2.76Å; V723-Y726 VanDerWaalsContact O-N 3.15Å; V723-A727 WeakPolarHBondContact O-CB 3.41Å; V723-A727 PolarHBondContact O-N 2.96Å
724	P	95.1	Very high	93.8	Very high	69 Å²	69	40.6 Å²	40.6	45%	0.448	23%	0.227	S	C	.	.	H	α-helix	trans	-61.6	-39.1	-178	-21.5	32.7	0	0	0	114.9	V720 T728	V720-P724 WeakPolarHBondContact O-CD 3.27Å; V720-P724 VanDerWaalsContact O-CG 3.32Å; V720-P724 WeakPolarHBondContact O-CG 3.43Å; P724-T728 WeakPolarHBondContact O-CB 3.16Å; P724-T728 PolarHBondContact O-N 3.42Å; P724-T728 PolarHBondContact O-OG1 2.87Å
725	P	94.8	Very high	93.4	Very high	34 Å²	34	40.9 Å²	40.9	22%	0.221	23%	0.229	C	C	.	.	H	α-helix	trans	-56.8	-48.8	169	-28.2	37.4	0	0	0	112.7	F560 I721 T728 L729	F560-P725 HydrophobicContact CB-CB 4.45Å; F560-P725 HydrophobicContact CD1-CB 4.03Å; F560-P725 CarbonylContact O-C 3.45Å; F560-P725 WeakPolarHBondContact O-CB 3.38Å; I721-P725 WeakPolarHBondContact O-CD 3.46Å; I721-P725 VanDerWaalsContact O-CG 3.32Å; I721-P725 WeakPolarHBondContact O-CG 3.5Å; P725-T728 WeakPolarHBondContact O-CB 3.46Å; P725-T728 PolarHBondContact O-N 3.13Å; P725-L729 PolarHBondContact O-N 2.96Å
726	Y	94.8	Very high	92.8	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-66.2	-40.5	-179.3	176.2	-113.4	0	0	0	112.7	F560 A561 L564 R620 I624 L668 L672 V723 T728 L729 E730	F560-Y726 WeakPolarHBondContact O-CA 3.38Å; F560-Y726 PolarHBondContact O-N 2.99Å; A561-Y726 HydrophobicContact CB-CD2 4.29Å; L564-Y726 HydrophobicContact CD2-CD1 3.32Å; L564-Y726 HydrophobicContact CD2-CD2 4.11Å; L564-Y726 HydrophobicContact CD2-CE1 3.82Å; L564-Y726 HydrophobicContact CD2-CG 3.49Å; L564-Y726 VanDerWaalsContact CD2-CG 3.49Å; R620-Y726 PolarHBondContact NH1-OH 3.03Å; I624-Y726 HydrophobicContact CD1-CD1 3.86Å; I624-Y726 HydrophobicContact CD1-CE1 3.47Å; I624-Y726 VanDerWaalsContact CD1-CE1 3.47Å; I624-Y726 HydrophobicContact CG1-CD1 4.29Å; I624-Y726 HydrophobicContact CG1-CE1 3.86Å; I624-Y726 HydrophobicContact CG2-CD1 4.49Å; L668-Y726 HydrophobicContact CB-CE1 4.1Å; L668-Y726 HydrophobicContact CD1-CE1 4.27Å; L668-Y726 HydrophobicContact CD2-CE1 4.43Å; L672-Y726 HydrophobicContact CD2-CE2 4.14Å; V723-Y726 PolarHBondContact O-N 2.76Å; V723-Y726 VanDerWaalsContact O-N 3.15Å; Y726-T728 VanDerWaalsContact C-N 3.3Å; Y726-T728 PolarHBondContact O-N 3.07Å; Y726-L729 HydrophobicContact CD2-CD2 4.49Å; Y726-L729 WeakPolarHBondContact O-CB 3.29Å; Y726-L729 PolarHBondContact O-N 3.39Å; Y726-E730 HydrophobicContact CD2-CG 4.37Å; Y726-E730 HydrophobicContact CE1-CG 4.23Å; Y726-E730 HydrophobicContact CE2-CG 3.66Å; Y726-E730 PolarHBondContact O-N 2.77Å; Y726-E730 WeakPolarHBondContact OH-CG 3.33Å; Y726-E730 PolarHBondContact OH-OE1 3.24Å
727	A	94.1	Very high	92	Very high	12 Å²	12	48.5 Å²	48.5	10%	0.099	26%	0.258	C	S	.	.	H	α-helix	trans	-58.5	-42.6	172.4	0	0	0	0	0	111.6	I621 I624 V723 E730 I731	I621-A727 HydrophobicContact CD1-CB 3.77Å; I624-A727 HydrophobicContact CG2-CB 4.15Å; V723-A727 WeakPolarHBondContact O-CB 3.41Å; V723-A727 PolarHBondContact O-N 2.96Å; A727-E730 PolarHBondContact O-N 3.24Å; A727-I731 WeakPolarHBondContact O-CD1 3.19Å; A727-I731 VanDerWaalsContact O-CG1 3.27Å; A727-I731 WeakPolarHBondContact O-CG1 3.29Å; A727-I731 PolarHBondContact O-N 3.15Å
728	T	92.5	Very high	91.3	Very high	57 Å²	57	50.2 Å²	50.2	35%	0.35	26%	0.258	S	S	.	.	H	α-helix	trans	-63.7	-41.2	176.9	-58.6	0	0	0	0	111.9	P724 P725 Y726 I731 R732	P724-T728 WeakPolarHBondContact O-CB 3.16Å; P724-T728 PolarHBondContact O-N 3.42Å; P724-T728 PolarHBondContact O-OG1 2.87Å; P725-T728 WeakPolarHBondContact O-CB 3.46Å; P725-T728 PolarHBondContact O-N 3.13Å; Y726-T728 VanDerWaalsContact C-N 3.3Å; Y726-T728 PolarHBondContact O-N 3.07Å; T728-I731 PolarHBondContact O-N 2.95Å; T728-R732 WeakPolarHBondContact O-CG 3.37Å; T728-R732 PolarHBondContact O-N 3Å
729	L	92.3	Very high	90.5	Very high	6 Å²	6	51 Å²	51	3%	0.031	27%	0.272	C	S	.	.	H	α-helix	trans	-60.6	-50.7	174.9	177.6	65.1	0	0	0	111.8	T557 F560 A561 L672 P725 Y726 I731 R732 L733	T557-L729 HydrophobicContact CG2-CD2 4.21Å; F560-L729 HydrophobicContact CB-CB 3.68Å; F560-L729 HydrophobicContact CB-CD1 4.43Å; F560-L729 HydrophobicContact CB-CD2 4.16Å; F560-L729 HydrophobicContact CB-CG 4.31Å; F560-L729 HydrophobicContact CD2-CD1 4.47Å; F560-L729 HydrophobicContact CG-CB 4.32Å; A561-L729 HydrophobicContact CB-CD2 3.89Å; L672-L729 HydrophobicContact CD1-CD2 4.11Å; L672-L729 HydrophobicContact CD2-CD2 3.88Å; P725-L729 PolarHBondContact O-N 2.96Å; Y726-L729 HydrophobicContact CD2-CD2 4.49Å; Y726-L729 WeakPolarHBondContact O-CB 3.29Å; Y726-L729 PolarHBondContact O-N 3.39Å; L729-I731 VanDerWaalsContact C-N 3.3Å; L729-I731 PolarHBondContact O-N 3.28Å; L729-R732 WeakPolarHBondContact O-CB 3.36Å; L729-R732 PolarHBondContact O-N 3.2Å; L729-R732 VanDerWaalsContact O-N 3.1Å; L729-L733 HydrophobicContact CD1-CD1 4.12Å; L729-L733 HydrophobicContact CD1-CG 4.13Å; L729-L733 HydrophobicContact CG-CD1 3.97Å; L729-L733 HydrophobicContact CG-CG 4.34Å; L729-L733 WeakPolarHBondContact O-CG 3.28Å; L729-L733 PolarHBondContact O-N 2.87Å
730	E	90.9	Very high	89.5	Confident	4 Å²	4	54.6 Å²	54.6	2%	0.019	29%	0.294	C	S	.	.	H	α-helix	trans	-66.3	-32	-178.4	-69.3	-76.2	-165.4	0	0	112.2	R620 I624 Y726 A727 E734	R620-E730 VanDerWaalsContact CD-OE1 3.29Å; R620-E730 WeakPolarHBondContact CD-OE1 3.39Å; R620-E730 VanDerWaalsContact CD-OE2 3.3Å; R620-E730 WeakPolarHBondContact CD-OE2 3.49Å; R620-E730 HydrophobicContact CG-CB 4.48Å; R620-E730 HydrophobicContact CG-CG 4.4Å; R620-E730 IonicContact CZ-OE1 3.65Å; R620-E730 IonicContact NE-OE1 3.64Å; R620-E730 IonicContact NE-OE2 2.69Å; R620-E730 IonicContact NH1-OE1 2.71Å; R620-E730 PolarHBondContact NH1-OE1 2.71Å; I624-E730 HydrophobicContact CD1-CB 4.23Å; I624-E730 HydrophobicContact CD1-CG 4.15Å; Y726-E730 HydrophobicContact CD2-CG 4.37Å; Y726-E730 HydrophobicContact CE1-CG 4.23Å; Y726-E730 HydrophobicContact CE2-CG 3.66Å; Y726-E730 PolarHBondContact O-N 2.77Å; Y726-E730 WeakPolarHBondContact OH-CG 3.33Å; Y726-E730 PolarHBondContact OH-OE1 3.24Å; A727-E730 PolarHBondContact O-N 3.24Å; E730-E734 WeakPolarHBondContact O-CB 3.12Å; E730-E734 PolarHBondContact O-N 3.3Å
731	I	90.3	Very high	88.4	Confident	93 Å²	93	55.6 Å²	55.6	48%	0.477	30%	0.296	S	S	.	.	H	α-helix	trans	-64.2	-44.3	169.9	-69	165.3	0	0	0	111.1	I621 A727 T728 L729 E734 A735	I621-I731 HydrophobicContact CD1-CD1 3.92Å; I621-I731 HydrophobicContact CD1-CG1 4.28Å; I621-I731 HydrophobicContact CG1-CD1 4.25Å; I621-I731 HydrophobicContact CG1-CG1 4.46Å; A727-I731 WeakPolarHBondContact O-CD1 3.19Å; A727-I731 VanDerWaalsContact O-CG1 3.27Å; A727-I731 WeakPolarHBondContact O-CG1 3.29Å; A727-I731 PolarHBondContact O-N 3.15Å; T728-I731 PolarHBondContact O-N 2.95Å; L729-I731 VanDerWaalsContact C-N 3.3Å; L729-I731 PolarHBondContact O-N 3.28Å; I731-E734 PolarHBondContact O-N 3.22Å; I731-A735 WeakPolarHBondContact O-CB 3.15Å; I731-A735 PolarHBondContact O-N 3.47Å
732	R	89.6	Confident	87.4	Confident	126 Å²	126	56.8 Å²	56.8	48%	0.475	31%	0.308	S	S	.	.	H	α-helix	trans	-62.6	-44.1	176	-73	175.4	-179.1	-155.8	2.1	111.8	T728 L729 A735 Q736	T728-R732 WeakPolarHBondContact O-CG 3.37Å; T728-R732 PolarHBondContact O-N 3Å; L729-R732 WeakPolarHBondContact O-CB 3.36Å; L729-R732 PolarHBondContact O-N 3.2Å; L729-R732 VanDerWaalsContact O-N 3.1Å; R732-A735 PolarHBondContact O-N 2.92Å; R732-Q736 WeakPolarHBondContact O-CG 3.46Å; R732-Q736 PolarHBondContact O-N 2.83Å
733	L	86.8	Confident	86.1	Confident	4 Å²	4	61.1 Å²	61.1	2%	0.021	34%	0.338	C	S	.	.	H	α-helix	trans	-67.2	-39.7	177.4	-65.8	177.9	0	0	0	112	L672 N676 L729 A735 R737	L672-L733 HydrophobicContact CD1-CD1 3.47Å; L672-L733 VanDerWaalsContact CD1-CD1 3.47Å; N676-L733 HydrophobicContact CB-CD1 4.46Å; N676-L733 WeakPolarHBondContact ND2-CD2 3.41Å; L729-L733 HydrophobicContact CD1-CD1 4.12Å; L729-L733 HydrophobicContact CD1-CG 4.13Å; L729-L733 HydrophobicContact CG-CD1 3.97Å; L729-L733 HydrophobicContact CG-CG 4.34Å; L729-L733 WeakPolarHBondContact O-CG 3.28Å; L729-L733 PolarHBondContact O-N 2.87Å; L733-A735 VanDerWaalsContact C-N 3.33Å; L733-R737 WeakPolarHBondContact O-CB 3.39Å; L733-R737 VanDerWaalsContact O-CG 3.28Å; L733-R737 WeakPolarHBondContact O-CG 3.43Å; L733-R737 PolarHBondContact O-N 3.03Å
734	E	85.8	Confident	84	Confident	42 Å²	42	66.5 Å²	66.5	20%	0.196	37%	0.366	C	S	.	.	H	α-helix	trans	-61.8	-39.7	170.6	-89.2	-159.2	-151.3	0	0	111.9	E730 I731 K738	E730-E734 WeakPolarHBondContact O-CB 3.12Å; E730-E734 PolarHBondContact O-N 3.3Å; I731-E734 PolarHBondContact O-N 3.22Å; E734-K738 VanDerWaalsContact O-CD 3.24Å; E734-K738 WeakPolarHBondContact O-CD 3.39Å; E734-K738 WeakPolarHBondContact O-CE 2.91Å; E734-K738 WeakPolarHBondContact O-CG 3.32Å; E734-K738 PolarHBondContact O-N 2.9Å; E734-K738 VanDerWaalsContact O-N 3.12Å; E734-K738 IonicContact OE2-NZ 2.69Å; E734-K738 PolarHBondContact OE2-NZ 3.02Å
735	A	86.5	Confident	83.4	Confident	54 Å²	54	66.4 Å²	66.4	45%	0.446	36%	0.362	S	S	.	.	H	α-helix	trans	-67.7	-44.8	177.7	0	0	0	0	0	112	I731 R732 L733 R737 K738 A739	I731-A735 WeakPolarHBondContact O-CB 3.15Å; I731-A735 PolarHBondContact O-N 3.47Å; R732-A735 PolarHBondContact O-N 2.92Å; L733-A735 VanDerWaalsContact C-N 3.33Å; A735-R737 PolarHBondContact O-N 3.29Å; A735-K738 PolarHBondContact O-N 2.75Å; A735-A739 WeakPolarHBondContact O-CB 3.27Å; A735-A739 PolarHBondContact O-N 2.96Å
736	Q	84.1	Confident	82.8	Confident	108 Å²	108	68.1 Å²	68.1	51%	0.505	37%	0.37	S	S	.	.	H	α-helix	trans	-59.4	-45.5	174.8	-75.3	174	-16.3	0	0	111.9	R732 K738 A739 T740	R732-Q736 WeakPolarHBondContact O-CG 3.46Å; R732-Q736 PolarHBondContact O-N 2.83Å; Q736-K738 VanDerWaalsContact C-N 3.28Å; Q736-K738 PolarHBondContact O-N 2.67Å; Q736-A739 PolarHBondContact O-N 2.77Å; Q736-T740 PolarHBondContact O-N 3Å; Q736-T740 PolarHBondContact O-OG1 3.31Å
737	R	79.3	Confident	82.1	Confident	102 Å²	102	71.9 Å²	71.9	39%	0.385	39%	0.39	S	S	.	.	H	α-helix	trans	-63.9	-31.2	176.5	-69.9	174.2	-165.2	153	8.6	113.1	N676 L733 A735 T740 L741	N676-R737 PolarHBondContact OD1-NH2 3.45Å; L733-R737 WeakPolarHBondContact O-CB 3.39Å; L733-R737 VanDerWaalsContact O-CG 3.28Å; L733-R737 WeakPolarHBondContact O-CG 3.43Å; L733-R737 PolarHBondContact O-N 3.03Å; A735-R737 PolarHBondContact O-N 3.29Å; R737-T740 PolarHBondContact O-OG1 2.84Å; R737-L741 VanDerWaalsContact O-CB 3.31Å; R737-L741 WeakPolarHBondContact O-CB 3.41Å; R737-L741 WeakPolarHBondContact O-CD1 3.48Å; R737-L741 VanDerWaalsContact O-CG 3.26Å; R737-L741 WeakPolarHBondContact O-CG 3.39Å; R737-L741 PolarHBondContact O-N 3.42Å
738	K	81.8	Confident	81.4	Confident	112 Å²	112	75.4 Å²	75.4	49%	0.487	41%	0.407	S	S	.	.	H	α-helix	trans	-74.6	-38.4	173.7	-69.9	159.6	-163.1	163.5	0	111.4	E734 A735 Q736 L741 V742	E734-K738 VanDerWaalsContact O-CD 3.24Å; E734-K738 WeakPolarHBondContact O-CD 3.39Å; E734-K738 WeakPolarHBondContact O-CE 2.91Å; E734-K738 WeakPolarHBondContact O-CG 3.32Å; E734-K738 PolarHBondContact O-N 2.9Å; E734-K738 VanDerWaalsContact O-N 3.12Å; E734-K738 IonicContact OE2-NZ 2.69Å; E734-K738 PolarHBondContact OE2-NZ 3.02Å; A735-K738 PolarHBondContact O-N 2.75Å; Q736-K738 VanDerWaalsContact C-N 3.28Å; Q736-K738 PolarHBondContact O-N 2.67Å; K738-L741 PolarHBondContact O-N 3.42Å; K738-V742 VanDerWaalsContact O-CG2 3.31Å; K738-V742 WeakPolarHBondContact O-CG2 3.42Å; K738-V742 PolarHBondContact O-N 3.26Å
739	A	80.6	Confident	80.7	Confident	64 Å²	64	76.6 Å²	76.6	53%	0.529	41%	0.411	S	S	.	.	H	α-helix	trans	-64.8	-44.7	175.9	0	0	0	0	0	111.7	A735 Q736 V742 S743	A735-A739 WeakPolarHBondContact O-CB 3.27Å; A735-A739 PolarHBondContact O-N 2.96Å; Q736-A739 PolarHBondContact O-N 2.77Å; A739-V742 PolarHBondContact O-N 3.01Å; A739-V742 VanDerWaalsContact O-N 3.15Å; A739-S743 PolarHBondContact O-N 3.42Å; A739-S743 VanDerWaalsContact O-N 3.16Å; A739-S743 PolarHBondContact O-OG 3.39Å
740	T	74.7	Confident	80	Confident	74 Å²	74	81.3 Å²	81.3	45%	0.454	44%	0.436	S	S	.	.	H	α-helix	trans	-62.2	-48.1	174.7	54.7	0	0	0	0	111.1	Q736 R737 V742 S743 L744	Q736-T740 PolarHBondContact O-N 3Å; Q736-T740 PolarHBondContact O-OG1 3.31Å; R737-T740 PolarHBondContact O-OG1 2.84Å; T740-V742 PolarHBondContact O-N 2.6Å; T740-S743 WeakPolarHBondContact CA-OG 3.27Å; T740-S743 PolarHBondContact O-N 3.34Å; T740-S743 PolarHBondContact O-OG 2.92Å; T740-L744 VanDerWaalsContact O-CG 3.29Å; T740-L744 WeakPolarHBondContact O-CG 3.48Å; T740-L744 PolarHBondContact O-N 3.27Å; T740-L744 VanDerWaalsContact O-N 3.11Å
741	L	73.2	Confident	79.2	Confident	95 Å²	95	86.8 Å²	86.8	50%	0.497	47%	0.466	S	S	.	.	H	α-helix	trans	-59	-10.1	174	-80.2	172.2	0	0	0	116	H396 R737 K738	H396-L741 VanDerWaalsContact CE1-CD2 3.45Å; H396-L741 WeakPolarHBondContact CE1-CD2 3.36Å; R737-L741 VanDerWaalsContact O-CB 3.31Å; R737-L741 WeakPolarHBondContact O-CB 3.41Å; R737-L741 WeakPolarHBondContact O-CD1 3.48Å; R737-L741 VanDerWaalsContact O-CG 3.26Å; R737-L741 WeakPolarHBondContact O-CG 3.39Å; R737-L741 PolarHBondContact O-N 3.42Å; K738-L741 PolarHBondContact O-N 3.42Å
742	V	76.9	Confident	78.3	Confident	128 Å²	128	86.3 Å²	86.3	78%	0.776	47%	0.465	S	S	*	.	H	α-helix	trans	-104	-14.2	174.2	168.9	0	0	0	0	112	K738 A739 T740	K738-V742 VanDerWaalsContact O-CG2 3.31Å; K738-V742 WeakPolarHBondContact O-CG2 3.42Å; K738-V742 PolarHBondContact O-N 3.26Å; A739-V742 PolarHBondContact O-N 3.01Å; A739-V742 VanDerWaalsContact O-N 3.15Å; T740-V742 PolarHBondContact O-N 2.6Å
743	S	68.7	Low	77.4	Confident	93 Å²	93	83 Å²	83	65%	0.65	47%	0.465	S	S	*	.	H	α-helix	trans	-95.4	-11	173	64.2	0	0	0	0	114.6	A739 T740	A739-S743 PolarHBondContact O-N 3.42Å; A739-S743 VanDerWaalsContact O-N 3.16Å; A739-S743 PolarHBondContact O-OG 3.39Å; T740-S743 WeakPolarHBondContact CA-OG 3.27Å; T740-S743 PolarHBondContact O-N 3.34Å; T740-S743 PolarHBondContact O-OG 2.92Å
744	L	50.7	Low	76.6	Confident	120 Å²	120	90.2 Å²	90.2	63%	0.628	51%	0.505	S	S	*	.			trans	-96	0	175.4	-57.6	172.3	0	0	0	110.7	L392 T740	L392-L744 HydrophobicContact CD1-CD2 3.69Å; L392-L744 HydrophobicContact CD2-CB 4.25Å; L392-L744 HydrophobicContact CD2-CD2 3.68Å; L392-L744 HydrophobicContact CG-CD2 3.72Å; T740-L744 VanDerWaalsContact O-CG 3.29Å; T740-L744 WeakPolarHBondContact O-CG 3.48Å; T740-L744 PolarHBondContact O-N 3.27Å; T740-L744 VanDerWaalsContact O-N 3.11Å

Retrieved 744 of 744 residues in 621.4 ms (Link to these results)

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