A0A077Z514_TRITR Loading...

PhoU and BPD transp 1 and ABC tran domain contain ing protein

AlphaFold DB , UniProt , Accession A0A077Z514, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 708 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	47.1	Very low	55	Low	230 Å²	230	125.5 Å²	125.5	100%	1.133	71%	0.707	S	S	*	*				0	10.7	0	-89.6	176.2	170.6	0	0	114.2
2	A	50.6	Low	56.3	Low	93 Å²	93	123.2 Å²	123.2	77%	0.769	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.3	4.9	-174.5	0	0	0	0	0	115.9
3	M	47	Very low	57.9	Low	175 Å²	175	117.4 Å²	117.4	86%	0.862	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.7	-2.3	178	-71.3	-174.3	100.1	0	0	114.4
4	V	49	Very low	59.2	Low	115 Å²	115	116.4 Å²	116.4	70%	0.697	66%	0.655	S	S	*	*	S	Bend	trans	-96.6	-18.4	-178.6	179.8	0	0	0	0	112.7
5	E	49.9	Very low	60.3	Low	154 Å²	154	112.4 Å²	112.4	72%	0.72	64%	0.638	S	S	*	*	S	Bend	trans	-91.3	-17.4	-176.8	-79.6	-175.5	146.1	0	0	115.8	T8	E5-T8 PolarHBondContact O-OG1 2.93Å
6	M	49.8	Very low	61.6	Low	158 Å²	158	115.3 Å²	115.3	78%	0.778	64%	0.635	S	S	*	*	H	α-helix	trans	-85.9	-21.4	178.8	-92.9	-176.5	82.2	0	0	114.3	T8 T9	M6-T8 VanDerWaalsContact C-N 3.3Å; M6-T8 PolarHBondContact O-N 3.22Å; M6-T9 PolarHBondContact O-OG1 2.87Å
7	Q	49.9	Very low	62.7	Low	156 Å²	156	119.9 Å²	119.9	73%	0.729	64%	0.641	S	S	*	*	H	α-helix	trans	-73.9	-21.8	175.8	-81.2	-176.8	-26.7	0	0	112.7	A11	Q7-A11 WeakPolarHBondContact O-CB 3.35Å; Q7-A11 PolarHBondContact O-N 3.19Å
8	T	61.6	Low	63.7	Low	87 Å²	87	120.2 Å²	120.2	53%	0.534	64%	0.636	S	S	.	*	H	α-helix	trans	-78.4	-36.1	-176.9	55.8	0	0	0	0	112.9	E5 M6 L12	E5-T8 PolarHBondContact O-OG1 2.93Å; M6-T8 VanDerWaalsContact C-N 3.3Å; M6-T8 PolarHBondContact O-N 3.22Å; T8-L12 WeakPolarHBondContact O-CB 3.39Å; T8-L12 PolarHBondContact O-N 3.13Å
9	T	63.8	Low	64.5	Low	94 Å²	94	119 Å²	119	58%	0.577	63%	0.627	S	S	*	*	H	α-helix	trans	-74.2	-42.2	-178.5	54.7	0	0	0	0	112.9	M6 L12 A13	M6-T9 PolarHBondContact O-OG1 2.87Å; T9-L12 PolarHBondContact O-N 2.72Å; T9-A13 WeakPolarHBondContact O-CB 3.36Å; T9-A13 PolarHBondContact O-N 3.13Å
10	A	68	Low	65.5	Low	63 Å²	63	118.7 Å²	118.7	52%	0.521	62%	0.622	S	S	.	*	H	α-helix	trans	-65.6	-45.2	175.6	0	0	0	0	0	111.5	L12 A13 E14	A10-L12 PolarHBondContact O-N 3.47Å; A10-A13 PolarHBondContact O-N 3.38Å; A10-E14 WeakPolarHBondContact O-CB 3.4Å; A10-E14 PolarHBondContact O-N 3.5Å
11	A	68.7	Low	66.4	Low	56 Å²	56	115.8 Å²	115.8	46%	0.463	62%	0.615	S	S	.	*	H	α-helix	trans	-64	-38.8	176.1	0	0	0	0	0	112.4	Q7 E14 S15	Q7-A11 WeakPolarHBondContact O-CB 3.35Å; Q7-A11 PolarHBondContact O-N 3.19Å; A11-E14 PolarHBondContact O-N 3.25Å; A11-S15 VanDerWaalsContact O-CB 3.31Å; A11-S15 WeakPolarHBondContact O-CB 3.2Å; A11-S15 PolarHBondContact O-N 3.17Å
12	L	70.8	Confident	68.2	Low	97 Å²	97	113.8 Å²	113.8	51%	0.508	60%	0.595	S	S	.	*	H	α-helix	trans	-67.1	-40.7	175.7	-161.5	91.5	0	0	0	111.7	T8 T9 A10 S15 R16	T8-L12 WeakPolarHBondContact O-CB 3.39Å; T8-L12 PolarHBondContact O-N 3.13Å; T9-L12 PolarHBondContact O-N 2.72Å; A10-L12 PolarHBondContact O-N 3.47Å; L12-S15 PolarHBondContact O-N 2.99Å; L12-R16 WeakPolarHBondContact O-CB 3.33Å; L12-R16 WeakPolarHBondContact O-CG 3.38Å; L12-R16 PolarHBondContact O-N 3.11Å
13	A	76.9	Confident	70	Confident	48 Å²	48	118.3 Å²	118.3	40%	0.397	59%	0.592	S	S	.	*	H	α-helix	trans	-65.5	-40.9	176	0	0	0	0	0	111.8	T9 A10 R16 R17	T9-A13 WeakPolarHBondContact O-CB 3.36Å; T9-A13 PolarHBondContact O-N 3.13Å; A10-A13 PolarHBondContact O-N 3.38Å; A13-R16 PolarHBondContact O-N 3.07Å; A13-R17 WeakPolarHBondContact O-CG 3.41Å; A13-R17 PolarHBondContact O-N 3.12Å
14	E	76.2	Confident	72	Confident	104 Å²	104	118.6 Å²	118.6	49%	0.486	58%	0.584	S	S	.	*	H	α-helix	trans	-65.5	-42	174.6	-161.1	-167.1	146.4	0	0	111.7	A10 A11 R17 K18	A10-E14 WeakPolarHBondContact O-CB 3.4Å; A10-E14 PolarHBondContact O-N 3.5Å; A11-E14 PolarHBondContact O-N 3.25Å; E14-R17 PolarHBondContact O-N 3.46Å; E14-K18 WeakPolarHBondContact O-CB 3.33Å; E14-K18 PolarHBondContact O-N 3.44Å; E14-K18 WeakPolarHBondContact OE1-CE 3.41Å; E14-K18 IonicContact OE1-NZ 2.81Å; E14-K18 PolarHBondContact OE1-NZ 2.69Å
15	S	75.4	Confident	73.9	Confident	56 Å²	56	118 Å²	118	39%	0.392	58%	0.576	S	S	.	*	H	α-helix	trans	-61.4	-44.6	174.2	-179.4	0	0	0	0	112.1	A11 L12 R17 K18 M19	A11-S15 VanDerWaalsContact O-CB 3.31Å; A11-S15 WeakPolarHBondContact O-CB 3.2Å; A11-S15 PolarHBondContact O-N 3.17Å; L12-S15 PolarHBondContact O-N 2.99Å; S15-R17 PolarHBondContact O-N 3.3Å; S15-K18 PolarHBondContact O-N 3.37Å; S15-M19 WeakPolarHBondContact O-CB 3.39Å; S15-M19 WeakPolarHBondContact O-CG 3.35Å; S15-M19 PolarHBondContact O-N 3.02Å
16	R	80.3	Confident	75.9	Confident	159 Å²	159	118.2 Å²	118.2	60%	0.6	58%	0.575	S	S	*	*	H	α-helix	trans	-61.5	-41.8	173.6	-75.9	178.1	178	-178.2	0.4	112	L12 A13 M19 Q20	L12-R16 WeakPolarHBondContact O-CB 3.33Å; L12-R16 WeakPolarHBondContact O-CG 3.38Å; L12-R16 PolarHBondContact O-N 3.11Å; A13-R16 PolarHBondContact O-N 3.07Å; R16-M19 HydrophobicContact CG-CE 4.48Å; R16-M19 PolarHBondContact O-N 3.1Å; R16-Q20 WeakPolarHBondContact O-CB 3.48Å; R16-Q20 WeakPolarHBondContact O-CG 3.31Å; R16-Q20 PolarHBondContact O-N 3.06Å
17	R	81.1	Confident	78	Confident	193 Å²	193	115.3 Å²	115.3	73%	0.728	56%	0.563	S	S	*	*	H	α-helix	trans	-62.5	-45.6	174.4	-77.6	-178.9	179.8	-174.8	1.4	111.6	A13 E14 S15 M19 Q20 A21	A13-R17 WeakPolarHBondContact O-CG 3.41Å; A13-R17 PolarHBondContact O-N 3.12Å; E14-R17 PolarHBondContact O-N 3.46Å; S15-R17 PolarHBondContact O-N 3.3Å; R17-M19 PolarHBondContact O-N 2.91Å; R17-Q20 PolarHBondContact O-N 3.34Å; R17-A21 VanDerWaalsContact O-CB 3.26Å; R17-A21 WeakPolarHBondContact O-CB 3.26Å; R17-A21 PolarHBondContact O-N 3.41Å
18	K	80.3	Confident	80	Confident	126 Å²	126	116.5 Å²	116.5	55%	0.548	56%	0.56	S	S	.	*	H	α-helix	trans	-60.9	-42.9	175.1	-80.1	172.1	169.6	161.2	0	111.8	E14 S15 R22	E14-K18 WeakPolarHBondContact O-CB 3.33Å; E14-K18 PolarHBondContact O-N 3.44Å; E14-K18 WeakPolarHBondContact OE1-CE 3.41Å; E14-K18 IonicContact OE1-NZ 2.81Å; E14-K18 PolarHBondContact OE1-NZ 2.69Å; S15-K18 PolarHBondContact O-N 3.37Å; K18-R22 WeakPolarHBondContact O-CG 3.33Å; K18-R22 PolarHBondContact O-N 3.44Å
19	M	78.4	Confident	81.6	Confident	97 Å²	97	116.6 Å²	116.6	48%	0.478	56%	0.556	S	S	.	*	H	α-helix	trans	-66.8	-43.5	176.2	-76.4	-168.4	-75	0	0	113	S15 R16 R17 R22 R23	S15-M19 WeakPolarHBondContact O-CB 3.39Å; S15-M19 WeakPolarHBondContact O-CG 3.35Å; S15-M19 PolarHBondContact O-N 3.02Å; R16-M19 HydrophobicContact CG-CE 4.48Å; R16-M19 PolarHBondContact O-N 3.1Å; R17-M19 PolarHBondContact O-N 2.91Å; M19-R22 PolarHBondContact O-N 3.05Å; M19-R23 WeakPolarHBondContact O-CG 3.09Å; M19-R23 PolarHBondContact O-N 2.73Å
20	Q	84.6	Confident	83.1	Confident	113 Å²	113	114.3 Å²	114.3	53%	0.528	55%	0.547	S	S	.	.	H	α-helix	trans	-66.1	-39.5	175.4	-79.2	-173.8	-14.1	0	0	111.9	R16 R17 R23 R24	R16-Q20 WeakPolarHBondContact O-CB 3.48Å; R16-Q20 WeakPolarHBondContact O-CG 3.31Å; R16-Q20 PolarHBondContact O-N 3.06Å; R17-Q20 PolarHBondContact O-N 3.34Å; Q20-R23 PolarHBondContact O-N 3.42Å; Q20-R24 WeakPolarHBondContact O-CB 3.39Å; Q20-R24 WeakPolarHBondContact O-CG 3.46Å; Q20-R24 PolarHBondContact O-N 2.85Å
21	A	85.5	Confident	84.4	Confident	58 Å²	58	115.6 Å²	115.6	48%	0.479	55%	0.545	S	S	.	.	H	α-helix	trans	-60.8	-44.1	173.7	0	0	0	0	0	111.1	R17 R24 L25	R17-A21 VanDerWaalsContact O-CB 3.26Å; R17-A21 WeakPolarHBondContact O-CB 3.26Å; R17-A21 PolarHBondContact O-N 3.41Å; A21-R24 PolarHBondContact O-N 3.15Å; A21-L25 WeakPolarHBondContact O-CB 3.35Å; A21-L25 PolarHBondContact O-N 2.91Å
22	R	83.6	Confident	85.7	Confident	188 Å²	188	116.8 Å²	116.8	71%	0.709	55%	0.546	S	S	*	.	H	α-helix	trans	-61	-43.2	172.7	-78.6	-177.7	174.7	-177.1	-0.8	112.6	K18 M19 L25 K26	K18-R22 WeakPolarHBondContact O-CG 3.33Å; K18-R22 PolarHBondContact O-N 3.44Å; M19-R22 PolarHBondContact O-N 3.05Å; R22-L25 PolarHBondContact O-N 3.48Å; R22-K26 WeakPolarHBondContact O-CB 3.49Å; R22-K26 WeakPolarHBondContact O-CG 3.44Å; R22-K26 PolarHBondContact O-N 3.34Å
23	R	88.7	Confident	86.9	Confident	188 Å²	188	117.2 Å²	117.2	71%	0.709	55%	0.549	S	S	*	.	H	α-helix	trans	-65.5	-41.8	176.6	-73.1	-178.8	-177.5	-176	0.7	112.2	M19 Q20 K26 N27	M19-R23 WeakPolarHBondContact O-CG 3.09Å; M19-R23 PolarHBondContact O-N 2.73Å; Q20-R23 PolarHBondContact O-N 3.42Å; R23-K26 PolarHBondContact O-N 3.41Å; R23-N27 WeakPolarHBondContact O-CB 3.43Å; R23-N27 PolarHBondContact O-N 2.85Å
24	R	89.3	Confident	87.8	Confident	181 Å²	181	118.6 Å²	118.6	68%	0.683	56%	0.555	S	S	*	*	H	α-helix	trans	-64.4	-40.9	175.1	-74.5	179.8	-178	-176.2	1	111.7	Q20 A21 N27 R28	Q20-R24 WeakPolarHBondContact O-CB 3.39Å; Q20-R24 WeakPolarHBondContact O-CG 3.46Å; Q20-R24 PolarHBondContact O-N 2.85Å; A21-R24 PolarHBondContact O-N 3.15Å; R24-N27 PolarHBondContact O-N 3.38Å; R24-R28 WeakPolarHBondContact O-CB 3.27Å; R24-R28 PolarHBondContact O-N 3.3Å
25	L	89.6	Confident	88.7	Confident	103 Å²	103	118.7 Å²	118.7	54%	0.539	56%	0.557	S	S	.	*	H	α-helix	trans	-64.5	-47.5	175	-176.6	63	0	0	0	111	A21 R22 N27 R28 I29	A21-L25 WeakPolarHBondContact O-CB 3.35Å; A21-L25 PolarHBondContact O-N 2.91Å; R22-L25 PolarHBondContact O-N 3.48Å; L25-N27 VanDerWaalsContact C-N 3.34Å; L25-N27 PolarHBondContact O-N 3.45Å; L25-R28 PolarHBondContact O-N 2.86Å; L25-I29 HydrophobicContact CD1-CD1 4.11Å; L25-I29 HydrophobicContact CD1-CG1 4.34Å; L25-I29 HydrophobicContact CG-CD1 3.86Å; L25-I29 HydrophobicContact CG-CG1 4.48Å; L25-I29 WeakPolarHBondContact O-CB 3.38Å; L25-I29 VanDerWaalsContact O-CG1 3.28Å; L25-I29 WeakPolarHBondContact O-CG1 3.32Å; L25-I29 PolarHBondContact O-N 3.09Å
26	K	90.6	Very high	89.7	Confident	158 Å²	158	118.8 Å²	118.8	69%	0.687	56%	0.561	S	S	*	*	H	α-helix	trans	-57.7	-44.6	174.3	-77.1	-172	176.4	-167.3	0	112.1	R22 R23 I29 A30	R22-K26 WeakPolarHBondContact O-CB 3.49Å; R22-K26 WeakPolarHBondContact O-CG 3.44Å; R22-K26 PolarHBondContact O-N 3.34Å; R23-K26 PolarHBondContact O-N 3.41Å; K26-I29 PolarHBondContact O-N 3.2Å; K26-A30 WeakPolarHBondContact O-CB 3.46Å; K26-A30 PolarHBondContact O-N 3.46Å
27	N	94	Very high	90.4	Very high	97 Å²	97	115.9 Å²	115.9	52%	0.519	56%	0.561	S	S	.	*	H	α-helix	trans	-64.2	-42.5	177.2	-172.1	60.2	0	0	0	112	R23 R24 L25 A30 L31	R23-N27 WeakPolarHBondContact O-CB 3.43Å; R23-N27 PolarHBondContact O-N 2.85Å; R24-N27 PolarHBondContact O-N 3.38Å; L25-N27 VanDerWaalsContact C-N 3.34Å; L25-N27 PolarHBondContact O-N 3.45Å; N27-A30 PolarHBondContact O-N 3.29Å; N27-L31 WeakPolarHBondContact O-CB 3.41Å; N27-L31 WeakPolarHBondContact O-CG 3.28Å; N27-L31 PolarHBondContact O-N 3.05Å
28	R	93.3	Very high	91.1	Very high	181 Å²	181	112.3 Å²	112.3	68%	0.683	55%	0.554	S	S	*	*	H	α-helix	trans	-63.7	-45.8	176.6	-173.6	175.5	-76	175.2	-6	110.7	R24 L25 A30 L31 T32	R24-R28 WeakPolarHBondContact O-CB 3.27Å; R24-R28 PolarHBondContact O-N 3.3Å; L25-R28 PolarHBondContact O-N 2.86Å; R28-A30 PolarHBondContact O-N 3.41Å; R28-L31 PolarHBondContact O-N 3.19Å; R28-T32 WeakPolarHBondContact O-CB 3.33Å; R28-T32 PolarHBondContact O-N 3.42Å; R28-T32 PolarHBondContact O-OG1 3.26Å
29	I	94.7	Very high	91.8	Very high	88 Å²	88	109 Å²	109	45%	0.451	55%	0.55	S	S	.	.	H	α-helix	trans	-58.6	-48.9	175.1	-69.9	168.4	0	0	0	110.5	L25 K26 L31 T32 L33	L25-I29 HydrophobicContact CD1-CD1 4.11Å; L25-I29 HydrophobicContact CD1-CG1 4.34Å; L25-I29 HydrophobicContact CG-CD1 3.86Å; L25-I29 HydrophobicContact CG-CG1 4.48Å; L25-I29 WeakPolarHBondContact O-CB 3.38Å; L25-I29 VanDerWaalsContact O-CG1 3.28Å; L25-I29 WeakPolarHBondContact O-CG1 3.32Å; L25-I29 PolarHBondContact O-N 3.09Å; K26-I29 PolarHBondContact O-N 3.2Å; I29-L31 PolarHBondContact O-N 2.81Å; I29-T32 PolarHBondContact O-N 2.92Å; I29-L33 HydrophobicContact CG2-CD1 3.58Å; I29-L33 WeakPolarHBondContact O-CB 3.48Å; I29-L33 WeakPolarHBondContact O-CD1 3.3Å; I29-L33 WeakPolarHBondContact O-CG 3.18Å; I29-L33 PolarHBondContact O-N 3.24Å
30	A	94.8	Very high	92.6	Very high	47 Å²	47	110.7 Å²	110.7	39%	0.388	56%	0.555	S	S	.	*	H	α-helix	trans	-62.1	-43.1	180	0	0	0	0	0	112.8	K26 N27 R28 S34	K26-A30 WeakPolarHBondContact O-CB 3.46Å; K26-A30 PolarHBondContact O-N 3.46Å; N27-A30 PolarHBondContact O-N 3.29Å; R28-A30 PolarHBondContact O-N 3.41Å; A30-S34 WeakPolarHBondContact O-CB 3.23Å; A30-S34 PolarHBondContact O-N 2.92Å; A30-S34 PolarHBondContact O-OG 2.99Å
31	L	95.2	Very high	93	Very high	90 Å²	90	107.3 Å²	107.3	47%	0.471	55%	0.55	S	S	.	*	H	α-helix	trans	-66.8	-43.1	175.6	-77.1	169.4	0	0	0	111.8	N27 R28 I29 S34 M35	N27-L31 WeakPolarHBondContact O-CB 3.41Å; N27-L31 WeakPolarHBondContact O-CG 3.28Å; N27-L31 PolarHBondContact O-N 3.05Å; R28-L31 PolarHBondContact O-N 3.19Å; I29-L31 PolarHBondContact O-N 2.81Å; L31-S34 PolarHBondContact O-N 3.25Å; L31-M35 HydrophobicContact CB-CE 4.46Å; L31-M35 WeakPolarHBondContact O-CB 3.42Å; L31-M35 WeakPolarHBondContact O-CG 3.49Å; L31-M35 PolarHBondContact O-N 3.02Å
32	T	95.8	Very high	93.5	Very high	80 Å²	80	108.6 Å²	108.6	49%	0.491	55%	0.549	S	S	.	.	H	α-helix	trans	-63	-44.2	177.4	-60.4	0	0	0	0	111.2	R28 I29 M35 A36	R28-T32 WeakPolarHBondContact O-CB 3.33Å; R28-T32 PolarHBondContact O-N 3.42Å; R28-T32 PolarHBondContact O-OG1 3.26Å; I29-T32 PolarHBondContact O-N 2.92Å; T32-M35 PolarHBondContact O-N 3.12Å; T32-A36 VanDerWaalsContact O-CB 3.26Å; T32-A36 WeakPolarHBondContact O-CB 3.49Å; T32-A36 PolarHBondContact O-N 3.49Å
33	L	95.9	Very high	94.1	Very high	107 Å²	107	104.7 Å²	104.7	56%	0.56	54%	0.537	S	S	*	.	H	α-helix	trans	-60.1	-48.5	173.7	-82.5	154.9	0	0	0	111.2	I29 M35 A36 T37	I29-L33 HydrophobicContact CG2-CD1 3.58Å; I29-L33 WeakPolarHBondContact O-CB 3.48Å; I29-L33 WeakPolarHBondContact O-CD1 3.3Å; I29-L33 WeakPolarHBondContact O-CG 3.18Å; I29-L33 PolarHBondContact O-N 3.24Å; L33-M35 PolarHBondContact O-N 2.88Å; L33-A36 PolarHBondContact O-N 3.48Å; L33-T37 PolarHBondContact O-N 2.7Å; L33-T37 PolarHBondContact O-OG1 3.03Å
34	S	96.1	Very high	94.4	Very high	76 Å²	76	101.5 Å²	101.5	53%	0.531	53%	0.525	S	S	.	.	H	α-helix	trans	-61.9	-42.3	-179.8	-56	0	0	0	0	112.3	A30 L31 M38	A30-S34 WeakPolarHBondContact O-CB 3.23Å; A30-S34 PolarHBondContact O-N 2.92Å; A30-S34 PolarHBondContact O-OG 2.99Å; L31-S34 PolarHBondContact O-N 3.25Å; S34-M38 WeakPolarHBondContact O-CB 3.18Å; S34-M38 PolarHBondContact O-N 3.37Å
35	M	95.6	Very high	94.6	Very high	107 Å²	107	98 Å²	98	53%	0.527	52%	0.519	S	S	.	.	H	α-helix	trans	-67.7	-38.5	175.6	-72.1	-174.6	-64	0	0	112.2	L31 T32 L33 M38 A39	L31-M35 HydrophobicContact CB-CE 4.46Å; L31-M35 WeakPolarHBondContact O-CB 3.42Å; L31-M35 WeakPolarHBondContact O-CG 3.49Å; L31-M35 PolarHBondContact O-N 3.02Å; T32-M35 PolarHBondContact O-N 3.12Å; L33-M35 PolarHBondContact O-N 2.88Å; M35-M38 PolarHBondContact O-N 3.35Å; M35-A39 WeakPolarHBondContact O-CB 3.43Å; M35-A39 PolarHBondContact O-N 3.49Å
36	A	95.6	Very high	94.8	Very high	57 Å²	57	98.1 Å²	98.1	47%	0.471	52%	0.52	S	S	.	.	H	α-helix	trans	-64.6	-43.6	176.1	0	0	0	0	0	111.4	T32 L33 A39 F40	T32-A36 VanDerWaalsContact O-CB 3.26Å; T32-A36 WeakPolarHBondContact O-CB 3.49Å; T32-A36 PolarHBondContact O-N 3.49Å; L33-A36 PolarHBondContact O-N 3.48Å; A36-A39 PolarHBondContact O-N 2.88Å; A36-F40 WeakPolarHBondContact O-CB 3.22Å; A36-F40 PolarHBondContact O-N 3.32Å
37	T	96.1	Very high	95	Very high	99 Å²	99	97.8 Å²	97.8	61%	0.607	51%	0.514	S	S	*	.	H	α-helix	trans	-63.1	-41.5	174.8	-53.8	0	0	0	0	111.8	L33 F40 G41	L33-T37 PolarHBondContact O-N 2.7Å; L33-T37 PolarHBondContact O-OG1 3.03Å; T37-F40 PolarHBondContact O-N 3.19Å; T37-G41 PolarHBondContact O-N 3.41Å
38	M	95.5	Very high	94.7	Very high	118 Å²	118	97.9 Å²	97.9	58%	0.581	51%	0.514	S	S	*	.	H	α-helix	trans	-62.3	-46.8	174.4	-176.4	-172.3	74.8	0	0	111.7	S34 M35 F40 G41 L42	S34-M38 WeakPolarHBondContact O-CB 3.18Å; S34-M38 PolarHBondContact O-N 3.37Å; M35-M38 PolarHBondContact O-N 3.35Å; M38-F40 VanDerWaalsContact C-N 3.32Å; M38-F40 PolarHBondContact O-N 2.97Å; M38-G41 PolarHBondContact O-N 3.09Å; M38-L42 HydrophobicContact CG-CD1 4.11Å; M38-L42 WeakPolarHBondContact O-CG 3.43Å; M38-L42 PolarHBondContact O-N 2.95Å
39	A	95.4	Very high	94.6	Very high	55 Å²	55	94.1 Å²	94.1	46%	0.455	51%	0.506	S	S	.	.	H	α-helix	trans	-62.6	-39.8	178.6	0	0	0	0	0	111.8	M35 A36 L42 F43	M35-A39 WeakPolarHBondContact O-CB 3.43Å; M35-A39 PolarHBondContact O-N 3.49Å; A36-A39 PolarHBondContact O-N 2.88Å; A39-L42 PolarHBondContact O-N 2.98Å; A39-F43 WeakPolarHBondContact O-CB 3.28Å; A39-F43 PolarHBondContact O-N 3.5Å
40	F	95.5	Very high	94.5	Very high	134 Å²	134	95.1 Å²	95.1	59%	0.588	51%	0.51	S	S	*	.	H	α-helix	trans	-60.3	-46.8	174.4	179.6	-97	0	0	0	111.9	A36 T37 M38 F43 W44	A36-F40 WeakPolarHBondContact O-CB 3.22Å; A36-F40 PolarHBondContact O-N 3.32Å; T37-F40 PolarHBondContact O-N 3.19Å; M38-F40 VanDerWaalsContact C-N 3.32Å; M38-F40 PolarHBondContact O-N 2.97Å; F40-F43 PolarHBondContact O-N 3.11Å; F40-W44 AromaticContact CD2-NE1 3.95Å; F40-W44 AromaticContact CE1-CD1 3.78Å; F40-W44 AromaticContact CE1-NE1 3.69Å; F40-W44 AromaticContact CE2-NE1 3.29Å; F40-W44 VanDerWaalsContact CE2-NE1 3.29Å; F40-W44 AromaticContact CZ-CD1 3.74Å; F40-W44 AromaticContact CZ-NE1 3.14Å; F40-W44 VanDerWaalsContact O-CD1 3.24Å; F40-W44 PolarHBondContact O-N 3.24Å
41	G	92.3	Very high	94	Very high	41 Å²	41	94.7 Å²	94.7	42%	0.423	51%	0.505	S	S	.	.	H	α-helix	trans	-62.9	-44.3	176.4	0	0	0	0	0	113	T37 M38 F43 W44 L45	T37-G41 PolarHBondContact O-N 3.41Å; M38-G41 PolarHBondContact O-N 3.09Å; G41-F43 PolarHBondContact O-N 3.28Å; G41-W44 PolarHBondContact O-N 3.02Å; G41-L45 PolarHBondContact O-N 2.88Å; G41-L45 VanDerWaalsContact O-N 3.15Å
42	L	95.6	Very high	93.4	Very high	85 Å²	85	94.9 Å²	94.9	45%	0.445	51%	0.509	S	S	.	.	H	α-helix	trans	-65.2	-37	177.8	-73.5	173.5	0	0	0	112.5	M38 A39 L45 I46	M38-L42 HydrophobicContact CG-CD1 4.11Å; M38-L42 WeakPolarHBondContact O-CG 3.43Å; M38-L42 PolarHBondContact O-N 2.95Å; A39-L42 PolarHBondContact O-N 2.98Å; L42-L45 PolarHBondContact O-N 3.33Å; L42-I46 WeakPolarHBondContact O-CB 3.49Å; L42-I46 VanDerWaalsContact O-CG1 3.22Å; L42-I46 WeakPolarHBondContact O-CG1 3.04Å; L42-I46 PolarHBondContact O-N 3.48Å
43	F	96.6	Very high	93	Very high	107 Å²	107	94.9 Å²	94.9	47%	0.469	51%	0.506	S	S	.	.	H	α-helix	trans	-57.4	-51.2	176.7	170.4	-95.9	0	0	0	111.5	A39 F40 G41 L45 I46 W47	A39-F43 WeakPolarHBondContact O-CB 3.28Å; A39-F43 PolarHBondContact O-N 3.5Å; F40-F43 PolarHBondContact O-N 3.11Å; G41-F43 PolarHBondContact O-N 3.28Å; F43-L45 PolarHBondContact O-N 3.22Å; F43-I46 PolarHBondContact O-N 3.03Å; F43-W47 HydrophobicContact CE1-CE3 4.01Å; F43-W47 HydrophobicContact CE2-CE3 4.07Å; F43-W47 AromaticContact CZ-CE3 3.43Å; F43-W47 HydrophobicContact CZ-CE3 3.43Å; F43-W47 VanDerWaalsContact CZ-CE3 3.43Å; F43-W47 AromaticContact CZ-CZ3 3.76Å; F43-W47 HydrophobicContact CZ-CZ3 3.76Å; F43-W47 WeakPolarHBondContact O-CB 3.27Å; F43-W47 PolarHBondContact O-N 3.35Å
44	W	94.7	Very high	92.4	Very high	121 Å²	121	93.3 Å²	93.3	46%	0.458	50%	0.501	S	S	.	.	H	α-helix	trans	-65.1	-39.4	179.1	-72.6	110.5	0	0	0	112.4	F40 G41 W47 I48	F40-W44 AromaticContact CD2-NE1 3.95Å; F40-W44 AromaticContact CE1-CD1 3.78Å; F40-W44 AromaticContact CE1-NE1 3.69Å; F40-W44 AromaticContact CE2-NE1 3.29Å; F40-W44 VanDerWaalsContact CE2-NE1 3.29Å; F40-W44 AromaticContact CZ-CD1 3.74Å; F40-W44 AromaticContact CZ-NE1 3.14Å; F40-W44 VanDerWaalsContact O-CD1 3.24Å; F40-W44 PolarHBondContact O-N 3.24Å; G41-W44 PolarHBondContact O-N 3.02Å; W44-W47 PolarHBondContact O-N 3.27Å; W44-I48 WeakPolarHBondContact O-CB 3.3Å; W44-I48 WeakPolarHBondContact O-CD1 3.47Å; W44-I48 VanDerWaalsContact O-CG1 3.22Å; W44-I48 WeakPolarHBondContact O-CG1 3.31Å; W44-I48 PolarHBondContact O-N 2.89Å
45	L	92.8	Very high	91.4	Very high	106 Å²	106	98.9 Å²	98.9	56%	0.555	51%	0.51	S	S	*	.	H	α-helix	trans	-62	-47.8	176.4	-177.1	67	0	0	0	111.6	G41 L42 F43 W47 I48 L49	G41-L45 PolarHBondContact O-N 2.88Å; G41-L45 VanDerWaalsContact O-N 3.15Å; L42-L45 PolarHBondContact O-N 3.33Å; F43-L45 PolarHBondContact O-N 3.22Å; L45-W47 VanDerWaalsContact C-N 3.34Å; L45-I48 PolarHBondContact O-N 3.39Å; L45-L49 VanDerWaalsContact O-CB 3.3Å; L45-L49 WeakPolarHBondContact O-CB 3.44Å; L45-L49 PolarHBondContact O-N 2.96Å
46	I	95.2	Very high	90.4	Very high	107 Å²	107	95.4 Å²	95.4	55%	0.549	50%	0.502	S	S	.	.	H	α-helix	trans	-63.1	-43.3	178.2	-68.9	166.2	0	0	0	110.3	L42 F43 L49 M50	L42-I46 WeakPolarHBondContact O-CB 3.49Å; L42-I46 VanDerWaalsContact O-CG1 3.22Å; L42-I46 WeakPolarHBondContact O-CG1 3.04Å; L42-I46 PolarHBondContact O-N 3.48Å; F43-I46 PolarHBondContact O-N 3.03Å; I46-L49 PolarHBondContact O-N 3.23Å; I46-M50 HydrophobicContact CG2-CG 4.31Å; I46-M50 VanDerWaalsContact O-CB 3.32Å; I46-M50 WeakPolarHBondContact O-CB 3.48Å; I46-M50 WeakPolarHBondContact O-CG 3.08Å; I46-M50 PolarHBondContact O-N 2.97Å
47	W	94.2	Very high	89.7	Confident	151 Å²	151	97 Å²	97	57%	0.572	50%	0.502	S	S	*	.	H	α-helix	trans	-59.3	-51.1	177.2	-177.1	-60.8	0	0	0	111.4	F43 W44 L45 L49 M50 S51	F43-W47 HydrophobicContact CE1-CE3 4.01Å; F43-W47 HydrophobicContact CE2-CE3 4.07Å; F43-W47 AromaticContact CZ-CE3 3.43Å; F43-W47 HydrophobicContact CZ-CE3 3.43Å; F43-W47 VanDerWaalsContact CZ-CE3 3.43Å; F43-W47 AromaticContact CZ-CZ3 3.76Å; F43-W47 HydrophobicContact CZ-CZ3 3.76Å; F43-W47 WeakPolarHBondContact O-CB 3.27Å; F43-W47 PolarHBondContact O-N 3.35Å; W44-W47 PolarHBondContact O-N 3.27Å; L45-W47 VanDerWaalsContact C-N 3.34Å; W47-L49 VanDerWaalsContact C-N 3.31Å; W47-L49 PolarHBondContact O-N 3.42Å; W47-M50 PolarHBondContact O-N 2.89Å; W47-S51 WeakPolarHBondContact O-CB 2.93Å; W47-S51 PolarHBondContact O-N 3.03Å
48	I	88.5	Confident	88.5	Confident	99 Å²	99	99.4 Å²	99.4	51%	0.508	51%	0.511	S	S	.	.	H	α-helix	trans	-59.1	-48.1	-179.6	-70.5	165.2	0	0	0	109.3	W44 L45 M50 S51 T52	W44-I48 WeakPolarHBondContact O-CB 3.3Å; W44-I48 WeakPolarHBondContact O-CD1 3.47Å; W44-I48 VanDerWaalsContact O-CG1 3.22Å; W44-I48 WeakPolarHBondContact O-CG1 3.31Å; W44-I48 PolarHBondContact O-N 2.89Å; L45-I48 PolarHBondContact O-N 3.39Å; I48-M50 PolarHBondContact O-N 3.17Å; I48-S51 PolarHBondContact O-N 2.84Å; I48-T52 WeakPolarHBondContact O-CB 3.41Å; I48-T52 PolarHBondContact O-N 3.35Å; I48-T52 PolarHBondContact O-OG1 3.17Å
49	L	90.2	Very high	87.2	Confident	101 Å²	101	95.9 Å²	95.9	53%	0.529	51%	0.505	S	S	.	.	H	α-helix	trans	-64.3	-42.3	-177.9	-158.5	133.6	0	0	0	111.9	L45 I46 W47 T52 I53	L45-L49 VanDerWaalsContact O-CB 3.3Å; L45-L49 WeakPolarHBondContact O-CB 3.44Å; L45-L49 PolarHBondContact O-N 2.96Å; I46-L49 PolarHBondContact O-N 3.23Å; W47-L49 VanDerWaalsContact C-N 3.31Å; W47-L49 PolarHBondContact O-N 3.42Å; L49-T52 PolarHBondContact O-N 3.26Å; L49-I53 HydrophobicContact CD2-CD1 3.6Å; L49-I53 HydrophobicContact CG-CD1 4.45Å; L49-I53 WeakPolarHBondContact O-CB 3.46Å; L49-I53 VanDerWaalsContact O-CG1 3.24Å; L49-I53 WeakPolarHBondContact O-CG1 3.35Å; L49-I53 PolarHBondContact O-N 3.32Å
50	M	92.2	Very high	86.2	Confident	109 Å²	109	99.1 Å²	99.1	54%	0.537	51%	0.512	S	S	.	.	H	α-helix	trans	-62.2	-46.1	173.3	-80.2	-68.3	-74.1	0	0	111.6	I46 W47 I48 T52 I53 T54	I46-M50 HydrophobicContact CG2-CG 4.31Å; I46-M50 VanDerWaalsContact O-CB 3.32Å; I46-M50 WeakPolarHBondContact O-CB 3.48Å; I46-M50 WeakPolarHBondContact O-CG 3.08Å; I46-M50 PolarHBondContact O-N 2.97Å; W47-M50 PolarHBondContact O-N 2.89Å; I48-M50 PolarHBondContact O-N 3.17Å; M50-T52 VanDerWaalsContact C-N 3.33Å; M50-T52 PolarHBondContact O-N 2.9Å; M50-I53 PolarHBondContact O-N 2.91Å; M50-T54 WeakPolarHBondContact O-CG2 3.21Å; M50-T54 PolarHBondContact O-N 3.32Å; M50-T54 PolarHBondContact O-OG1 3.3Å
51	S	85.1	Confident	85.5	Confident	39 Å²	39	95.5 Å²	95.5	27%	0.273	50%	0.503	S	S	.	.	H	α-helix	trans	-64.5	-37.3	178.8	-173.1	0	0	0	0	112.3	W47 I48 T54 R55	W47-S51 WeakPolarHBondContact O-CB 2.93Å; W47-S51 PolarHBondContact O-N 3.03Å; I48-S51 PolarHBondContact O-N 2.84Å; S51-T54 PolarHBondContact O-OG1 2.87Å; S51-R55 WeakPolarHBondContact O-CB 3.46Å; S51-R55 WeakPolarHBondContact O-CG 3.29Å; S51-R55 PolarHBondContact O-N 3Å; S51-R55 VanDerWaalsContact O-N 3.09Å
52	T	82.8	Confident	85	Confident	93 Å²	93	100.4 Å²	100.4	57%	0.571	52%	0.519	S	S	*	.	H	α-helix	trans	-67.7	-40.2	175.8	-59.5	0	0	0	0	110.9	I48 L49 M50 G56	I48-T52 WeakPolarHBondContact O-CB 3.41Å; I48-T52 PolarHBondContact O-N 3.35Å; I48-T52 PolarHBondContact O-OG1 3.17Å; L49-T52 PolarHBondContact O-N 3.26Å; M50-T52 VanDerWaalsContact C-N 3.33Å; M50-T52 PolarHBondContact O-N 2.9Å; T52-G56 VanDerWaalsContact O-CA 3.23Å; T52-G56 WeakPolarHBondContact O-CA 3.36Å; T52-G56 PolarHBondContact O-N 3.46Å
53	I	86.3	Confident	84.3	Confident	81 Å²	81	97.8 Å²	97.8	42%	0.415	51%	0.509	S	S	.	.	H	α-helix	trans	-67.8	-51.4	176.9	-70	170.2	0	0	0	110.6	L49 M50 G56 I57	L49-I53 HydrophobicContact CD2-CD1 3.6Å; L49-I53 HydrophobicContact CG-CD1 4.45Å; L49-I53 WeakPolarHBondContact O-CB 3.46Å; L49-I53 VanDerWaalsContact O-CG1 3.24Å; L49-I53 WeakPolarHBondContact O-CG1 3.35Å; L49-I53 PolarHBondContact O-N 3.32Å; M50-I53 PolarHBondContact O-N 2.91Å; I53-G56 PolarHBondContact O-N 2.79Å; I53-I57 HydrophobicContact CG2-CD1 3.59Å; I53-I57 HydrophobicContact CG2-CG1 4.36Å; I53-I57 WeakPolarHBondContact O-CD1 3.38Å; I53-I57 WeakPolarHBondContact O-CG1 3.47Å; I53-I57 PolarHBondContact O-N 3.46Å
54	T	83.2	Confident	83.6	Confident	74 Å²	74	95 Å²	95	45%	0.454	50%	0.499	S	S	.	.	H	α-helix	trans	-63.6	-47.6	-175.1	54.2	0	0	0	0	111.8	M50 S51	M50-T54 WeakPolarHBondContact O-CG2 3.21Å; M50-T54 PolarHBondContact O-N 3.32Å; M50-T54 PolarHBondContact O-OG1 3.3Å; S51-T54 PolarHBondContact O-OG1 2.87Å
55	R	76.1	Confident	83.1	Confident	193 Å²	193	94.6 Å²	94.6	73%	0.728	50%	0.501	S	S	*	.	H	α-helix	trans	-75.5	-27.8	178	-62.2	-173.9	-178.2	-136.1	0.2	113.1	S51	S51-R55 WeakPolarHBondContact O-CB 3.46Å; S51-R55 WeakPolarHBondContact O-CG 3.29Å; S51-R55 PolarHBondContact O-N 3Å; S51-R55 VanDerWaalsContact O-N 3.09Å
56	G	75.5	Confident	82.7	Confident	34 Å²	34	93.9 Å²	93.9	35%	0.351	50%	0.501	S	S	.	.	H	α-helix	trans	-74.5	-37.1	-178.7	0	0	0	0	0	113.1	T52 I53 D58 G59 M60	T52-G56 VanDerWaalsContact O-CA 3.23Å; T52-G56 WeakPolarHBondContact O-CA 3.36Å; T52-G56 PolarHBondContact O-N 3.46Å; I53-G56 PolarHBondContact O-N 2.79Å; G56-D58 VanDerWaalsContact C-N 3.34Å; G56-D58 PolarHBondContact O-N 2.91Å; G56-G59 PolarHBondContact O-N 2.94Å; G56-M60 WeakPolarHBondContact O-CG 3.48Å; G56-M60 PolarHBondContact O-N 2.91Å
57	I	79.7	Confident	82.2	Confident	91 Å²	91	93.2 Å²	93.2	47%	0.467	50%	0.496	S	S	.	.	H	α-helix	trans	-60.8	-43.6	179.8	-72.6	165.5	0	0	0	111.4	I53 G59 M60	I53-I57 HydrophobicContact CG2-CD1 3.59Å; I53-I57 HydrophobicContact CG2-CG1 4.36Å; I53-I57 WeakPolarHBondContact O-CD1 3.38Å; I53-I57 WeakPolarHBondContact O-CG1 3.47Å; I53-I57 PolarHBondContact O-N 3.46Å; I57-G59 PolarHBondContact O-N 3.48Å; I57-M60 HydrophobicContact CB-CE 4.21Å; I57-M60 HydrophobicContact CG1-CE 3.72Å; I57-M60 PolarHBondContact O-N 3.32Å; I57-M60 VanDerWaalsContact O-N 3.07Å
58	D	71.1	Confident	81.8	Confident	149 Å²	149	89.6 Å²	89.6	80%	0.797	49%	0.486	S	S	*	.	H	α-helix	trans	-63.8	-27.4	-179.4	-64.8	-17.7	0	0	0	112.3	G56	G56-D58 VanDerWaalsContact C-N 3.34Å; G56-D58 PolarHBondContact O-N 2.91Å
59	G	69.3	Low	81.5	Confident	44 Å²	44	85.2 Å²	85.2	45%	0.454	46%	0.464	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-5.5	176.1	0	0	0	0	0	115.1	G56 I57 S61	G56-G59 PolarHBondContact O-N 2.94Å; I57-G59 PolarHBondContact O-N 3.48Å; G59-S61 PolarHBondContact O-N 3.03Å; G59-S61 VanDerWaalsContact O-N 3.09Å
60	M	73.3	Confident	80.7	Confident	122 Å²	122	81.8 Å²	81.8	60%	0.601	45%	0.448	S	S	*	.			trans	-78.9	94.7	-179.4	-76.1	-162.2	-73.1	0	0	111.2	G56 I57	G56-M60 WeakPolarHBondContact O-CG 3.48Å; G56-M60 PolarHBondContact O-N 2.91Å; I57-M60 HydrophobicContact CB-CE 4.21Å; I57-M60 HydrophobicContact CG1-CE 3.72Å; I57-M60 PolarHBondContact O-N 3.32Å; I57-M60 VanDerWaalsContact O-N 3.07Å
61	S	81.4	Confident	79.6	Confident	59 Å²	59	80.1 Å²	80.1	41%	0.413	45%	0.445	S	S	.	.			trans	-113.8	158.3	170.3	73	0	0	0	0	111.2	G59 A63 L64 F65	G59-S61 PolarHBondContact O-N 3.03Å; G59-S61 VanDerWaalsContact O-N 3.09Å; S61-A63 PolarHBondContact O-N 3Å; S61-L64 VanDerWaalsContact O-CB 3.25Å; S61-L64 WeakPolarHBondContact O-CB 3.31Å; S61-L64 PolarHBondContact O-N 3.23Å; S61-L64 PolarHBondContact OG-N 2.94Å; S61-L64 VanDerWaalsContact OG-N 3.17Å; S61-F65 WeakPolarHBondContact O-CD2 3.18Å
62	L	81.8	Confident	78.5	Confident	143 Å²	143	82.3 Å²	82.3	75%	0.749	46%	0.458	S	S	*	.	H	α-helix	trans	-63.1	-31.8	173.1	-165	76.6	0	0	0	111.3	L64 F65 T66	L62-L64 VanDerWaalsContact C-N 3.29Å; L62-L64 PolarHBondContact O-N 2.92Å; L62-F65 PolarHBondContact O-N 3.05Å; L62-T66 HydrophobicContact CG-CG2 4.36Å; L62-T66 PolarHBondContact O-N 3.35Å; L62-T66 PolarHBondContact O-OG1 2.96Å
63	A	80.1	Confident	77.3	Confident	30 Å²	30	84.2 Å²	84.2	25%	0.248	47%	0.465	C	S	.	.	H	α-helix	trans	-60.7	-37.1	175.7	0	0	0	0	0	111.8	S61 F65 T66 E67 G78	S61-A63 PolarHBondContact O-N 3Å; A63-F65 PolarHBondContact O-N 3.33Å; A63-F65 VanDerWaalsContact O-N 3.12Å; A63-T66 PolarHBondContact O-N 2.97Å; A63-E67 HydrophobicContact CB-CG 4.19Å; A63-E67 WeakPolarHBondContact O-CB 3.14Å; A63-E67 PolarHBondContact O-N 2.96Å; A63-G78 WeakPolarHBondContact O-CA 3.42Å
64	L	81.2	Confident	75.9	Confident	50 Å²	50	83.9 Å²	83.9	26%	0.262	47%	0.467	S	S	.	.	H	α-helix	trans	-52.7	-37.8	176.3	-172.4	74	0	0	0	112.9	S61 L62 G78 L79	S61-L64 VanDerWaalsContact O-CB 3.25Å; S61-L64 WeakPolarHBondContact O-CB 3.31Å; S61-L64 PolarHBondContact O-N 3.23Å; S61-L64 PolarHBondContact OG-N 2.94Å; S61-L64 VanDerWaalsContact OG-N 3.17Å; L62-L64 VanDerWaalsContact C-N 3.29Å; L62-L64 PolarHBondContact O-N 2.92Å; L64-G78 CarbonylContact O-C 3.56Å; L64-G78 WeakPolarHBondContact O-CA 3.4Å; L64-L79 HydrophobicContact CD1-CD1 3.85Å; L64-L79 HydrophobicContact CD1-CG 4.08Å; L64-L79 PolarHBondContact O-N 2.97Å
65	F	85.5	Confident	74.7	Confident	111 Å²	111	86.9 Å²	86.9	49%	0.487	48%	0.476	S	S	.	.	H	α-helix	trans	-94.1	-21.8	-176.7	-61.8	-79	0	0	0	113.8	S61 L62 A63 A80 L83	S61-F65 WeakPolarHBondContact O-CD2 3.18Å; L62-F65 PolarHBondContact O-N 3.05Å; A63-F65 PolarHBondContact O-N 3.33Å; A63-F65 VanDerWaalsContact O-N 3.12Å; F65-A80 WeakPolarHBondContact O-CB 3.34Å; F65-L83 HydrophobicContact CD1-CD1 3.75Å; F65-L83 HydrophobicContact CE1-CD1 4.43Å
66	T	83.8	Confident	74.2	Confident	91 Å²	91	80.5 Å²	80.5	56%	0.558	47%	0.47	S	S	*	.	H	α-helix	trans	-106.6	-25.9	-170.5	53.7	0	0	0	0	113.3	L62 A63	L62-T66 HydrophobicContact CG-CG2 4.36Å; L62-T66 PolarHBondContact O-N 3.35Å; L62-T66 PolarHBondContact O-OG1 2.96Å; A63-T66 PolarHBondContact O-N 2.97Å
67	E	84.7	Confident	74.1	Confident	93 Å²	93	80.1 Å²	80.1	44%	0.435	47%	0.466	S	S	.	.	S	Bend	trans	-96.9	158.2	-178.2	-63.5	-172.5	176.8	0	0	113	A63 G77 G78 L79 A80	A63-E67 HydrophobicContact CB-CG 4.19Å; A63-E67 WeakPolarHBondContact O-CB 3.14Å; A63-E67 PolarHBondContact O-N 2.96Å; E67-G77 VanDerWaalsContact OE2-CA 3.3Å; E67-G77 WeakPolarHBondContact OE2-CA 3.46Å; E67-G77 PolarHBondContact OE2-N 3.26Å; E67-G78 CarbonylContact O-C 3.56Å; E67-G78 WeakPolarHBondContact O-CA 3.37Å; E67-L79 PolarHBondContact O-N 2.96Å; E67-A80 WeakPolarHBondContact O-CB 3.47Å; E67-A80 PolarHBondContact O-N 2.97Å
68	M	85.3	Confident	74.2	Confident	75 Å²	75	75.9 Å²	75.9	37%	0.369	45%	0.445	S	S	.	.	P	Polyproline II helix	trans	-73.6	154.7	179.9	-74.9	-66.1	-67.9	0	0	112.4	P70 G78 N81 W238	M68-P70 WeakPolarHBondContact O-CD 3.25Å; M68-P70 VanDerWaalsContact O-N 3.13Å; M68-G78 CarbonylContact C-O 3.54Å; M68-G78 VanDerWaalsContact C-O 3.26Å; M68-G78 PolarHBondContact O-N 3.22Å; M68-N81 HydrophobicContact CE-CB 3.63Å; M68-N81 HydrophobicContact SD-CB 3.64Å; M68-W238 HydrophobicContact CE-CB 3.62Å; M68-W238 HydrophobicContact SD-CB 3.95Å; M68-W238 HydrophobicContact SD-CD2 4.45Å; M68-W238 HydrophobicContact SD-CE3 3.7Å
69	T	82.3	Confident	75	Confident	7 Å²	7	70 Å²	70	4%	0.043	41%	0.413	C	S	.	.	P	Polyproline II helix	trans	-56.6	116.7	171.8	-53.2	0	0	0	0	109.3	G78 N81 Q236 T252 F256	T69-G78 WeakPolarHBondContact CA-O 3.39Å; T69-G78 PolarHBondContact N-O 3.17Å; T69-G78 VanDerWaalsContact N-O 3.14Å; T69-N81 WeakPolarHBondContact CB-OD1 3.41Å; T69-N81 PolarHBondContact N-OD1 2.8Å; T69-N81 PolarHBondContact OG1-ND2 2.81Å; T69-N81 PolarHBondContact OG1-OD1 2.77Å; T69-Q236 HydrophobicContact CG2-CG 4.47Å; T69-T252 HydrophobicContact CG2-CG2 4.08Å; T69-F256 HydrophobicContact CG2-CE1 4.28Å; T69-F256 HydrophobicContact CG2-CE2 4.29Å; T69-F256 HydrophobicContact CG2-CZ 3.51Å
70	P	74.2	Confident	75.9	Confident	29 Å²	29	68.5 Å²	68.5	19%	0.188	40%	0.396	C	S	.	.	P	Polyproline II helix	trans	-68.4	147.9	-177.9	29.2	-35.6	0	0	0	110	M68 T74 G76	M68-P70 WeakPolarHBondContact O-CD 3.25Å; M68-P70 VanDerWaalsContact O-N 3.13Å; P70-T74 WeakPolarHBondContact CB-OG1 3.41Å; P70-G76 WeakPolarHBondContact CB-O 3.43Å; P70-G76 WeakPolarHBondContact CG-O 3.39Å
71	P	68.4	Low	76.6	Confident	75 Å²	75	62.9 Å²	62.9	49%	0.487	37%	0.369	S	S	.	.	P	Polyproline II helix	trans	-55.7	156.9	161.7	-18.9	28.2	0	0	0	111.2	N73 T74	P71-N73 PolarHBondContact O-N 3.44Å; P71-T74 WeakPolarHBondContact CD-OG1 3.43Å; P71-T74 PolarHBondContact O-N 2.78Å; P71-T74 PolarHBondContact O-OG1 3.02Å
72	P	62.3	Low	77.1	Confident	85 Å²	85	60.1 Å²	60.1	55%	0.552	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.6	139.1	170.2	-22.1	32.5	0	0	0	111.1
73	N	57.6	Low	77.5	Confident	133 Å²	133	56.1 Å²	56.1	71%	0.711	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.7	31.6	179.7	-59.2	-12.8	0	0	0	116.5	P71	P71-N73 PolarHBondContact O-N 3.44Å
74	T	57	Low	78.1	Confident	73 Å²	73	56.2 Å²	56.2	45%	0.448	33%	0.33	S	S	.	.			trans	-113.3	130.6	167.2	39	0	0	0	0	110.8	P70 P71	P70-T74 WeakPolarHBondContact CB-OG1 3.41Å; P71-T74 WeakPolarHBondContact CD-OG1 3.43Å; P71-T74 PolarHBondContact O-N 2.78Å; P71-T74 PolarHBondContact O-OG1 3.02Å
75	E	58	Low	78.7	Confident	138 Å²	138	54 Å²	54	65%	0.645	32%	0.318	S	S	*	.	S	Bend	trans	-68.3	132.9	175.2	-75.9	-168.8	150	0	0	110.4	R273	E75-R273 IonicContact OE1-NH2 2.7Å; E75-R273 PolarHBondContact OE1-NH2 3.17Å; E75-R273 IonicContact OE2-CZ 2.68Å; E75-R273 IonicContact OE2-NE 3.38Å; E75-R273 PolarHBondContact OE2-NE 2.98Å; E75-R273 IonicContact OE2-NH2 3.83Å; E75-R273 PolarHBondContact OE2-NH2 3.23Å
76	G	65.4	Low	79	Confident	59 Å²	59	49.3 Å²	49.3	61%	0.608	30%	0.3	S	S	*	.			trans	85.3	-157.8	-179.6	0	0	0	0	0	113.5	P70	P70-G76 WeakPolarHBondContact CB-O 3.43Å; P70-G76 WeakPolarHBondContact CG-O 3.39Å
77	G	73.4	Confident	79.6	Confident	25 Å²	25	46.8 Å²	46.8	26%	0.258	29%	0.292	S	S	.	.			trans	93.8	174.4	-172.4	0	0	0	0	0	113.5	E67	E67-G77 VanDerWaalsContact OE2-CA 3.3Å; E67-G77 WeakPolarHBondContact OE2-CA 3.46Å; E67-G77 PolarHBondContact OE2-N 3.26Å
78	G	82.4	Confident	80	Confident	3 Å²	3	44.4 Å²	44.4	3%	0.031	28%	0.282	C	S	.	.			trans	-142.9	-163.6	-175.6	0	0	0	0	0	112.3	A63 L64 E67 M68 T69	A63-G78 WeakPolarHBondContact O-CA 3.42Å; L64-G78 CarbonylContact O-C 3.56Å; L64-G78 WeakPolarHBondContact O-CA 3.4Å; E67-G78 CarbonylContact O-C 3.56Å; E67-G78 WeakPolarHBondContact O-CA 3.37Å; M68-G78 CarbonylContact C-O 3.54Å; M68-G78 VanDerWaalsContact C-O 3.26Å; M68-G78 PolarHBondContact O-N 3.22Å; T69-G78 WeakPolarHBondContact CA-O 3.39Å; T69-G78 PolarHBondContact N-O 3.17Å; T69-G78 VanDerWaalsContact N-O 3.14Å
79	L	87.2	Confident	80.5	Confident	24 Å²	24	40.9 Å²	40.9	13%	0.126	26%	0.264	C	S	.	.			trans	-122.5	20.4	-178.3	-65.4	173.1	0	0	0	110.8	L64 E67 N81 A82 L83 L249 T252 F256	L64-L79 HydrophobicContact CD1-CD1 3.85Å; L64-L79 HydrophobicContact CD1-CG 4.08Å; L64-L79 PolarHBondContact O-N 2.97Å; E67-L79 PolarHBondContact O-N 2.96Å; L79-N81 VanDerWaalsContact C-N 3.34Å; L79-N81 PolarHBondContact O-N 3.25Å; L79-A82 HydrophobicContact CB-CB 4.47Å; L79-A82 CarbonylContact O-C 3.57Å; L79-A82 PolarHBondContact O-N 3.17Å; L79-L83 HydrophobicContact CB-CD1 4.43Å; L79-L83 HydrophobicContact CB-CG 4.4Å; L79-L83 WeakPolarHBondContact O-CB 3.39Å; L79-L83 WeakPolarHBondContact O-CG 3.49Å; L79-L83 PolarHBondContact O-N 2.89Å; L79-L249 HydrophobicContact CB-CD1 4.21Å; L79-L249 HydrophobicContact CD1-CD1 3.8Å; L79-L249 HydrophobicContact CG-CD1 4.46Å; L79-T252 HydrophobicContact CD2-CG2 3.82Å; L79-F256 HydrophobicContact CD2-CE2 3.89Å
80	A	88.7	Confident	81.2	Confident	13 Å²	13	42.3 Å²	42.3	11%	0.107	27%	0.271	C	S	.	.	H	α-helix	trans	-55.9	-45.1	-172.4	0	0	0	0	0	112.6	F65 E67 L83 A84 W238	F65-A80 WeakPolarHBondContact O-CB 3.34Å; E67-A80 WeakPolarHBondContact O-CB 3.47Å; E67-A80 PolarHBondContact O-N 2.97Å; A80-L83 PolarHBondContact O-N 3.41Å; A80-A84 VanDerWaalsContact O-CB 3.28Å; A80-A84 WeakPolarHBondContact O-CB 3.2Å; A80-A84 PolarHBondContact O-N 2.89Å; A80-W238 HydrophobicContact CB-CZ3 4.3Å
81	N	89.1	Confident	82.2	Confident	5 Å²	5	45.7 Å²	45.7	3%	0.027	29%	0.287	C	S	.	.	H	α-helix	trans	-66.2	-39.8	175.2	56.8	-43.8	0	0	0	113.2	M68 T69 L79 A84 G85 Q236 F237 W238 A247	M68-N81 HydrophobicContact CE-CB 3.63Å; M68-N81 HydrophobicContact SD-CB 3.64Å; T69-N81 WeakPolarHBondContact CB-OD1 3.41Å; T69-N81 PolarHBondContact N-OD1 2.8Å; T69-N81 PolarHBondContact OG1-ND2 2.81Å; T69-N81 PolarHBondContact OG1-OD1 2.77Å; L79-N81 VanDerWaalsContact C-N 3.34Å; L79-N81 PolarHBondContact O-N 3.25Å; N81-A84 PolarHBondContact O-N 3.36Å; N81-G85 PolarHBondContact O-N 3.31Å; N81-Q236 VanDerWaalsContact ND2-C 3.25Å; N81-Q236 PolarHBondContact ND2-O 3.45Å; N81-F237 PolarHBondContact ND2-O 3.2Å; N81-W238 HydrophobicContact CB-CE3 3.79Å; N81-W238 HydrophobicContact CB-CZ3 4.47Å; N81-A247 HydrophobicContact CB-CB 4.27Å
82	A	90.1	Very high	83.5	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-68.4	-36.6	178.2	0	0	0	0	0	111.6	L79 S86 L249 T252	L79-A82 HydrophobicContact CB-CB 4.47Å; L79-A82 CarbonylContact O-C 3.57Å; L79-A82 PolarHBondContact O-N 3.17Å; A82-S86 VanDerWaalsContact O-CB 3.31Å; A82-S86 WeakPolarHBondContact O-CB 3.35Å; A82-S86 PolarHBondContact O-N 3.45Å; A82-S86 PolarHBondContact O-OG 3.32Å; A82-L249 HydrophobicContact CB-CD1 4.34Å; A82-L249 PolarHBondContact O-N 3.26Å; A82-T252 HydrophobicContact CB-CG2 4.47Å
83	L	91.5	Very high	85.2	Confident	60 Å²	60	42.3 Å²	42.3	31%	0.314	25%	0.254	S	S	.	.	H	α-helix	trans	-66.3	-48.4	173.1	-72.6	167.7	0	0	0	111.2	F65 L79 A80 S86 G87 L249	F65-L83 HydrophobicContact CD1-CD1 3.75Å; F65-L83 HydrophobicContact CE1-CD1 4.43Å; L79-L83 HydrophobicContact CB-CD1 4.43Å; L79-L83 HydrophobicContact CB-CG 4.4Å; L79-L83 WeakPolarHBondContact O-CB 3.39Å; L79-L83 WeakPolarHBondContact O-CG 3.49Å; L79-L83 PolarHBondContact O-N 2.89Å; A80-L83 PolarHBondContact O-N 3.41Å; L83-S86 PolarHBondContact O-N 3.47Å; L83-G87 PolarHBondContact O-N 3.49Å; L83-L249 HydrophobicContact CD2-CD1 4.31Å; L83-L249 HydrophobicContact CD2-CD2 3.95Å
84	A	92.6	Very high	87	Confident	32 Å²	32	37.2 Å²	37.2	26%	0.264	23%	0.228	S	C	.	.	H	α-helix	trans	-62.2	-46.2	178.5	0	0	0	0	0	111.8	A80 N81 G87 L88 W238	A80-A84 VanDerWaalsContact O-CB 3.28Å; A80-A84 WeakPolarHBondContact O-CB 3.2Å; A80-A84 PolarHBondContact O-N 2.89Å; N81-A84 PolarHBondContact O-N 3.36Å; A84-G87 PolarHBondContact O-N 3.47Å; A84-L88 PolarHBondContact O-N 2.93Å; A84-W238 HydrophobicContact CB-CH2 3.44Å; A84-W238 VanDerWaalsContact CB-CH2 3.44Å; A84-W238 HydrophobicContact CB-CZ2 4.05Å; A84-W238 HydrophobicContact CB-CZ3 3.75Å
85	G	92.4	Very high	88.9	Confident	2 Å²	2	37 Å²	37	2%	0.021	23%	0.226	C	C	.	.	H	α-helix	trans	-67.5	-37.7	178.3	0	0	0	0	0	113.1	N81 G87 L88 L89 A247	N81-G85 PolarHBondContact O-N 3.31Å; G85-G87 VanDerWaalsContact C-N 3.32Å; G85-G87 PolarHBondContact O-N 3.03Å; G85-L88 PolarHBondContact O-N 2.95Å; G85-L89 WeakPolarHBondContact O-CG 3.37Å; G85-L89 PolarHBondContact O-N 2.99Å; G85-A247 CarbonylContact C-O 3.53Å; G85-A247 VanDerWaalsContact CA-O 3.22Å; G85-A247 WeakPolarHBondContact CA-O 3.49Å
86	S	93.8	Very high	90.8	Very high	14 Å²	14	35.4 Å²	35.4	10%	0.098	22%	0.217	C	C	.	.	H	α-helix	trans	-62.1	-41.9	169.9	-54.8	0	0	0	0	111.7	A82 L83 L88 L89 I90 N248 L249	A82-S86 VanDerWaalsContact O-CB 3.31Å; A82-S86 WeakPolarHBondContact O-CB 3.35Å; A82-S86 PolarHBondContact O-N 3.45Å; A82-S86 PolarHBondContact O-OG 3.32Å; L83-S86 PolarHBondContact O-N 3.47Å; S86-L88 VanDerWaalsContact C-N 3.33Å; S86-L88 PolarHBondContact O-N 3.21Å; S86-L89 PolarHBondContact O-N 3.46Å; S86-I90 WeakPolarHBondContact O-CB 3.43Å; S86-I90 WeakPolarHBondContact O-CD1 3.45Å; S86-I90 WeakPolarHBondContact O-CG1 3.47Å; S86-I90 PolarHBondContact O-N 3.29Å; S86-N248 WeakPolarHBondContact OG-CA 3.35Å; S86-L249 VanDerWaalsContact OG-CB 3.29Å; S86-L249 WeakPolarHBondContact OG-CB 3.4Å; S86-L249 PolarHBondContact OG-N 2.91Å
87	G	94.6	Very high	92.2	Very high	38 Å²	38	32.7 Å²	32.7	39%	0.392	19%	0.189	S	C	.	.	H	α-helix	trans	-57.6	-45.5	175	0	0	0	0	0	112	L83 A84 G85 L91	L83-G87 PolarHBondContact O-N 3.49Å; A84-G87 PolarHBondContact O-N 3.47Å; G85-G87 VanDerWaalsContact C-N 3.32Å; G85-G87 PolarHBondContact O-N 3.03Å; G87-L91 WeakPolarHBondContact O-CB 3.28Å; G87-L91 PolarHBondContact O-N 3.4Å
88	L	94.6	Very high	93.3	Very high	43 Å²	43	32.1 Å²	32.1	23%	0.225	18%	0.181	C	C	.	.	H	α-helix	trans	-62.2	-47.8	175.6	-76.2	168.1	0	0	0	112.2	A84 G85 S86 L91 W92 T240 M242	A84-L88 PolarHBondContact O-N 2.93Å; G85-L88 PolarHBondContact O-N 2.95Å; S86-L88 VanDerWaalsContact C-N 3.33Å; S86-L88 PolarHBondContact O-N 3.21Å; L88-L91 PolarHBondContact O-N 3.3Å; L88-W92 VanDerWaalsContact O-CD1 3.22Å; L88-W92 PolarHBondContact O-N 2.96Å; L88-T240 HydrophobicContact CD1-CG2 4.36Å; L88-M242 HydrophobicContact CB-SD 4.28Å
89	L	95.3	Very high	94	Very high	1 Å²	1	35 Å²	35	1%	0.005	20%	0.199	C	C	.	.	H	α-helix	trans	-60.6	-47.5	178.8	-70.9	174.5	0	0	0	111.6	G85 S86 A93 G153 V157 L160 L228 A232 M242 I246 N248	G85-L89 WeakPolarHBondContact O-CG 3.37Å; G85-L89 PolarHBondContact O-N 2.99Å; S86-L89 PolarHBondContact O-N 3.46Å; L89-A93 WeakPolarHBondContact O-CB 3.47Å; L89-A93 PolarHBondContact O-N 2.68Å; L89-G153 VanDerWaalsContact CD2-O 3.28Å; L89-G153 WeakPolarHBondContact CD2-O 3.22Å; L89-V157 HydrophobicContact CD2-CG2 3.91Å; L89-L160 HydrophobicContact CB-CD1 4.06Å; L89-L228 HydrophobicContact CD1-CD1 4.3Å; L89-L228 HydrophobicContact CD1-CD2 4.19Å; L89-A232 HydrophobicContact CD1-CB 4.37Å; L89-M242 HydrophobicContact CD2-CE 4.13Å; L89-I246 HydrophobicContact CD1-CG2 4.2Å; L89-I246 HydrophobicContact CG-CG2 4.22Å; L89-N248 HydrophobicContact CD1-CB 3.79Å
90	I	95.7	Very high	94.4	Very high	37 Å²	37	39 Å²	39	19%	0.19	22%	0.219	C	C	.	.	H	α-helix	trans	-65.8	-42.6	179.5	-67.2	162.4	0	0	0	110.8	S86 T94 I218 A222	S86-I90 WeakPolarHBondContact O-CB 3.43Å; S86-I90 WeakPolarHBondContact O-CD1 3.45Å; S86-I90 WeakPolarHBondContact O-CG1 3.47Å; S86-I90 PolarHBondContact O-N 3.29Å; I90-T94 WeakPolarHBondContact O-CB 3.11Å; I90-T94 PolarHBondContact O-N 3.18Å; I90-T94 PolarHBondContact O-OG1 3.28Å; I90-I218 HydrophobicContact CG2-CG2 3.77Å; I90-A222 HydrophobicContact CD1-CB 3.54Å; I90-A222 HydrophobicContact CG1-CB 4.29Å
91	L	96.3	Very high	94.8	Very high	100 Å²	100	38.3 Å²	38.3	52%	0.524	21%	0.214	S	C	.	.	H	α-helix	trans	-58.1	-54.6	178.3	176.5	66	0	0	0	110.2	G87 L88 T94 V95	G87-L91 WeakPolarHBondContact O-CB 3.28Å; G87-L91 PolarHBondContact O-N 3.4Å; L88-L91 PolarHBondContact O-N 3.3Å; L91-T94 PolarHBondContact O-N 2.9Å; L91-V95 HydrophobicContact CD1-CG2 4.36Å; L91-V95 WeakPolarHBondContact O-CB 3.42Å; L91-V95 VanDerWaalsContact O-CG2 3.22Å; L91-V95 WeakPolarHBondContact O-CG2 3.19Å; L91-V95 PolarHBondContact O-N 3.48Å
92	W	96.4	Very high	95.1	Very high	88 Å²	88	40 Å²	40	33%	0.333	22%	0.223	S	C	.	.	H	α-helix	trans	-67.2	-41.4	-178.8	-74.7	117.7	0	0	0	112.4	L88 T94 V95 F96 W154 V157	L88-W92 VanDerWaalsContact O-CD1 3.22Å; L88-W92 PolarHBondContact O-N 2.96Å; W92-T94 VanDerWaalsContact C-N 3.25Å; W92-T94 PolarHBondContact O-N 2.95Å; W92-V95 HydrophobicContact CE3-CB 4.35Å; W92-V95 HydrophobicContact CE3-CG1 4.23Å; W92-V95 HydrophobicContact CZ3-CG1 4.28Å; W92-V95 PolarHBondContact O-N 2.84Å; W92-F96 HydrophobicContact CB-CE2 4.31Å; W92-F96 HydrophobicContact CD2-CE2 4.38Å; W92-F96 AromaticContact CE3-CE2 3.6Å; W92-F96 HydrophobicContact CE3-CE2 3.6Å; W92-F96 AromaticContact CE3-CZ 3.92Å; W92-F96 HydrophobicContact CE3-CZ 3.92Å; W92-F96 HydrophobicContact CZ3-CE2 4.32Å; W92-F96 HydrophobicContact CZ3-CZ 4.17Å; W92-F96 WeakPolarHBondContact O-CD2 3.43Å; W92-F96 PolarHBondContact O-N 3.23Å; W92-W154 HydrophobicContact CD2-CH2 4.44Å; W92-V157 HydrophobicContact CB-CB 4.46Å; W92-V157 HydrophobicContact CB-CG1 3.88Å; W92-V157 HydrophobicContact CB-CG2 3.65Å
93	A	96.6	Very high	95.4	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-58.2	-41.1	174.5	0	0	0	0	0	111.4	L89 F96 G97 L160 Q164 I221	L89-A93 WeakPolarHBondContact O-CB 3.47Å; L89-A93 PolarHBondContact O-N 2.68Å; A93-F96 PolarHBondContact O-N 2.97Å; A93-G97 WeakPolarHBondContact O-CA 3.35Å; A93-G97 PolarHBondContact O-N 3.21Å; A93-L160 HydrophobicContact CB-CB 3.7Å; A93-Q164 PolarHBondContact O-OE1 3.31Å; A93-Q164 VanDerWaalsContact O-OE1 3.06Å; A93-I221 HydrophobicContact CB-CD1 3.96Å
94	T	96.7	Very high	95.5	Very high	27 Å²	27	44.8 Å²	44.8	17%	0.166	25%	0.25	C	C	.	.	H	α-helix	trans	-68	-43.7	177.4	-58.2	0	0	0	0	112.1	I90 L91 W92 F96 T98 P99 Q164 I218	I90-T94 WeakPolarHBondContact O-CB 3.11Å; I90-T94 PolarHBondContact O-N 3.18Å; I90-T94 PolarHBondContact O-OG1 3.28Å; L91-T94 PolarHBondContact O-N 2.9Å; W92-T94 VanDerWaalsContact C-N 3.25Å; W92-T94 PolarHBondContact O-N 2.95Å; T94-F96 VanDerWaalsContact C-N 3.27Å; T94-F96 PolarHBondContact O-N 3.46Å; T94-T98 WeakPolarHBondContact CG2-OG1 3.37Å; T94-T98 WeakPolarHBondContact O-CB 3.34Å; T94-T98 PolarHBondContact O-N 3.36Å; T94-T98 PolarHBondContact O-OG1 3.33Å; T94-P99 WeakPolarHBondContact O-CD 3.35Å; T94-Q164 VanDerWaalsContact CA-OE1 3.3Å; T94-Q164 PolarHBondContact OG1-NE2 2.92Å; T94-I218 HydrophobicContact CG2-CD1 3.81Å; T94-I218 HydrophobicContact CG2-CG1 4.17Å
95	V	97	Very high	95.6	Very high	69 Å²	69	43.3 Å²	43.3	42%	0.418	24%	0.237	S	C	.	.	H	α-helix	trans	-59.2	-37.7	178.1	166.6	0	0	0	0	111.6	L91 W92 P99	L91-V95 HydrophobicContact CD1-CG2 4.36Å; L91-V95 WeakPolarHBondContact O-CB 3.42Å; L91-V95 VanDerWaalsContact O-CG2 3.22Å; L91-V95 WeakPolarHBondContact O-CG2 3.19Å; L91-V95 PolarHBondContact O-N 3.48Å; W92-V95 HydrophobicContact CE3-CB 4.35Å; W92-V95 HydrophobicContact CE3-CG1 4.23Å; W92-V95 HydrophobicContact CZ3-CG1 4.28Å; W92-V95 PolarHBondContact O-N 2.84Å; V95-P99 WeakPolarHBondContact O-CD 3.44Å; V95-P99 VanDerWaalsContact O-CG 3.25Å; V95-P99 WeakPolarHBondContact O-CG 3.17Å
96	F	95.9	Very high	95.7	Very high	104 Å²	104	44.6 Å²	44.6	46%	0.456	24%	0.244	S	C	.	.	H	α-helix	trans	-88.4	-45.6	177.9	-63.5	-62.8	0	0	0	113.3	W92 A93 T94 L100 W154 V157	W92-F96 HydrophobicContact CB-CE2 4.31Å; W92-F96 HydrophobicContact CD2-CE2 4.38Å; W92-F96 AromaticContact CE3-CE2 3.6Å; W92-F96 HydrophobicContact CE3-CE2 3.6Å; W92-F96 AromaticContact CE3-CZ 3.92Å; W92-F96 HydrophobicContact CE3-CZ 3.92Å; W92-F96 HydrophobicContact CZ3-CE2 4.32Å; W92-F96 HydrophobicContact CZ3-CZ 4.17Å; W92-F96 WeakPolarHBondContact O-CD2 3.43Å; W92-F96 PolarHBondContact O-N 3.23Å; A93-F96 PolarHBondContact O-N 2.97Å; T94-F96 VanDerWaalsContact C-N 3.27Å; T94-F96 PolarHBondContact O-N 3.46Å; F96-L100 WeakPolarHBondContact O-CB 3.45Å; F96-W154 AromaticContact CE2-CZ3 3.91Å; F96-W154 HydrophobicContact CE2-CZ3 3.91Å; F96-W154 HydrophobicContact CZ-CZ3 4.38Å; F96-V157 HydrophobicContact CD2-CG1 3.91Å; F96-V157 HydrophobicContact CE2-CG1 4.35Å
97	G	95.9	Very high	95.7	Very high	1 Å²	1	48 Å²	48	1%	0.01	26%	0.255	C	S	.	.	H	α-helix	trans	-74.6	-38.4	-172.2	0	0	0	0	0	113.8	A93 G101 V165	A93-G97 WeakPolarHBondContact O-CA 3.35Å; A93-G97 PolarHBondContact O-N 3.21Å; G97-G101 PolarHBondContact O-N 3.42Å; G97-V165 WeakPolarHBondContact O-CG2 3.37Å
98	T	96.9	Very high	95.7	Very high	14 Å²	14	46.2 Å²	46.2	9%	0.086	24%	0.236	C	C	.	.	H	α-helix	trans	-70	-50.1	-174.8	-63.8	0	0	0	0	112.8	T94 L100 G101 I102 V168 I214	T94-T98 WeakPolarHBondContact CG2-OG1 3.37Å; T94-T98 WeakPolarHBondContact O-CB 3.34Å; T94-T98 PolarHBondContact O-N 3.36Å; T94-T98 PolarHBondContact O-OG1 3.33Å; T98-L100 VanDerWaalsContact C-N 3.31Å; T98-L100 PolarHBondContact O-N 3.25Å; T98-G101 PolarHBondContact O-N 2.88Å; T98-I102 HydrophobicContact CG2-CD1 3.74Å; T98-I102 HydrophobicContact CG2-CG1 4.27Å; T98-I102 WeakPolarHBondContact O-CG1 3.5Å; T98-I102 PolarHBondContact O-N 2.96Å; T98-V168 HydrophobicContact CG2-CG1 4.5Å; T98-I214 HydrophobicContact CG2-CD1 3.68Å; T98-I214 HydrophobicContact CG2-CG1 3.87Å; T98-I214 HydrophobicContact CG2-CG2 4.08Å
99	P	96.9	Very high	95.5	Very high	64 Å²	64	44.2 Å²	44.2	42%	0.416	23%	0.226	S	C	.	.	H	α-helix	trans	-59.1	-43	176.9	-25.5	36.6	0	0	0	112.3	T94 V95 G101 I102 M103	T94-P99 WeakPolarHBondContact O-CD 3.35Å; V95-P99 WeakPolarHBondContact O-CD 3.44Å; V95-P99 VanDerWaalsContact O-CG 3.25Å; V95-P99 WeakPolarHBondContact O-CG 3.17Å; P99-G101 PolarHBondContact O-N 3.2Å; P99-I102 PolarHBondContact O-N 3.05Å; P99-M103 WeakPolarHBondContact O-CB 3.42Å; P99-M103 VanDerWaalsContact O-CG 3.24Å; P99-M103 WeakPolarHBondContact O-CG 3.46Å; P99-M103 PolarHBondContact O-N 3.34Å
100	L	96.3	Very high	95.3	Very high	106 Å²	106	44.7 Å²	44.7	56%	0.555	23%	0.228	S	C	*	.	H	α-helix	trans	-60.6	-45.9	177.7	-175.5	64.5	0	0	0	111.3	F96 T98 M103 A104 V165	F96-L100 WeakPolarHBondContact O-CB 3.45Å; T98-L100 VanDerWaalsContact C-N 3.31Å; T98-L100 PolarHBondContact O-N 3.25Å; L100-M103 PolarHBondContact O-N 3.29Å; L100-A104 WeakPolarHBondContact O-CB 3.49Å; L100-A104 PolarHBondContact O-N 2.72Å; L100-V165 HydrophobicContact CB-CG2 4.41Å; L100-V165 HydrophobicContact CD2-CG1 4.46Å; L100-V165 HydrophobicContact CD2-CG2 3.99Å; L100-V165 HydrophobicContact CG-CG2 4.45Å
101	G	95.7	Very high	94.9	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-65.1	-42.4	178.9	0	0	0	0	0	113.4	G97 T98 P99 G105 I169	G97-G101 PolarHBondContact O-N 3.42Å; T98-G101 PolarHBondContact O-N 2.88Å; P99-G101 PolarHBondContact O-N 3.2Å; G101-G105 PolarHBondContact O-N 3.48Å; G101-I169 WeakPolarHBondContact O-CG1 3.46Å
102	I	96.3	Very high	94.1	Very high	39 Å²	39	43.5 Å²	43.5	20%	0.2	22%	0.215	C	C	.	.	H	α-helix	trans	-63.3	-47.1	176.8	-67.6	170.5	0	0	0	110	T98 P99 A104 G105 I106 V168 T172 I210 I214	T98-I102 HydrophobicContact CG2-CD1 3.74Å; T98-I102 HydrophobicContact CG2-CG1 4.27Å; T98-I102 WeakPolarHBondContact O-CG1 3.5Å; T98-I102 PolarHBondContact O-N 2.96Å; P99-I102 PolarHBondContact O-N 3.05Å; I102-A104 PolarHBondContact O-N 3.11Å; I102-G105 PolarHBondContact O-N 2.95Å; I102-I106 HydrophobicContact CG2-CD1 3.69Å; I102-I106 HydrophobicContact CG2-CG1 4.29Å; I102-I106 VanDerWaalsContact O-CG1 3.28Å; I102-I106 WeakPolarHBondContact O-CG1 3.49Å; I102-I106 PolarHBondContact O-N 3.49Å; I102-V168 HydrophobicContact CG1-CG1 3.79Å; I102-T172 HydrophobicContact CG2-CG2 4.39Å; I102-I210 HydrophobicContact CD1-CG2 4.5Å; I102-I210 HydrophobicContact CG1-CG2 4.39Å; I102-I214 HydrophobicContact CD1-CD1 3.91Å; I102-I214 HydrophobicContact CG1-CD1 4.48Å
103	M	95.1	Very high	93.1	Very high	134 Å²	134	44.5 Å²	44.5	66%	0.66	22%	0.219	S	C	*	.	H	α-helix	trans	-62.1	-45.3	-179.1	-72.9	177.2	65	0	0	111.9	P99 L100 I106 Y107	P99-M103 WeakPolarHBondContact O-CB 3.42Å; P99-M103 VanDerWaalsContact O-CG 3.24Å; P99-M103 WeakPolarHBondContact O-CG 3.46Å; P99-M103 PolarHBondContact O-N 3.34Å; L100-M103 PolarHBondContact O-N 3.29Å; M103-I106 PolarHBondContact O-N 2.81Å; M103-Y107 PolarHBondContact O-N 2.97Å
104	A	94	Very high	92.2	Very high	28 Å²	28	54.5 Å²	54.5	23%	0.231	26%	0.262	C	S	.	.	H	α-helix	trans	-64.5	-41.2	175.4	0	0	0	0	0	111.7	L100 I102 I106 Y107 L108 I169	L100-A104 WeakPolarHBondContact O-CB 3.49Å; L100-A104 PolarHBondContact O-N 2.72Å; I102-A104 PolarHBondContact O-N 3.11Å; A104-I106 PolarHBondContact O-N 3Å; A104-Y107 WeakPolarHBondContact O-CB 3.42Å; A104-Y107 PolarHBondContact O-N 3.23Å; A104-L108 WeakPolarHBondContact O-CG 3.4Å; A104-L108 PolarHBondContact O-N 2.95Å; A104-I169 HydrophobicContact CB-CD1 3.74Å; A104-I169 HydrophobicContact CB-CG1 3.77Å
105	G	94.7	Very high	91.8	Very high	0 Å²	0	55 Å²	55	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-61.2	-43.2	174.7	0	0	0	0	0	113.3	G101 I102 Y107 L108 A109	G101-G105 PolarHBondContact O-N 3.48Å; I102-G105 PolarHBondContact O-N 2.95Å; G105-Y107 VanDerWaalsContact C-N 3.34Å; G105-L108 PolarHBondContact O-N 2.95Å; G105-A109 WeakPolarHBondContact O-CB 3.44Å; G105-A109 PolarHBondContact O-N 3.47Å
106	I	94.8	Very high	91.4	Very high	29 Å²	29	60.8 Å²	60.8	15%	0.149	28%	0.282	C	S	.	.	H	α-helix	trans	-60.6	-45.1	173.5	-70.5	166.5	0	0	0	110.4	I102 M103 A104 L108 A109 E110 Y111 T172 L176 I198 L203	I102-I106 HydrophobicContact CG2-CD1 3.69Å; I102-I106 HydrophobicContact CG2-CG1 4.29Å; I102-I106 VanDerWaalsContact O-CG1 3.28Å; I102-I106 WeakPolarHBondContact O-CG1 3.49Å; I102-I106 PolarHBondContact O-N 3.49Å; M103-I106 PolarHBondContact O-N 2.81Å; A104-I106 PolarHBondContact O-N 3Å; I106-L108 PolarHBondContact O-N 3.31Å; I106-A109 PolarHBondContact O-N 3.31Å; I106-E110 WeakPolarHBondContact O-CB 3.4Å; I106-E110 PolarHBondContact O-N 3.22Å; I106-Y111 HydrophobicContact CG2-CE2 4.43Å; I106-T172 HydrophobicContact CG1-CG2 4.29Å; I106-L176 HydrophobicContact CB-CD1 4.34Å; I106-L176 HydrophobicContact CG1-CD1 3.82Å; I106-I198 HydrophobicContact CG2-CD1 4.26Å; I106-I198 HydrophobicContact CG2-CG2 3.73Å; I106-L203 HydrophobicContact CD1-CD1 4.05Å; I106-L203 HydrophobicContact CG1-CD1 4.42Å
107	Y	94.2	Very high	91.1	Very high	86 Å²	86	59.7 Å²	59.7	34%	0.337	28%	0.28	S	S	.	.	I	π-helix	trans	-57.9	-49.8	177.4	175.7	-99.1	0	0	0	111.3	M103 A104 G105 A109 Y111 G112 I121	M103-Y107 PolarHBondContact O-N 2.97Å; A104-Y107 WeakPolarHBondContact O-CB 3.42Å; A104-Y107 PolarHBondContact O-N 3.23Å; G105-Y107 VanDerWaalsContact C-N 3.34Å; Y107-A109 PolarHBondContact O-N 3.41Å; Y107-Y111 HydrophobicContact CD2-CD2 4.5Å; Y107-Y111 HydrophobicContact CD2-CG 4.31Å; Y107-Y111 CarbonylContact O-C 3.56Å; Y107-Y111 WeakPolarHBondContact O-CA 3.49Å; Y107-Y111 WeakPolarHBondContact O-CB 3.5Å; Y107-Y111 PolarHBondContact O-N 2.85Å; Y107-G112 PolarHBondContact O-N 3.5Å; Y107-I121 HydrophobicContact CE1-CD1 4.45Å
108	L	93.5	Very high	90.9	Very high	1 Å²	1	59.7 Å²	59.7	1%	0.005	28%	0.28	C	S	.	.	I	π-helix	trans	-65.2	-37.8	-179.3	-65.7	176	0	0	0	113.2	A104 G105 I106 A118 I121 R122 I169 E173	A104-L108 WeakPolarHBondContact O-CG 3.4Å; A104-L108 PolarHBondContact O-N 2.95Å; G105-L108 PolarHBondContact O-N 2.95Å; I106-L108 PolarHBondContact O-N 3.31Å; L108-A118 HydrophobicContact CD2-CB 3.56Å; L108-I121 HydrophobicContact CD1-CG2 3.91Å; L108-I121 HydrophobicContact CD2-CB 4.08Å; L108-I121 HydrophobicContact CD2-CD1 4.45Å; L108-I121 HydrophobicContact CD2-CG2 3.99Å; L108-I121 HydrophobicContact CG-CG2 4.39Å; L108-R122 HydrophobicContact CD1-CG 4.28Å; L108-R122 PolarHBondContact O-NH2 3.49Å; L108-I169 HydrophobicContact CD1-CG2 3.59Å; L108-E173 HydrophobicContact CB-CG 4.3Å
109	A	92.2	Very high	90.5	Very high	1 Å²	1	65.5 Å²	65.5	1%	0.008	31%	0.306	C	S	.	.	I	π-helix	trans	-75.1	-40.1	-178.7	0	0	0	0	0	113.3	G105 I106 Y107 R113 E173 L176	G105-A109 WeakPolarHBondContact O-CB 3.44Å; G105-A109 PolarHBondContact O-N 3.47Å; I106-A109 PolarHBondContact O-N 3.31Å; Y107-A109 PolarHBondContact O-N 3.41Å; A109-R113 WeakPolarHBondContact O-CG 3.21Å; A109-R113 PolarHBondContact O-NE 3.47Å; A109-E173 HydrophobicContact CB-CG 4.21Å; A109-L176 HydrophobicContact CB-CB 3.66Å; A109-L176 HydrophobicContact CB-CD1 3.74Å; A109-L176 HydrophobicContact CB-CG 4.37Å
110	E	90.9	Very high	90.2	Very high	10 Å²	10	64.7 Å²	64.7	5%	0.047	30%	0.3	C	S	.	.	I	π-helix	trans	-110.8	-36.4	-167.3	-64.1	-67.6	168.1	0	0	113.1	I106 R113 R184 K194 I198	I106-E110 WeakPolarHBondContact O-CB 3.4Å; I106-E110 PolarHBondContact O-N 3.22Å; E110-R113 IonicContact OE2-NH2 3.46Å; E110-R184 IonicContact OE1-CZ 2.78Å; E110-R184 IonicContact OE1-NE 3.77Å; E110-R184 PolarHBondContact OE1-NE 2.84Å; E110-R184 IonicContact OE1-NH2 3.21Å; E110-R184 PolarHBondContact OE1-NH2 3.06Å; E110-R184 IonicContact OE2-NE 2.85Å; E110-R184 PolarHBondContact OE2-NE 2.84Å; E110-K194 WeakPolarHBondContact O-CE 3.31Å; E110-K194 PolarHBondContact O-NZ 3.41Å; E110-I198 HydrophobicContact CB-CD1 3.62Å; E110-I198 HydrophobicContact CB-CG1 4.15Å; E110-I198 HydrophobicContact CG-CD1 3.93Å; E110-I198 HydrophobicContact CG-CG1 3.91Å
111	Y	87.8	Confident	89.9	Confident	113 Å²	113	62.1 Å²	62.1	44%	0.443	29%	0.286	S	S	.	.	I	π-helix	trans	-99.9	-42.6	-176.8	-65.7	-89.9	0	0	0	112.8	I106 Y107 K194 I198	I106-Y111 HydrophobicContact CG2-CE2 4.43Å; Y107-Y111 HydrophobicContact CD2-CD2 4.5Å; Y107-Y111 HydrophobicContact CD2-CG 4.31Å; Y107-Y111 CarbonylContact O-C 3.56Å; Y107-Y111 WeakPolarHBondContact O-CA 3.49Å; Y107-Y111 WeakPolarHBondContact O-CB 3.5Å; Y107-Y111 PolarHBondContact O-N 2.85Å; Y111-K194 HydrophobicContact CD1-CD 4.18Å; Y111-K194 HydrophobicContact CE1-CD 3.73Å; Y111-K194 HydrophobicContact CE1-CG 4.16Å; Y111-I198 HydrophobicContact CD2-CD1 4.25Å; Y111-I198 HydrophobicContact CE2-CD1 3.38Å
112	G	77.8	Confident	89.8	Confident	0 Å²	0	64.8 Å²	64.8	0%	0	30%	0.296	C	S	.	.			trans	-96.7	24	-171.3	0	0	0	0	0	115.6	Y107 K114 S115 A118	Y107-G112 PolarHBondContact O-N 3.5Å; G112-K114 PolarHBondContact O-N 2.95Å; G112-S115 PolarHBondContact O-N 3.4Å; G112-A118 WeakPolarHBondContact O-CB 3.06Å
113	R	76	Confident	89.5	Confident	108 Å²	108	69.4 Å²	69.4	41%	0.408	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.4	-32.2	-173.7	-72.5	-170.4	-177.3	-172.8	1.9	114.2	A109 E110 D181 R184	A109-R113 WeakPolarHBondContact O-CG 3.21Å; A109-R113 PolarHBondContact O-NE 3.47Å; E110-R113 IonicContact OE2-NH2 3.46Å; R113-D181 IonicContact CZ-OD1 3.45Å; R113-D181 IonicContact NH1-OD1 3.12Å; R113-D181 PolarHBondContact NH1-OD1 2.93Å; R113-D181 IonicContact NH2-OD1 2.86Å; R113-R184 VanDerWaalsContact NH2-CZ 3.26Å
114	K	78.4	Confident	89.3	Confident	210 Å²	210	67.2 Å²	67.2	91%	0.913	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-131.4	15.1	-178.4	-61.9	-173.5	178.6	-177.8	0	114.3	G112	G112-K114 PolarHBondContact O-N 2.95Å
115	S	87	Confident	89.2	Confident	38 Å²	38	66.4 Å²	66.4	27%	0.266	30%	0.297	S	S	.	.			trans	-83.9	141.4	-179.2	66.7	0	0	0	0	110.9	G112 L117 A118 E119	G112-S115 PolarHBondContact O-N 3.4Å; S115-L117 PolarHBondContact O-N 3.41Å; S115-A118 WeakPolarHBondContact O-CB 3.22Å; S115-A118 PolarHBondContact O-N 2.96Å; S115-A118 VanDerWaalsContact OG-CB 3.27Å; S115-A118 WeakPolarHBondContact OG-CB 3.26Å; S115-A118 PolarHBondContact OG-N 3.37Å; S115-E119 PolarHBondContact O-N 3.48Å
116	W	90.1	Very high	89	Confident	191 Å²	191	69.9 Å²	69.9	72%	0.723	32%	0.315	S	S	*	.	H	α-helix	trans	-54.1	-40.5	172.4	166.2	82.9	0	0	0	111.6	A118 E119 V120	W116-A118 VanDerWaalsContact C-N 3.28Å; W116-A118 PolarHBondContact O-N 2.89Å; W116-E119 WeakPolarHBondContact O-CB 3.27Å; W116-E119 PolarHBondContact O-N 3.25Å; W116-E119 VanDerWaalsContact O-N 3.12Å; W116-V120 HydrophobicContact CD2-CG2 4.14Å; W116-V120 HydrophobicContact CH2-CG2 4.29Å; W116-V120 HydrophobicContact CZ2-CG2 3.69Å; W116-V120 WeakPolarHBondContact O-CG2 3.4Å; W116-V120 PolarHBondContact O-N 2.87Å
117	L	89.5	Confident	88.7	Confident	81 Å²	81	72.6 Å²	72.6	42%	0.424	33%	0.329	S	S	.	.	H	α-helix	trans	-58.6	-39.9	176.5	-178.7	63.4	0	0	0	112	S115 V120 I121	S115-L117 PolarHBondContact O-N 3.41Å; L117-V120 PolarHBondContact O-N 3.48Å; L117-I121 HydrophobicContact CD1-CD1 4.18Å; L117-I121 HydrophobicContact CD1-CG1 4.41Å; L117-I121 HydrophobicContact CG-CD1 3.88Å; L117-I121 WeakPolarHBondContact O-CB 3.28Å; L117-I121 WeakPolarHBondContact O-CG1 3.15Å; L117-I121 PolarHBondContact O-N 3.43Å
118	A	90.2	Very high	88.4	Confident	0 Å²	0	72 Å²	72	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-69.7	-33.4	178	0	0	0	0	0	112.7	L108 G112 S115 W116 R122	L108-A118 HydrophobicContact CD2-CB 3.56Å; G112-A118 WeakPolarHBondContact O-CB 3.06Å; S115-A118 WeakPolarHBondContact O-CB 3.22Å; S115-A118 PolarHBondContact O-N 2.96Å; S115-A118 VanDerWaalsContact OG-CB 3.27Å; S115-A118 WeakPolarHBondContact OG-CB 3.26Å; S115-A118 PolarHBondContact OG-N 3.37Å; W116-A118 VanDerWaalsContact C-N 3.28Å; W116-A118 PolarHBondContact O-N 2.89Å; A118-R122 WeakPolarHBondContact O-CB 3.18Å; A118-R122 VanDerWaalsContact O-CG 3.29Å; A118-R122 WeakPolarHBondContact O-CG 3.32Å; A118-R122 PolarHBondContact O-N 3.06Å
119	E	89.9	Confident	88.2	Confident	136 Å²	136	73.3 Å²	73.3	64%	0.636	34%	0.338	S	S	*	.	H	α-helix	trans	-65.7	-44.1	174.2	-167.4	170.5	-168.3	0	0	111.4	S115 W116 R122 F123	S115-E119 PolarHBondContact O-N 3.48Å; W116-E119 WeakPolarHBondContact O-CB 3.27Å; W116-E119 PolarHBondContact O-N 3.25Å; W116-E119 VanDerWaalsContact O-N 3.12Å; E119-R122 PolarHBondContact O-N 3.3Å; E119-F123 WeakPolarHBondContact O-CB 3.4Å; E119-F123 PolarHBondContact O-N 3.05Å
120	V	90.6	Very high	88	Confident	47 Å²	47	78 Å²	78	29%	0.285	37%	0.371	S	S	.	.	H	α-helix	trans	-61.9	-46.6	174.1	175	0	0	0	0	111.6	W116 L117 R122 F123 I124	W116-V120 HydrophobicContact CD2-CG2 4.14Å; W116-V120 HydrophobicContact CH2-CG2 4.29Å; W116-V120 HydrophobicContact CZ2-CG2 3.69Å; W116-V120 WeakPolarHBondContact O-CG2 3.4Å; W116-V120 PolarHBondContact O-N 2.87Å; L117-V120 PolarHBondContact O-N 3.48Å; V120-R122 VanDerWaalsContact C-N 3.34Å; V120-R122 PolarHBondContact O-N 3.37Å; V120-F123 PolarHBondContact O-N 3.37Å; V120-I124 HydrophobicContact CG1-CD1 3.86Å; V120-I124 HydrophobicContact CG1-CG1 4.47Å; V120-I124 WeakPolarHBondContact O-CG1 3.49Å; V120-I124 PolarHBondContact O-N 3.24Å
121	I	90.5	Very high	87.7	Confident	52 Å²	52	78.7 Å²	78.7	27%	0.267	38%	0.379	S	S	.	.	H	α-helix	trans	-60.8	-44.1	178.1	-68.8	166.8	0	0	0	110.6	Y107 L108 L117 F123 I124 N125	Y107-I121 HydrophobicContact CE1-CD1 4.45Å; L108-I121 HydrophobicContact CD1-CG2 3.91Å; L108-I121 HydrophobicContact CD2-CB 4.08Å; L108-I121 HydrophobicContact CD2-CD1 4.45Å; L108-I121 HydrophobicContact CD2-CG2 3.99Å; L108-I121 HydrophobicContact CG-CG2 4.39Å; L117-I121 HydrophobicContact CD1-CD1 4.18Å; L117-I121 HydrophobicContact CD1-CG1 4.41Å; L117-I121 HydrophobicContact CG-CD1 3.88Å; L117-I121 WeakPolarHBondContact O-CB 3.28Å; L117-I121 WeakPolarHBondContact O-CG1 3.15Å; L117-I121 PolarHBondContact O-N 3.43Å; I121-F123 PolarHBondContact O-N 3.47Å; I121-I124 PolarHBondContact O-N 3.36Å; I121-N125 WeakPolarHBondContact O-CB 3.47Å; I121-N125 PolarHBondContact O-N 3.31Å
122	R	91.5	Very high	87.8	Confident	56 Å²	56	77.3 Å²	77.3	21%	0.211	38%	0.383	C	S	.	.	H	α-helix	trans	-60.8	-44.3	176.6	-76.3	179.5	-167.1	110.8	5.3	111.9	L108 A118 E119 V120 N125 D126 E173	L108-R122 HydrophobicContact CD1-CG 4.28Å; L108-R122 PolarHBondContact O-NH2 3.49Å; A118-R122 WeakPolarHBondContact O-CB 3.18Å; A118-R122 VanDerWaalsContact O-CG 3.29Å; A118-R122 WeakPolarHBondContact O-CG 3.32Å; A118-R122 PolarHBondContact O-N 3.06Å; E119-R122 PolarHBondContact O-N 3.3Å; V120-R122 VanDerWaalsContact C-N 3.34Å; V120-R122 PolarHBondContact O-N 3.37Å; R122-N125 WeakPolarHBondContact O-CB 3.34Å; R122-N125 PolarHBondContact O-N 3.13Å; R122-D126 PolarHBondContact O-N 3.12Å; R122-E173 IonicContact CZ-OE1 3.33Å; R122-E173 IonicContact NE-OE1 3.95Å; R122-E173 PolarHBondContact NE-OE1 2.73Å; R122-E173 IonicContact NE-OE2 3.92Å; R122-E173 IonicContact NH2-OE1 3.78Å; R122-E173 PolarHBondContact NH2-OE1 2.72Å
123	F	91.3	Very high	88.5	Confident	137 Å²	137	78.5 Å²	78.5	60%	0.601	39%	0.391	S	S	*	.	H	α-helix	trans	-60.2	-48.6	178	178	-105.5	0	0	0	112	E119 V120 I121 N125 D126 I127	E119-F123 WeakPolarHBondContact O-CB 3.4Å; E119-F123 PolarHBondContact O-N 3.05Å; V120-F123 PolarHBondContact O-N 3.37Å; I121-F123 PolarHBondContact O-N 3.47Å; F123-N125 VanDerWaalsContact C-N 3.31Å; F123-N125 PolarHBondContact O-N 3.11Å; F123-D126 PolarHBondContact O-N 3.25Å; F123-I127 HydrophobicContact CD1-CD1 3.86Å; F123-I127 HydrophobicContact CE1-CD1 3.35Å; F123-I127 HydrophobicContact CE2-CD1 4.17Å; F123-I127 HydrophobicContact CG-CD1 4.47Å; F123-I127 HydrophobicContact CZ-CD1 3.53Å; F123-I127 HydrophobicContact CZ-CG1 4.44Å; F123-I127 WeakPolarHBondContact O-CG1 3.49Å; F123-I127 PolarHBondContact O-N 3.01Å
124	I	90.6	Very high	89.2	Confident	88 Å²	88	76.9 Å²	76.9	45%	0.451	39%	0.39	S	S	.	.	H	α-helix	trans	-61.9	-42.3	176.3	-66.2	171	0	0	0	110.5	V120 I121 D126 I127 L128	V120-I124 HydrophobicContact CG1-CD1 3.86Å; V120-I124 HydrophobicContact CG1-CG1 4.47Å; V120-I124 WeakPolarHBondContact O-CG1 3.49Å; V120-I124 PolarHBondContact O-N 3.24Å; I121-I124 PolarHBondContact O-N 3.36Å; I124-D126 VanDerWaalsContact C-N 3.33Å; I124-D126 PolarHBondContact O-N 3.45Å; I124-I127 PolarHBondContact O-N 2.91Å; I124-L128 HydrophobicContact CG2-CD1 4.07Å; I124-L128 HydrophobicContact CG2-CG 4.34Å; I124-L128 WeakPolarHBondContact O-CG 3.36Å; I124-L128 PolarHBondContact O-N 3.39Å
125	N	91.6	Very high	89.9	Confident	10 Å²	10	70.8 Å²	70.8	5%	0.053	37%	0.37	C	S	.	.	H	α-helix	trans	-60.4	-42.2	178.5	-167.6	80.4	0	0	0	112.2	I121 R122 F123 L128 L129 P166	I121-N125 WeakPolarHBondContact O-CB 3.47Å; I121-N125 PolarHBondContact O-N 3.31Å; R122-N125 WeakPolarHBondContact O-CB 3.34Å; R122-N125 PolarHBondContact O-N 3.13Å; F123-N125 VanDerWaalsContact C-N 3.31Å; F123-N125 PolarHBondContact O-N 3.11Å; N125-L128 PolarHBondContact O-N 2.86Å; N125-L129 WeakPolarHBondContact O-CG 3.41Å; N125-L129 PolarHBondContact O-N 3.31Å; N125-P166 PolarHBondContact ND2-O 3.32Å; N125-P166 WeakPolarHBondContact OD1-CA 3.23Å; N125-P166 VanDerWaalsContact OD1-CB 3.27Å; N125-P166 WeakPolarHBondContact OD1-CB 3.19Å; N125-P166 PolarHBondContact OD1-O 2.96Å
126	D	90.2	Very high	90.1	Very high	73 Å²	73	69.6 Å²	69.6	39%	0.39	36%	0.362	S	S	.	.	H	α-helix	trans	-68.2	-34.9	177.5	-75.5	-26.1	0	0	0	112.3	R122 F123 I124 S130 R170	R122-D126 PolarHBondContact O-N 3.12Å; F123-D126 PolarHBondContact O-N 3.25Å; I124-D126 VanDerWaalsContact C-N 3.33Å; I124-D126 PolarHBondContact O-N 3.45Å; D126-S130 PolarHBondContact O-N 2.68Å; D126-S130 PolarHBondContact O-OG 3.48Å; D126-R170 IonicContact OD1-NH1 3.05Å; D126-R170 PolarHBondContact OD1-NH1 3.38Å
127	I	88.7	Confident	90.2	Very high	87 Å²	87	60.5 Å²	60.5	45%	0.446	33%	0.327	S	S	.	.	H	α-helix	trans	-63.9	-49.4	171.3	-68.7	170.8	0	0	0	110.3	F123 I124 L129 S130 A131	F123-I127 HydrophobicContact CD1-CD1 3.86Å; F123-I127 HydrophobicContact CE1-CD1 3.35Å; F123-I127 HydrophobicContact CE2-CD1 4.17Å; F123-I127 HydrophobicContact CG-CD1 4.47Å; F123-I127 HydrophobicContact CZ-CD1 3.53Å; F123-I127 HydrophobicContact CZ-CG1 4.44Å; F123-I127 WeakPolarHBondContact O-CG1 3.49Å; F123-I127 PolarHBondContact O-N 3.01Å; I124-I127 PolarHBondContact O-N 2.91Å; I127-L129 VanDerWaalsContact C-N 3.29Å; I127-L129 PolarHBondContact O-N 3.36Å; I127-S130 CarbonylContact O-C 3.52Å; I127-S130 PolarHBondContact O-N 2.86Å; I127-A131 PolarHBondContact O-N 3.4Å
128	L	88.7	Confident	90.4	Very high	72 Å²	72	60.5 Å²	60.5	38%	0.377	33%	0.327	S	S	.	.	H	α-helix	trans	-61.7	-36.4	-178.7	-71.7	174.4	0	0	0	112.5	I124 N125 S130 A131 P166	I124-L128 HydrophobicContact CG2-CD1 4.07Å; I124-L128 HydrophobicContact CG2-CG 4.34Å; I124-L128 WeakPolarHBondContact O-CG 3.36Å; I124-L128 PolarHBondContact O-N 3.39Å; N125-L128 PolarHBondContact O-N 2.86Å; L128-S130 PolarHBondContact O-N 3.49Å; L128-A131 PolarHBondContact O-N 3.3Å; L128-P166 HydrophobicContact CB-CB 4.23Å; L128-P166 HydrophobicContact CB-CG 3.71Å; L128-P166 HydrophobicContact CD1-CG 3.95Å; L128-P166 HydrophobicContact CG-CG 4.49Å
129	L	88.2	Confident	90.6	Very high	30 Å²	30	66 Å²	66	16%	0.157	35%	0.351	C	S	.	.	H	α-helix	trans	-65.8	-26.7	174.9	-76.3	172.2	0	0	0	113.5	N125 I127 P166 I167 R170	N125-L129 WeakPolarHBondContact O-CG 3.41Å; N125-L129 PolarHBondContact O-N 3.31Å; I127-L129 VanDerWaalsContact C-N 3.29Å; I127-L129 PolarHBondContact O-N 3.36Å; L129-P166 HydrophobicContact CD2-CB 3.81Å; L129-P166 HydrophobicContact CG-CB 3.75Å; L129-I167 HydrophobicContact CD2-CB 4.32Å; L129-I167 HydrophobicContact CD2-CG1 3.49Å; L129-I167 VanDerWaalsContact CD2-CG1 3.49Å; L129-R170 HydrophobicContact CD1-CB 4.21Å; L129-R170 VanDerWaalsContact CD1-CD 3.46Å; L129-R170 HydrophobicContact CD1-CG 4.49Å
130	S	88.2	Confident	90.8	Very high	99 Å²	99	59.5 Å²	59.5	69%	0.692	32%	0.321	S	S	*	.	H	α-helix	trans	-97.6	-15.4	-177	-51.2	0	0	0	0	112.7	D126 I127 L128	D126-S130 PolarHBondContact O-N 2.68Å; D126-S130 PolarHBondContact O-OG 3.48Å; I127-S130 CarbonylContact O-C 3.52Å; I127-S130 PolarHBondContact O-N 2.86Å; L128-S130 PolarHBondContact O-N 3.49Å
131	A	85.8	Confident	91	Very high	25 Å²	25	61.6 Å²	61.6	21%	0.207	32%	0.324	C	S	.	.	S	Bend	trans	-67.5	136.7	-178.5	0	0	0	0	0	111	I127 L128 S133	I127-A131 PolarHBondContact O-N 3.4Å; L128-A131 PolarHBondContact O-N 3.3Å; A131-S133 PolarHBondContact O-N 2.93Å
132	P	89.3	Confident	91.1	Very high	84 Å²	84	63.5 Å²	63.5	55%	0.545	34%	0.338	S	S	.	.			trans	-57.6	131.3	170.7	-23.3	33.6	0	0	0	110.6	I134 V135	P132-I134 HydrophobicContact CB-CG2 4.08Å; P132-I134 PolarHBondContact O-N 2.85Å; P132-I134 VanDerWaalsContact O-N 3.07Å; P132-V135 HydrophobicContact CB-CG2 4.26Å; P132-V135 HydrophobicContact CG-CG2 4.49Å; P132-V135 WeakPolarHBondContact O-CB 3.41Å; P132-V135 PolarHBondContact O-N 2.7Å
133	S	92.1	Very high	91.3	Very high	24 Å²	24	64.1 Å²	64.1	17%	0.168	35%	0.345	C	S	.	.	H	α-helix	trans	-61.9	-22.9	-173.9	56	0	0	0	0	113.8	A131 V135 V136 G137 E224	A131-S133 PolarHBondContact O-N 2.93Å; S133-V135 VanDerWaalsContact C-N 3.29Å; S133-V135 PolarHBondContact O-N 3.27Å; S133-V136 PolarHBondContact O-N 3.11Å; S133-G137 PolarHBondContact O-N 3.37Å; S133-G137 VanDerWaalsContact O-N 3.15Å; S133-E224 WeakPolarHBondContact CB-OE2 3.45Å; S133-E224 PolarHBondContact OG-OE2 3.44Å
134	I	90.3	Very high	91.4	Very high	75 Å²	75	58.8 Å²	58.8	39%	0.385	32%	0.324	S	S	.	.	H	α-helix	trans	-61.7	-34.1	172.6	-165.7	154.5	0	0	0	113.2	P132 V136 G137 L138 A226 F230	P132-I134 HydrophobicContact CB-CG2 4.08Å; P132-I134 PolarHBondContact O-N 2.85Å; P132-I134 VanDerWaalsContact O-N 3.07Å; I134-V136 VanDerWaalsContact C-N 3.33Å; I134-V136 PolarHBondContact O-N 3.34Å; I134-G137 PolarHBondContact O-N 2.99Å; I134-L138 PolarHBondContact O-N 2.89Å; I134-A226 HydrophobicContact CB-CB 4.08Å; I134-A226 HydrophobicContact CG1-CB 4.49Å; I134-F230 HydrophobicContact CD1-CE2 3.65Å; I134-F230 HydrophobicContact CD1-CZ 4.04Å; I134-F230 HydrophobicContact CG1-CD2 4.28Å; I134-F230 HydrophobicContact CG1-CE2 3.57Å; I134-F230 HydrophobicContact CG1-CZ 4.26Å
135	V	92.8	Very high	91.5	Very high	81 Å²	81	54.8 Å²	54.8	49%	0.491	30%	0.303	S	S	.	.	H	α-helix	trans	-67.1	-39	179.5	178.9	0	0	0	0	110.2	P132 S133 G137 L138 F139	P132-V135 HydrophobicContact CB-CG2 4.26Å; P132-V135 HydrophobicContact CG-CG2 4.49Å; P132-V135 WeakPolarHBondContact O-CB 3.41Å; P132-V135 PolarHBondContact O-N 2.7Å; S133-V135 VanDerWaalsContact C-N 3.29Å; S133-V135 PolarHBondContact O-N 3.27Å; V135-G137 VanDerWaalsContact C-N 3.33Å; V135-L138 PolarHBondContact O-N 3.21Å; V135-F139 WeakPolarHBondContact O-CB 3.42Å; V135-F139 PolarHBondContact O-N 2.72Å
136	V	92.2	Very high	91.4	Very high	14 Å²	14	56.7 Å²	56.7	9%	0.085	32%	0.32	C	S	.	.	H	α-helix	trans	-65.1	-40.3	174.4	-178.6	0	0	0	0	110.6	S133 I134 F139 V140 L162 L163	S133-V136 PolarHBondContact O-N 3.11Å; I134-V136 VanDerWaalsContact C-N 3.33Å; I134-V136 PolarHBondContact O-N 3.34Å; V136-F139 PolarHBondContact O-N 3.03Å; V136-V140 WeakPolarHBondContact O-CG2 3.36Å; V136-V140 PolarHBondContact O-N 3.33Å; V136-L162 HydrophobicContact CG1-CB 3.83Å; V136-L162 HydrophobicContact CG1-CD1 4.19Å; V136-L163 HydrophobicContact CB-CD2 4.09Å; V136-L163 HydrophobicContact CB-CG 4.42Å; V136-L163 HydrophobicContact CG1-CD2 4.32Å; V136-L163 HydrophobicContact CG1-CG 4.2Å; V136-L163 HydrophobicContact CG2-CD2 3.76Å
137	G	92.3	Very high	91.4	Very high	0 Å²	0	60.6 Å²	60.6	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-57.4	-50.4	172.9	0	0	0	0	0	113.2	S133 I134 V135 V140 Y141	S133-G137 PolarHBondContact O-N 3.37Å; S133-G137 VanDerWaalsContact O-N 3.15Å; I134-G137 PolarHBondContact O-N 2.99Å; V135-G137 VanDerWaalsContact C-N 3.33Å; G137-V140 PolarHBondContact O-N 3.29Å; G137-Y141 WeakPolarHBondContact O-CB 3.24Å; G137-Y141 PolarHBondContact O-N 3.06Å
138	L	92.9	Very high	91.4	Very high	80 Å²	80	59.4 Å²	59.4	42%	0.419	33%	0.33	S	S	.	.	H	α-helix	trans	-63.7	-40.3	177.7	-75.7	170.5	0	0	0	112.4	I134 V135 Y141 T142 F230	I134-L138 PolarHBondContact O-N 2.89Å; V135-L138 PolarHBondContact O-N 3.21Å; L138-Y141 WeakPolarHBondContact O-CB 3.41Å; L138-Y141 PolarHBondContact O-N 3.12Å; L138-T142 PolarHBondContact O-N 2.93Å; L138-T142 PolarHBondContact O-OG1 3.06Å; L138-T142 VanDerWaalsContact O-OG1 3.11Å; L138-F230 HydrophobicContact CD2-CD1 3.94Å; L138-F230 HydrophobicContact CD2-CE1 4Å; L138-F230 HydrophobicContact CD2-CG 4.35Å; L138-F230 HydrophobicContact CD2-CZ 4.49Å
139	F	94.7	Very high	91.4	Very high	115 Å²	115	64.5 Å²	64.5	50%	0.504	35%	0.352	S	S	.	.	H	α-helix	trans	-57.5	-52.2	175	175	-103.1	0	0	0	110.8	V135 V136 Y141 T142 I143 L162	V135-F139 WeakPolarHBondContact O-CB 3.42Å; V135-F139 PolarHBondContact O-N 2.72Å; V136-F139 PolarHBondContact O-N 3.03Å; F139-Y141 VanDerWaalsContact C-N 3.3Å; F139-Y141 PolarHBondContact O-N 3.49Å; F139-T142 PolarHBondContact O-N 3.2Å; F139-I143 HydrophobicContact CD1-CD1 4.33Å; F139-I143 HydrophobicContact CE1-CD1 3.75Å; F139-I143 HydrophobicContact CE1-CG1 4.29Å; F139-I143 HydrophobicContact CE2-CG2 4.27Å; F139-I143 HydrophobicContact CZ-CD1 4.13Å; F139-I143 HydrophobicContact CZ-CG2 4.33Å; F139-I143 VanDerWaalsContact O-CG1 3.27Å; F139-I143 WeakPolarHBondContact O-CG1 3.2Å; F139-I143 PolarHBondContact O-N 3.08Å; F139-I143 VanDerWaalsContact O-N 3.13Å; F139-L162 HydrophobicContact CD1-CD1 4.33Å; F139-L162 HydrophobicContact CE1-CD1 4.42Å
140	V	95.1	Very high	91.4	Very high	0 Å²	0	66.5 Å²	66.5	0%	0	36%	0.36	C	S	.	.	H	α-helix	trans	-64.6	-35.4	178.6	177.6	0	0	0	0	111.8	V136 G137 T142 I143 V144 A155 I158 A159 L162 T231	V136-V140 WeakPolarHBondContact O-CG2 3.36Å; V136-V140 PolarHBondContact O-N 3.33Å; G137-V140 PolarHBondContact O-N 3.29Å; V140-T142 PolarHBondContact O-N 2.83Å; V140-I143 PolarHBondContact O-N 2.88Å; V140-V144 HydrophobicContact CG1-CB 4.22Å; V140-V144 HydrophobicContact CG1-CG2 4.05Å; V140-V144 WeakPolarHBondContact O-CB 3.39Å; V140-V144 PolarHBondContact O-N 3.14Å; V140-A155 HydrophobicContact CG1-CB 4.44Å; V140-I158 HydrophobicContact CG1-CB 4.28Å; V140-I158 HydrophobicContact CG1-CG2 4.06Å; V140-I158 HydrophobicContact CG2-CG2 3.99Å; V140-A159 HydrophobicContact CB-CB 4.25Å; V140-A159 HydrophobicContact CG1-CB 4.36Å; V140-A159 HydrophobicContact CG2-CB 4.01Å; V140-L162 HydrophobicContact CG2-CD1 3.6Å; V140-T231 HydrophobicContact CB-CG2 3.86Å; V140-T231 HydrophobicContact CG1-CG2 3.66Å
141	Y	94.1	Very high	91.6	Very high	92 Å²	92	64.7 Å²	64.7	36%	0.361	34%	0.34	S	S	.	.	I	π-helix	trans	-56.6	-50.9	172.5	177.6	-90.6	0	0	0	111	G137 L138 F139 I143 V145 A146 F151 F230	G137-Y141 WeakPolarHBondContact O-CB 3.24Å; G137-Y141 PolarHBondContact O-N 3.06Å; L138-Y141 WeakPolarHBondContact O-CB 3.41Å; L138-Y141 PolarHBondContact O-N 3.12Å; F139-Y141 VanDerWaalsContact C-N 3.3Å; F139-Y141 PolarHBondContact O-N 3.49Å; Y141-I143 PolarHBondContact O-N 2.99Å; Y141-V145 HydrophobicContact CD2-CB 3.6Å; Y141-V145 HydrophobicContact CD2-CG1 3.56Å; Y141-V145 HydrophobicContact CD2-CG2 4.18Å; Y141-V145 HydrophobicContact CE2-CB 4.07Å; Y141-V145 HydrophobicContact CE2-CG1 3.56Å; Y141-V145 HydrophobicContact CG-CB 4.19Å; Y141-V145 PolarHBondContact O-N 3.3Å; Y141-A146 HydrophobicContact CE1-CB 4.31Å; Y141-A146 WeakPolarHBondContact O-CB 3.49Å; Y141-A146 PolarHBondContact O-N 3.39Å; Y141-F151 HydrophobicContact CD2-CE1 4.15Å; Y141-F151 HydrophobicContact CE2-CE1 4.01Å; Y141-F151 HydrophobicContact CE2-CZ 4.07Å; Y141-F230 VanDerWaalsContact CD2-O 3.23Å; Y141-F230 WeakPolarHBondContact CD2-O 3.5Å
142	T	93.3	Very high	91.9	Very high	91 Å²	91	63.5 Å²	63.5	56%	0.558	33%	0.33	S	S	*	.	I	π-helix	trans	-62.8	-39.6	-178.6	-55	0	0	0	0	112.9	L138 F139 V140	L138-T142 PolarHBondContact O-N 2.93Å; L138-T142 PolarHBondContact O-OG1 3.06Å; L138-T142 VanDerWaalsContact O-OG1 3.11Å; F139-T142 PolarHBondContact O-N 3.2Å; V140-T142 PolarHBondContact O-N 2.83Å
143	I	94.7	Very high	92.1	Very high	70 Å²	70	59.5 Å²	59.5	36%	0.359	30%	0.304	S	S	.	.	I	π-helix	trans	-89.2	-25.6	-174.7	58.8	148.5	0	0	0	114.3	F139 V140 Y141 Q147	F139-I143 HydrophobicContact CD1-CD1 4.33Å; F139-I143 HydrophobicContact CE1-CD1 3.75Å; F139-I143 HydrophobicContact CE1-CG1 4.29Å; F139-I143 HydrophobicContact CE2-CG2 4.27Å; F139-I143 HydrophobicContact CZ-CD1 4.13Å; F139-I143 HydrophobicContact CZ-CG2 4.33Å; F139-I143 VanDerWaalsContact O-CG1 3.27Å; F139-I143 WeakPolarHBondContact O-CG1 3.2Å; F139-I143 PolarHBondContact O-N 3.08Å; F139-I143 VanDerWaalsContact O-N 3.13Å; V140-I143 PolarHBondContact O-N 2.88Å; Y141-I143 PolarHBondContact O-N 2.99Å; I143-Q147 VanDerWaalsContact O-CD 3.31Å; I143-Q147 PolarHBondContact O-OE1 3.29Å
144	V	94.2	Very high	92.2	Very high	24 Å²	24	62.4 Å²	62.4	15%	0.145	31%	0.311	C	S	.	.	I	π-helix	trans	-114.8	-63	-176.9	-177.5	0	0	0	0	110.7	V140 A146 Q147 M148 A155 I158	V140-V144 HydrophobicContact CG1-CB 4.22Å; V140-V144 HydrophobicContact CG1-CG2 4.05Å; V140-V144 WeakPolarHBondContact O-CB 3.39Å; V140-V144 PolarHBondContact O-N 3.14Å; V144-A146 PolarHBondContact O-N 2.91Å; V144-Q147 PolarHBondContact O-N 2.88Å; V144-M148 HydrophobicContact CG1-CG 4.44Å; V144-M148 HydrophobicContact CG1-SD 3.71Å; V144-M148 WeakPolarHBondContact O-CB 3.28Å; V144-M148 VanDerWaalsContact O-CG 3.32Å; V144-M148 WeakPolarHBondContact O-CG 3.46Å; V144-M148 PolarHBondContact O-N 3.01Å; V144-A155 HydrophobicContact CB-CB 4.46Å; V144-A155 HydrophobicContact CG1-CB 3.92Å; V144-I158 HydrophobicContact CG1-CD1 4.5Å; V144-I158 HydrophobicContact CG2-CD1 3.94Å
145	V	92.1	Very high	92.5	Very high	4 Å²	4	58.9 Å²	58.9	2%	0.024	29%	0.293	C	S	.	.	I	π-helix	trans	-65.6	-43.9	-170.8	-179.6	0	0	0	0	111.9	Y141 Q147 M148 E149 F151 A155 T231	Y141-V145 HydrophobicContact CD2-CB 3.6Å; Y141-V145 HydrophobicContact CD2-CG1 3.56Å; Y141-V145 HydrophobicContact CD2-CG2 4.18Å; Y141-V145 HydrophobicContact CE2-CB 4.07Å; Y141-V145 HydrophobicContact CE2-CG1 3.56Å; Y141-V145 HydrophobicContact CG-CB 4.19Å; Y141-V145 PolarHBondContact O-N 3.3Å; V145-Q147 PolarHBondContact O-N 3.2Å; V145-M148 PolarHBondContact O-N 3.26Å; V145-E149 WeakPolarHBondContact O-CA 3.26Å; V145-E149 PolarHBondContact O-N 3.01Å; V145-F151 HydrophobicContact CG1-CD1 3.87Å; V145-F151 HydrophobicContact CG1-CE1 4.04Å; V145-F151 HydrophobicContact CG1-CG 4.25Å; V145-A155 HydrophobicContact CG2-CB 3.67Å; V145-T231 HydrophobicContact CG2-CG2 4.5Å
146	A	89.8	Confident	92.6	Very high	50 Å²	50	55 Å²	55	41%	0.413	27%	0.27	S	S	.	.	H	α-helix	trans	-66	-28.2	178.5	0	0	0	0	0	112.4	Y141 V144	Y141-A146 HydrophobicContact CE1-CB 4.31Å; Y141-A146 WeakPolarHBondContact O-CB 3.49Å; Y141-A146 PolarHBondContact O-N 3.39Å; V144-A146 PolarHBondContact O-N 2.91Å
147	Q	90.5	Very high	92.8	Very high	156 Å²	156	54.5 Å²	54.5	73%	0.729	27%	0.266	S	S	*	.	H	α-helix	trans	-80.4	-33.9	174.5	-64.9	-164.9	-7.5	0	0	112.6	I143 V144 V145 E149	I143-Q147 VanDerWaalsContact O-CD 3.31Å; I143-Q147 PolarHBondContact O-OE1 3.29Å; V144-Q147 PolarHBondContact O-N 2.88Å; V145-Q147 PolarHBondContact O-N 3.2Å; Q147-E149 VanDerWaalsContact C-N 3.33Å
148	M	88.9	Confident	93	Very high	61 Å²	61	57.7 Å²	57.7	30%	0.3	28%	0.283	S	S	.	.	H	α-helix	trans	-80.9	-14.9	176.6	-66.1	-176.9	77.9	0	0	112.8	V144 V145 H150 M243	V144-M148 HydrophobicContact CG1-CG 4.44Å; V144-M148 HydrophobicContact CG1-SD 3.71Å; V144-M148 WeakPolarHBondContact O-CB 3.28Å; V144-M148 VanDerWaalsContact O-CG 3.32Å; V144-M148 WeakPolarHBondContact O-CG 3.46Å; V144-M148 PolarHBondContact O-N 3.01Å; V145-M148 PolarHBondContact O-N 3.26Å; M148-H150 PolarHBondContact O-CD2 2.89Å; M148-H150 PolarHBondContact O-N 2.83Å; M148-M243 HydrophobicContact CE-CE 3.7Å; M148-M243 HydrophobicContact CE-SD 4.36Å
149	E	87.2	Confident	93.1	Very high	180 Å²	180	53.9 Å²	53.9	84%	0.841	26%	0.263	S	S	*	.	S	Bend	trans	60.8	4.4	-173.4	-57.7	-175.8	167	0	0	115.2	V145 Q147	V145-E149 WeakPolarHBondContact O-CA 3.26Å; V145-E149 PolarHBondContact O-N 3.01Å; Q147-E149 VanDerWaalsContact C-N 3.33Å
150	H	88.4	Confident	93.1	Very high	72 Å²	72	48.5 Å²	48.5	33%	0.333	24%	0.24	S	C	.	.	S	Bend	trans	-143.7	155	177	69.1	80.2	0	0	0	112.4	M148 M243	M148-H150 PolarHBondContact O-CD2 2.89Å; M148-H150 PolarHBondContact O-N 2.83Å; H150-M243 PolarHBondContact CE1-O 3.07Å; H150-M243 PolarHBondContact ND1-O 3.21Å
151	F	91.8	Very high	93.2	Very high	60 Å²	60	49.1 Å²	49.1	26%	0.263	25%	0.245	S	C	.	.			trans	-73.2	148.7	173.3	-61.9	-86.4	0	0	0	110.8	Y141 V145 T231 L233 P245	Y141-F151 HydrophobicContact CD2-CE1 4.15Å; Y141-F151 HydrophobicContact CE2-CE1 4.01Å; Y141-F151 HydrophobicContact CE2-CZ 4.07Å; V145-F151 HydrophobicContact CG1-CD1 3.87Å; V145-F151 HydrophobicContact CG1-CE1 4.04Å; V145-F151 HydrophobicContact CG1-CG 4.25Å; F151-T231 WeakPolarHBondContact CA-O 3.3Å; F151-T231 WeakPolarHBondContact CB-O 3.49Å; F151-T231 WeakPolarHBondContact CD1-O 3.25Å; F151-L233 HydrophobicContact CB-CB 3.76Å; F151-L233 HydrophobicContact CB-CD2 4.5Å; F151-L233 HydrophobicContact CD1-CB 3.97Å; F151-L233 HydrophobicContact CD2-CB 4.24Å; F151-L233 HydrophobicContact CD2-CD2 3.68Å; F151-L233 HydrophobicContact CD2-CG 4.46Å; F151-L233 HydrophobicContact CE2-CD2 4.02Å; F151-L233 HydrophobicContact CG-CB 3.73Å; F151-L233 HydrophobicContact CG-CD2 4.06Å; F151-L233 HydrophobicContact CG-CG 4.4Å; F151-P245 HydrophobicContact CB-CG 4.17Å; F151-P245 WeakPolarHBondContact O-CD 3.39Å
152	S	92.9	Very high	93.2	Very high	0 Å²	0	48 Å²	48	0%	0	25%	0.245	C	C	.	.			trans	-152	146.4	-177.6	67.8	0	0	0	0	112.6	W154 A155 G156 T231 A232 M243	S152-W154 PolarHBondContact O-N 2.86Å; S152-A155 WeakPolarHBondContact O-CB 3.4Å; S152-A155 PolarHBondContact O-N 2.88Å; S152-A155 PolarHBondContact OG-N 3.26Å; S152-A155 VanDerWaalsContact OG-N 3.17Å; S152-G156 PolarHBondContact O-N 2.72Å; S152-T231 PolarHBondContact N-O 2.94Å; S152-T231 VanDerWaalsContact N-O 3.09Å; S152-A232 VanDerWaalsContact O-CA 3.27Å; S152-A232 WeakPolarHBondContact O-CA 3.41Å; S152-M243 VanDerWaalsContact CB-O 3.24Å; S152-M243 WeakPolarHBondContact CB-O 3.25Å
153	G	93.3	Very high	93.2	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-51.9	-37.6	170.9	0	0	0	0	0	112.6	L89 G156 V157 M242 Q244	L89-G153 VanDerWaalsContact CD2-O 3.28Å; L89-G153 WeakPolarHBondContact CD2-O 3.22Å; G153-G156 WeakPolarHBondContact O-CA 3.44Å; G153-G156 PolarHBondContact O-N 2.96Å; G153-G156 VanDerWaalsContact O-N 3.13Å; G153-V157 WeakPolarHBondContact O-CG2 3.48Å; G153-V157 PolarHBondContact O-N 3.39Å; G153-M242 CarbonylContact C-O 3.59Å; G153-M242 WeakPolarHBondContact CA-O 3.34Å; G153-M242 PolarHBondContact N-O 3.49Å; G153-Q244 PolarHBondContact N-O 3.16Å
154	W	95.6	Very high	93.3	Very high	86 Å²	86	41 Å²	41	33%	0.326	21%	0.205	S	C	.	.	H	α-helix	trans	-61.6	-41.9	175.2	-72	117.8	0	0	0	113.7	W92 F96 S152 G156 V157 I158 M242	W92-W154 HydrophobicContact CD2-CH2 4.44Å; F96-W154 AromaticContact CE2-CZ3 3.91Å; F96-W154 HydrophobicContact CE2-CZ3 3.91Å; F96-W154 HydrophobicContact CZ-CZ3 4.38Å; S152-W154 PolarHBondContact O-N 2.86Å; W154-G156 VanDerWaalsContact C-N 3.26Å; W154-G156 PolarHBondContact O-N 2.98Å; W154-V157 PolarHBondContact O-N 2.83Å; W154-I158 WeakPolarHBondContact O-CG1 3.42Å; W154-I158 PolarHBondContact O-N 2.84Å; W154-M242 VanDerWaalsContact CD1-C 3.47Å; W154-M242 HydrophobicContact CD2-CB 3.99Å; W154-M242 HydrophobicContact CG-CB 4.08Å; W154-M242 HydrophobicContact CZ2-CB 4Å; W154-M242 HydrophobicContact CZ2-CG 4.3Å; W154-M242 PolarHBondContact N-O 3.16Å; W154-M242 VanDerWaalsContact NE1-CB 3.3Å
155	A	95.5	Very high	93.3	Very high	0 Å²	0	41 Å²	41	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-60.5	-40.5	173.3	0	0	0	0	0	110.8	V140 V144 V145 S152 I158 A159 T231	V140-A155 HydrophobicContact CG1-CB 4.44Å; V144-A155 HydrophobicContact CB-CB 4.46Å; V144-A155 HydrophobicContact CG1-CB 3.92Å; V145-A155 HydrophobicContact CG2-CB 3.67Å; S152-A155 WeakPolarHBondContact O-CB 3.4Å; S152-A155 PolarHBondContact O-N 2.88Å; S152-A155 PolarHBondContact OG-N 3.26Å; S152-A155 VanDerWaalsContact OG-N 3.17Å; A155-I158 PolarHBondContact O-N 2.79Å; A155-A159 PolarHBondContact O-N 3.04Å; A155-A159 VanDerWaalsContact O-N 3.08Å; A155-T231 HydrophobicContact CB-CG2 4.39Å
156	G	94.8	Very high	93.4	Very high	0 Å²	0	41 Å²	41	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-59.6	-46.2	173.2	0	0	0	0	0	113.2	S152 G153 W154 I158 A159 L160 T231	S152-G156 PolarHBondContact O-N 2.72Å; G153-G156 WeakPolarHBondContact O-CA 3.44Å; G153-G156 PolarHBondContact O-N 2.96Å; G153-G156 VanDerWaalsContact O-N 3.13Å; W154-G156 VanDerWaalsContact C-N 3.26Å; W154-G156 PolarHBondContact O-N 2.98Å; G156-I158 VanDerWaalsContact C-N 3.33Å; G156-I158 PolarHBondContact O-N 3.49Å; G156-A159 PolarHBondContact O-N 3.31Å; G156-L160 WeakPolarHBondContact O-CG 3.25Å; G156-L160 PolarHBondContact O-N 3.49Å; G156-T231 WeakPolarHBondContact CA-OG1 3.41Å
157	V	96.4	Very high	93.7	Very high	3 Å²	3	39.6 Å²	39.6	2%	0.018	19%	0.19	C	C	.	.	H	α-helix	trans	-58.8	-44.2	176.6	168.8	0	0	0	0	111.4	L89 W92 F96 G153 W154 L160 A161 M242	L89-V157 HydrophobicContact CD2-CG2 3.91Å; W92-V157 HydrophobicContact CB-CB 4.46Å; W92-V157 HydrophobicContact CB-CG1 3.88Å; W92-V157 HydrophobicContact CB-CG2 3.65Å; F96-V157 HydrophobicContact CD2-CG1 3.91Å; F96-V157 HydrophobicContact CE2-CG1 4.35Å; G153-V157 WeakPolarHBondContact O-CG2 3.48Å; G153-V157 PolarHBondContact O-N 3.39Å; W154-V157 PolarHBondContact O-N 2.83Å; V157-L160 PolarHBondContact O-N 3.46Å; V157-A161 WeakPolarHBondContact O-CB 3.4Å; V157-A161 PolarHBondContact O-N 2.99Å; V157-M242 HydrophobicContact CG2-CE 3.45Å; V157-M242 VanDerWaalsContact CG2-CE 3.45Å
158	I	96	Very high	93.9	Very high	68 Å²	68	32.2 Å²	32.2	35%	0.349	16%	0.155	S	C	.	.	H	α-helix	trans	-61.8	-46	178.7	-68	166.2	0	0	0	110.4	V140 V144 W154 A155 G156 A161 L162	V140-I158 HydrophobicContact CG1-CB 4.28Å; V140-I158 HydrophobicContact CG1-CG2 4.06Å; V140-I158 HydrophobicContact CG2-CG2 3.99Å; V144-I158 HydrophobicContact CG1-CD1 4.5Å; V144-I158 HydrophobicContact CG2-CD1 3.94Å; W154-I158 WeakPolarHBondContact O-CG1 3.42Å; W154-I158 PolarHBondContact O-N 2.84Å; A155-I158 PolarHBondContact O-N 2.79Å; G156-I158 VanDerWaalsContact C-N 3.33Å; G156-I158 PolarHBondContact O-N 3.49Å; I158-A161 PolarHBondContact O-N 3.45Å; I158-L162 HydrophobicContact CG2-CD1 4.16Å; I158-L162 WeakPolarHBondContact O-CG 3.46Å; I158-L162 PolarHBondContact O-N 2.87Å
159	A	95.6	Very high	94.2	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-64	-44.8	179.2	0	0	0	0	0	112.6	V140 A155 G156 L162 L163 P227 T231	V140-A159 HydrophobicContact CB-CB 4.25Å; V140-A159 HydrophobicContact CG1-CB 4.36Å; V140-A159 HydrophobicContact CG2-CB 4.01Å; A155-A159 PolarHBondContact O-N 3.04Å; A155-A159 VanDerWaalsContact O-N 3.08Å; G156-A159 PolarHBondContact O-N 3.31Å; A159-L162 PolarHBondContact O-N 2.93Å; A159-L163 PolarHBondContact O-N 2.91Å; A159-P227 HydrophobicContact CB-CB 3.99Å; A159-T231 HydrophobicContact CB-CG2 4.04Å
160	L	95.8	Very high	94.6	Very high	2 Å²	2	27 Å²	27	1%	0.01	13%	0.125	C	C	.	.	H	α-helix	trans	-66.2	-39.5	176.9	-65.5	-177.4	0	0	0	111.9	L89 A93 G156 V157 L162 L163 Q164 I221 E224 P227 L228	L89-L160 HydrophobicContact CB-CD1 4.06Å; A93-L160 HydrophobicContact CB-CB 3.7Å; G156-L160 WeakPolarHBondContact O-CG 3.25Å; G156-L160 PolarHBondContact O-N 3.49Å; V157-L160 PolarHBondContact O-N 3.46Å; L160-L162 PolarHBondContact O-N 3.24Å; L160-L163 PolarHBondContact O-N 3.03Å; L160-Q164 WeakPolarHBondContact O-CB 3.23Å; L160-Q164 PolarHBondContact O-N 2.9Å; L160-I221 HydrophobicContact CB-CB 4.44Å; L160-I221 HydrophobicContact CB-CD1 4.47Å; L160-I221 HydrophobicContact CD2-CB 4.22Å; L160-E224 HydrophobicContact CD2-CB 4.24Å; L160-P227 HydrophobicContact CD2-CG 4.38Å; L160-L228 HydrophobicContact CD1-CD2 4.07Å; L160-L228 HydrophobicContact CD2-CD2 4.16Å; L160-L228 HydrophobicContact CD2-CG 4.31Å; L160-L228 HydrophobicContact CG-CD2 3.98Å
161	A	95.9	Very high	94.9	Very high	13 Å²	13	24.9 Å²	24.9	11%	0.107	12%	0.118	C	C	.	.	H	α-helix	trans	-62.9	-41.9	176.3	0	0	0	0	0	111.7	V157 I158 L163 Q164 V165	V157-A161 WeakPolarHBondContact O-CB 3.4Å; V157-A161 PolarHBondContact O-N 2.99Å; I158-A161 PolarHBondContact O-N 3.45Å; A161-L163 PolarHBondContact O-N 3.26Å; A161-Q164 PolarHBondContact O-N 2.92Å; A161-Q164 VanDerWaalsContact O-N 3.14Å; A161-V165 WeakPolarHBondContact O-CG2 3.44Å; A161-V165 PolarHBondContact O-N 3.05Å
162	L	94.3	Very high	95.1	Very high	69 Å²	69	22 Å²	22	36%	0.361	11%	0.105	S	C	.	.	H	α-helix	trans	-61.2	-32.1	175.6	-76.6	172.6	0	0	0	112.9	V136 F139 V140 I158 A159 L160 P166	V136-L162 HydrophobicContact CG1-CB 3.83Å; V136-L162 HydrophobicContact CG1-CD1 4.19Å; F139-L162 HydrophobicContact CD1-CD1 4.33Å; F139-L162 HydrophobicContact CE1-CD1 4.42Å; V140-L162 HydrophobicContact CG2-CD1 3.6Å; I158-L162 HydrophobicContact CG2-CD1 4.16Å; I158-L162 WeakPolarHBondContact O-CG 3.46Å; I158-L162 PolarHBondContact O-N 2.87Å; A159-L162 PolarHBondContact O-N 2.93Å; L160-L162 PolarHBondContact O-N 3.24Å; L162-P166 WeakPolarHBondContact O-CD 3.45Å
163	L	94	Very high	95.2	Very high	14 Å²	14	22.6 Å²	22.6	7%	0.073	11%	0.108	C	C	.	.	H	α-helix	trans	-78.3	-33.8	173.8	-68.8	172.1	0	0	0	112.8	V136 A159 L160 A161 I167 I221 E224 P227	V136-L163 HydrophobicContact CB-CD2 4.09Å; V136-L163 HydrophobicContact CB-CG 4.42Å; V136-L163 HydrophobicContact CG1-CD2 4.32Å; V136-L163 HydrophobicContact CG1-CG 4.2Å; V136-L163 HydrophobicContact CG2-CD2 3.76Å; A159-L163 PolarHBondContact O-N 2.91Å; L160-L163 PolarHBondContact O-N 3.03Å; A161-L163 PolarHBondContact O-N 3.26Å; L163-I167 WeakPolarHBondContact O-CD1 3.43Å; L163-I221 HydrophobicContact CB-CG2 4.18Å; L163-E224 HydrophobicContact CD1-CB 4.45Å; L163-E224 HydrophobicContact CD1-CG 4.19Å; L163-P227 HydrophobicContact CD1-CB 4.35Å; L163-P227 HydrophobicContact CD1-CG 3.79Å
164	Q	95.3	Very high	95.2	Very high	0 Å²	0	26 Å²	26	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-73.4	-43.2	-178.3	-162.2	-177	40.1	0	0	112.5	A93 T94 L160 A161 I167 V168 A217 I221	A93-Q164 PolarHBondContact O-OE1 3.31Å; A93-Q164 VanDerWaalsContact O-OE1 3.06Å; T94-Q164 VanDerWaalsContact CA-OE1 3.3Å; T94-Q164 PolarHBondContact OG1-NE2 2.92Å; L160-Q164 WeakPolarHBondContact O-CB 3.23Å; L160-Q164 PolarHBondContact O-N 2.9Å; A161-Q164 PolarHBondContact O-N 2.92Å; A161-Q164 VanDerWaalsContact O-N 3.14Å; Q164-I167 PolarHBondContact O-N 3.04Å; Q164-I167 VanDerWaalsContact O-N 3.16Å; Q164-V168 HydrophobicContact CG-CG2 4.13Å; Q164-V168 PolarHBondContact O-N 3.4Å; Q164-A217 HydrophobicContact CG-CB 3.81Å; Q164-I221 HydrophobicContact CB-CD1 4.29Å; Q164-I221 HydrophobicContact CB-CG2 3.96Å; Q164-I221 HydrophobicContact CG-CD1 4.2Å; Q164-I221 HydrophobicContact CG-CG2 4.43Å
165	V	95.6	Very high	95.2	Very high	23 Å²	23	24.7 Å²	24.7	14%	0.139	12%	0.124	C	C	.	.	H	α-helix	trans	-52.6	-49.7	-172.9	165.4	0	0	0	0	112.2	G97 L100 A161 I167 V168 I169	G97-V165 WeakPolarHBondContact O-CG2 3.37Å; L100-V165 HydrophobicContact CB-CG2 4.41Å; L100-V165 HydrophobicContact CD2-CG1 4.46Å; L100-V165 HydrophobicContact CD2-CG2 3.99Å; L100-V165 HydrophobicContact CG-CG2 4.45Å; A161-V165 WeakPolarHBondContact O-CG2 3.44Å; A161-V165 PolarHBondContact O-N 3.05Å; V165-I167 VanDerWaalsContact C-N 3.26Å; V165-I167 PolarHBondContact O-N 2.96Å; V165-V168 PolarHBondContact O-N 2.88Å; V165-V168 VanDerWaalsContact O-N 3.16Å; V165-I169 HydrophobicContact CG1-CD1 3.57Å; V165-I169 HydrophobicContact CG1-CG1 4.15Å; V165-I169 VanDerWaalsContact O-CG1 3.3Å; V165-I169 WeakPolarHBondContact O-CG1 3.19Å; V165-I169 PolarHBondContact O-N 3.25Å
166	P	94.4	Very high	95.1	Very high	3 Å²	3	24.7 Å²	24.7	2%	0.019	12%	0.124	C	C	.	.	H	α-helix	trans	-63.2	-30.8	-176.3	-25	35.1	0	0	0	114.8	N125 L128 L129 L162 R170	N125-P166 PolarHBondContact ND2-O 3.32Å; N125-P166 WeakPolarHBondContact OD1-CA 3.23Å; N125-P166 VanDerWaalsContact OD1-CB 3.27Å; N125-P166 WeakPolarHBondContact OD1-CB 3.19Å; N125-P166 PolarHBondContact OD1-O 2.96Å; L128-P166 HydrophobicContact CB-CB 4.23Å; L128-P166 HydrophobicContact CB-CG 3.71Å; L128-P166 HydrophobicContact CD1-CG 3.95Å; L128-P166 HydrophobicContact CG-CG 4.49Å; L129-P166 HydrophobicContact CD2-CB 3.81Å; L129-P166 HydrophobicContact CG-CB 3.75Å; L162-P166 WeakPolarHBondContact O-CD 3.45Å; P166-R170 WeakPolarHBondContact O-CB 3.29Å; P166-R170 PolarHBondContact O-N 3.45Å; P166-R170 VanDerWaalsContact O-N 3.14Å
167	I	94.6	Very high	95	Very high	22 Å²	22	29.5 Å²	29.5	11%	0.113	15%	0.145	C	C	.	.	H	α-helix	trans	-71.2	-45.5	178.1	-55.8	165.7	0	0	0	109.4	L129 L163 Q164 V165 R170 T171 A217 R220	L129-I167 HydrophobicContact CD2-CB 4.32Å; L129-I167 HydrophobicContact CD2-CG1 3.49Å; L129-I167 VanDerWaalsContact CD2-CG1 3.49Å; L163-I167 WeakPolarHBondContact O-CD1 3.43Å; Q164-I167 PolarHBondContact O-N 3.04Å; Q164-I167 VanDerWaalsContact O-N 3.16Å; V165-I167 VanDerWaalsContact C-N 3.26Å; V165-I167 PolarHBondContact O-N 2.96Å; I167-R170 PolarHBondContact O-N 3.29Å; I167-T171 HydrophobicContact CG2-CG2 4.42Å; I167-T171 WeakPolarHBondContact O-CB 3.36Å; I167-T171 VanDerWaalsContact O-CG2 3.3Å; I167-T171 WeakPolarHBondContact O-CG2 3.26Å; I167-T171 PolarHBondContact O-N 3.16Å; I167-T171 PolarHBondContact O-OG1 2.9Å; I167-A217 HydrophobicContact CB-CB 3.97Å; I167-A217 HydrophobicContact CD1-CB 4.4Å; I167-A217 HydrophobicContact CG2-CB 3.72Å; I167-R220 HydrophobicContact CD1-CB 4.37Å; I167-R220 HydrophobicContact CD1-CG 4.34Å
168	V	96.4	Very high	94.8	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-66.6	-38.4	178.9	-178.9	0	0	0	0	111	T98 I102 Q164 V165 T171 T172 I214 A217	T98-V168 HydrophobicContact CG2-CG1 4.5Å; I102-V168 HydrophobicContact CG1-CG1 3.79Å; Q164-V168 HydrophobicContact CG-CG2 4.13Å; Q164-V168 PolarHBondContact O-N 3.4Å; V165-V168 PolarHBondContact O-N 2.88Å; V165-V168 VanDerWaalsContact O-N 3.16Å; V168-T171 WeakPolarHBondContact CA-OG1 3.48Å; V168-T171 PolarHBondContact O-OG1 3.29Å; V168-T171 VanDerWaalsContact O-OG1 3.11Å; V168-T172 WeakPolarHBondContact O-CB 3.18Å; V168-T172 PolarHBondContact O-N 3.47Å; V168-T172 PolarHBondContact O-OG1 2.9Å; V168-I214 HydrophobicContact CG1-CG1 4.33Å; V168-A217 HydrophobicContact CG2-CB 3.83Å
169	I	95.5	Very high	94.6	Very high	12 Å²	12	32.7 Å²	32.7	6%	0.062	16%	0.162	C	C	.	.	H	α-helix	trans	-57.7	-55.1	174	-69.9	174.5	0	0	0	110.3	G101 A104 L108 V165 T171 T172 E173	G101-I169 WeakPolarHBondContact O-CG1 3.46Å; A104-I169 HydrophobicContact CB-CD1 3.74Å; A104-I169 HydrophobicContact CB-CG1 3.77Å; L108-I169 HydrophobicContact CD1-CG2 3.59Å; V165-I169 HydrophobicContact CG1-CD1 3.57Å; V165-I169 HydrophobicContact CG1-CG1 4.15Å; V165-I169 VanDerWaalsContact O-CG1 3.3Å; V165-I169 WeakPolarHBondContact O-CG1 3.19Å; V165-I169 PolarHBondContact O-N 3.25Å; I169-T171 PolarHBondContact O-N 3.25Å; I169-T172 PolarHBondContact O-N 3.39Å; I169-E173 WeakPolarHBondContact O-CB 3.27Å; I169-E173 PolarHBondContact O-N 3.3Å
170	R	94.3	Very high	94.5	Very high	119 Å²	119	36 Å²	36	45%	0.449	18%	0.184	S	C	.	.	H	α-helix	trans	-65.7	-41.9	-174.5	-175.8	168.4	-179.6	169.8	-2	112.3	D126 L129 P166 I167 N174	D126-R170 IonicContact OD1-NH1 3.05Å; D126-R170 PolarHBondContact OD1-NH1 3.38Å; L129-R170 HydrophobicContact CD1-CB 4.21Å; L129-R170 VanDerWaalsContact CD1-CD 3.46Å; L129-R170 HydrophobicContact CD1-CG 4.49Å; P166-R170 WeakPolarHBondContact O-CB 3.29Å; P166-R170 PolarHBondContact O-N 3.45Å; P166-R170 VanDerWaalsContact O-N 3.14Å; I167-R170 PolarHBondContact O-N 3.29Å; R170-N174 WeakPolarHBondContact O-CB 3.05Å; R170-N174 PolarHBondContact O-N 2.86Å; R170-N174 PolarHBondContact O-ND2 2.99Å
171	T	94.5	Very high	94.3	Very high	29 Å²	29	39.8 Å²	39.8	18%	0.178	20%	0.204	C	C	.	.	H	α-helix	trans	-65.4	-46.3	177.3	51	0	0	0	0	110.9	I167 V168 I169 E173 N174 M175	I167-T171 HydrophobicContact CG2-CG2 4.42Å; I167-T171 WeakPolarHBondContact O-CB 3.36Å; I167-T171 VanDerWaalsContact O-CG2 3.3Å; I167-T171 WeakPolarHBondContact O-CG2 3.26Å; I167-T171 PolarHBondContact O-N 3.16Å; I167-T171 PolarHBondContact O-OG1 2.9Å; V168-T171 WeakPolarHBondContact CA-OG1 3.48Å; V168-T171 PolarHBondContact O-OG1 3.29Å; V168-T171 VanDerWaalsContact O-OG1 3.11Å; I169-T171 PolarHBondContact O-N 3.25Å; T171-E173 PolarHBondContact O-N 3.27Å; T171-N174 PolarHBondContact O-N 3.45Å; T171-M175 WeakPolarHBondContact O-CB 3.34Å; T171-M175 WeakPolarHBondContact O-CG 3.36Å; T171-M175 PolarHBondContact O-N 2.89Å
172	T	96	Very high	94.1	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-61	-46.6	177.1	-57.5	0	0	0	0	112	I102 I106 V168 I169 N174 M175 L176 I210	I102-T172 HydrophobicContact CG2-CG2 4.39Å; I106-T172 HydrophobicContact CG1-CG2 4.29Å; V168-T172 WeakPolarHBondContact O-CB 3.18Å; V168-T172 PolarHBondContact O-N 3.47Å; V168-T172 PolarHBondContact O-OG1 2.9Å; I169-T172 PolarHBondContact O-N 3.39Å; T172-N174 PolarHBondContact O-N 2.92Å; T172-M175 PolarHBondContact O-N 3Å; T172-L176 HydrophobicContact CG2-CD1 3.88Å; T172-L176 HydrophobicContact CG2-CG 4.5Å; T172-L176 WeakPolarHBondContact O-CB 3.45Å; T172-L176 WeakPolarHBondContact O-CG 3.32Å; T172-L176 PolarHBondContact O-N 3.48Å; T172-I210 HydrophobicContact CG2-CD1 4.02Å; T172-I210 HydrophobicContact CG2-CG1 4.43Å
173	E	94.7	Very high	94	Very high	12 Å²	12	43.1 Å²	43.1	6%	0.056	23%	0.226	C	C	.	.	H	α-helix	trans	-60.5	-46.7	179.2	-178.1	178.7	-166	0	0	111.7	L108 A109 R122 I169 T171 L176 K177	L108-E173 HydrophobicContact CB-CG 4.3Å; A109-E173 HydrophobicContact CB-CG 4.21Å; R122-E173 IonicContact CZ-OE1 3.33Å; R122-E173 IonicContact NE-OE1 3.95Å; R122-E173 PolarHBondContact NE-OE1 2.73Å; R122-E173 IonicContact NE-OE2 3.92Å; R122-E173 IonicContact NH2-OE1 3.78Å; R122-E173 PolarHBondContact NH2-OE1 2.72Å; I169-E173 WeakPolarHBondContact O-CB 3.27Å; I169-E173 PolarHBondContact O-N 3.3Å; T171-E173 PolarHBondContact O-N 3.27Å; E173-L176 PolarHBondContact O-N 3.33Å; E173-K177 VanDerWaalsContact CD-NZ 3.33Å; E173-K177 HydrophobicContact CG-CD 4.19Å; E173-K177 WeakPolarHBondContact O-CG 3.42Å; E173-K177 PolarHBondContact O-N 2.73Å; E173-K177 WeakPolarHBondContact OE1-CE 3.43Å; E173-K177 IonicContact OE1-NZ 3.68Å; E173-K177 PolarHBondContact OE1-NZ 3.46Å
174	N	93.9	Very high	93.9	Very high	71 Å²	71	43 Å²	43	38%	0.38	22%	0.224	S	C	.	.	H	α-helix	trans	-64.9	-43.8	-179.7	-73.4	-19.8	0	0	0	111.9	R170 T171 T172 L176 K177 L178	R170-N174 WeakPolarHBondContact O-CB 3.05Å; R170-N174 PolarHBondContact O-N 2.86Å; R170-N174 PolarHBondContact O-ND2 2.99Å; T171-N174 PolarHBondContact O-N 3.45Å; T172-N174 PolarHBondContact O-N 2.92Å; N174-L176 VanDerWaalsContact C-N 3.33Å; N174-L176 PolarHBondContact O-N 2.9Å; N174-K177 PolarHBondContact O-N 3.41Å; N174-L178 WeakPolarHBondContact O-CG 3.35Å; N174-L178 PolarHBondContact O-N 2.88Å; N174-L178 VanDerWaalsContact O-N 3.11Å
175	M	95	Very high	93.8	Very high	58 Å²	58	49.3 Å²	49.3	29%	0.286	25%	0.254	S	S	.	.	H	α-helix	trans	-65.9	-36.5	-179.8	-66.6	-60.4	116	0	0	112.1	T171 T172 L178 G209 I210	T171-M175 WeakPolarHBondContact O-CB 3.34Å; T171-M175 WeakPolarHBondContact O-CG 3.36Å; T171-M175 PolarHBondContact O-N 2.89Å; T172-M175 PolarHBondContact O-N 3Å; M175-L178 HydrophobicContact CE-CD1 3.73Å; M175-L178 PolarHBondContact O-N 3Å; M175-L178 HydrophobicContact SD-CD1 4.04Å; M175-G209 VanDerWaalsContact SD-CA 3.6Å; M175-I210 HydrophobicContact CB-CG1 3.99Å; M175-I210 HydrophobicContact CG-CG1 4.47Å
176	L	94.5	Very high	93.6	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-68	-40.7	173.6	-72.7	170	0	0	0	111.8	I106 A109 T172 E173 N174 L178 V179 R184 S206	I106-L176 HydrophobicContact CB-CD1 4.34Å; I106-L176 HydrophobicContact CG1-CD1 3.82Å; A109-L176 HydrophobicContact CB-CB 3.66Å; A109-L176 HydrophobicContact CB-CD1 3.74Å; A109-L176 HydrophobicContact CB-CG 4.37Å; T172-L176 HydrophobicContact CG2-CD1 3.88Å; T172-L176 HydrophobicContact CG2-CG 4.5Å; T172-L176 WeakPolarHBondContact O-CB 3.45Å; T172-L176 WeakPolarHBondContact O-CG 3.32Å; T172-L176 PolarHBondContact O-N 3.48Å; E173-L176 PolarHBondContact O-N 3.33Å; N174-L176 VanDerWaalsContact C-N 3.33Å; N174-L176 PolarHBondContact O-N 2.9Å; L176-L178 PolarHBondContact O-N 3.49Å; L176-V179 WeakPolarHBondContact O-CB 3.44Å; L176-V179 PolarHBondContact O-N 2.87Å; L176-V179 VanDerWaalsContact O-N 3.11Å; L176-R184 PolarHBondContact O-NH2 3.21Å; L176-S206 WeakPolarHBondContact CD2-OG 3.5Å
177	K	92	Very high	93.5	Very high	101 Å²	101	50.9 Å²	50.9	44%	0.439	27%	0.27	S	S	.	.	H	α-helix	trans	-64.6	-25.4	177.3	-75.9	177.7	-176.7	169.9	0	113.6	E173 N174 V179	E173-K177 VanDerWaalsContact CD-NZ 3.33Å; E173-K177 HydrophobicContact CG-CD 4.19Å; E173-K177 WeakPolarHBondContact O-CG 3.42Å; E173-K177 PolarHBondContact O-N 2.73Å; E173-K177 WeakPolarHBondContact OE1-CE 3.43Å; E173-K177 IonicContact OE1-NZ 3.68Å; E173-K177 PolarHBondContact OE1-NZ 3.46Å; N174-K177 PolarHBondContact O-N 3.41Å; K177-V179 VanDerWaalsContact C-N 3.28Å
178	L	92	Very high	93.4	Very high	127 Å²	127	54.5 Å²	54.5	67%	0.665	28%	0.283	S	S	*	.	H	α-helix	trans	-71.8	-21.4	174.6	-72.4	171.6	0	0	0	113.2	N174 M175 L176 P180	N174-L178 WeakPolarHBondContact O-CG 3.35Å; N174-L178 PolarHBondContact O-N 2.88Å; N174-L178 VanDerWaalsContact O-N 3.11Å; M175-L178 HydrophobicContact CE-CD1 3.73Å; M175-L178 PolarHBondContact O-N 3Å; M175-L178 HydrophobicContact SD-CD1 4.04Å; L176-L178 PolarHBondContact O-N 3.49Å; L178-P180 WeakPolarHBondContact O-CD 3.4Å
179	V	93.3	Very high	93.3	Very high	11 Å²	11	58.8 Å²	58.8	7%	0.067	32%	0.318	C	S	.	.	S	Bend	trans	-64.5	127	176	-177.4	0	0	0	0	108.6	L176 K177 L183 R184 T202 A205	L176-V179 WeakPolarHBondContact O-CB 3.44Å; L176-V179 PolarHBondContact O-N 2.87Å; L176-V179 VanDerWaalsContact O-N 3.11Å; K177-V179 VanDerWaalsContact C-N 3.28Å; V179-L183 HydrophobicContact CG1-CB 4.43Å; V179-L183 HydrophobicContact CG1-CD1 3.91Å; V179-R184 PolarHBondContact O-NH1 3.45Å; V179-T202 HydrophobicContact CG1-CG2 4.18Å; V179-A205 HydrophobicContact CG1-CB 4.39Å; V179-A205 HydrophobicContact CG2-CB 4.14Å
180	P	93	Very high	93.1	Very high	71 Å²	71	65.3 Å²	65.3	46%	0.461	35%	0.352	S	S	.	.			trans	-57	137.8	179.7	-27	34.4	0	0	0	112.8	L178 S182 L183	L178-P180 WeakPolarHBondContact O-CD 3.4Å; P180-S182 PolarHBondContact O-N 3.42Å; P180-L183 PolarHBondContact O-N 3.14Å; P180-L183 VanDerWaalsContact O-N 3.17Å
181	D	90.6	Very high	93	Very high	81 Å²	81	62.8 Å²	62.8	43%	0.433	36%	0.363	S	S	.	.	H	α-helix	trans	-64	-25.2	177.5	-76.8	-35.2	0	0	0	112.7	R113 L183 R184 E185	R113-D181 IonicContact CZ-OD1 3.45Å; R113-D181 IonicContact NH1-OD1 3.12Å; R113-D181 PolarHBondContact NH1-OD1 2.93Å; R113-D181 IonicContact NH2-OD1 2.86Å; D181-L183 PolarHBondContact O-N 3.02Å; D181-R184 WeakPolarHBondContact O-CA 3.35Å; D181-R184 WeakPolarHBondContact O-CB 3.19Å; D181-R184 PolarHBondContact O-N 3.48Å; D181-R184 IonicContact OD1-CZ 3.22Å; D181-R184 IonicContact OD1-NE 3.83Å; D181-R184 IonicContact OD1-NH1 3.53Å; D181-R184 PolarHBondContact OD1-NH1 3.38Å; D181-E185 PolarHBondContact O-N 3.36Å
182	S	93.4	Very high	92.9	Very high	76 Å²	76	62.8 Å²	62.8	53%	0.531	36%	0.364	S	S	.	.	H	α-helix	trans	-58.1	-33.7	173.7	56.7	0	0	0	0	113.5	P180 R184 A186	P180-S182 PolarHBondContact O-N 3.42Å; S182-R184 VanDerWaalsContact C-N 3.35Å; S182-A186 WeakPolarHBondContact O-CB 3.4Å; S182-A186 PolarHBondContact O-N 3.23Å
183	L	91.8	Very high	92.7	Very high	75 Å²	75	65.8 Å²	65.8	39%	0.393	38%	0.383	S	S	.	.	H	α-helix	trans	-69.4	-34.4	174.8	-69.8	177	0	0	0	111.9	V179 P180 D181 A187 I201	V179-L183 HydrophobicContact CG1-CB 4.43Å; V179-L183 HydrophobicContact CG1-CD1 3.91Å; P180-L183 PolarHBondContact O-N 3.14Å; P180-L183 VanDerWaalsContact O-N 3.17Å; D181-L183 PolarHBondContact O-N 3.02Å; L183-A187 PolarHBondContact O-N 3.43Å; L183-I201 HydrophobicContact CB-CG2 4.39Å
184	R	91.7	Very high	92.5	Very high	11 Å²	11	68.4 Å²	68.4	4%	0.042	39%	0.394	C	S	.	.	H	α-helix	trans	-68.9	-45.8	175.6	-60.3	-177.2	176.2	78.1	13.9	110.4	E110 R113 L176 V179 D181 S182 A187 Y188 M197 T202	E110-R184 IonicContact OE1-CZ 2.78Å; E110-R184 IonicContact OE1-NE 3.77Å; E110-R184 PolarHBondContact OE1-NE 2.84Å; E110-R184 IonicContact OE1-NH2 3.21Å; E110-R184 PolarHBondContact OE1-NH2 3.06Å; E110-R184 IonicContact OE2-NE 2.85Å; E110-R184 PolarHBondContact OE2-NE 2.84Å; R113-R184 VanDerWaalsContact NH2-CZ 3.26Å; L176-R184 PolarHBondContact O-NH2 3.21Å; V179-R184 PolarHBondContact O-NH1 3.45Å; D181-R184 WeakPolarHBondContact O-CA 3.35Å; D181-R184 WeakPolarHBondContact O-CB 3.19Å; D181-R184 PolarHBondContact O-N 3.48Å; D181-R184 IonicContact OD1-CZ 3.22Å; D181-R184 IonicContact OD1-NE 3.83Å; D181-R184 IonicContact OD1-NH1 3.53Å; D181-R184 PolarHBondContact OD1-NH1 3.38Å; S182-R184 VanDerWaalsContact C-N 3.35Å; R184-A187 WeakPolarHBondContact O-CB 3.46Å; R184-A187 PolarHBondContact O-N 3.02Å; R184-Y188 HydrophobicContact CB-CE2 4.42Å; R184-Y188 WeakPolarHBondContact O-CD2 3.36Å; R184-Y188 PolarHBondContact O-N 2.88Å; R184-M197 HydrophobicContact CB-SD 4.47Å; R184-M197 HydrophobicContact CG-CE 4.42Å; R184-M197 HydrophobicContact CG-SD 4.08Å; R184-T202 HydrophobicContact CG-CG2 3.97Å
185	E	91.7	Very high	92.5	Very high	134 Å²	134	72.8 Å²	72.8	63%	0.626	41%	0.406	S	S	*	.	H	α-helix	trans	-60.3	-45.3	177.5	-70.1	175.6	-175.7	0	0	111.5	D181 A187 Y188 A189	D181-E185 PolarHBondContact O-N 3.36Å; E185-A187 VanDerWaalsContact C-N 3.29Å; E185-A187 PolarHBondContact O-N 2.91Å; E185-Y188 PolarHBondContact O-N 3.33Å; E185-A189 WeakPolarHBondContact O-CB 3.43Å; E185-A189 PolarHBondContact O-N 3Å
186	A	93.3	Very high	92.4	Very high	56 Å²	56	75.3 Å²	75.3	46%	0.463	42%	0.415	S	S	.	.	H	α-helix	trans	-58.7	-40.3	175.6	0	0	0	0	0	112.3	S182 A189 L190	S182-A186 WeakPolarHBondContact O-CB 3.4Å; S182-A186 PolarHBondContact O-N 3.23Å; A186-A189 PolarHBondContact O-N 2.88Å; A186-L190 PolarHBondContact O-N 2.94Å
187	A	92	Very high	92.4	Very high	3 Å²	3	75.3 Å²	75.3	3%	0.025	42%	0.415	C	S	.	.	H	α-helix	trans	-65.6	-44.6	176.6	0	0	0	0	0	112.7	L183 R184 E185 A189 L190 T192 M197 I201	L183-A187 PolarHBondContact O-N 3.43Å; R184-A187 WeakPolarHBondContact O-CB 3.46Å; R184-A187 PolarHBondContact O-N 3.02Å; E185-A187 VanDerWaalsContact C-N 3.29Å; E185-A187 PolarHBondContact O-N 2.91Å; A187-A189 VanDerWaalsContact C-N 3.32Å; A187-L190 PolarHBondContact O-N 3.22Å; A187-T192 WeakPolarHBondContact O-CB 3.34Å; A187-T192 PolarHBondContact O-N 3.4Å; A187-T192 PolarHBondContact O-OG1 3.05Å; A187-M197 HydrophobicContact CB-CB 4.16Å; A187-M197 HydrophobicContact CB-CG 3.54Å; A187-I201 HydrophobicContact CB-CD1 3.29Å
188	Y	91.8	Very high	92.4	Very high	97 Å²	97	70.8 Å²	70.8	38%	0.38	40%	0.396	S	S	.	.	H	α-helix	trans	-67.2	-33.7	178.3	-75.3	-58.5	0	0	0	112.1	R184 E185 L190 G191 K194 M197	R184-Y188 HydrophobicContact CB-CE2 4.42Å; R184-Y188 WeakPolarHBondContact O-CD2 3.36Å; R184-Y188 PolarHBondContact O-N 2.88Å; E185-Y188 PolarHBondContact O-N 3.33Å; Y188-L190 PolarHBondContact O-N 3.46Å; Y188-G191 PolarHBondContact O-N 2.97Å; Y188-K194 HydrophobicContact CE1-CB 4.3Å; Y188-K194 WeakPolarHBondContact OH-CD 3.03Å; Y188-K194 VanDerWaalsContact OH-CG 3.3Å; Y188-K194 WeakPolarHBondContact OH-CG 3.35Å; Y188-M197 HydrophobicContact CE2-CE 3.89Å; Y188-M197 VanDerWaalsContact OH-CE 3.31Å; Y188-M197 WeakPolarHBondContact OH-CE 3.47Å
189	A	93.8	Very high	92.5	Very high	91 Å²	91	67.5 Å²	67.5	75%	0.752	38%	0.383	S	S	*	.	H	α-helix	trans	-60.8	-27.6	175	0	0	0	0	0	112.8	E185 A186 A187 G191	E185-A189 WeakPolarHBondContact O-CB 3.43Å; E185-A189 PolarHBondContact O-N 3Å; A186-A189 PolarHBondContact O-N 2.88Å; A187-A189 VanDerWaalsContact C-N 3.32Å; A189-G191 PolarHBondContact O-N 3.11Å
190	L	92.8	Very high	92.5	Very high	148 Å²	148	69.4 Å²	69.4	78%	0.775	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.1	4.9	173.8	-62.2	174.2	0	0	0	113.6	A186 A187 Y188 T192	A186-L190 PolarHBondContact O-N 2.94Å; A187-L190 PolarHBondContact O-N 3.22Å; Y188-L190 PolarHBondContact O-N 3.46Å; L190-T192 VanDerWaalsContact C-N 3.28Å; L190-T192 PolarHBondContact O-N 3.44Å
191	G	91.3	Very high	92.5	Very high	66 Å²	66	68.5 Å²	68.5	68%	0.68	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	73	18.2	-175.7	0	0	0	0	0	113.8	Y188 A189	Y188-G191 PolarHBondContact O-N 2.97Å; A189-G191 PolarHBondContact O-N 3.11Å
192	T	92.1	Very high	92.6	Very high	30 Å²	30	64.7 Å²	64.7	18%	0.184	37%	0.37	C	S	.	.			trans	-68.6	128.3	-177.8	-51.7	0	0	0	0	110.6	A187 L190 K196 M197	A187-T192 WeakPolarHBondContact O-CB 3.34Å; A187-T192 PolarHBondContact O-N 3.4Å; A187-T192 PolarHBondContact O-OG1 3.05Å; L190-T192 VanDerWaalsContact C-N 3.28Å; L190-T192 PolarHBondContact O-N 3.44Å; T192-K196 HydrophobicContact CG2-CB 3.78Å; T192-K196 HydrophobicContact CG2-CD 4.42Å; T192-K196 HydrophobicContact CG2-CG 4.02Å; T192-M197 HydrophobicContact CG2-CB 4.28Å
193	P	92.4	Very high	92.7	Very high	63 Å²	63	63.2 Å²	63.2	41%	0.409	36%	0.356	S	S	.	.			trans	-67.5	147.8	174.7	27.8	-33.8	0	0	0	110.9	W195 K196 M197	P193-W195 VanDerWaalsContact C-N 3.32Å; P193-W195 PolarHBondContact O-N 3.26Å; P193-W195 VanDerWaalsContact O-N 3.17Å; P193-K196 HydrophobicContact CG-CB 3.93Å; P193-K196 WeakPolarHBondContact O-CA 3.26Å; P193-K196 PolarHBondContact O-N 3.4Å; P193-M197 PolarHBondContact O-N 2.81Å
194	K	91.1	Very high	92.8	Very high	66 Å²	66	67.2 Å²	67.2	29%	0.287	37%	0.371	S	S	.	.	H	α-helix	trans	-52.3	-42.7	-172.1	-175.7	163.8	-175.7	174.9	0	114.1	E110 Y111 Y188 K196 M197 I198	E110-K194 WeakPolarHBondContact O-CE 3.31Å; E110-K194 PolarHBondContact O-NZ 3.41Å; Y111-K194 HydrophobicContact CD1-CD 4.18Å; Y111-K194 HydrophobicContact CE1-CD 3.73Å; Y111-K194 HydrophobicContact CE1-CG 4.16Å; Y188-K194 HydrophobicContact CE1-CB 4.3Å; Y188-K194 WeakPolarHBondContact OH-CD 3.03Å; Y188-K194 VanDerWaalsContact OH-CG 3.3Å; Y188-K194 WeakPolarHBondContact OH-CG 3.35Å; K194-K196 VanDerWaalsContact C-N 3.27Å; K194-K196 PolarHBondContact O-N 3.32Å; K194-M197 HydrophobicContact CG-CE 4.36Å; K194-M197 PolarHBondContact O-N 2.83Å; K194-I198 HydrophobicContact CG-CD1 3.94Å; K194-I198 HydrophobicContact CG-CG1 4.47Å; K194-I198 VanDerWaalsContact O-CG1 3.23Å; K194-I198 WeakPolarHBondContact O-CG1 3.45Å; K194-I198 PolarHBondContact O-N 3.39Å
195	W	92.3	Very high	92.9	Very high	164 Å²	164	69.8 Å²	69.8	62%	0.621	39%	0.394	S	S	*	.	H	α-helix	trans	-62.4	-33.6	178.2	72.6	-96.1	0	0	0	112.9	P193 S199	P193-W195 VanDerWaalsContact C-N 3.32Å; P193-W195 PolarHBondContact O-N 3.26Å; P193-W195 VanDerWaalsContact O-N 3.17Å; W195-S199 WeakPolarHBondContact O-CB 3.15Å; W195-S199 PolarHBondContact O-N 2.96Å; W195-S199 PolarHBondContact O-OG 3.36Å
196	K	93.7	Very high	93	Very high	110 Å²	110	63.7 Å²	63.7	48%	0.478	37%	0.366	S	S	.	.	H	α-helix	trans	-80.2	-35.7	179	-167	168.6	-173.4	175.4	0	111.3	T192 P193 K194 I198 S199 A200	T192-K196 HydrophobicContact CG2-CB 3.78Å; T192-K196 HydrophobicContact CG2-CD 4.42Å; T192-K196 HydrophobicContact CG2-CG 4.02Å; P193-K196 HydrophobicContact CG-CB 3.93Å; P193-K196 WeakPolarHBondContact O-CA 3.26Å; P193-K196 PolarHBondContact O-N 3.4Å; K194-K196 VanDerWaalsContact C-N 3.27Å; K194-K196 PolarHBondContact O-N 3.32Å; K196-I198 VanDerWaalsContact C-N 3.3Å; K196-I198 PolarHBondContact O-N 3.26Å; K196-S199 WeakPolarHBondContact CA-OG 3.41Å; K196-S199 PolarHBondContact O-OG 2.88Å; K196-A200 WeakPolarHBondContact O-CB 3.5Å; K196-A200 PolarHBondContact O-N 3.43Å
197	M	93.6	Very high	93.1	Very high	0 Å²	0	64.4 Å²	64.4	0%	0	36%	0.364	C	S	.	.	H	α-helix	trans	-58.3	-45.2	168.4	179.2	-79.3	-72.8	0	0	110.5	R184 A187 Y188 T192 P193 K194 I201 T202	R184-M197 HydrophobicContact CB-SD 4.47Å; R184-M197 HydrophobicContact CG-CE 4.42Å; R184-M197 HydrophobicContact CG-SD 4.08Å; A187-M197 HydrophobicContact CB-CB 4.16Å; A187-M197 HydrophobicContact CB-CG 3.54Å; Y188-M197 HydrophobicContact CE2-CE 3.89Å; Y188-M197 VanDerWaalsContact OH-CE 3.31Å; Y188-M197 WeakPolarHBondContact OH-CE 3.47Å; T192-M197 HydrophobicContact CG2-CB 4.28Å; P193-M197 PolarHBondContact O-N 2.81Å; K194-M197 HydrophobicContact CG-CE 4.36Å; K194-M197 PolarHBondContact O-N 2.83Å; M197-I201 WeakPolarHBondContact O-CA 3.27Å; M197-I201 VanDerWaalsContact O-CB 3.28Å; M197-I201 WeakPolarHBondContact O-CB 3.26Å; M197-I201 PolarHBondContact O-N 2.86Å; M197-T202 PolarHBondContact O-N 2.89Å; M197-T202 HydrophobicContact SD-CG2 3.47Å; M197-T202 WeakPolarHBondContact SD-CG2 3.4Å
198	I	93.7	Very high	93.2	Very high	7 Å²	7	68.8 Å²	68.8	4%	0.036	40%	0.395	C	S	.	.	I	π-helix	trans	-64.6	-56.1	179.6	-66.1	168.7	0	0	0	111.3	I106 E110 Y111 K194 K196 T202 L203	I106-I198 HydrophobicContact CG2-CD1 4.26Å; I106-I198 HydrophobicContact CG2-CG2 3.73Å; E110-I198 HydrophobicContact CB-CD1 3.62Å; E110-I198 HydrophobicContact CB-CG1 4.15Å; E110-I198 HydrophobicContact CG-CD1 3.93Å; E110-I198 HydrophobicContact CG-CG1 3.91Å; Y111-I198 HydrophobicContact CD2-CD1 4.25Å; Y111-I198 HydrophobicContact CE2-CD1 3.38Å; K194-I198 HydrophobicContact CG-CD1 3.94Å; K194-I198 HydrophobicContact CG-CG1 4.47Å; K194-I198 VanDerWaalsContact O-CG1 3.23Å; K194-I198 WeakPolarHBondContact O-CG1 3.45Å; K194-I198 PolarHBondContact O-N 3.39Å; K196-I198 VanDerWaalsContact C-N 3.3Å; K196-I198 PolarHBondContact O-N 3.26Å; I198-T202 WeakPolarHBondContact CA-OG1 3.27Å; I198-T202 PolarHBondContact O-N 3.41Å; I198-T202 PolarHBondContact O-OG1 3.4Å; I198-L203 WeakPolarHBondContact O-CB 3.43Å; I198-L203 PolarHBondContact O-N 2.83Å
199	S	93.8	Very high	93.2	Very high	57 Å²	57	65.1 Å²	65.1	40%	0.399	39%	0.387	S	S	.	.	I	π-helix	trans	-66.7	-40.6	-174.6	51.2	0	0	0	0	113.5	W195 K196	W195-S199 WeakPolarHBondContact O-CB 3.15Å; W195-S199 PolarHBondContact O-N 2.96Å; W195-S199 PolarHBondContact O-OG 3.36Å; K196-S199 WeakPolarHBondContact CA-OG 3.41Å; K196-S199 PolarHBondContact O-OG 2.88Å
200	A	93.1	Very high	93.3	Very high	51 Å²	51	61.2 Å²	61.2	42%	0.421	35%	0.353	S	S	.	.	I	π-helix	trans	-90.6	-23.4	-173.1	0	0	0	0	0	114.3	K196 K204	K196-A200 WeakPolarHBondContact O-CB 3.5Å; K196-A200 PolarHBondContact O-N 3.43Å; A200-K204 WeakPolarHBondContact O-CB 3.22Å
201	I	93.3	Very high	93.5	Very high	53 Å²	53	58.9 Å²	58.9	27%	0.272	34%	0.34	S	S	.	.	I	π-helix	trans	-119	-69	-172	-55.2	170.9	0	0	0	111	L183 A187 M197 K204 A205	L183-I201 HydrophobicContact CB-CG2 4.39Å; A187-I201 HydrophobicContact CB-CD1 3.29Å; M197-I201 WeakPolarHBondContact O-CA 3.27Å; M197-I201 VanDerWaalsContact O-CB 3.28Å; M197-I201 WeakPolarHBondContact O-CB 3.26Å; M197-I201 PolarHBondContact O-N 2.86Å; I201-K204 PolarHBondContact O-N 3.02Å; I201-A205 VanDerWaalsContact O-CB 3.26Å; I201-A205 WeakPolarHBondContact O-CB 3.36Å; I201-A205 PolarHBondContact O-N 3.41Å
202	T	93.2	Very high	93.6	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	33%	0.329	C	S	.	.	I	π-helix	trans	-69.5	-45.2	-171.1	60.5	0	0	0	0	111.8	V179 R184 M197 I198 A205 S206	V179-T202 HydrophobicContact CG1-CG2 4.18Å; R184-T202 HydrophobicContact CG-CG2 3.97Å; M197-T202 PolarHBondContact O-N 2.89Å; M197-T202 HydrophobicContact SD-CG2 3.47Å; M197-T202 WeakPolarHBondContact SD-CG2 3.4Å; I198-T202 WeakPolarHBondContact CA-OG1 3.27Å; I198-T202 PolarHBondContact O-N 3.41Å; I198-T202 PolarHBondContact O-OG1 3.4Å; T202-A205 PolarHBondContact O-N 2.98Å; T202-S206 WeakPolarHBondContact O-CB 3.16Å; T202-S206 PolarHBondContact O-N 3.41Å; T202-S206 PolarHBondContact O-OG 2.9Å
203	L	94.1	Very high	93.6	Very high	46 Å²	46	58 Å²	58	24%	0.241	32%	0.322	C	S	.	.	H	α-helix	trans	-60	-51.9	175.9	-166.7	70.4	0	0	0	109.4	I106 I198 A205 S206 V207 I210	I106-L203 HydrophobicContact CD1-CD1 4.05Å; I106-L203 HydrophobicContact CG1-CD1 4.42Å; I198-L203 WeakPolarHBondContact O-CB 3.43Å; I198-L203 PolarHBondContact O-N 2.83Å; L203-A205 VanDerWaalsContact C-N 3.31Å; L203-A205 PolarHBondContact O-N 2.86Å; L203-S206 WeakPolarHBondContact CA-OG 3.43Å; L203-S206 CarbonylContact O-C 3.48Å; L203-S206 PolarHBondContact O-N 3.14Å; L203-S206 PolarHBondContact O-OG 3.14Å; L203-V207 VanDerWaalsContact O-CG2 3.29Å; L203-V207 WeakPolarHBondContact O-CG2 3.39Å; L203-V207 PolarHBondContact O-N 3.48Å; L203-I210 HydrophobicContact CD1-CD1 3.63Å
204	K	94	Very high	93.8	Very high	159 Å²	159	55.7 Å²	55.7	69%	0.691	31%	0.306	S	S	*	.	H	α-helix	trans	-56.1	-41	178.5	-169.4	175.3	-178.3	179	0	113.4	A200 I201 S206	A200-K204 WeakPolarHBondContact O-CB 3.22Å; I201-K204 PolarHBondContact O-N 3.02Å; K204-S206 VanDerWaalsContact C-N 3.32Å
205	A	93.5	Very high	94	Very high	64 Å²	64	57.8 Å²	57.8	53%	0.529	32%	0.32	S	S	.	.	H	α-helix	trans	-68.1	-32.6	177	0	0	0	0	0	112.6	V179 I201 T202 L203	V179-A205 HydrophobicContact CG1-CB 4.39Å; V179-A205 HydrophobicContact CG2-CB 4.14Å; I201-A205 VanDerWaalsContact O-CB 3.26Å; I201-A205 WeakPolarHBondContact O-CB 3.36Å; I201-A205 PolarHBondContact O-N 3.41Å; T202-A205 PolarHBondContact O-N 2.98Å; L203-A205 VanDerWaalsContact C-N 3.31Å; L203-A205 PolarHBondContact O-N 2.86Å
206	S	95.5	Very high	94	Very high	7 Å²	7	55.2 Å²	55.2	5%	0.049	32%	0.318	C	S	.	.	H	α-helix	trans	-92.6	-8.1	-178.5	65.8	0	0	0	0	115.1	L176 T202 L203 K204 S208 G209 I210	L176-S206 WeakPolarHBondContact CD2-OG 3.5Å; T202-S206 WeakPolarHBondContact O-CB 3.16Å; T202-S206 PolarHBondContact O-N 3.41Å; T202-S206 PolarHBondContact O-OG 2.9Å; L203-S206 WeakPolarHBondContact CA-OG 3.43Å; L203-S206 CarbonylContact O-C 3.48Å; L203-S206 PolarHBondContact O-N 3.14Å; L203-S206 PolarHBondContact O-OG 3.14Å; K204-S206 VanDerWaalsContact C-N 3.32Å; S206-S208 VanDerWaalsContact C-N 3.28Å; S206-S208 PolarHBondContact O-N 3.24Å; S206-S208 VanDerWaalsContact O-N 3.15Å; S206-G209 PolarHBondContact O-N 3.25Å; S206-I210 WeakPolarHBondContact O-CG1 3.39Å; S206-I210 PolarHBondContact O-N 3.24Å; S206-I210 WeakPolarHBondContact OG-CD1 3.46Å
207	V	94.9	Very high	94.1	Very high	70 Å²	70	50 Å²	50	42%	0.424	30%	0.295	S	S	.	.	H	α-helix	trans	-50.9	-44.8	-172.5	157.8	0	0	0	0	112.2	L203 G209 I210 M211	L203-V207 VanDerWaalsContact O-CG2 3.29Å; L203-V207 WeakPolarHBondContact O-CG2 3.39Å; L203-V207 PolarHBondContact O-N 3.48Å; V207-G209 VanDerWaalsContact C-N 3.3Å; V207-G209 PolarHBondContact O-N 2.62Å; V207-I210 PolarHBondContact O-N 2.98Å; V207-M211 HydrophobicContact CG1-CG 4.08Å; V207-M211 WeakPolarHBondContact O-CB 3.14Å; V207-M211 VanDerWaalsContact O-CG 3.25Å; V207-M211 WeakPolarHBondContact O-CG 3.49Å; V207-M211 PolarHBondContact O-N 3.43Å
208	S	93	Very high	94.2	Very high	95 Å²	95	52 Å²	52	66%	0.664	31%	0.306	S	S	*	.	H	α-helix	trans	-58.9	-43.9	-179.9	-171.3	0	0	0	0	111.7	S206 T212	S206-S208 VanDerWaalsContact C-N 3.28Å; S206-S208 PolarHBondContact O-N 3.24Å; S206-S208 VanDerWaalsContact O-N 3.15Å; S208-T212 PolarHBondContact O-N 3.21Å; S208-T212 VanDerWaalsContact O-N 3.14Å; S208-T212 PolarHBondContact O-OG1 3.3Å; S208-T212 VanDerWaalsContact O-OG1 3.04Å
209	G	93.1	Very high	94.2	Very high	21 Å²	21	54.9 Å²	54.9	22%	0.216	33%	0.33	C	S	.	.	H	α-helix	trans	-71.1	-39	179	0	0	0	0	0	112.8	M175 S206 V207 T212 G213	M175-G209 VanDerWaalsContact SD-CA 3.6Å; S206-G209 PolarHBondContact O-N 3.25Å; V207-G209 VanDerWaalsContact C-N 3.3Å; V207-G209 PolarHBondContact O-N 2.62Å; G209-T212 PolarHBondContact O-N 3.02Å; G209-G213 PolarHBondContact O-N 2.97Å
210	I	95.6	Very high	94.1	Very high	8 Å²	8	57.5 Å²	57.5	4%	0.041	33%	0.331	C	S	.	.	H	α-helix	trans	-63.7	-44.8	176.4	-64.9	174.3	0	0	0	110.2	I102 T172 M175 L203 S206 V207 T212 G213 I214	I102-I210 HydrophobicContact CD1-CG2 4.5Å; I102-I210 HydrophobicContact CG1-CG2 4.39Å; T172-I210 HydrophobicContact CG2-CD1 4.02Å; T172-I210 HydrophobicContact CG2-CG1 4.43Å; M175-I210 HydrophobicContact CB-CG1 3.99Å; M175-I210 HydrophobicContact CG-CG1 4.47Å; L203-I210 HydrophobicContact CD1-CD1 3.63Å; S206-I210 WeakPolarHBondContact O-CG1 3.39Å; S206-I210 PolarHBondContact O-N 3.24Å; S206-I210 WeakPolarHBondContact OG-CD1 3.46Å; V207-I210 PolarHBondContact O-N 2.98Å; I210-T212 VanDerWaalsContact C-N 3.35Å; I210-T212 PolarHBondContact O-N 3.02Å; I210-G213 CarbonylContact O-C 3.45Å; I210-G213 WeakPolarHBondContact O-CA 3.25Å; I210-G213 PolarHBondContact O-N 3.26Å; I210-I214 HydrophobicContact CG2-CD1 3.82Å; I210-I214 HydrophobicContact CG2-CG1 4.38Å; I210-I214 WeakPolarHBondContact O-CG1 3.38Å; I210-I214 PolarHBondContact O-N 3.25Å
211	M	95.8	Very high	94.2	Very high	99 Å²	99	55.1 Å²	55.1	49%	0.488	31%	0.312	S	S	.	.	H	α-helix	trans	-61.4	-41.8	177.5	-73.5	-57.1	-58.1	0	0	112.1	V207 G213 I214 L215	V207-M211 HydrophobicContact CG1-CG 4.08Å; V207-M211 WeakPolarHBondContact O-CB 3.14Å; V207-M211 VanDerWaalsContact O-CG 3.25Å; V207-M211 WeakPolarHBondContact O-CG 3.49Å; V207-M211 PolarHBondContact O-N 3.43Å; M211-G213 VanDerWaalsContact C-N 3.31Å; M211-G213 PolarHBondContact O-N 3.36Å; M211-I214 PolarHBondContact O-N 3.44Å; M211-I214 HydrophobicContact SD-CD1 4.16Å; M211-L215 WeakPolarHBondContact O-CG 3.35Å; M211-L215 PolarHBondContact O-N 3.42Å
212	T	93.4	Very high	94.2	Very high	75 Å²	75	54.4 Å²	54.4	46%	0.46	31%	0.313	S	S	.	.	H	α-helix	trans	-60.3	-42.7	171.9	-56.2	0	0	0	0	111.4	S208 G209 I210 I214 L215 L216	S208-T212 PolarHBondContact O-N 3.21Å; S208-T212 VanDerWaalsContact O-N 3.14Å; S208-T212 PolarHBondContact O-OG1 3.3Å; S208-T212 VanDerWaalsContact O-OG1 3.04Å; G209-T212 PolarHBondContact O-N 3.02Å; I210-T212 VanDerWaalsContact C-N 3.35Å; I210-T212 PolarHBondContact O-N 3.02Å; T212-I214 PolarHBondContact O-N 3.34Å; T212-L215 PolarHBondContact O-N 3.13Å; T212-L216 HydrophobicContact CG2-CD1 4.31Å; T212-L216 WeakPolarHBondContact O-CG 3.4Å; T212-L216 PolarHBondContact O-N 3.11Å
213	G	93.4	Very high	93.9	Very high	4 Å²	4	57 Å²	57	4%	0.041	34%	0.34	C	S	.	.	H	α-helix	trans	-60	-42.2	175.6	0	0	0	0	0	113.5	G209 I210 M211 L216 A217	G209-G213 PolarHBondContact O-N 2.97Å; I210-G213 CarbonylContact O-C 3.45Å; I210-G213 WeakPolarHBondContact O-CA 3.25Å; I210-G213 PolarHBondContact O-N 3.26Å; M211-G213 VanDerWaalsContact C-N 3.31Å; M211-G213 PolarHBondContact O-N 3.36Å; G213-L216 PolarHBondContact O-N 2.99Å; G213-A217 WeakPolarHBondContact O-CB 3.38Å; G213-A217 PolarHBondContact O-N 3.49Å
214	I	96.1	Very high	93.7	Very high	14 Å²	14	56.2 Å²	56.2	7%	0.072	34%	0.335	C	S	.	.	H	α-helix	trans	-65.6	-45.5	176.8	-66.3	163.3	0	0	0	110.7	T98 I102 V168 I210 M211 T212 L216 A217 I218	T98-I214 HydrophobicContact CG2-CD1 3.68Å; T98-I214 HydrophobicContact CG2-CG1 3.87Å; T98-I214 HydrophobicContact CG2-CG2 4.08Å; I102-I214 HydrophobicContact CD1-CD1 3.91Å; I102-I214 HydrophobicContact CG1-CD1 4.48Å; V168-I214 HydrophobicContact CG1-CG1 4.33Å; I210-I214 HydrophobicContact CG2-CD1 3.82Å; I210-I214 HydrophobicContact CG2-CG1 4.38Å; I210-I214 WeakPolarHBondContact O-CG1 3.38Å; I210-I214 PolarHBondContact O-N 3.25Å; M211-I214 PolarHBondContact O-N 3.44Å; M211-I214 HydrophobicContact SD-CD1 4.16Å; T212-I214 PolarHBondContact O-N 3.34Å; I214-L216 VanDerWaalsContact C-N 3.3Å; I214-L216 PolarHBondContact O-N 2.85Å; I214-A217 WeakPolarHBondContact O-CB 3.36Å; I214-A217 PolarHBondContact O-N 3.19Å; I214-A217 VanDerWaalsContact O-N 3.08Å; I214-I218 HydrophobicContact CG2-CD1 3.81Å; I214-I218 HydrophobicContact CG2-CG1 4.31Å; I214-I218 WeakPolarHBondContact O-CG1 3.33Å; I214-I218 PolarHBondContact O-N 3.4Å
215	L	95.8	Very high	93.4	Very high	109 Å²	109	50.5 Å²	50.5	57%	0.571	31%	0.313	S	S	*	.	H	α-helix	trans	-58.7	-42.6	176.9	-76.3	167	0	0	0	111.6	M211 T212 A217 I218 A219	M211-L215 WeakPolarHBondContact O-CG 3.35Å; M211-L215 PolarHBondContact O-N 3.42Å; T212-L215 PolarHBondContact O-N 3.13Å; L215-A217 VanDerWaalsContact C-N 3.34Å; L215-I218 PolarHBondContact O-N 2.94Å; L215-A219 VanDerWaalsContact O-CB 3.29Å; L215-A219 WeakPolarHBondContact O-CB 3.44Å; L215-A219 PolarHBondContact O-N 3.48Å
216	L	92.3	Very high	93.3	Very high	111 Å²	111	48.6 Å²	48.6	58%	0.581	30%	0.298	S	S	*	.	H	α-helix	trans	-64.5	-38.5	174.7	-69.4	172.4	0	0	0	112.1	T212 G213 I214 R220	T212-L216 HydrophobicContact CG2-CD1 4.31Å; T212-L216 WeakPolarHBondContact O-CG 3.4Å; T212-L216 PolarHBondContact O-N 3.11Å; G213-L216 PolarHBondContact O-N 2.99Å; I214-L216 VanDerWaalsContact C-N 3.3Å; I214-L216 PolarHBondContact O-N 2.85Å; L216-R220 WeakPolarHBondContact O-CB 3.25Å; L216-R220 PolarHBondContact O-N 2.98Å
217	A	94.5	Very high	93.1	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-65.6	-43.7	176.4	0	0	0	0	0	111.8	Q164 I167 V168 G213 I214 L215 R220 I221	Q164-A217 HydrophobicContact CG-CB 3.81Å; I167-A217 HydrophobicContact CB-CB 3.97Å; I167-A217 HydrophobicContact CD1-CB 4.4Å; I167-A217 HydrophobicContact CG2-CB 3.72Å; V168-A217 HydrophobicContact CG2-CB 3.83Å; G213-A217 WeakPolarHBondContact O-CB 3.38Å; G213-A217 PolarHBondContact O-N 3.49Å; I214-A217 WeakPolarHBondContact O-CB 3.36Å; I214-A217 PolarHBondContact O-N 3.19Å; I214-A217 VanDerWaalsContact O-N 3.08Å; L215-A217 VanDerWaalsContact C-N 3.34Å; A217-R220 PolarHBondContact O-N 3.07Å; A217-I221 PolarHBondContact O-N 3.18Å; A217-I221 VanDerWaalsContact O-N 3.09Å
218	I	96.3	Very high	93.1	Very high	43 Å²	43	45.1 Å²	45.1	22%	0.221	28%	0.277	C	S	.	.	H	α-helix	trans	-61.6	-49.3	174.7	-68	170.9	0	0	0	110.5	I90 T94 I214 L215 R220 I221 A222	I90-I218 HydrophobicContact CG2-CG2 3.77Å; T94-I218 HydrophobicContact CG2-CD1 3.81Å; T94-I218 HydrophobicContact CG2-CG1 4.17Å; I214-I218 HydrophobicContact CG2-CD1 3.81Å; I214-I218 HydrophobicContact CG2-CG1 4.31Å; I214-I218 WeakPolarHBondContact O-CG1 3.33Å; I214-I218 PolarHBondContact O-N 3.4Å; L215-I218 PolarHBondContact O-N 2.94Å; I218-R220 PolarHBondContact O-N 2.92Å; I218-I221 VanDerWaalsContact O-CG1 3.28Å; I218-I221 WeakPolarHBondContact O-CG1 3.22Å; I218-I221 PolarHBondContact O-N 3.02Å; I218-A222 WeakPolarHBondContact O-CB 3.41Å; I218-A222 PolarHBondContact O-N 2.93Å
219	A	93.5	Very high	92.9	Very high	67 Å²	67	43 Å²	43	55%	0.554	26%	0.257	S	S	*	.	H	α-helix	trans	-58.4	-37.1	179.4	0	0	0	0	0	111.8	L215	L215-A219 VanDerWaalsContact O-CB 3.29Å; L215-A219 WeakPolarHBondContact O-CB 3.44Å; L215-A219 PolarHBondContact O-N 3.48Å
220	R	92.3	Very high	92.8	Very high	111 Å²	111	45 Å²	45	42%	0.419	26%	0.26	S	S	.	.	H	α-helix	trans	-65.6	-56	175.1	-178.5	161.1	174.5	177.9	-1.2	111.8	I167 L216 A217 I218 A222 G223 E224	I167-R220 HydrophobicContact CD1-CB 4.37Å; I167-R220 HydrophobicContact CD1-CG 4.34Å; L216-R220 WeakPolarHBondContact O-CB 3.25Å; L216-R220 PolarHBondContact O-N 2.98Å; A217-R220 PolarHBondContact O-N 3.07Å; I218-R220 PolarHBondContact O-N 2.92Å; R220-A222 PolarHBondContact O-N 3.38Å; R220-G223 PolarHBondContact O-N 2.95Å; R220-G223 VanDerWaalsContact O-N 3.11Å; R220-E224 IonicContact NE-OE1 3.51Å; R220-E224 WeakPolarHBondContact O-CG 3.09Å
221	I	93.8	Very high	92.7	Very high	2 Å²	2	44.6 Å²	44.6	1%	0.01	26%	0.258	C	S	.	.	H	α-helix	trans	-64.9	-26.9	-176.4	63.7	169	0	0	0	113.1	A93 L160 L163 Q164 A217 I218 G223 E224	A93-I221 HydrophobicContact CB-CD1 3.96Å; L160-I221 HydrophobicContact CB-CB 4.44Å; L160-I221 HydrophobicContact CB-CD1 4.47Å; L160-I221 HydrophobicContact CD2-CB 4.22Å; L163-I221 HydrophobicContact CB-CG2 4.18Å; Q164-I221 HydrophobicContact CB-CD1 4.29Å; Q164-I221 HydrophobicContact CB-CG2 3.96Å; Q164-I221 HydrophobicContact CG-CD1 4.2Å; Q164-I221 HydrophobicContact CG-CG2 4.43Å; A217-I221 PolarHBondContact O-N 3.18Å; A217-I221 VanDerWaalsContact O-N 3.09Å; I218-I221 VanDerWaalsContact O-CG1 3.28Å; I218-I221 WeakPolarHBondContact O-CG1 3.22Å; I218-I221 PolarHBondContact O-N 3.02Å; I221-G223 PolarHBondContact O-N 3.39Å; I221-E224 PolarHBondContact O-N 2.69Å
222	A	93.3	Very high	92.3	Very high	37 Å²	37	39.9 Å²	39.9	31%	0.306	24%	0.235	S	C	.	.	H	α-helix	trans	-62.5	-25	176.5	0	0	0	0	0	113.2	I90 I218 R220 P250	I90-A222 HydrophobicContact CD1-CB 3.54Å; I90-A222 HydrophobicContact CG1-CB 4.29Å; I218-A222 WeakPolarHBondContact O-CB 3.41Å; I218-A222 PolarHBondContact O-N 2.93Å; R220-A222 PolarHBondContact O-N 3.38Å; A222-P250 WeakPolarHBondContact O-CG 3.16Å
223	G	88.4	Confident	91.7	Very high	54 Å²	54	38.9 Å²	38.9	56%	0.557	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-103.3	3.8	179.9	0	0	0	0	0	115.1	R220 I221 T225	R220-G223 PolarHBondContact O-N 2.95Å; R220-G223 VanDerWaalsContact O-N 3.11Å; I221-G223 PolarHBondContact O-N 3.39Å; G223-T225 PolarHBondContact O-N 2.98Å
224	E	90.5	Very high	91.1	Very high	30 Å²	30	39 Å²	39	14%	0.14	23%	0.227	C	C	.	.			trans	-83.4	101.9	-175.3	-69.6	-73.4	174.9	0	0	111.5	S133 L160 L163 R220 I221 P227	S133-E224 WeakPolarHBondContact CB-OE2 3.45Å; S133-E224 PolarHBondContact OG-OE2 3.44Å; L160-E224 HydrophobicContact CD2-CB 4.24Å; L163-E224 HydrophobicContact CD1-CB 4.45Å; L163-E224 HydrophobicContact CD1-CG 4.19Å; R220-E224 IonicContact NE-OE1 3.51Å; R220-E224 WeakPolarHBondContact O-CG 3.09Å; I221-E224 PolarHBondContact O-N 2.69Å; E224-P227 HydrophobicContact CB-CG 3.93Å
225	T	87.7	Confident	90.4	Very high	39 Å²	39	40 Å²	40	24%	0.239	23%	0.232	C	C	.	.			trans	-79.6	-44.8	179	-51.1	0	0	0	0	113.2	G223 L228 L229 P250 V251 F254	G223-T225 PolarHBondContact O-N 2.98Å; T225-L228 PolarHBondContact O-N 3.5Å; T225-L229 HydrophobicContact CG2-CD1 4.28Å; T225-L229 HydrophobicContact CG2-CG 4.3Å; T225-L229 PolarHBondContact O-N 3.35Å; T225-P250 HydrophobicContact CG2-CB 4.33Å; T225-P250 VanDerWaalsContact OG1-CB 3.23Å; T225-P250 WeakPolarHBondContact OG1-CB 3.34Å; T225-V251 HydrophobicContact CG2-CG2 4.01Å; T225-F254 HydrophobicContact CG2-CB 3.81Å; T225-F254 HydrophobicContact CG2-CG 4.16Å
226	A	89.7	Confident	89.5	Confident	25 Å²	25	38.4 Å²	38.4	21%	0.207	22%	0.222	C	C	.	.	H	α-helix	trans	-55.3	-51.4	-170.4	0	0	0	0	0	114.2	I134 L228 L229 F230	I134-A226 HydrophobicContact CB-CB 4.08Å; I134-A226 HydrophobicContact CG1-CB 4.49Å; A226-L228 VanDerWaalsContact C-N 3.28Å; A226-L228 PolarHBondContact O-N 3.4Å; A226-L229 PolarHBondContact O-N 3.01Å; A226-F230 VanDerWaalsContact O-CD2 3.22Å; A226-F230 WeakPolarHBondContact O-CD2 3.4Å
227	P	92.7	Very high	89	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-63.2	-33.8	-179.9	24.7	-35.5	0	0	0	113	A159 L160 L163 E224 L229 F230 T231	A159-P227 HydrophobicContact CB-CB 3.99Å; L160-P227 HydrophobicContact CD2-CG 4.38Å; L163-P227 HydrophobicContact CD1-CB 4.35Å; L163-P227 HydrophobicContact CD1-CG 3.79Å; E224-P227 HydrophobicContact CB-CG 3.93Å; P227-L229 VanDerWaalsContact C-N 3.35Å; P227-L229 PolarHBondContact O-N 2.9Å; P227-F230 PolarHBondContact O-N 2.75Å; P227-T231 WeakPolarHBondContact O-CB 3.19Å; P227-T231 WeakPolarHBondContact O-CG2 3.27Å; P227-T231 PolarHBondContact O-N 3.39Å; P227-T231 PolarHBondContact O-OG1 3.47Å
228	L	93.8	Very high	88.5	Confident	4 Å²	4	47.2 Å²	47.2	2%	0.021	25%	0.252	C	S	.	.	H	α-helix	trans	-71.4	-29	-178.2	-63.5	-178.2	0	0	0	112.8	L89 L160 T225 A226 F230 T231 A232 L233 N248 V251	L89-L228 HydrophobicContact CD1-CD1 4.3Å; L89-L228 HydrophobicContact CD1-CD2 4.19Å; L160-L228 HydrophobicContact CD1-CD2 4.07Å; L160-L228 HydrophobicContact CD2-CD2 4.16Å; L160-L228 HydrophobicContact CD2-CG 4.31Å; L160-L228 HydrophobicContact CG-CD2 3.98Å; T225-L228 PolarHBondContact O-N 3.5Å; A226-L228 VanDerWaalsContact C-N 3.28Å; A226-L228 PolarHBondContact O-N 3.4Å; L228-F230 PolarHBondContact O-N 2.97Å; L228-T231 WeakPolarHBondContact CA-OG1 3.41Å; L228-T231 PolarHBondContact O-N 3.14Å; L228-A232 HydrophobicContact CD2-CB 4.22Å; L228-A232 PolarHBondContact O-N 3.3Å; L228-L233 WeakPolarHBondContact O-CA 3.4Å; L228-L233 PolarHBondContact O-N 2.96Å; L228-N248 HydrophobicContact CD1-CB 4.25Å; L228-N248 WeakPolarHBondContact CD1-OD1 3.46Å; L228-V251 HydrophobicContact CB-CG2 3.81Å
229	L	89.1	Confident	87.8	Confident	49 Å²	49	46.7 Å²	46.7	26%	0.257	25%	0.252	S	S	.	.	H	α-helix	trans	-60	-31.6	173	-72.4	172.5	0	0	0	112.6	T225 A226 P227 V251 F254	T225-L229 HydrophobicContact CG2-CD1 4.28Å; T225-L229 HydrophobicContact CG2-CG 4.3Å; T225-L229 PolarHBondContact O-N 3.35Å; A226-L229 PolarHBondContact O-N 3.01Å; P227-L229 VanDerWaalsContact C-N 3.35Å; P227-L229 PolarHBondContact O-N 2.9Å; L229-V251 HydrophobicContact CD2-CB 4.36Å; L229-V251 HydrophobicContact CD2-CG1 3.63Å; L229-V251 HydrophobicContact CD2-CG2 3.88Å; L229-V251 HydrophobicContact CG-CG2 4.08Å; L229-F254 HydrophobicContact CD1-CD1 4.35Å; L229-F254 HydrophobicContact CD1-CE1 4.17Å; L229-F254 HydrophobicContact CD2-CD1 4.23Å; L229-F254 HydrophobicContact CD2-CE1 4.46Å
230	F	91	Very high	87.5	Confident	63 Å²	63	48.2 Å²	48.2	28%	0.276	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.8	1.6	-179	-59.8	-78.6	0	0	0	113.4	I134 L138 Y141 A226 P227 L228	I134-F230 HydrophobicContact CD1-CE2 3.65Å; I134-F230 HydrophobicContact CD1-CZ 4.04Å; I134-F230 HydrophobicContact CG1-CD2 4.28Å; I134-F230 HydrophobicContact CG1-CE2 3.57Å; I134-F230 HydrophobicContact CG1-CZ 4.26Å; L138-F230 HydrophobicContact CD2-CD1 3.94Å; L138-F230 HydrophobicContact CD2-CE1 4Å; L138-F230 HydrophobicContact CD2-CG 4.35Å; L138-F230 HydrophobicContact CD2-CZ 4.49Å; Y141-F230 VanDerWaalsContact CD2-O 3.23Å; Y141-F230 WeakPolarHBondContact CD2-O 3.5Å; A226-F230 VanDerWaalsContact O-CD2 3.22Å; A226-F230 WeakPolarHBondContact O-CD2 3.4Å; P227-F230 PolarHBondContact O-N 2.75Å; L228-F230 PolarHBondContact O-N 2.97Å
231	T	92.8	Very high	87.4	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-134.1	-72.1	-170.2	54.6	0	0	0	0	114.5	V140 V145 F151 S152 A155 G156 A159 P227 L228 L233	V140-T231 HydrophobicContact CB-CG2 3.86Å; V140-T231 HydrophobicContact CG1-CG2 3.66Å; V145-T231 HydrophobicContact CG2-CG2 4.5Å; F151-T231 WeakPolarHBondContact CA-O 3.3Å; F151-T231 WeakPolarHBondContact CB-O 3.49Å; F151-T231 WeakPolarHBondContact CD1-O 3.25Å; S152-T231 PolarHBondContact N-O 2.94Å; S152-T231 VanDerWaalsContact N-O 3.09Å; A155-T231 HydrophobicContact CB-CG2 4.39Å; G156-T231 WeakPolarHBondContact CA-OG1 3.41Å; A159-T231 HydrophobicContact CB-CG2 4.04Å; P227-T231 WeakPolarHBondContact O-CB 3.19Å; P227-T231 WeakPolarHBondContact O-CG2 3.27Å; P227-T231 PolarHBondContact O-N 3.39Å; P227-T231 PolarHBondContact O-OG1 3.47Å; L228-T231 WeakPolarHBondContact CA-OG1 3.41Å; L228-T231 PolarHBondContact O-N 3.14Å; T231-L233 VanDerWaalsContact C-N 3.29Å
232	A	88.2	Confident	87.3	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-29.6	174.7	0	0	0	0	0	112.1	L89 S152 L228 P245	L89-A232 HydrophobicContact CD1-CB 4.37Å; S152-A232 VanDerWaalsContact O-CA 3.27Å; S152-A232 WeakPolarHBondContact O-CA 3.41Å; L228-A232 HydrophobicContact CD2-CB 4.22Å; L228-A232 PolarHBondContact O-N 3.3Å; A232-P245 VanDerWaalsContact O-CA 3.26Å; A232-P245 WeakPolarHBondContact O-CA 3.35Å; A232-P245 WeakPolarHBondContact O-CB 3.38Å
233	L	79.8	Confident	87.2	Confident	55 Å²	55	49.7 Å²	49.7	29%	0.288	26%	0.264	S	S	.	.			trans	51.2	-175.3	-158.6	-157.9	63.4	0	0	0	109.3	F151 L228 T231 P245 I246 N248	F151-L233 HydrophobicContact CB-CB 3.76Å; F151-L233 HydrophobicContact CB-CD2 4.5Å; F151-L233 HydrophobicContact CD1-CB 3.97Å; F151-L233 HydrophobicContact CD2-CB 4.24Å; F151-L233 HydrophobicContact CD2-CD2 3.68Å; F151-L233 HydrophobicContact CD2-CG 4.46Å; F151-L233 HydrophobicContact CE2-CD2 4.02Å; F151-L233 HydrophobicContact CG-CB 3.73Å; F151-L233 HydrophobicContact CG-CD2 4.06Å; F151-L233 HydrophobicContact CG-CG 4.4Å; L228-L233 WeakPolarHBondContact O-CA 3.4Å; L228-L233 PolarHBondContact O-N 2.96Å; T231-L233 VanDerWaalsContact C-N 3.29Å; L233-P245 HydrophobicContact CB-CB 4.49Å; L233-I246 VanDerWaalsContact O-O 3.05Å; L233-N248 PolarHBondContact O-ND2 3.22Å
234	S	81.5	Confident	87.2	Confident	6 Å²	6	51.9 Å²	51.9	4%	0.042	26%	0.259	C	S	.	.			trans	-133.8	134.1	173.1	-177.6	0	0	0	0	108.9	N248 T252 K255	S234-N248 PolarHBondContact OG-N 3.3Å; S234-T252 PolarHBondContact OG-OG1 2.84Å; S234-T252 VanDerWaalsContact OG-OG1 3.13Å; S234-K255 PolarHBondContact O-NZ 3.17Å
235	N	81.9	Confident	87.2	Confident	35 Å²	35	51.9 Å²	51.9	19%	0.187	26%	0.262	C	S	.	.			trans	-107.5	170.1	170.9	67.9	15.5	0	0	0	110.7	F237 P245 A247	N235-F237 PolarHBondContact OD1-O 3.3Å; N235-P245 PolarHBondContact ND2-O 3.18Å; N235-A247 WeakPolarHBondContact O-CA 3.42Å; N235-A247 WeakPolarHBondContact O-CB 3.48Å; N235-A247 WeakPolarHBondContact OD1-CB 3.26Å; N235-A247 PolarHBondContact OD1-N 3.22Å
236	Q	76.8	Confident	87.4	Confident	76 Å²	76	50 Å²	50	36%	0.355	25%	0.251	S	S	.	.	S	Bend	trans	-96.8	-3.4	178.8	-69.7	176.9	-1.2	0	0	112.9	T69 N81	T69-Q236 HydrophobicContact CG2-CG 4.47Å; N81-Q236 VanDerWaalsContact ND2-C 3.25Å; N81-Q236 PolarHBondContact ND2-O 3.45Å
237	F	81.9	Confident	87.3	Confident	151 Å²	151	49 Å²	49	66%	0.662	24%	0.242	S	C	*	.	S	Bend	trans	-96.8	167	-174.1	-56.2	-69.5	0	0	0	112	N81 N235 S239	N81-F237 PolarHBondContact ND2-O 3.2Å; N235-F237 PolarHBondContact OD1-O 3.3Å; F237-S239 PolarHBondContact O-N 2.88Å
238	W	83.1	Confident	87.3	Confident	145 Å²	145	49 Å²	49	55%	0.549	24%	0.242	S	C	.	.			trans	-82.8	115.1	172	-173.9	-85.1	0	0	0	107.4	M68 A80 N81 A84	M68-W238 HydrophobicContact CE-CB 3.62Å; M68-W238 HydrophobicContact SD-CB 3.95Å; M68-W238 HydrophobicContact SD-CD2 4.45Å; M68-W238 HydrophobicContact SD-CE3 3.7Å; A80-W238 HydrophobicContact CB-CZ3 4.3Å; N81-W238 HydrophobicContact CB-CE3 3.79Å; N81-W238 HydrophobicContact CB-CZ3 4.47Å; A84-W238 HydrophobicContact CB-CH2 3.44Å; A84-W238 VanDerWaalsContact CB-CH2 3.44Å; A84-W238 HydrophobicContact CB-CZ2 4.05Å; A84-W238 HydrophobicContact CB-CZ3 3.75Å
239	S	82.7	Confident	87.1	Confident	31 Å²	31	51 Å²	51	22%	0.217	25%	0.252	C	S	.	.			trans	-133.7	136	174.2	-175.7	0	0	0	0	109.7	F237 D241	F237-S239 PolarHBondContact O-N 2.88Å; S239-D241 PolarHBondContact OG-N 2.78Å
240	T	86.4	Confident	87.1	Confident	100 Å²	100	49.3 Å²	49.3	61%	0.613	25%	0.245	S	C	*	.			trans	-110.6	-2.7	168.5	54.4	0	0	0	0	111.6	L88 M242	L88-T240 HydrophobicContact CD1-CG2 4.36Å; T240-M242 PolarHBondContact O-N 3.43Å
241	D	89.4	Confident	86.9	Confident	81 Å²	81	46.3 Å²	46.3	43%	0.433	23%	0.231	S	C	.	.			trans	-81	112.6	177.5	-174.6	-2.2	0	0	0	110	S239 M243 Q244	S239-D241 PolarHBondContact OG-N 2.78Å; D241-M243 VanDerWaalsContact C-N 3.27Å; D241-M243 PolarHBondContact O-N 2.91Å; D241-M243 WeakPolarHBondContact OD1-CB 3.49Å; D241-M243 PolarHBondContact OD1-N 2.99Å; D241-Q244 HydrophobicContact CB-CG 4.46Å; D241-Q244 PolarHBondContact O-N 2.95Å
242	M	91.8	Very high	86.5	Confident	13 Å²	13	46.6 Å²	46.6	6%	0.064	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-13.8	-178.1	-62.5	-66.8	-65.5	0	0	113.2	L88 L89 G153 W154 V157 T240 Q244 I246	L88-M242 HydrophobicContact CB-SD 4.28Å; L89-M242 HydrophobicContact CD2-CE 4.13Å; G153-M242 CarbonylContact C-O 3.59Å; G153-M242 WeakPolarHBondContact CA-O 3.34Å; G153-M242 PolarHBondContact N-O 3.49Å; W154-M242 VanDerWaalsContact CD1-C 3.47Å; W154-M242 HydrophobicContact CD2-CB 3.99Å; W154-M242 HydrophobicContact CG-CB 4.08Å; W154-M242 HydrophobicContact CZ2-CB 4Å; W154-M242 HydrophobicContact CZ2-CG 4.3Å; W154-M242 PolarHBondContact N-O 3.16Å; W154-M242 VanDerWaalsContact NE1-CB 3.3Å; V157-M242 HydrophobicContact CG2-CE 3.45Å; V157-M242 VanDerWaalsContact CG2-CE 3.45Å; T240-M242 PolarHBondContact O-N 3.43Å; M242-Q244 VanDerWaalsContact C-N 3.28Å; M242-I246 HydrophobicContact CG-CD1 4.41Å; M242-I246 HydrophobicContact SD-CD1 3.36Å; M242-I246 WeakPolarHBondContact SD-CD1 3.3Å
243	M	92.3	Very high	86.2	Confident	87 Å²	87	50.8 Å²	50.8	43%	0.429	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77	-19.1	173.4	-66.8	-63.5	-80.2	0	0	112	M148 H150 S152 D241	M148-M243 HydrophobicContact CE-CE 3.7Å; M148-M243 HydrophobicContact CE-SD 4.36Å; H150-M243 PolarHBondContact CE1-O 3.07Å; H150-M243 PolarHBondContact ND1-O 3.21Å; S152-M243 VanDerWaalsContact CB-O 3.24Å; S152-M243 WeakPolarHBondContact CB-O 3.25Å; D241-M243 VanDerWaalsContact C-N 3.27Å; D241-M243 PolarHBondContact O-N 2.91Å; D241-M243 WeakPolarHBondContact OD1-CB 3.49Å; D241-M243 PolarHBondContact OD1-N 2.99Å
244	Q	89.1	Confident	86.2	Confident	100 Å²	100	52.6 Å²	52.6	47%	0.467	26%	0.26	S	S	.	.	S	Bend	trans	-97.6	165	177.7	-66	-65.3	-25.4	0	0	111.3	G153 D241 M242	G153-Q244 PolarHBondContact N-O 3.16Å; D241-Q244 HydrophobicContact CB-CG 4.46Å; D241-Q244 PolarHBondContact O-N 2.95Å; M242-Q244 VanDerWaalsContact C-N 3.28Å
245	P	89.6	Confident	85.9	Confident	30 Å²	30	56.6 Å²	56.6	20%	0.195	28%	0.277	C	S	.	.			trans	-54.9	140.7	167.4	-24.5	34.4	0	0	0	110.8	F151 A232 L233 N235	F151-P245 HydrophobicContact CB-CG 4.17Å; F151-P245 WeakPolarHBondContact O-CD 3.39Å; A232-P245 VanDerWaalsContact O-CA 3.26Å; A232-P245 WeakPolarHBondContact O-CA 3.35Å; A232-P245 WeakPolarHBondContact O-CB 3.38Å; L233-P245 HydrophobicContact CB-CB 4.49Å; N235-P245 PolarHBondContact ND2-O 3.18Å
246	I	90.9	Very high	85.5	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	29%	0.287	C	S	.	.			trans	-122.6	132.9	-177.9	-95	176.8	0	0	0	110.5	L89 L233 M242 N248	L89-I246 HydrophobicContact CD1-CG2 4.2Å; L89-I246 HydrophobicContact CG-CG2 4.22Å; L233-I246 VanDerWaalsContact O-O 3.05Å; M242-I246 HydrophobicContact CG-CD1 4.41Å; M242-I246 HydrophobicContact SD-CD1 3.36Å; M242-I246 WeakPolarHBondContact SD-CD1 3.3Å; I246-N248 PolarHBondContact O-N 3.14Å; I246-N248 PolarHBondContact O-ND2 3.32Å
247	A	89	Confident	85	Confident	3 Å²	3	59.5 Å²	59.5	3%	0.025	30%	0.302	C	S	.	.			trans	-54.1	127.7	170.8	0	0	0	0	0	110.3	N81 G85 N235	N81-A247 HydrophobicContact CB-CB 4.27Å; G85-A247 CarbonylContact C-O 3.53Å; G85-A247 VanDerWaalsContact CA-O 3.22Å; G85-A247 WeakPolarHBondContact CA-O 3.49Å; N235-A247 WeakPolarHBondContact O-CA 3.42Å; N235-A247 WeakPolarHBondContact O-CB 3.48Å; N235-A247 WeakPolarHBondContact OD1-CB 3.26Å; N235-A247 PolarHBondContact OD1-N 3.22Å
248	N	91.9	Very high	84.3	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	30%	0.301	C	S	.	.			trans	-139.4	143.6	175.3	65.8	82.1	0	0	0	110.9	S86 L89 L228 L233 S234 I246 V251 T252	S86-N248 WeakPolarHBondContact OG-CA 3.35Å; L89-N248 HydrophobicContact CD1-CB 3.79Å; L228-N248 HydrophobicContact CD1-CB 4.25Å; L228-N248 WeakPolarHBondContact CD1-OD1 3.46Å; L233-N248 PolarHBondContact O-ND2 3.22Å; S234-N248 PolarHBondContact OG-N 3.3Å; I246-N248 PolarHBondContact O-N 3.14Å; I246-N248 PolarHBondContact O-ND2 3.32Å; N248-V251 PolarHBondContact O-N 3.49Å; N248-V251 WeakPolarHBondContact OD1-CB 3.4Å; N248-V251 WeakPolarHBondContact OD1-CG2 3.46Å; N248-V251 PolarHBondContact OD1-N 2.89Å; N248-V251 VanDerWaalsContact OD1-N 3.13Å; N248-T252 WeakPolarHBondContact O-CB 3.45Å; N248-T252 PolarHBondContact O-N 3.29Å; N248-T252 PolarHBondContact O-OG1 3.46Å
249	L	89.5	Confident	83.1	Confident	45 Å²	45	53.2 Å²	53.2	24%	0.236	29%	0.286	C	S	.	.	H	α-helix	trans	-63	-45.3	-169.3	-170.7	72.2	0	0	0	112	L79 A82 L83 S86 V251 T252 I253	L79-L249 HydrophobicContact CB-CD1 4.21Å; L79-L249 HydrophobicContact CD1-CD1 3.8Å; L79-L249 HydrophobicContact CG-CD1 4.46Å; A82-L249 HydrophobicContact CB-CD1 4.34Å; A82-L249 PolarHBondContact O-N 3.26Å; L83-L249 HydrophobicContact CD2-CD1 4.31Å; L83-L249 HydrophobicContact CD2-CD2 3.95Å; S86-L249 VanDerWaalsContact OG-CB 3.29Å; S86-L249 WeakPolarHBondContact OG-CB 3.4Å; S86-L249 PolarHBondContact OG-N 2.91Å; L249-V251 PolarHBondContact O-N 3.29Å; L249-T252 PolarHBondContact O-N 2.95Å; L249-I253 HydrophobicContact CD1-CD1 4.07Å; L249-I253 HydrophobicContact CD1-CG1 4.3Å; L249-I253 HydrophobicContact CD2-CD1 4.3Å; L249-I253 HydrophobicContact CG-CD1 3.72Å; L249-I253 HydrophobicContact CG-CG1 4.3Å; L249-I253 WeakPolarHBondContact O-CB 3.42Å; L249-I253 VanDerWaalsContact O-CG1 3.25Å; L249-I253 WeakPolarHBondContact O-CG1 3.33Å; L249-I253 PolarHBondContact O-N 2.91Å
250	P	89	Confident	81.5	Confident	15 Å²	15	57.3 Å²	57.3	10%	0.097	31%	0.312	C	S	.	.	H	α-helix	trans	-62.3	-42.8	-178.9	-22.6	34.9	0	0	0	112.7	A222 T225 F254	A222-P250 WeakPolarHBondContact O-CG 3.16Å; T225-P250 HydrophobicContact CG2-CB 4.33Å; T225-P250 VanDerWaalsContact OG1-CB 3.23Å; T225-P250 WeakPolarHBondContact OG1-CB 3.34Å; P250-F254 WeakPolarHBondContact O-CB 3.33Å; P250-F254 PolarHBondContact O-N 2.85Å
251	V	87.1	Confident	79.7	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-73.6	-37.1	178.1	175.6	0	0	0	0	111.4	T225 L228 L229 N248 L249 F254 K255	T225-V251 HydrophobicContact CG2-CG2 4.01Å; L228-V251 HydrophobicContact CB-CG2 3.81Å; L229-V251 HydrophobicContact CD2-CB 4.36Å; L229-V251 HydrophobicContact CD2-CG1 3.63Å; L229-V251 HydrophobicContact CD2-CG2 3.88Å; L229-V251 HydrophobicContact CG-CG2 4.08Å; N248-V251 PolarHBondContact O-N 3.49Å; N248-V251 WeakPolarHBondContact OD1-CB 3.4Å; N248-V251 WeakPolarHBondContact OD1-CG2 3.46Å; N248-V251 PolarHBondContact OD1-N 2.89Å; N248-V251 VanDerWaalsContact OD1-N 3.13Å; L249-V251 PolarHBondContact O-N 3.29Å; V251-F254 PolarHBondContact O-N 2.82Å; V251-K255 HydrophobicContact CG1-CD 4.17Å; V251-K255 HydrophobicContact CG1-CG 4.27Å; V251-K255 WeakPolarHBondContact O-CB 3.28Å; V251-K255 VanDerWaalsContact O-CG 3.3Å; V251-K255 WeakPolarHBondContact O-CG 3.42Å; V251-K255 PolarHBondContact O-N 3.11Å
252	T	85.2	Confident	77.4	Confident	5 Å²	5	56.5 Å²	56.5	3%	0.031	31%	0.306	C	S	.	.	H	α-helix	trans	-64.1	-44.7	175.9	-62.8	0	0	0	0	111.2	T69 L79 A82 S234 N248 L249 F254 K255 F256	T69-T252 HydrophobicContact CG2-CG2 4.08Å; L79-T252 HydrophobicContact CD2-CG2 3.82Å; A82-T252 HydrophobicContact CB-CG2 4.47Å; S234-T252 PolarHBondContact OG-OG1 2.84Å; S234-T252 VanDerWaalsContact OG-OG1 3.13Å; N248-T252 WeakPolarHBondContact O-CB 3.45Å; N248-T252 PolarHBondContact O-N 3.29Å; N248-T252 PolarHBondContact O-OG1 3.46Å; L249-T252 PolarHBondContact O-N 2.95Å; T252-F254 VanDerWaalsContact C-N 3.35Å; T252-F254 PolarHBondContact O-N 3.3Å; T252-K255 PolarHBondContact O-N 2.78Å; T252-F256 HydrophobicContact CG2-CD2 4.19Å; T252-F256 HydrophobicContact CG2-CE1 4.32Å; T252-F256 HydrophobicContact CG2-CE2 3.87Å; T252-F256 HydrophobicContact CG2-CZ 3.96Å; T252-F256 WeakPolarHBondContact O-CB 3.11Å; T252-F256 WeakPolarHBondContact O-CG 3.48Å; T252-F256 PolarHBondContact O-N 3.37Å
253	I	81.5	Confident	74.9	Confident	89 Å²	89	62.5 Å²	62.5	46%	0.456	33%	0.334	S	S	.	.	H	α-helix	trans	-60.9	-44.7	173.4	-68.3	170.7	0	0	0	110.5	L249 K255 F256 A257	L249-I253 HydrophobicContact CD1-CD1 4.07Å; L249-I253 HydrophobicContact CD1-CG1 4.3Å; L249-I253 HydrophobicContact CD2-CD1 4.3Å; L249-I253 HydrophobicContact CG-CD1 3.72Å; L249-I253 HydrophobicContact CG-CG1 4.3Å; L249-I253 WeakPolarHBondContact O-CB 3.42Å; L249-I253 VanDerWaalsContact O-CG1 3.25Å; L249-I253 WeakPolarHBondContact O-CG1 3.33Å; L249-I253 PolarHBondContact O-N 2.91Å; I253-K255 PolarHBondContact O-N 2.96Å; I253-F256 PolarHBondContact O-N 3.48Å; I253-A257 VanDerWaalsContact O-CB 3.31Å; I253-A257 WeakPolarHBondContact O-CB 3.4Å; I253-A257 PolarHBondContact O-N 3.47Å
254	F	80.4	Confident	72.4	Confident	93 Å²	93	63 Å²	63	41%	0.408	33%	0.331	S	S	.	.	H	α-helix	trans	-61.1	-43.8	176.7	175.7	-99.2	0	0	0	112.3	T225 L229 P250 V251 T252 F256 A257 M258	T225-F254 HydrophobicContact CG2-CB 3.81Å; T225-F254 HydrophobicContact CG2-CG 4.16Å; L229-F254 HydrophobicContact CD1-CD1 4.35Å; L229-F254 HydrophobicContact CD1-CE1 4.17Å; L229-F254 HydrophobicContact CD2-CD1 4.23Å; L229-F254 HydrophobicContact CD2-CE1 4.46Å; P250-F254 WeakPolarHBondContact O-CB 3.33Å; P250-F254 PolarHBondContact O-N 2.85Å; V251-F254 PolarHBondContact O-N 2.82Å; T252-F254 VanDerWaalsContact C-N 3.35Å; T252-F254 PolarHBondContact O-N 3.3Å; F254-F256 VanDerWaalsContact C-N 3.32Å; F254-F256 PolarHBondContact O-N 2.84Å; F254-A257 PolarHBondContact O-N 3.27Å; F254-M258 HydrophobicContact CD1-CG 4.42Å; F254-M258 HydrophobicContact CD2-CG 4.05Å; F254-M258 HydrophobicContact CE1-CG 4.05Å; F254-M258 HydrophobicContact CE2-CG 3.63Å; F254-M258 HydrophobicContact CE2-SD 4.3Å; F254-M258 HydrophobicContact CG-CG 4.43Å; F254-M258 HydrophobicContact CZ-CG 3.64Å; F254-M258 HydrophobicContact CZ-SD 4.48Å; F254-M258 VanDerWaalsContact O-CB 3.31Å; F254-M258 WeakPolarHBondContact O-CB 3.12Å; F254-M258 WeakPolarHBondContact O-CG 3.41Å; F254-M258 PolarHBondContact O-N 3.35Å
255	K	74.5	Confident	69.8	Low	90 Å²	90	64.2 Å²	64.2	39%	0.391	34%	0.336	S	S	.	.	H	α-helix	trans	-61.1	-41.2	175.2	-77.2	179	176.6	-171.1	0	111.5	S234 V251 T252 I253 S259	S234-K255 PolarHBondContact O-NZ 3.17Å; V251-K255 HydrophobicContact CG1-CD 4.17Å; V251-K255 HydrophobicContact CG1-CG 4.27Å; V251-K255 WeakPolarHBondContact O-CB 3.28Å; V251-K255 VanDerWaalsContact O-CG 3.3Å; V251-K255 WeakPolarHBondContact O-CG 3.42Å; V251-K255 PolarHBondContact O-N 3.11Å; T252-K255 PolarHBondContact O-N 2.78Å; I253-K255 PolarHBondContact O-N 2.96Å; K255-S259 WeakPolarHBondContact O-CA 3.39Å; K255-S259 VanDerWaalsContact O-CB 3.26Å; K255-S259 WeakPolarHBondContact O-CB 3.36Å; K255-S259 PolarHBondContact O-N 3.36Å
256	F	74	Confident	67.4	Low	90 Å²	90	72.4 Å²	72.4	40%	0.395	37%	0.372	S	S	.	.	H	α-helix	trans	-70	-39	176.5	-70.9	-7.4	0	0	0	112.5	T69 L79 T252 I253 F254 S259	T69-F256 HydrophobicContact CG2-CE1 4.28Å; T69-F256 HydrophobicContact CG2-CE2 4.29Å; T69-F256 HydrophobicContact CG2-CZ 3.51Å; L79-F256 HydrophobicContact CD2-CE2 3.89Å; T252-F256 HydrophobicContact CG2-CD2 4.19Å; T252-F256 HydrophobicContact CG2-CE1 4.32Å; T252-F256 HydrophobicContact CG2-CE2 3.87Å; T252-F256 HydrophobicContact CG2-CZ 3.96Å; T252-F256 WeakPolarHBondContact O-CB 3.11Å; T252-F256 WeakPolarHBondContact O-CG 3.48Å; T252-F256 PolarHBondContact O-N 3.37Å; I253-F256 PolarHBondContact O-N 3.48Å; F254-F256 VanDerWaalsContact C-N 3.32Å; F254-F256 PolarHBondContact O-N 2.84Å; F256-S259 WeakPolarHBondContact O-CB 3.3Å; F256-S259 PolarHBondContact O-N 3.14Å
257	A	66.8	Low	64.9	Low	81 Å²	81	77.6 Å²	77.6	67%	0.669	40%	0.399	S	S	*	.	H	α-helix	trans	-70.7	-34.9	178	0	0	0	0	0	112.9	I253 F254 S259	I253-A257 VanDerWaalsContact O-CB 3.31Å; I253-A257 WeakPolarHBondContact O-CB 3.4Å; I253-A257 PolarHBondContact O-N 3.47Å; F254-A257 PolarHBondContact O-N 3.27Å; A257-S259 VanDerWaalsContact C-N 3.33Å
258	M	66.3	Low	62.7	Low	132 Å²	132	80.2 Å²	80.2	65%	0.65	42%	0.421	S	S	*	.	S	Bend	trans	-85.6	-8.8	174.5	-68	-62.1	-59.8	0	0	112.8	F254	F254-M258 HydrophobicContact CD1-CG 4.42Å; F254-M258 HydrophobicContact CD2-CG 4.05Å; F254-M258 HydrophobicContact CE1-CG 4.05Å; F254-M258 HydrophobicContact CE2-CG 3.63Å; F254-M258 HydrophobicContact CE2-SD 4.3Å; F254-M258 HydrophobicContact CG-CG 4.43Å; F254-M258 HydrophobicContact CZ-CG 3.64Å; F254-M258 HydrophobicContact CZ-SD 4.48Å; F254-M258 VanDerWaalsContact O-CB 3.31Å; F254-M258 WeakPolarHBondContact O-CB 3.12Å; F254-M258 WeakPolarHBondContact O-CG 3.41Å; F254-M258 PolarHBondContact O-N 3.35Å
259	S	58.7	Low	61.4	Low	32 Å²	32	81.1 Å²	81.1	22%	0.224	43%	0.425	C	S	.	.			trans	-62.2	127.4	176.2	179.3	0	0	0	0	108.3	K255 F256 A257 F261	K255-S259 WeakPolarHBondContact O-CA 3.39Å; K255-S259 VanDerWaalsContact O-CB 3.26Å; K255-S259 WeakPolarHBondContact O-CB 3.36Å; K255-S259 PolarHBondContact O-N 3.36Å; F256-S259 WeakPolarHBondContact O-CB 3.3Å; F256-S259 PolarHBondContact O-N 3.14Å; A257-S259 VanDerWaalsContact C-N 3.33Å; S259-F261 PolarHBondContact O-N 3.04Å; S259-F261 VanDerWaalsContact O-N 3.11Å; S259-F261 WeakPolarHBondContact OG-CA 3.5Å; S259-F261 VanDerWaalsContact OG-CB 3.31Å; S259-F261 WeakPolarHBondContact OG-CB 3.43Å; S259-F261 WeakPolarHBondContact OG-CD2 3.32Å; S259-F261 PolarHBondContact OG-N 3.36Å; S259-F261 VanDerWaalsContact OG-N 3.09Å; S259-F261 PolarHBondContact OG-O 3.34Å
260	P	47.7	Very low	60.3	Low	118 Å²	118	79.1 Å²	79.1	77%	0.766	42%	0.415	S	S	*	.	S	Bend	trans	-63.7	-13.3	169.5	28.7	-33.7	0	0	0	111.5	A262	P260-A262 PolarHBondContact O-N 3.38Å
261	F	49.5	Very low	60	Low	111 Å²	111	78.6 Å²	78.6	49%	0.487	41%	0.412	S	S	.	.			trans	-90.3	73.6	169.1	-34.7	-73.2	0	0	0	108.5	S259	S259-F261 PolarHBondContact O-N 3.04Å; S259-F261 VanDerWaalsContact O-N 3.11Å; S259-F261 WeakPolarHBondContact OG-CA 3.5Å; S259-F261 VanDerWaalsContact OG-CB 3.31Å; S259-F261 WeakPolarHBondContact OG-CB 3.43Å; S259-F261 WeakPolarHBondContact OG-CD2 3.32Å; S259-F261 PolarHBondContact OG-N 3.36Å; S259-F261 VanDerWaalsContact OG-N 3.09Å; S259-F261 PolarHBondContact OG-O 3.34Å
262	A	41.2	Very low	60	Low	52 Å²	52	78.6 Å²	78.6	43%	0.43	41%	0.412	S	S	.	.	S	Bend	trans	-59.9	-179.2	142	0	0	0	0	0	106.5	P260 W264	P260-A262 PolarHBondContact O-N 3.38Å; A262-W264 PolarHBondContact O-N 3.44Å
263	E	38.9	Very low	60.1	Low	140 Å²	140	80.6 Å²	80.6	65%	0.654	42%	0.419	S	S	*	.			trans	-44.5	140.1	161.2	-60.1	122.7	152.2	0	0	109.9	Q265	E263-Q265 VanDerWaalsContact CB-CA 3.46Å; E263-Q265 HydrophobicContact CB-CB 4.15Å; E263-Q265 HydrophobicContact CB-CG 4.02Å; E263-Q265 PolarHBondContact O-N 3.14Å; E263-Q265 WeakPolarHBondContact OE2-CG 3.47Å; E263-Q265 PolarHBondContact OE2-NE2 3.36Å
264	W	40.1	Very low	60.5	Low	98 Å²	98	80.9 Å²	80.9	37%	0.371	42%	0.421	S	S	.	.			trans	-50.1	69.7	132.6	-89.4	51.6	0	0	0	108.6	A262 Q266 L267 A293 K294 Q296	A262-W264 PolarHBondContact O-N 3.44Å; W264-Q266 VanDerWaalsContact C-N 3.35Å; W264-Q266 PolarHBondContact O-N 3.05Å; W264-L267 WeakPolarHBondContact CZ3-O 3.47Å; W264-L267 PolarHBondContact O-N 3.36Å; W264-A293 HydrophobicContact CD2-CB 4.08Å; W264-A293 HydrophobicContact CE3-CB 4.23Å; W264-A293 HydrophobicContact CH2-CB 3.38Å; W264-A293 VanDerWaalsContact CZ2-CA 3.42Å; W264-A293 HydrophobicContact CZ2-CB 3.01Å; W264-A293 HydrophobicContact CZ3-CB 3.95Å; W264-K294 HydrophobicContact CH2-CB 3.93Å; W264-K294 VanDerWaalsContact CH2-O 3.26Å; W264-K294 WeakPolarHBondContact CH2-O 3.29Å; W264-K294 HydrophobicContact CZ3-CB 3.97Å; W264-Q296 HydrophobicContact CZ2-CG 4.23Å
265	Q	34.6	Very low	61.1	Low	124 Å²	124	76.5 Å²	76.5	58%	0.579	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.3	94.5	-166.5	-121	131.6	26.5	0	0	107.7	E263 L267	E263-Q265 VanDerWaalsContact CB-CA 3.46Å; E263-Q265 HydrophobicContact CB-CB 4.15Å; E263-Q265 HydrophobicContact CB-CG 4.02Å; E263-Q265 PolarHBondContact O-N 3.14Å; E263-Q265 WeakPolarHBondContact OE2-CG 3.47Å; E263-Q265 PolarHBondContact OE2-NE2 3.36Å; Q265-L267 PolarHBondContact O-N 3.06Å
266	Q	38.8	Very low	62.1	Low	202 Å²	202	73.1 Å²	73.1	94%	0.944	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.9	18.7	-176.6	-57.8	178.1	-33.7	0	0	119	W264	W264-Q266 VanDerWaalsContact C-N 3.35Å; W264-Q266 PolarHBondContact O-N 3.05Å
267	L	37.9	Very low	63.1	Low	109 Å²	109	68.9 Å²	68.9	57%	0.571	37%	0.37	S	S	*	.			trans	-134.4	36.6	-166.6	-91	167.1	0	0	0	117	W264 Q265 W269	W264-L267 WeakPolarHBondContact CZ3-O 3.47Å; W264-L267 PolarHBondContact O-N 3.36Å; Q265-L267 PolarHBondContact O-N 3.06Å; L267-W269 VanDerWaalsContact C-N 3.31Å; L267-W269 PolarHBondContact O-N 2.96Å
268	A	43	Very low	64.4	Low	59 Å²	59	66.9 Å²	66.9	49%	0.488	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58	102	158.4	0	0	0	0	0	108	A270	A268-A270 VanDerWaalsContact C-N 3.35Å
269	W	64.7	Low	65.6	Low	19 Å²	19	64.3 Å²	64.3	7%	0.072	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	-33.4	-176.4	170.2	77.1	0	0	0	110.6	L267 K294 L333 D334 E432 V433	L267-W269 VanDerWaalsContact C-N 3.31Å; L267-W269 PolarHBondContact O-N 2.96Å; W269-K294 HydrophobicContact CB-CB 3.7Å; W269-K294 HydrophobicContact CB-CD 4.28Å; W269-K294 HydrophobicContact CB-CG 4.36Å; W269-K294 HydrophobicContact CG-CB 4.06Å; W269-K294 HydrophobicContact CG-CD 3.98Å; W269-K294 HydrophobicContact CG-CG 4.21Å; W269-L333 HydrophobicContact CH2-CD1 3.48Å; W269-L333 VanDerWaalsContact CH2-CD1 3.48Å; W269-L333 HydrophobicContact CH2-CD2 3.82Å; W269-L333 HydrophobicContact CH2-CG 3.47Å; W269-L333 VanDerWaalsContact CH2-CG 3.47Å; W269-L333 HydrophobicContact CZ2-CD1 4.43Å; W269-L333 HydrophobicContact CZ2-CD2 4.14Å; W269-L333 HydrophobicContact CZ2-CG 3.95Å; W269-L333 HydrophobicContact CZ3-CD1 3.71Å; W269-L333 HydrophobicContact CZ3-CG 4.06Å; W269-D334 PolarHBondContact NE1-OD1 2.82Å; W269-D334 PolarHBondContact O-N 3.21Å; W269-D334 VanDerWaalsContact O-N 3.07Å; W269-E432 HydrophobicContact CH2-CB 4.34Å; W269-E432 HydrophobicContact CZ2-CB 4Å; W269-E432 WeakPolarHBondContact CZ2-OE2 3.37Å; W269-V433 HydrophobicContact CE3-CG2 4.26Å; W269-V433 HydrophobicContact CH2-CB 4.49Å; W269-V433 HydrophobicContact CH2-CG2 3.06Å; W269-V433 HydrophobicContact CZ2-CG2 4.24Å; W269-V433 HydrophobicContact CZ3-CG2 3.07Å
270	A	67.2	Low	67.1	Low	3 Å²	3	64.1 Å²	64.1	3%	0.025	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	149.5	169.1	0	0	0	0	0	110.8	A268 I292 L332 L333	A268-A270 VanDerWaalsContact C-N 3.35Å; A270-I292 HydrophobicContact CB-CB 4.14Å; A270-I292 WeakPolarHBondContact O-CA 3.43Å; A270-I292 PolarHBondContact O-N 2.97Å; A270-L332 CarbonylContact C-O 3.54Å; A270-L332 WeakPolarHBondContact CA-O 3.36Å; A270-L332 VanDerWaalsContact CB-O 3.22Å; A270-L332 WeakPolarHBondContact CB-O 3.33Å; A270-L333 HydrophobicContact CB-CD1 3.88Å; A270-L333 HydrophobicContact CB-CG 4.41Å
271	G	81.5	Confident	69.1	Low	4 Å²	4	68.7 Å²	68.7	4%	0.041	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	143.8	-177.5	0	0	0	0	0	111.8	L290 I331 L332	G271-L290 CarbonylContact C-O 3.6Å; G271-I331 CarbonylContact O-C 3.53Å; G271-L332 PolarHBondContact N-O 2.91Å; G271-L332 PolarHBondContact O-N 3.4Å
272	V	87.5	Confident	71.1	Confident	0 Å²	0	70.1 Å²	70.1	0%	0	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	128.2	174.9	-176.1	0	0	0	0	108	L275 I288 N289 L290 F315 E330 I331	V272-L275 HydrophobicContact CG1-CB 3.25Å; V272-L275 HydrophobicContact CG1-CD2 3.6Å; V272-L275 HydrophobicContact CG1-CG 4.01Å; V272-I288 HydrophobicContact CG1-CG2 4.38Å; V272-N289 WeakPolarHBondContact O-CA 3.46Å; V272-L290 HydrophobicContact CB-CB 4.18Å; V272-L290 HydrophobicContact CG2-CB 4.45Å; V272-L290 PolarHBondContact N-O 3.34Å; V272-L290 PolarHBondContact O-N 3.15Å; V272-F315 HydrophobicContact CG2-CE1 3.37Å; V272-F315 HydrophobicContact CG2-CZ 3.55Å; V272-E330 WeakPolarHBondContact CA-O 3.49Å; V272-I331 HydrophobicContact CG1-CG1 4.46Å; V272-I331 HydrophobicContact CG2-CG1 4.48Å
273	R	87.2	Confident	73.5	Confident	47 Å²	47	70.1 Å²	70.1	18%	0.177	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	124.8	179.3	-63.4	-65.3	-178.2	-84.5	-1.4	110.8	E75 L275 N289 L290 D291 E330	E75-R273 IonicContact OE1-NH2 2.7Å; E75-R273 PolarHBondContact OE1-NH2 3.17Å; E75-R273 IonicContact OE2-CZ 2.68Å; E75-R273 IonicContact OE2-NE 3.38Å; E75-R273 PolarHBondContact OE2-NE 2.98Å; E75-R273 IonicContact OE2-NH2 3.83Å; E75-R273 PolarHBondContact OE2-NH2 3.23Å; R273-L275 PolarHBondContact O-N 2.74Å; R273-L275 VanDerWaalsContact O-N 3.11Å; R273-N289 WeakPolarHBondContact CA-OD1 3.19Å; R273-L290 PolarHBondContact NH1-O 3.4Å; R273-L290 VanDerWaalsContact NH1-O 3.09Å; R273-D291 IonicContact CZ-OD1 3.91Å; R273-D291 IonicContact CZ-OD2 2.82Å; R273-D291 IonicContact NH1-OD1 3.57Å; R273-D291 PolarHBondContact NH1-OD1 3.06Å; R273-D291 IonicContact NH1-OD2 3.48Å; R273-D291 VanDerWaalsContact NH2-CG 3.32Å; R273-D291 IonicContact NH2-OD1 3.91Å; R273-D291 PolarHBondContact NH2-OD1 3.14Å; R273-D291 IonicContact NH2-OD2 2.79Å; R273-D291 PolarHBondContact NH2-OD2 3.04Å; R273-E330 HydrophobicContact CB-CB 4.29Å; R273-E330 PolarHBondContact N-O 2.96Å; R273-E330 PolarHBondContact O-N 2.94Å
274	N	90.5	Very high	76	Confident	95 Å²	95	64.7 Å²	64.7	51%	0.508	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	47.5	38.7	179	-60.2	-50.7	0	0	0	113.8	N276 I288 N289	N274-N276 PolarHBondContact O-N 3.41Å; N274-N276 PolarHBondContact O-ND2 2.94Å; N274-I288 PolarHBondContact N-O 3.35Å; N274-N289 PolarHBondContact N-OD1 3.38Å
275	L	93.1	Very high	78.5	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	126	-177	176.2	74	0	0	0	110.5	V272 R273 L285 N287 I288 L311 T314 A327 E328 I331 L339	V272-L275 HydrophobicContact CG1-CB 3.25Å; V272-L275 HydrophobicContact CG1-CD2 3.6Å; V272-L275 HydrophobicContact CG1-CG 4.01Å; R273-L275 PolarHBondContact O-N 2.74Å; R273-L275 VanDerWaalsContact O-N 3.11Å; L275-L285 HydrophobicContact CD2-CD1 4.47Å; L275-N287 PolarHBondContact O-N 3.49Å; L275-I288 HydrophobicContact CB-CB 4.21Å; L275-I288 PolarHBondContact N-O 2.87Å; L275-I288 PolarHBondContact O-N 2.65Å; L275-L311 HydrophobicContact CD2-CD1 3.67Å; L275-T314 HydrophobicContact CD2-CG2 4.38Å; L275-A327 HydrophobicContact CD1-CB 4.28Å; L275-E328 CarbonylContact C-O 3.54Å; L275-E328 WeakPolarHBondContact CA-O 3.5Å; L275-I331 HydrophobicContact CD1-CD1 3.91Å; L275-I331 HydrophobicContact CD1-CG1 4Å; L275-I331 HydrophobicContact CD2-CD1 4.18Å; L275-I331 HydrophobicContact CD2-CG1 4.41Å; L275-L339 HydrophobicContact CD1-CD1 3.93Å
276	N	94.8	Very high	81.3	Confident	19 Å²	19	61 Å²	61	10%	0.102	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	135.7	174.8	-69.4	-80.6	0	0	0	109.1	N274 Y278 H283 L285 K286 N287 A327 E328	N274-N276 PolarHBondContact O-N 3.41Å; N274-N276 PolarHBondContact O-ND2 2.94Å; N276-Y278 HydrophobicContact CB-CE2 3.86Å; N276-H283 WeakPolarHBondContact CB-NE2 3.45Å; N276-H283 PolarHBondContact OD1-CE1 2.84Å; N276-H283 PolarHBondContact OD1-NE2 3.13Å; N276-L285 CarbonylContact C-O 3.11Å; N276-L285 VanDerWaalsContact CA-O 3.26Å; N276-L285 WeakPolarHBondContact CA-O 3.37Å; N276-K286 WeakPolarHBondContact OD1-CA 3.23Å; N276-N287 PolarHBondContact ND2-OD1 3.42Å; N276-N287 PolarHBondContact OD1-N 3.12Å; N276-N287 PolarHBondContact OD1-OD1 2.71Å; N276-A327 CarbonylContact O-C 3.53Å; N276-A327 WeakPolarHBondContact O-CA 3.49Å; N276-E328 HydrophobicContact CB-CB 4.37Å; N276-E328 PolarHBondContact N-O 2.89Å; N276-E328 PolarHBondContact O-N 3.48Å
277	F	95.6	Very high	83.9	Confident	2 Å²	2	56.2 Å²	56.2	1%	0.009	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	136.2	-178.7	-171.5	-84.3	0	0	0	111.9	Y279 H283 A284 L285 T310 T314 F319 Q325 A327	F277-Y279 HydrophobicContact CD1-CD2 4.25Å; F277-Y279 HydrophobicContact CD1-CE2 4.06Å; F277-Y279 HydrophobicContact CE1-CD1 4.09Å; F277-Y279 AromaticContact CE1-CD2 3.93Å; F277-Y279 HydrophobicContact CE1-CD2 3.93Å; F277-Y279 AromaticContact CE1-CE1 3.82Å; F277-Y279 HydrophobicContact CE1-CE1 3.82Å; F277-Y279 AromaticContact CE1-CE2 3.66Å; F277-Y279 HydrophobicContact CE1-CE2 3.66Å; F277-Y279 HydrophobicContact CE1-CG 4.13Å; F277-Y279 AromaticContact CE1-CZ 3.59Å; F277-Y279 HydrophobicContact CZ-CE1 4.38Å; F277-H283 PolarHBondContact O-CD2 3.5Å; F277-A284 HydrophobicContact CD1-CB 4.41Å; F277-A284 PolarHBondContact O-N 3Å; F277-L285 HydrophobicContact CB-CB 3.74Å; F277-L285 HydrophobicContact CB-CD1 3.76Å; F277-L285 HydrophobicContact CB-CG 3.84Å; F277-L285 HydrophobicContact CG-CD1 4.43Å; F277-L285 PolarHBondContact N-O 3.11Å; F277-L285 PolarHBondContact O-N 3.45Å; F277-T310 HydrophobicContact CB-CG2 4.43Å; F277-T310 HydrophobicContact CD1-CG2 3.3Å; F277-T310 HydrophobicContact CD2-CG2 4.35Å; F277-T310 HydrophobicContact CE1-CG2 3.52Å; F277-T310 HydrophobicContact CG-CG2 3.77Å; F277-T310 HydrophobicContact CZ-CG2 4.13Å; F277-T314 HydrophobicContact CD2-CG2 3.55Å; F277-T314 HydrophobicContact CE2-CG2 3.98Å; F277-T314 HydrophobicContact CG-CG2 4.37Å; F277-F319 HydrophobicContact CE2-CB 3.49Å; F277-F319 VanDerWaalsContact CE2-CB 3.49Å; F277-F319 AromaticContact CE2-CD1 3.79Å; F277-F319 HydrophobicContact CE2-CD1 3.79Å; F277-F319 HydrophobicContact CE2-CD2 4.15Å; F277-F319 AromaticContact CE2-CG 3.56Å; F277-F319 HydrophobicContact CE2-CG 3.56Å; F277-F319 HydrophobicContact CZ-CB 3.53Å; F277-F319 HydrophobicContact CZ-CG 4.12Å; F277-Q325 HydrophobicContact CZ-CB 4.05Å; F277-Q325 HydrophobicContact CZ-CG 4.49Å; F277-A327 HydrophobicContact CD2-CB 3.95Å; F277-A327 HydrophobicContact CE2-CB 4.47Å
278	Y	94.6	Very high	86.4	Confident	38 Å²	38	53.3 Å²	53.3	15%	0.149	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	133	-175.8	-51.9	-103.8	0	0	0	112.2	N276 F282 H283 Q325 R326 E328	N276-Y278 HydrophobicContact CB-CE2 3.86Å; Y278-F282 CarbonylContact C-O 3.47Å; Y278-F282 VanDerWaalsContact CA-O 3.22Å; Y278-F282 WeakPolarHBondContact CA-O 3.03Å; Y278-H283 HydrophobicContact CD1-CB 3.73Å; Y278-H283 AromaticContact CD1-CD2 3.88Å; Y278-H283 AromaticContact CD1-CG 3.86Å; Y278-H283 HydrophobicContact CE1-CB 3.64Å; Y278-H283 AromaticContact CE1-CD2 3.49Å; Y278-H283 VanDerWaalsContact CE1-CD2 3.49Å; Y278-H283 WeakPolarHBondContact CE1-CD2 3.35Å; Y278-H283 AromaticContact CE1-CG 3.37Å; Y278-H283 AromaticContact CE1-ND1 3.74Å; Y278-H283 AromaticContact CE1-NE2 3.91Å; Y278-H283 AromaticContact CZ-CD2 3.62Å; Y278-H283 AromaticContact CZ-CE1 3.84Å; Y278-H283 AromaticContact CZ-CG 3.9Å; Y278-H283 AromaticContact CZ-NE2 3.59Å; Y278-Q325 WeakPolarHBondContact O-CA 3.44Å; Y278-R326 HydrophobicContact CD2-CG 3.87Å; Y278-R326 HydrophobicContact CG-CG 4.22Å; Y278-R326 PolarHBondContact N-O 2.86Å; Y278-R326 PolarHBondContact O-N 3.23Å; Y278-E328 HydrophobicContact CE2-CG 4.33Å; Y278-E328 WeakPolarHBondContact CE2-OE2 3.48Å; Y278-E328 PolarHBondContact OH-OE2 3.38Å
279	Y	91.3	Very high	88.6	Confident	78 Å²	78	54.5 Å²	54.5	31%	0.306	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	96.4	162.5	-71.2	-75.9	0	0	0	108.4	F277 K281 F282 A284 T310 Q325	F277-Y279 HydrophobicContact CD1-CD2 4.25Å; F277-Y279 HydrophobicContact CD1-CE2 4.06Å; F277-Y279 HydrophobicContact CE1-CD1 4.09Å; F277-Y279 AromaticContact CE1-CD2 3.93Å; F277-Y279 HydrophobicContact CE1-CD2 3.93Å; F277-Y279 AromaticContact CE1-CE1 3.82Å; F277-Y279 HydrophobicContact CE1-CE1 3.82Å; F277-Y279 AromaticContact CE1-CE2 3.66Å; F277-Y279 HydrophobicContact CE1-CE2 3.66Å; F277-Y279 HydrophobicContact CE1-CG 4.13Å; F277-Y279 AromaticContact CE1-CZ 3.59Å; F277-Y279 HydrophobicContact CZ-CE1 4.38Å; Y279-K281 PolarHBondContact O-N 2.86Å; Y279-F282 PolarHBondContact N-O 2.87Å; Y279-F282 WeakPolarHBondContact O-CB 3.48Å; Y279-F282 PolarHBondContact O-N 3.42Å; Y279-A284 HydrophobicContact CD2-CB 3.84Å; Y279-A284 HydrophobicContact CE2-CB 4.05Å; Y279-T310 HydrophobicContact CE2-CG2 3.76Å; Y279-T310 WeakPolarHBondContact OH-CG2 3.44Å; Y279-T310 PolarHBondContact OH-OG1 3.26Å; Y279-Q325 HydrophobicContact CD1-CG 3.79Å; Y279-Q325 VanDerWaalsContact CE1-CD 3.48Å; Y279-Q325 HydrophobicContact CE1-CG 4.12Å
280	G	90.1	Very high	89.7	Confident	28 Å²	28	55.5 Å²	55.5	29%	0.289	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.8	-111.1	-171	0	0	0	0	0	110.8	E324	G280-E324 VanDerWaalsContact CA-O 3.26Å; G280-E324 WeakPolarHBondContact CA-O 3.22Å; G280-E324 PolarHBondContact N-O 3.44Å
281	K	88.3	Confident	90.4	Very high	214 Å²	214	58.1 Å²	58.1	93%	0.93	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.5	-11.9	176.9	-62.5	-175.1	-179.1	180	0	113.9	Y279	Y279-K281 PolarHBondContact O-N 2.86Å
282	F	91.8	Very high	90.5	Very high	141 Å²	141	58.1 Å²	58.1	62%	0.618	28%	0.284	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.1	119.3	-175.8	179.9	-107.7	0	0	0	111.2	Y278 Y279 A284	Y278-F282 CarbonylContact C-O 3.47Å; Y278-F282 VanDerWaalsContact CA-O 3.22Å; Y278-F282 WeakPolarHBondContact CA-O 3.03Å; Y279-F282 PolarHBondContact N-O 2.87Å; Y279-F282 WeakPolarHBondContact O-CB 3.48Å; Y279-F282 PolarHBondContact O-N 3.42Å; F282-A284 HydrophobicContact CD1-CB 4.05Å; F282-A284 HydrophobicContact CE1-CB 3.87Å; F282-A284 PolarHBondContact O-N 3.12Å
283	H	92.7	Very high	90.1	Very high	53 Å²	53	58.6 Å²	58.6	25%	0.245	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	98.7	179.3	-169.8	-177.4	0	0	0	110.7	N276 F277 Y278 L285 K286	N276-H283 WeakPolarHBondContact CB-NE2 3.45Å; N276-H283 PolarHBondContact OD1-CE1 2.84Å; N276-H283 PolarHBondContact OD1-NE2 3.13Å; F277-H283 PolarHBondContact O-CD2 3.5Å; Y278-H283 HydrophobicContact CD1-CB 3.73Å; Y278-H283 AromaticContact CD1-CD2 3.88Å; Y278-H283 AromaticContact CD1-CG 3.86Å; Y278-H283 HydrophobicContact CE1-CB 3.64Å; Y278-H283 AromaticContact CE1-CD2 3.49Å; Y278-H283 VanDerWaalsContact CE1-CD2 3.49Å; Y278-H283 WeakPolarHBondContact CE1-CD2 3.35Å; Y278-H283 AromaticContact CE1-CG 3.37Å; Y278-H283 AromaticContact CE1-ND1 3.74Å; Y278-H283 AromaticContact CE1-NE2 3.91Å; Y278-H283 AromaticContact CZ-CD2 3.62Å; Y278-H283 AromaticContact CZ-CE1 3.84Å; Y278-H283 AromaticContact CZ-CG 3.9Å; Y278-H283 AromaticContact CZ-NE2 3.59Å; H283-L285 PolarHBondContact CD2-O 3.42Å; H283-L285 PolarHBondContact NE2-O 2.81Å; H283-K286 VanDerWaalsContact O-CE 3.29Å; H283-K286 WeakPolarHBondContact O-CE 3.42Å
284	A	90.6	Very high	89.9	Confident	26 Å²	26	61.3 Å²	61.3	22%	0.215	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	-48.7	-170.1	0	0	0	0	0	113.9	F277 Y279 F282	F277-A284 HydrophobicContact CD1-CB 4.41Å; F277-A284 PolarHBondContact O-N 3Å; Y279-A284 HydrophobicContact CD2-CB 3.84Å; Y279-A284 HydrophobicContact CE2-CB 4.05Å; F282-A284 HydrophobicContact CD1-CB 4.05Å; F282-A284 HydrophobicContact CE1-CB 3.87Å; F282-A284 PolarHBondContact O-N 3.12Å
285	L	93.2	Very high	89.7	Confident	8 Å²	8	59.5 Å²	59.5	4%	0.042	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	130.9	174.5	-59	177	0	0	0	108.6	L275 N276 F277 H283 I288 T310 L311 T314	L275-L285 HydrophobicContact CD2-CD1 4.47Å; N276-L285 CarbonylContact C-O 3.11Å; N276-L285 VanDerWaalsContact CA-O 3.26Å; N276-L285 WeakPolarHBondContact CA-O 3.37Å; F277-L285 HydrophobicContact CB-CB 3.74Å; F277-L285 HydrophobicContact CB-CD1 3.76Å; F277-L285 HydrophobicContact CB-CG 3.84Å; F277-L285 HydrophobicContact CG-CD1 4.43Å; F277-L285 PolarHBondContact N-O 3.11Å; F277-L285 PolarHBondContact O-N 3.45Å; H283-L285 PolarHBondContact CD2-O 3.42Å; H283-L285 PolarHBondContact NE2-O 2.81Å; L285-I288 HydrophobicContact CB-CG1 3.99Å; L285-T310 HydrophobicContact CD1-CG2 4.04Å; L285-T310 HydrophobicContact CG-CG2 4.2Å; L285-L311 HydrophobicContact CD1-CB 3.84Å; L285-L311 HydrophobicContact CD1-CD1 4.09Å; L285-L311 HydrophobicContact CD2-CB 4.32Å; L285-T314 HydrophobicContact CD1-CG2 4.37Å
286	K	93.6	Very high	89.2	Confident	136 Å²	136	63.9 Å²	63.9	59%	0.591	31%	0.312	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125	115	-171.7	-57.2	176.4	-175	173	0	110	N276 H283 I288	N276-K286 WeakPolarHBondContact OD1-CA 3.23Å; H283-K286 VanDerWaalsContact O-CE 3.29Å; H283-K286 WeakPolarHBondContact O-CE 3.42Å; K286-I288 VanDerWaalsContact C-N 3.3Å; K286-I288 PolarHBondContact O-N 3.11Å
287	N	91.9	Very high	88.8	Confident	101 Å²	101	64.6 Å²	64.6	54%	0.54	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	45	49.2	176.5	-61.6	-32.7	0	0	0	114.1	L275 N276 N289	L275-N287 PolarHBondContact O-N 3.49Å; N276-N287 PolarHBondContact ND2-OD1 3.42Å; N276-N287 PolarHBondContact OD1-N 3.12Å; N276-N287 PolarHBondContact OD1-OD1 2.71Å; N287-N289 PolarHBondContact O-N 3.22Å; N287-N289 PolarHBondContact O-ND2 2.8Å; N287-N289 VanDerWaalsContact O-ND2 3.11Å
288	I	91.5	Very high	88.4	Confident	48 Å²	48	65.9 Å²	65.9	25%	0.246	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	128.8	177.8	-55.4	-60.3	0	0	0	109	V272 N274 L275 L285 K286 L311	V272-I288 HydrophobicContact CG1-CG2 4.38Å; N274-I288 PolarHBondContact N-O 3.35Å; L275-I288 HydrophobicContact CB-CB 4.21Å; L275-I288 PolarHBondContact N-O 2.87Å; L275-I288 PolarHBondContact O-N 2.65Å; L285-I288 HydrophobicContact CB-CG1 3.99Å; K286-I288 VanDerWaalsContact C-N 3.3Å; K286-I288 PolarHBondContact O-N 3.11Å; I288-L311 HydrophobicContact CG2-CD1 4.14Å; I288-L311 HydrophobicContact CG2-CD2 4.46Å
289	N	88.8	Confident	88.1	Confident	85 Å²	85	65.6 Å²	65.6	46%	0.455	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	125.1	172.5	-67.1	-77.1	0	0	0	107.5	V272 R273 N274 N287	V272-N289 WeakPolarHBondContact O-CA 3.46Å; R273-N289 WeakPolarHBondContact CA-OD1 3.19Å; N274-N289 PolarHBondContact N-OD1 3.38Å; N287-N289 PolarHBondContact O-N 3.22Å; N287-N289 PolarHBondContact O-ND2 2.8Å; N287-N289 VanDerWaalsContact O-ND2 3.11Å
290	L	87.7	Confident	87.9	Confident	40 Å²	40	63.2 Å²	63.2	21%	0.209	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154	142.8	-174	170.8	71.2	0	0	0	109.6	G271 V272 R273 I292 F300 F315	G271-L290 CarbonylContact C-O 3.6Å; V272-L290 HydrophobicContact CB-CB 4.18Å; V272-L290 HydrophobicContact CG2-CB 4.45Å; V272-L290 PolarHBondContact N-O 3.34Å; V272-L290 PolarHBondContact O-N 3.15Å; R273-L290 PolarHBondContact NH1-O 3.4Å; R273-L290 VanDerWaalsContact NH1-O 3.09Å; L290-I292 HydrophobicContact CD2-CD1 4.28Å; L290-I292 HydrophobicContact CD2-CG1 4.03Å; L290-I292 HydrophobicContact CG-CG1 4.25Å; L290-F300 HydrophobicContact CD2-CE1 3.54Å; L290-F300 HydrophobicContact CD2-CZ 3.57Å; L290-F315 HydrophobicContact CD2-CZ 4.3Å
291	D	83	Confident	87.5	Confident	57 Å²	57	65.5 Å²	65.5	31%	0.305	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	136.8	167.6	-69.5	-46	0	0	0	111.3	R273	R273-D291 IonicContact CZ-OD1 3.91Å; R273-D291 IonicContact CZ-OD2 2.82Å; R273-D291 IonicContact NH1-OD1 3.57Å; R273-D291 PolarHBondContact NH1-OD1 3.06Å; R273-D291 IonicContact NH1-OD2 3.48Å; R273-D291 VanDerWaalsContact NH2-CG 3.32Å; R273-D291 IonicContact NH2-OD1 3.91Å; R273-D291 PolarHBondContact NH2-OD1 3.14Å; R273-D291 IonicContact NH2-OD2 2.79Å; R273-D291 PolarHBondContact NH2-OD2 3.04Å
292	I	83	Confident	87.1	Confident	5 Å²	5	56.6 Å²	56.6	3%	0.026	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	125.1	-179.2	-62.9	-179.2	0	0	0	109.9	A270 L290 F315 T463 E465	A270-I292 HydrophobicContact CB-CB 4.14Å; A270-I292 WeakPolarHBondContact O-CA 3.43Å; A270-I292 PolarHBondContact O-N 2.97Å; L290-I292 HydrophobicContact CD2-CD1 4.28Å; L290-I292 HydrophobicContact CD2-CG1 4.03Å; L290-I292 HydrophobicContact CG-CG1 4.25Å; I292-F315 HydrophobicContact CD1-CD1 4.17Å; I292-F315 HydrophobicContact CD1-CE1 3.35Å; I292-F315 HydrophobicContact CD1-CE2 4.18Å; I292-F315 HydrophobicContact CD1-CZ 3.38Å; I292-T463 HydrophobicContact CG2-CG2 3.64Å; I292-E465 HydrophobicContact CD1-CG 3.92Å; I292-E465 WeakPolarHBondContact CD1-OE1 3.29Å; I292-E465 VanDerWaalsContact CG1-OE1 3.27Å; I292-E465 WeakPolarHBondContact CG1-OE1 3.38Å; I292-E465 HydrophobicContact CG2-CG 4.37Å; I292-E465 VanDerWaalsContact CG2-OE1 3.24Å; I292-E465 WeakPolarHBondContact CG2-OE1 3.44Å
293	A	79.5	Confident	86.2	Confident	10 Å²	10	54.7 Å²	54.7	8%	0.083	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	116.9	-178.4	0	0	0	0	0	111.6	W264 N295 Q296 T463	W264-A293 HydrophobicContact CD2-CB 4.08Å; W264-A293 HydrophobicContact CE3-CB 4.23Å; W264-A293 HydrophobicContact CH2-CB 3.38Å; W264-A293 VanDerWaalsContact CZ2-CA 3.42Å; W264-A293 HydrophobicContact CZ2-CB 3.01Å; W264-A293 HydrophobicContact CZ3-CB 3.95Å; A293-N295 PolarHBondContact O-N 2.94Å; A293-Q296 HydrophobicContact CB-CB 3.67Å; A293-Q296 HydrophobicContact CB-CG 3.93Å; A293-Q296 PolarHBondContact O-N 3.35Å; A293-T463 VanDerWaalsContact O-CG2 3.24Å; A293-T463 WeakPolarHBondContact O-CG2 3.38Å
294	K	83.1	Confident	85.5	Confident	103 Å²	103	57.9 Å²	57.9	45%	0.448	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.5	130.9	168.3	-168.4	165.5	-174.2	170.3	0	112.9	W264 W269 Q296 T463	W264-K294 HydrophobicContact CH2-CB 3.93Å; W264-K294 VanDerWaalsContact CH2-O 3.26Å; W264-K294 WeakPolarHBondContact CH2-O 3.29Å; W264-K294 HydrophobicContact CZ3-CB 3.97Å; W269-K294 HydrophobicContact CB-CB 3.7Å; W269-K294 HydrophobicContact CB-CD 4.28Å; W269-K294 HydrophobicContact CB-CG 4.36Å; W269-K294 HydrophobicContact CG-CB 4.06Å; W269-K294 HydrophobicContact CG-CD 3.98Å; W269-K294 HydrophobicContact CG-CG 4.21Å; K294-Q296 PolarHBondContact O-N 3.37Å; K294-T463 WeakPolarHBondContact CA-OG1 3.44Å
295	N	85.2	Confident	84.9	Confident	58 Å²	58	60.4 Å²	60.4	31%	0.31	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.7	32	177.3	-66.8	46.9	0	0	0	113.3	A293 K459 Q460 Y462 T463	A293-N295 PolarHBondContact O-N 2.94Å; N295-K459 CarbonylContact C-O 3.51Å; N295-K459 WeakPolarHBondContact CA-O 3.48Å; N295-K459 WeakPolarHBondContact CB-O 3.25Å; N295-Q460 PolarHBondContact ND2-O 3.06Å; N295-Y462 WeakPolarHBondContact CA-O 3.28Å; N295-T463 PolarHBondContact N-OG1 2.85Å
296	Q	83.1	Confident	84.5	Confident	91 Å²	91	63.3 Å²	63.3	43%	0.425	37%	0.374	S	S	.	.			trans	-118.9	163	167.2	-80	-148.6	-8.6	0	0	111.9	W264 A293 K294 V464	W264-Q296 HydrophobicContact CZ2-CG 4.23Å; A293-Q296 HydrophobicContact CB-CB 3.67Å; A293-Q296 HydrophobicContact CB-CG 3.93Å; A293-Q296 PolarHBondContact O-N 3.35Å; K294-Q296 PolarHBondContact O-N 3.37Å; Q296-V464 PolarHBondContact O-N 3.11Å
297	V	86.6	Confident	84.2	Confident	34 Å²	34	57.5 Å²	57.5	21%	0.206	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	113.7	169.7	-173.5	0	0	0	0	108.2	I455 K459 V464	V297-I455 HydrophobicContact CB-CG2 4.43Å; V297-I455 HydrophobicContact CG1-CG2 3.67Å; V297-I455 HydrophobicContact CG2-CG2 3.86Å; V297-K459 HydrophobicContact CG2-CB 3.6Å; V297-K459 HydrophobicContact CG2-CD 4.2Å; V297-V464 CarbonylContact C-O 3.58Å; V297-V464 VanDerWaalsContact CA-O 3.3Å; V297-V464 WeakPolarHBondContact CA-O 3.42Å; V297-V464 HydrophobicContact CB-CB 4.47Å; V297-V464 HydrophobicContact CG1-CB 4.36Å; V297-V464 HydrophobicContact CG1-CG1 4.32Å; V297-V464 HydrophobicContact CG2-CB 4.16Å
298	T	86.8	Confident	84.1	Confident	29 Å²	29	53.5 Å²	53.5	18%	0.178	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	131.4	168.1	-45.7	0	0	0	0	108.3	F300 V464 E465 C466	T298-F300 HydrophobicContact CG2-CE1 4.28Å; T298-V464 PolarHBondContact N-O 3.15Å; T298-E465 WeakPolarHBondContact CB-OE1 3.45Å; T298-E465 WeakPolarHBondContact CB-OE2 3.15Å; T298-E465 PolarHBondContact OG1-OE1 2.91Å; T298-C466 PolarHBondContact O-N 2.68Å; T298-C466 PolarHBondContact O-SG 3.06Å; T298-C466 VanDerWaalsContact O-SG 3.34Å
299	A	87.8	Confident	84	Confident	32 Å²	32	52.6 Å²	52.6	26%	0.264	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	123	177.8	0	0	0	0	0	110.7	I301 C466 M468	A299-I301 HydrophobicContact CB-CD1 4.45Å; A299-I301 HydrophobicContact CB-CG1 4.38Å; A299-C466 CarbonylContact C-O 3.57Å; A299-C466 VanDerWaalsContact CA-O 3.31Å; A299-C466 WeakPolarHBondContact CA-O 3.21Å; A299-M468 HydrophobicContact CB-CG 4.45Å; A299-M468 HydrophobicContact CB-SD 4.3Å
300	F	87.4	Confident	84.2	Confident	28 Å²	28	49.4 Å²	49.4	12%	0.123	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	121.2	170.1	-55.8	-57.2	0	0	0	110.1	L290 T298 K308 L311 L312 F315 E465 C466 M468	L290-F300 HydrophobicContact CD2-CE1 3.54Å; L290-F300 HydrophobicContact CD2-CZ 3.57Å; T298-F300 HydrophobicContact CG2-CE1 4.28Å; F300-K308 HydrophobicContact CB-CB 4.44Å; F300-L311 HydrophobicContact CD1-CD2 4.15Å; F300-L311 HydrophobicContact CD2-CD2 4.48Å; F300-L311 HydrophobicContact CE1-CD2 3.86Å; F300-L311 HydrophobicContact CE2-CD2 4.19Å; F300-L311 HydrophobicContact CG-CD2 4.45Å; F300-L311 HydrophobicContact CZ-CD2 3.86Å; F300-L311 HydrophobicContact CZ-CG 4.46Å; F300-L312 HydrophobicContact CD2-CD1 3.73Å; F300-L312 HydrophobicContact CE2-CD1 3.99Å; F300-F315 HydrophobicContact CE2-CE2 4.38Å; F300-F315 HydrophobicContact CZ-CE2 4.32Å; F300-E465 WeakPolarHBondContact CE2-OE2 3.16Å; F300-E465 WeakPolarHBondContact CZ-OE2 3.45Å; F300-C466 PolarHBondContact N-O 3.19Å; F300-M468 PolarHBondContact O-N 3.46Å; F300-M468 VanDerWaalsContact O-N 3.08Å
301	I	82.9	Confident	84.4	Confident	77 Å²	77	48.2 Å²	48.2	40%	0.395	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	140.7	-174.4	-50.7	163.1	0	0	0	108.1	A299 M468 L471	A299-I301 HydrophobicContact CB-CD1 4.45Å; A299-I301 HydrophobicContact CB-CG1 4.38Å; I301-M468 HydrophobicContact CG1-CB 4.46Å; I301-L471 HydrophobicContact CD1-CB 4.03Å; I301-L471 HydrophobicContact CD1-CD1 3.13Å; I301-L471 HydrophobicContact CD1-CD2 4.48Å; I301-L471 HydrophobicContact CD1-CG 3.27Å
302	G	78.9	Confident	84.9	Confident	26 Å²	26	45.5 Å²	45.5	27%	0.268	29%	0.291	S	S	.	.			trans	165.7	176.6	178	0	0	0	0	0	112	K308	G302-K308 PolarHBondContact O-NZ 2.84Å
303	P	73.8	Confident	85.3	Confident	101 Å²	101	48.8 Å²	48.8	66%	0.656	30%	0.303	S	S	*	.	S	Bend	trans	-56.9	156.3	-179.8	-21.8	32.2	0	0	0	112.7	G305 C306 K308	P303-G305 PolarHBondContact O-N 3.25Å; P303-C306 PolarHBondContact O-N 2.79Å; P303-C306 PolarHBondContact O-SG 3.24Å; P303-K308 PolarHBondContact O-NZ 2.9Å
304	S	77.2	Confident	86	Confident	121 Å²	121	48.3 Å²	48.3	85%	0.846	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	139.6	170.7	-168.7	0	0	0	0	110.3
305	G	78.7	Confident	86.4	Confident	79 Å²	79	43.6 Å²	43.6	81%	0.814	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.7	0.9	179.1	0	0	0	0	0	116.8	P303 G307	P303-G305 PolarHBondContact O-N 3.25Å; G305-G307 PolarHBondContact O-N 3.35Å
306	C	83.9	Confident	86.7	Confident	68 Å²	68	41 Å²	41	46%	0.459	27%	0.265	S	S	.	.	S	Bend	trans	-77.9	-0.8	178.6	69.9	0	0	0	0	115.2	P303 K308	P303-C306 PolarHBondContact O-N 2.79Å; P303-C306 PolarHBondContact O-SG 3.24Å; C306-K308 WeakPolarHBondContact SG-CG 3.39Å
307	G	87.6	Confident	87.1	Confident	14 Å²	14	37.4 Å²	37.4	14%	0.144	25%	0.248	C	C	.	.	S	Bend	trans	100.3	11.9	175.2	0	0	0	0	0	116.2	G305 T310 L311	G305-G307 PolarHBondContact O-N 3.35Å; G307-T310 WeakPolarHBondContact O-CB 3.45Å; G307-T310 PolarHBondContact O-N 2.93Å; G307-T310 VanDerWaalsContact O-N 3.15Å; G307-L311 PolarHBondContact O-N 3.02Å
308	K	90.6	Very high	87.3	Confident	17 Å²	17	36.9 Å²	36.9	7%	0.074	24%	0.243	C	C	.	.	H	α-helix	trans	-54.8	-56.2	-178.9	-47.2	-175.5	-64.2	-89.7	0	113	F300 G302 P303 C306 T310 L311 L312 V467	F300-K308 HydrophobicContact CB-CB 4.44Å; G302-K308 PolarHBondContact O-NZ 2.84Å; P303-K308 PolarHBondContact O-NZ 2.9Å; C306-K308 WeakPolarHBondContact SG-CG 3.39Å; K308-T310 VanDerWaalsContact C-N 3.25Å; K308-T310 PolarHBondContact O-N 3.05Å; K308-L311 WeakPolarHBondContact O-CB 3.5Å; K308-L311 PolarHBondContact O-N 3.38Å; K308-L312 PolarHBondContact O-N 3.38Å; K308-V467 HydrophobicContact CB-CB 4.41Å; K308-V467 HydrophobicContact CB-CG1 3.7Å; K308-V467 HydrophobicContact CB-CG2 3.74Å; K308-V467 HydrophobicContact CD-CG1 3.78Å; K308-V467 HydrophobicContact CG-CG1 4.35Å
309	S	89	Confident	87.5	Confident	30 Å²	30	36.1 Å²	36.1	21%	0.21	24%	0.238	C	C	.	.	H	α-helix	trans	-64.5	-31.5	177.8	-48.1	0	0	0	0	112.1	L312 R313 D437	S309-L312 PolarHBondContact O-N 3.48Å; S309-R313 WeakPolarHBondContact O-CB 3.44Å; S309-R313 WeakPolarHBondContact O-CG 3.43Å; S309-R313 PolarHBondContact O-N 3.28Å; S309-D437 VanDerWaalsContact CB-OD1 3.25Å; S309-D437 WeakPolarHBondContact CB-OD1 3.09Å; S309-D437 WeakPolarHBondContact CB-OD2 3.49Å; S309-D437 PolarHBondContact OG-OD1 3.03Å
310	T	91.5	Very high	87.6	Confident	17 Å²	17	38.5 Å²	38.5	10%	0.104	24%	0.243	C	C	.	.	H	α-helix	trans	-63.7	-48.4	173.9	-55.6	0	0	0	0	110.6	F277 Y279 L285 G307 K308 L312 R313 T314	F277-T310 HydrophobicContact CB-CG2 4.43Å; F277-T310 HydrophobicContact CD1-CG2 3.3Å; F277-T310 HydrophobicContact CD2-CG2 4.35Å; F277-T310 HydrophobicContact CE1-CG2 3.52Å; F277-T310 HydrophobicContact CG-CG2 3.77Å; F277-T310 HydrophobicContact CZ-CG2 4.13Å; Y279-T310 HydrophobicContact CE2-CG2 3.76Å; Y279-T310 WeakPolarHBondContact OH-CG2 3.44Å; Y279-T310 PolarHBondContact OH-OG1 3.26Å; L285-T310 HydrophobicContact CD1-CG2 4.04Å; L285-T310 HydrophobicContact CG-CG2 4.2Å; G307-T310 WeakPolarHBondContact O-CB 3.45Å; G307-T310 PolarHBondContact O-N 2.93Å; G307-T310 VanDerWaalsContact O-N 3.15Å; K308-T310 VanDerWaalsContact C-N 3.25Å; K308-T310 PolarHBondContact O-N 3.05Å; T310-L312 VanDerWaalsContact C-N 3.32Å; T310-L312 PolarHBondContact O-N 3.41Å; T310-R313 PolarHBondContact O-N 3.15Å; T310-T314 WeakPolarHBondContact O-CG2 3.45Å; T310-T314 PolarHBondContact O-N 3.49Å
311	L	93.7	Very high	87.6	Confident	15 Å²	15	42 Å²	42	8%	0.079	26%	0.263	C	S	.	.	H	α-helix	trans	-58	-48	176.4	176.5	62	0	0	0	110.3	L275 L285 I288 F300 G307 K308 R313 T314 F315	L275-L311 HydrophobicContact CD2-CD1 3.67Å; L285-L311 HydrophobicContact CD1-CB 3.84Å; L285-L311 HydrophobicContact CD1-CD1 4.09Å; L285-L311 HydrophobicContact CD2-CB 4.32Å; I288-L311 HydrophobicContact CG2-CD1 4.14Å; I288-L311 HydrophobicContact CG2-CD2 4.46Å; F300-L311 HydrophobicContact CD1-CD2 4.15Å; F300-L311 HydrophobicContact CD2-CD2 4.48Å; F300-L311 HydrophobicContact CE1-CD2 3.86Å; F300-L311 HydrophobicContact CE2-CD2 4.19Å; F300-L311 HydrophobicContact CG-CD2 4.45Å; F300-L311 HydrophobicContact CZ-CD2 3.86Å; F300-L311 HydrophobicContact CZ-CG 4.46Å; G307-L311 PolarHBondContact O-N 3.02Å; K308-L311 WeakPolarHBondContact O-CB 3.5Å; K308-L311 PolarHBondContact O-N 3.38Å; L311-R313 VanDerWaalsContact C-N 3.29Å; L311-R313 PolarHBondContact O-N 3.44Å; L311-T314 WeakPolarHBondContact O-CB 3.38Å; L311-T314 PolarHBondContact O-N 2.94Å; L311-T314 PolarHBondContact O-OG1 2.86Å; L311-F315 HydrophobicContact CD1-CE2 4.43Å; L311-F315 HydrophobicContact CG-CE2 4.28Å
312	L	92.6	Very high	88	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-59	-40.8	-179	-137.1	130.8	0	0	0	112	F300 K308 S309 T310 T314 F315 M354 L435 V467	F300-L312 HydrophobicContact CD2-CD1 3.73Å; F300-L312 HydrophobicContact CE2-CD1 3.99Å; K308-L312 PolarHBondContact O-N 3.38Å; S309-L312 PolarHBondContact O-N 3.48Å; T310-L312 VanDerWaalsContact C-N 3.32Å; T310-L312 PolarHBondContact O-N 3.41Å; L312-T314 PolarHBondContact O-N 3.3Å; L312-F315 PolarHBondContact O-N 2.82Å; L312-M354 HydrophobicContact CD2-CE 3.9Å; L312-L435 HydrophobicContact CD2-CB 3.47Å; L312-L435 VanDerWaalsContact CD2-CB 3.47Å; L312-L435 HydrophobicContact CD2-CD1 4.32Å; L312-L435 HydrophobicContact CD2-CD2 4.07Å; L312-L435 HydrophobicContact CD2-CG 4.15Å; L312-L435 HydrophobicContact CG-CD2 4.38Å; L312-L435 WeakPolarHBondContact O-CD1 3.39Å; L312-V467 HydrophobicContact CB-CG2 4.42Å; L312-V467 HydrophobicContact CD1-CB 4.4Å; L312-V467 HydrophobicContact CD1-CG2 3.4Å; L312-V467 HydrophobicContact CG-CG2 4.45Å
313	R	92.1	Very high	88.4	Confident	74 Å²	74	48.1 Å²	48.1	28%	0.279	29%	0.288	S	S	.	.	H	α-helix	trans	-69.8	-14.3	176.9	-71.2	172.8	-170	-158.9	3.8	114.7	S309 T310 L311 N316 M318 M354 D437	S309-R313 WeakPolarHBondContact O-CB 3.44Å; S309-R313 WeakPolarHBondContact O-CG 3.43Å; S309-R313 PolarHBondContact O-N 3.28Å; T310-R313 PolarHBondContact O-N 3.15Å; L311-R313 VanDerWaalsContact C-N 3.29Å; L311-R313 PolarHBondContact O-N 3.44Å; R313-N316 PolarHBondContact O-OD1 3.44Å; R313-M318 HydrophobicContact CB-CB 4.15Å; R313-M318 HydrophobicContact CG-CB 4.37Å; R313-M318 PolarHBondContact O-N 3.45Å; R313-M354 HydrophobicContact CG-CE 3.74Å; R313-M354 HydrophobicContact CG-SD 4.17Å; R313-D437 IonicContact NH2-OD2 3.12Å
314	T	93.2	Very high	89.1	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-73.5	-33	176.9	65.3	0	0	0	0	112.4	L275 F277 L285 T310 L311 L312 N316 K317	L275-T314 HydrophobicContact CD2-CG2 4.38Å; F277-T314 HydrophobicContact CD2-CG2 3.55Å; F277-T314 HydrophobicContact CE2-CG2 3.98Å; F277-T314 HydrophobicContact CG-CG2 4.37Å; L285-T314 HydrophobicContact CD1-CG2 4.37Å; T310-T314 WeakPolarHBondContact O-CG2 3.45Å; T310-T314 PolarHBondContact O-N 3.49Å; L311-T314 WeakPolarHBondContact O-CB 3.38Å; L311-T314 PolarHBondContact O-N 2.94Å; L311-T314 PolarHBondContact O-OG1 2.86Å; L312-T314 PolarHBondContact O-N 3.3Å; T314-N316 VanDerWaalsContact C-N 3.26Å; T314-N316 PolarHBondContact O-N 2.93Å; T314-K317 PolarHBondContact O-N 3.27Å; T314-K317 VanDerWaalsContact O-N 3.1Å
315	F	92.1	Very high	89.9	Confident	4 Å²	4	47.6 Å²	47.6	2%	0.018	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-24.1	-176.3	-70.2	-68.5	0	0	0	115	V272 L290 I292 F300 L311 L312 I331 I338 V352 L435	V272-F315 HydrophobicContact CG2-CE1 3.37Å; V272-F315 HydrophobicContact CG2-CZ 3.55Å; L290-F315 HydrophobicContact CD2-CZ 4.3Å; I292-F315 HydrophobicContact CD1-CD1 4.17Å; I292-F315 HydrophobicContact CD1-CE1 3.35Å; I292-F315 HydrophobicContact CD1-CE2 4.18Å; I292-F315 HydrophobicContact CD1-CZ 3.38Å; F300-F315 HydrophobicContact CE2-CE2 4.38Å; F300-F315 HydrophobicContact CZ-CE2 4.32Å; L311-F315 HydrophobicContact CD1-CE2 4.43Å; L311-F315 HydrophobicContact CG-CE2 4.28Å; L312-F315 PolarHBondContact O-N 2.82Å; F315-I331 HydrophobicContact CD1-CG2 3.76Å; F315-I331 HydrophobicContact CE1-CG2 4.05Å; F315-I338 WeakPolarHBondContact O-CD1 3.39Å; F315-V352 HydrophobicContact CB-CG1 4.21Å; F315-L435 HydrophobicContact CB-CD1 4Å; F315-L435 HydrophobicContact CB-CD2 4.2Å; F315-L435 HydrophobicContact CD2-CD2 4.29Å
316	N	91.3	Very high	90.6	Very high	3 Å²	3	48.8 Å²	48.8	2%	0.016	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-119.6	17.5	175	70.3	0.8	0	0	0	113.2	R313 T314 M318 R349 V352 M354 L435	R313-N316 PolarHBondContact O-OD1 3.44Å; T314-N316 VanDerWaalsContact C-N 3.26Å; T314-N316 PolarHBondContact O-N 2.93Å; N316-M318 VanDerWaalsContact C-N 3.28Å; N316-M318 HydrophobicContact CB-CE 4.33Å; N316-M318 VanDerWaalsContact CG-CE 3.46Å; N316-M318 WeakPolarHBondContact ND2-CE 3.46Å; N316-M318 PolarHBondContact O-N 3.32Å; N316-M318 WeakPolarHBondContact OD1-CB 3.42Å; N316-M318 WeakPolarHBondContact OD1-CE 3.43Å; N316-M318 PolarHBondContact OD1-N 3.06Å; N316-R349 HydrophobicContact CB-CG 4.31Å; N316-R349 PolarHBondContact O-NE 3.37Å; N316-V352 HydrophobicContact CB-CB 4.04Å; N316-V352 HydrophobicContact CB-CG1 3.88Å; N316-M354 WeakPolarHBondContact ND2-CB 3.35Å; N316-L435 HydrophobicContact CB-CD1 4.23Å
317	K	91.9	Very high	91.1	Very high	16 Å²	16	46.5 Å²	46.5	7%	0.07	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.1	42.5	179.8	-52.2	-177.8	93.2	-171.1	0	113.5	T314 F319 E320 I338 L339 L348 R349	T314-K317 PolarHBondContact O-N 3.27Å; T314-K317 VanDerWaalsContact O-N 3.1Å; K317-F319 HydrophobicContact CB-CE1 4.02Å; K317-F319 HydrophobicContact CB-CZ 4.4Å; K317-F319 HydrophobicContact CG-CE1 4.21Å; K317-F319 PolarHBondContact O-N 3.43Å; K317-E320 HydrophobicContact CB-CG 4.28Å; K317-E320 WeakPolarHBondContact CE-OE1 3.16Å; K317-E320 IonicContact NZ-OE1 3.48Å; K317-E320 PolarHBondContact NZ-OE1 3.41Å; K317-E320 PolarHBondContact O-N 3.41Å; K317-I338 WeakPolarHBondContact CD-O 3.37Å; K317-I338 WeakPolarHBondContact CE-O 3.32Å; K317-I338 HydrophobicContact CG-CD1 4.5Å; K317-I338 PolarHBondContact NZ-O 2.96Å; K317-L339 PolarHBondContact NZ-O 3.28Å; K317-L348 HydrophobicContact CD-CD2 3.79Å; K317-L348 HydrophobicContact CG-CD2 3.83Å; K317-R349 PolarHBondContact O-NH2 3.23Å
318	M	90.5	Very high	91.3	Very high	23 Å²	23	49.6 Å²	49.6	11%	0.113	24%	0.24	C	C	.	.	G	3₁₀ helix	trans	-69.8	-20.7	179.3	-143.7	43.8	49	0	0	113	R313 N316 E320 L321 R349	R313-M318 HydrophobicContact CB-CB 4.15Å; R313-M318 HydrophobicContact CG-CB 4.37Å; R313-M318 PolarHBondContact O-N 3.45Å; N316-M318 VanDerWaalsContact C-N 3.28Å; N316-M318 HydrophobicContact CB-CE 4.33Å; N316-M318 VanDerWaalsContact CG-CE 3.46Å; N316-M318 WeakPolarHBondContact ND2-CE 3.46Å; N316-M318 PolarHBondContact O-N 3.32Å; N316-M318 WeakPolarHBondContact OD1-CB 3.42Å; N316-M318 WeakPolarHBondContact OD1-CE 3.43Å; N316-M318 PolarHBondContact OD1-N 3.06Å; M318-E320 PolarHBondContact O-N 3.36Å; M318-L321 HydrophobicContact CG-CD1 4.13Å; M318-L321 WeakPolarHBondContact O-CB 3.44Å; M318-L321 PolarHBondContact O-N 2.99Å; M318-L321 HydrophobicContact SD-CD1 3.34Å; M318-L321 WeakPolarHBondContact SD-CD1 3.48Å; M318-L321 HydrophobicContact SD-CG 4.15Å; M318-R349 HydrophobicContact CE-CG 3.89Å
319	F	90.6	Very high	91.4	Very high	13 Å²	13	50.3 Å²	50.3	6%	0.057	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-62.4	-26.8	175.7	66.3	-94	0	0	0	113.6	F277 K317 L321 Y322 Q325 A327 L339	F277-F319 HydrophobicContact CE2-CB 3.49Å; F277-F319 VanDerWaalsContact CE2-CB 3.49Å; F277-F319 AromaticContact CE2-CD1 3.79Å; F277-F319 HydrophobicContact CE2-CD1 3.79Å; F277-F319 HydrophobicContact CE2-CD2 4.15Å; F277-F319 AromaticContact CE2-CG 3.56Å; F277-F319 HydrophobicContact CE2-CG 3.56Å; F277-F319 HydrophobicContact CZ-CB 3.53Å; F277-F319 HydrophobicContact CZ-CG 4.12Å; K317-F319 HydrophobicContact CB-CE1 4.02Å; K317-F319 HydrophobicContact CB-CZ 4.4Å; K317-F319 HydrophobicContact CG-CE1 4.21Å; K317-F319 PolarHBondContact O-N 3.43Å; F319-L321 PolarHBondContact O-N 3.08Å; F319-L321 VanDerWaalsContact O-N 3.16Å; F319-Y322 PolarHBondContact O-N 3.21Å; F319-Q325 HydrophobicContact CB-CB 4.01Å; F319-Q325 HydrophobicContact CD2-CB 4.42Å; F319-A327 HydrophobicContact CE1-CB 3.88Å; F319-A327 HydrophobicContact CE2-CB 4.17Å; F319-A327 HydrophobicContact CZ-CB 3.63Å; F319-L339 HydrophobicContact CE1-CD2 4.24Å; F319-L339 HydrophobicContact CZ-CD2 4.06Å
320	E	89.2	Confident	91.4	Very high	83 Å²	83	53.3 Å²	53.3	39%	0.388	26%	0.264	S	S	.	.	G	3₁₀ helix	trans	-66.5	-15.2	178.8	-68.6	-177.8	163.8	0	0	113.3	K317 M318 Y322 I345	K317-E320 HydrophobicContact CB-CG 4.28Å; K317-E320 WeakPolarHBondContact CE-OE1 3.16Å; K317-E320 IonicContact NZ-OE1 3.48Å; K317-E320 PolarHBondContact NZ-OE1 3.41Å; K317-E320 PolarHBondContact O-N 3.41Å; M318-E320 PolarHBondContact O-N 3.36Å; E320-Y322 PolarHBondContact O-N 2.86Å; E320-I345 WeakPolarHBondContact OE2-CD1 3.49Å
321	L	89.3	Confident	91.3	Very high	101 Å²	101	52.5 Å²	52.5	53%	0.529	26%	0.259	S	S	.	.	G	3₁₀ helix	trans	-70.8	-16.8	172.4	-67.6	178.2	0	0	0	113.1	M318 F319	M318-L321 HydrophobicContact CG-CD1 4.13Å; M318-L321 WeakPolarHBondContact O-CB 3.44Å; M318-L321 PolarHBondContact O-N 2.99Å; M318-L321 HydrophobicContact SD-CD1 3.34Å; M318-L321 WeakPolarHBondContact SD-CD1 3.48Å; M318-L321 HydrophobicContact SD-CG 4.15Å; F319-L321 PolarHBondContact O-N 3.08Å; F319-L321 VanDerWaalsContact O-N 3.16Å
322	Y	89.4	Confident	91	Very high	116 Å²	116	54.3 Å²	54.3	46%	0.455	27%	0.268	S	S	.	.	S	Bend	trans	-116.9	131.9	-173.7	-58.4	-78.3	0	0	0	110.2	F319 E320	F319-Y322 PolarHBondContact O-N 3.21Å; E320-Y322 PolarHBondContact O-N 2.86Å
323	P	87.7	Confident	90.6	Very high	115 Å²	115	54.9 Å²	54.9	75%	0.747	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	155	175.3	25.9	-31.9	0	0	0	111.1	Q325	P323-Q325 PolarHBondContact O-N 3.27Å
324	E	89.9	Confident	89.9	Confident	164 Å²	164	55.3 Å²	55.3	77%	0.766	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.3	12.5	178.6	-49.7	-168.8	162.8	0	0	116.1	G280	G280-E324 VanDerWaalsContact CA-O 3.26Å; G280-E324 WeakPolarHBondContact CA-O 3.22Å; G280-E324 PolarHBondContact N-O 3.44Å
325	Q	93.7	Very high	89	Confident	47 Å²	47	58.2 Å²	58.2	22%	0.22	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	137	172.1	-61	-176.5	25.1	0	0	110.9	F277 Y278 Y279 F319 P323	F277-Q325 HydrophobicContact CZ-CB 4.05Å; F277-Q325 HydrophobicContact CZ-CG 4.49Å; Y278-Q325 WeakPolarHBondContact O-CA 3.44Å; Y279-Q325 HydrophobicContact CD1-CG 3.79Å; Y279-Q325 VanDerWaalsContact CE1-CD 3.48Å; Y279-Q325 HydrophobicContact CE1-CG 4.12Å; F319-Q325 HydrophobicContact CB-CB 4.01Å; F319-Q325 HydrophobicContact CD2-CB 4.42Å; P323-Q325 PolarHBondContact O-N 3.27Å
326	R	93.2	Very high	88.5	Confident	104 Å²	104	61.8 Å²	61.8	39%	0.392	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	144.8	178.6	68.3	-172.8	-162	105.5	15.5	111.6	Y278 E328	Y278-R326 HydrophobicContact CD2-CG 3.87Å; Y278-R326 HydrophobicContact CG-CG 4.22Å; Y278-R326 PolarHBondContact N-O 2.86Å; Y278-R326 PolarHBondContact O-N 3.23Å; R326-E328 IonicContact CZ-OE1 3.61Å; R326-E328 IonicContact CZ-OE2 3.02Å; R326-E328 IonicContact NH1-OE1 2.81Å; R326-E328 PolarHBondContact NH1-OE1 2.87Å; R326-E328 IonicContact NH1-OE2 3.52Å; R326-E328 PolarHBondContact NH1-OE2 3.36Å; R326-E328 IonicContact NH2-OE1 2.62Å; R326-E328 IonicContact NH2-OE2 3.39Å; R326-E328 PolarHBondContact NH2-OE2 2.96Å
327	A	93.7	Very high	88.3	Confident	20 Å²	20	62.7 Å²	62.7	17%	0.165	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	138.4	171.8	0	0	0	0	0	109.6	L275 N276 F277 F319 L339	L275-A327 HydrophobicContact CD1-CB 4.28Å; N276-A327 CarbonylContact O-C 3.53Å; N276-A327 WeakPolarHBondContact O-CA 3.49Å; F277-A327 HydrophobicContact CD2-CB 3.95Å; F277-A327 HydrophobicContact CE2-CB 4.47Å; F319-A327 HydrophobicContact CE1-CB 3.88Å; F319-A327 HydrophobicContact CE2-CB 4.17Å; F319-A327 HydrophobicContact CZ-CB 3.63Å; A327-L339 HydrophobicContact CB-CD1 4.14Å; A327-L339 HydrophobicContact CB-CD2 3.95Å
328	E	93.1	Very high	88.2	Confident	79 Å²	79	62.4 Å²	62.4	37%	0.369	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	151	176.5	-63.5	-178	134.6	0	0	109.6	L275 N276 Y278 R326	L275-E328 CarbonylContact C-O 3.54Å; L275-E328 WeakPolarHBondContact CA-O 3.5Å; N276-E328 HydrophobicContact CB-CB 4.37Å; N276-E328 PolarHBondContact N-O 2.89Å; N276-E328 PolarHBondContact O-N 3.48Å; Y278-E328 HydrophobicContact CE2-CG 4.33Å; Y278-E328 WeakPolarHBondContact CE2-OE2 3.48Å; Y278-E328 PolarHBondContact OH-OE2 3.38Å; R326-E328 IonicContact CZ-OE1 3.61Å; R326-E328 IonicContact CZ-OE2 3.02Å; R326-E328 IonicContact NH1-OE1 2.81Å; R326-E328 PolarHBondContact NH1-OE1 2.87Å; R326-E328 IonicContact NH1-OE2 3.52Å; R326-E328 PolarHBondContact NH1-OE2 3.36Å; R326-E328 IonicContact NH2-OE1 2.62Å; R326-E328 IonicContact NH2-OE2 3.39Å; R326-E328 PolarHBondContact NH2-OE2 2.96Å
329	G	91	Very high	88.2	Confident	33 Å²	33	62.7 Å²	62.7	34%	0.34	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	108.6	-150.4	-175	0	0	0	0	0	111.5
330	E	89.3	Confident	87.9	Confident	93 Å²	93	67.4 Å²	67.4	44%	0.435	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	133.1	-176.3	-48.9	-173.6	149.7	0	0	111.3	V272 R273 N337	V272-E330 WeakPolarHBondContact CA-O 3.49Å; R273-E330 HydrophobicContact CB-CB 4.29Å; R273-E330 PolarHBondContact N-O 2.96Å; R273-E330 PolarHBondContact O-N 2.94Å; E330-N337 WeakPolarHBondContact CG-ND2 3.45Å
331	I	90.5	Very high	87.3	Confident	0 Å²	0	65.7 Å²	65.7	0%	0	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	101	165.7	-59.1	174.8	0	0	0	106	G271 V272 L275 F315 N337 I338 L339	G271-I331 CarbonylContact O-C 3.53Å; V272-I331 HydrophobicContact CG1-CG1 4.46Å; V272-I331 HydrophobicContact CG2-CG1 4.48Å; L275-I331 HydrophobicContact CD1-CD1 3.91Å; L275-I331 HydrophobicContact CD1-CG1 4Å; L275-I331 HydrophobicContact CD2-CD1 4.18Å; L275-I331 HydrophobicContact CD2-CG1 4.41Å; F315-I331 HydrophobicContact CD1-CG2 3.76Å; F315-I331 HydrophobicContact CE1-CG2 4.05Å; I331-N337 PolarHBondContact N-OD1 2.87Å; I331-N337 VanDerWaalsContact N-OD1 3.13Å; I331-N337 CarbonylContact O-C 3.48Å; I331-N337 VanDerWaalsContact O-CA 3.31Å; I331-N337 WeakPolarHBondContact O-CA 3.35Å; I331-N337 PolarHBondContact O-OD1 3.06Å; I331-I338 HydrophobicContact CB-CD1 4.01Å; I331-I338 HydrophobicContact CB-CG1 3.72Å; I331-I338 HydrophobicContact CD1-CD1 4.45Å; I331-I338 HydrophobicContact CG2-CD1 3.6Å; I331-I338 HydrophobicContact CG2-CG1 3.79Å; I331-I338 WeakPolarHBondContact O-CG1 3.41Å; I331-I338 PolarHBondContact O-N 3.4Å; I331-L339 HydrophobicContact CB-CG 4.4Å; I331-L339 HydrophobicContact CD1-CD1 4.2Å; I331-L339 HydrophobicContact CD1-CD2 4.11Å; I331-L339 HydrophobicContact CD1-CG 4.17Å; I331-L339 HydrophobicContact CG1-CD1 4.06Å; I331-L339 HydrophobicContact CG1-CG 4.2Å
332	L	87	Confident	86.4	Confident	53 Å²	53	66.6 Å²	66.6	28%	0.277	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	127.7	-179.8	-59.5	169.5	0	0	0	108.9	A270 G271 D336 N337	A270-L332 CarbonylContact C-O 3.54Å; A270-L332 WeakPolarHBondContact CA-O 3.36Å; A270-L332 VanDerWaalsContact CB-O 3.22Å; A270-L332 WeakPolarHBondContact CB-O 3.33Å; G271-L332 PolarHBondContact N-O 2.91Å; G271-L332 PolarHBondContact O-N 3.4Å; L332-D336 CarbonylContact C-O 3.51Å; L332-D336 WeakPolarHBondContact CA-O 3.45Å; L332-N337 HydrophobicContact CD2-CB 4Å
333	L	83.6	Confident	85.5	Confident	11 Å²	11	65.6 Å²	65.6	6%	0.058	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	121.8	173.9	-155.4	105.3	0	0	0	107.2	W269 A270 G335 D336 I338 V352	W269-L333 HydrophobicContact CH2-CD1 3.48Å; W269-L333 VanDerWaalsContact CH2-CD1 3.48Å; W269-L333 HydrophobicContact CH2-CD2 3.82Å; W269-L333 HydrophobicContact CH2-CG 3.47Å; W269-L333 VanDerWaalsContact CH2-CG 3.47Å; W269-L333 HydrophobicContact CZ2-CD1 4.43Å; W269-L333 HydrophobicContact CZ2-CD2 4.14Å; W269-L333 HydrophobicContact CZ2-CG 3.95Å; W269-L333 HydrophobicContact CZ3-CD1 3.71Å; W269-L333 HydrophobicContact CZ3-CG 4.06Å; A270-L333 HydrophobicContact CB-CD1 3.88Å; A270-L333 HydrophobicContact CB-CG 4.41Å; L333-G335 PolarHBondContact O-N 3.49Å; L333-G335 VanDerWaalsContact O-N 3.16Å; L333-D336 PolarHBondContact N-O 3.27Å; L333-D336 PolarHBondContact O-N 2.89Å; L333-I338 HydrophobicContact CB-CG2 3.8Å; L333-V352 HydrophobicContact CD1-CG2 4.18Å; L333-V352 HydrophobicContact CD2-CG2 3.98Å
334	D	77.9	Confident	85.3	Confident	83 Å²	83	64.8 Å²	64.8	44%	0.444	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.1	28.5	-170.1	-67	-46.7	0	0	0	113.7	W269 D336 K351	W269-D334 PolarHBondContact NE1-OD1 2.82Å; W269-D334 PolarHBondContact O-N 3.21Å; W269-D334 VanDerWaalsContact O-N 3.07Å; D334-D336 VanDerWaalsContact C-N 3.28Å; D334-D336 PolarHBondContact O-N 3.25Å; D334-K351 IonicContact OD2-NZ 3.41Å; D334-K351 PolarHBondContact OD2-NZ 3.35Å
335	G	74.7	Confident	85.2	Confident	61 Å²	61	59.9 Å²	59.9	63%	0.629	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.9	-5.9	-176.5	0	0	0	0	0	115.4	L333	L333-G335 PolarHBondContact O-N 3.49Å; L333-G335 VanDerWaalsContact O-N 3.16Å
336	D	80.8	Confident	84.8	Confident	80 Å²	80	60 Å²	60	43%	0.428	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	133.3	176.2	-83.7	-17.6	0	0	0	111.4	L332 L333 D334 I338 N341	L332-D336 CarbonylContact C-O 3.51Å; L332-D336 WeakPolarHBondContact CA-O 3.45Å; L333-D336 PolarHBondContact N-O 3.27Å; L333-D336 PolarHBondContact O-N 2.89Å; D334-D336 VanDerWaalsContact C-N 3.28Å; D334-D336 PolarHBondContact O-N 3.25Å; D336-I338 PolarHBondContact O-N 3.45Å; D336-N341 PolarHBondContact OD2-ND2 3.12Å
337	N	87.8	Confident	84.5	Confident	22 Å²	22	59.9 Å²	59.9	12%	0.118	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	106.9	173.6	-177.2	-0.7	0	0	0	111.3	E330 I331 L332 L339 T340 N341	E330-N337 WeakPolarHBondContact CG-ND2 3.45Å; I331-N337 PolarHBondContact N-OD1 2.87Å; I331-N337 VanDerWaalsContact N-OD1 3.13Å; I331-N337 CarbonylContact O-C 3.48Å; I331-N337 VanDerWaalsContact O-CA 3.31Å; I331-N337 WeakPolarHBondContact O-CA 3.35Å; I331-N337 PolarHBondContact O-OD1 3.06Å; L332-N337 HydrophobicContact CD2-CB 4Å; N337-L339 PolarHBondContact O-N 3.23Å; N337-L339 PolarHBondContact OD1-N 2.85Å; N337-L339 VanDerWaalsContact OD1-N 3.1Å; N337-T340 PolarHBondContact O-N 2.92Å; N337-T340 PolarHBondContact O-OG1 3.4Å; N337-N341 WeakPolarHBondContact O-CB 3.47Å; N337-N341 PolarHBondContact O-N 3.31Å
338	I	90.4	Very high	84.3	Confident	10 Å²	10	59.3 Å²	59.3	5%	0.051	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-18.7	-175.7	68.2	169.8	0	0	0	113.8	F315 K317 I331 L333 D336 L348	F315-I338 WeakPolarHBondContact O-CD1 3.39Å; K317-I338 WeakPolarHBondContact CD-O 3.37Å; K317-I338 WeakPolarHBondContact CE-O 3.32Å; K317-I338 HydrophobicContact CG-CD1 4.5Å; K317-I338 PolarHBondContact NZ-O 2.96Å; I331-I338 HydrophobicContact CB-CD1 4.01Å; I331-I338 HydrophobicContact CB-CG1 3.72Å; I331-I338 HydrophobicContact CD1-CD1 4.45Å; I331-I338 HydrophobicContact CG2-CD1 3.6Å; I331-I338 HydrophobicContact CG2-CG1 3.79Å; I331-I338 WeakPolarHBondContact O-CG1 3.41Å; I331-I338 PolarHBondContact O-N 3.4Å; L333-I338 HydrophobicContact CB-CG2 3.8Å; D336-I338 PolarHBondContact O-N 3.45Å; I338-L348 HydrophobicContact CB-CD1 4.37Å; I338-L348 HydrophobicContact CB-CD2 4.23Å; I338-L348 HydrophobicContact CD1-CD1 4.46Å; I338-L348 HydrophobicContact CD1-CD2 4.28Å; I338-L348 HydrophobicContact CG2-CD1 3.9Å
339	L	88.8	Confident	84.2	Confident	28 Å²	28	58.7 Å²	58.7	15%	0.147	34%	0.344	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-36.8	179.7	-65.9	-177.2	0	0	0	111.9	L275 K317 F319 A327 I331 N337	L275-L339 HydrophobicContact CD1-CD1 3.93Å; K317-L339 PolarHBondContact NZ-O 3.28Å; F319-L339 HydrophobicContact CE1-CD2 4.24Å; F319-L339 HydrophobicContact CZ-CD2 4.06Å; A327-L339 HydrophobicContact CB-CD1 4.14Å; A327-L339 HydrophobicContact CB-CD2 3.95Å; I331-L339 HydrophobicContact CB-CG 4.4Å; I331-L339 HydrophobicContact CD1-CD1 4.2Å; I331-L339 HydrophobicContact CD1-CD2 4.11Å; I331-L339 HydrophobicContact CD1-CG 4.17Å; I331-L339 HydrophobicContact CG1-CD1 4.06Å; I331-L339 HydrophobicContact CG1-CG 4.2Å; N337-L339 PolarHBondContact O-N 3.23Å; N337-L339 PolarHBondContact OD1-N 2.85Å; N337-L339 VanDerWaalsContact OD1-N 3.1Å
340	T	85.2	Confident	84.1	Confident	112 Å²	112	58 Å²	58	69%	0.687	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.9	-21.9	-178.7	53.5	0	0	0	0	113.3	N337	N337-T340 PolarHBondContact O-N 2.92Å; N337-T340 PolarHBondContact O-OG1 3.4Å
341	N	76	Confident	84	Confident	47 Å²	47	56.7 Å²	56.7	25%	0.251	33%	0.328	S	S	.	.			trans	-68.5	138.3	-178.8	-164.3	-14	0	0	0	111.2	D336 N337 Q343	D336-N341 PolarHBondContact OD2-ND2 3.12Å; N337-N341 WeakPolarHBondContact O-CB 3.47Å; N337-N341 PolarHBondContact O-N 3.31Å; N341-Q343 PolarHBondContact O-N 2.91Å; N341-Q343 PolarHBondContact OD1-N 3.4Å
342	S	70.3	Confident	84.1	Confident	121 Å²	121	56.7 Å²	56.7	85%	0.846	33%	0.328	S	S	*	.			trans	-87	22.6	176.3	56.2	0	0	0	0	113.1
343	Q	71.8	Confident	84.3	Confident	94 Å²	94	54.3 Å²	54.3	44%	0.439	32%	0.316	S	S	.	.			trans	-59.9	149.7	173	-86.4	-173.6	18.1	0	0	111	N341 I345	N341-Q343 PolarHBondContact O-N 2.91Å; N341-Q343 PolarHBondContact OD1-N 3.4Å; Q343-I345 PolarHBondContact O-N 3.29Å; Q343-I345 VanDerWaalsContact O-N 3.17Å
344	D	82	Confident	84.8	Confident	99 Å²	99	55.2 Å²	55.2	53%	0.529	32%	0.32	S	S	.	.			trans	-60.4	119.3	174.2	-170.3	-24.7	0	0	0	109.9	A346 L347 L348	D344-A346 PolarHBondContact O-N 3.38Å; D344-A346 VanDerWaalsContact O-N 3.17Å; D344-A346 VanDerWaalsContact OD1-CB 3.31Å; D344-A346 WeakPolarHBondContact OD1-CB 3.39Å; D344-A346 PolarHBondContact OD1-N 2.98Å; D344-L347 HydrophobicContact CB-CB 4.39Å; D344-L347 HydrophobicContact CB-CD1 4.06Å; D344-L347 HydrophobicContact CB-CG 4.19Å; D344-L347 WeakPolarHBondContact O-CB 3.49Å; D344-L347 PolarHBondContact O-N 2.89Å; D344-L348 PolarHBondContact O-N 2.94Å; D344-L348 VanDerWaalsContact O-N 3.09Å
345	I	87.9	Confident	85.5	Confident	60 Å²	60	51.5 Å²	51.5	31%	0.308	30%	0.3	S	S	.	.	H	α-helix	trans	-54.6	-32.6	177.5	-86.1	148.4	0	0	0	112.2	E320 Q343 L348 R349	E320-I345 WeakPolarHBondContact OE2-CD1 3.49Å; Q343-I345 PolarHBondContact O-N 3.29Å; Q343-I345 VanDerWaalsContact O-N 3.17Å; I345-L348 PolarHBondContact O-N 2.89Å; I345-R349 VanDerWaalsContact CG2-CZ 3.46Å; I345-R349 WeakPolarHBondContact O-CB 3.26Å; I345-R349 VanDerWaalsContact O-CG 3.28Å; I345-R349 WeakPolarHBondContact O-CG 3.47Å; I345-R349 PolarHBondContact O-N 3.27Å
346	A	86.4	Confident	86.3	Confident	49 Å²	49	52.1 Å²	52.1	41%	0.405	29%	0.286	S	S	.	.	H	α-helix	trans	-65.3	-39.8	176.7	0	0	0	0	0	111.7	D344 R349 A350	D344-A346 PolarHBondContact O-N 3.38Å; D344-A346 VanDerWaalsContact O-N 3.17Å; D344-A346 VanDerWaalsContact OD1-CB 3.31Å; D344-A346 WeakPolarHBondContact OD1-CB 3.39Å; D344-A346 PolarHBondContact OD1-N 2.98Å; A346-R349 PolarHBondContact O-N 3.28Å; A346-A350 PolarHBondContact O-N 3.38Å; A346-A350 VanDerWaalsContact O-N 3.07Å
347	L	86.4	Confident	86.6	Confident	102 Å²	102	52 Å²	52	53%	0.534	28%	0.283	S	S	.	.	H	α-helix	trans	-69.5	-41.7	176.2	-70.2	173.7	0	0	0	111.6	D344 R349 A350 K351	D344-L347 HydrophobicContact CB-CB 4.39Å; D344-L347 HydrophobicContact CB-CD1 4.06Å; D344-L347 HydrophobicContact CB-CG 4.19Å; D344-L347 WeakPolarHBondContact O-CB 3.49Å; D344-L347 PolarHBondContact O-N 2.89Å; L347-R349 VanDerWaalsContact C-N 3.31Å; L347-R349 PolarHBondContact O-N 3.08Å; L347-A350 WeakPolarHBondContact O-CB 3.33Å; L347-A350 PolarHBondContact O-N 3.28Å; L347-A350 VanDerWaalsContact O-N 3.14Å; L347-K351 PolarHBondContact O-N 3.26Å
348	L	88.8	Confident	86.7	Confident	9 Å²	9	58.8 Å²	58.8	5%	0.047	31%	0.311	C	S	.	.	H	α-helix	trans	-57.6	-45.4	174.6	175.9	63.5	0	0	0	111.2	K317 I338 D344 I345 A350 K351 V352	K317-L348 HydrophobicContact CD-CD2 3.79Å; K317-L348 HydrophobicContact CG-CD2 3.83Å; I338-L348 HydrophobicContact CB-CD1 4.37Å; I338-L348 HydrophobicContact CB-CD2 4.23Å; I338-L348 HydrophobicContact CD1-CD1 4.46Å; I338-L348 HydrophobicContact CD1-CD2 4.28Å; I338-L348 HydrophobicContact CG2-CD1 3.9Å; D344-L348 PolarHBondContact O-N 2.94Å; D344-L348 VanDerWaalsContact O-N 3.09Å; I345-L348 PolarHBondContact O-N 2.89Å; L348-A350 VanDerWaalsContact C-N 3.27Å; L348-A350 PolarHBondContact O-N 3.48Å; L348-K351 PolarHBondContact O-N 2.98Å; L348-V352 HydrophobicContact CD1-CG2 4.11Å; L348-V352 PolarHBondContact O-N 2.92Å
349	R	90.9	Very high	86.6	Confident	65 Å²	65	59.8 Å²	59.8	25%	0.245	32%	0.319	C	S	.	.	H	α-helix	trans	-71.3	-21.1	179.2	-70.2	169.9	178.3	177.7	0.8	113.4	N316 K317 M318 I345 A346 L347 V352	N316-R349 HydrophobicContact CB-CG 4.31Å; N316-R349 PolarHBondContact O-NE 3.37Å; K317-R349 PolarHBondContact O-NH2 3.23Å; M318-R349 HydrophobicContact CE-CG 3.89Å; I345-R349 VanDerWaalsContact CG2-CZ 3.46Å; I345-R349 WeakPolarHBondContact O-CB 3.26Å; I345-R349 VanDerWaalsContact O-CG 3.28Å; I345-R349 WeakPolarHBondContact O-CG 3.47Å; I345-R349 PolarHBondContact O-N 3.27Å; A346-R349 PolarHBondContact O-N 3.28Å; L347-R349 VanDerWaalsContact C-N 3.31Å; L347-R349 PolarHBondContact O-N 3.08Å; R349-V352 CarbonylContact O-C 3.58Å
350	A	88.7	Confident	86.6	Confident	18 Å²	18	61.7 Å²	61.7	15%	0.149	33%	0.331	C	S	.	.	H	α-helix	trans	-75.4	-40.5	170	0	0	0	0	0	111.6	A346 L347 L348 F377	A346-A350 PolarHBondContact O-N 3.38Å; A346-A350 VanDerWaalsContact O-N 3.07Å; L347-A350 WeakPolarHBondContact O-CB 3.33Å; L347-A350 PolarHBondContact O-N 3.28Å; L347-A350 VanDerWaalsContact O-N 3.14Å; L348-A350 VanDerWaalsContact C-N 3.27Å; L348-A350 PolarHBondContact O-N 3.48Å; A350-F377 HydrophobicContact CB-CD1 4.18Å; A350-F377 HydrophobicContact CB-CD2 4.37Å; A350-F377 HydrophobicContact CB-CE1 3.69Å; A350-F377 HydrophobicContact CB-CE2 3.91Å; A350-F377 HydrophobicContact CB-CZ 3.55Å
351	K	89	Confident	86.9	Confident	66 Å²	66	56.6 Å²	56.6	29%	0.287	30%	0.3	S	S	.	.	H	α-helix	trans	-67.6	-40.9	173	-95.4	-170.4	174.9	-125.7	0	112.7	D334 L347 L348 P431 E432 V433	D334-K351 IonicContact OD2-NZ 3.41Å; D334-K351 PolarHBondContact OD2-NZ 3.35Å; L347-K351 PolarHBondContact O-N 3.26Å; L348-K351 PolarHBondContact O-N 2.98Å; K351-P431 WeakPolarHBondContact O-CB 3.45Å; K351-E432 WeakPolarHBondContact CE-OE1 3.38Å; K351-E432 HydrophobicContact CG-CG 4.46Å; K351-E432 IonicContact NZ-OE1 3.59Å; K351-E432 PolarHBondContact NZ-OE1 2.94Å; K351-E432 IonicContact NZ-OE2 2.77Å; K351-E432 PolarHBondContact NZ-OE2 2.9Å; K351-E432 PolarHBondContact O-N 3.13Å; K351-V433 PolarHBondContact O-N 3.31Å; K351-V433 VanDerWaalsContact O-N 3.1Å
352	V	92	Very high	87.8	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	82.2	-176.8	-172.6	0	0	0	0	109.3	F315 N316 L333 L348 R349 V433 L435	F315-V352 HydrophobicContact CB-CG1 4.21Å; N316-V352 HydrophobicContact CB-CB 4.04Å; N316-V352 HydrophobicContact CB-CG1 3.88Å; L333-V352 HydrophobicContact CD1-CG2 4.18Å; L333-V352 HydrophobicContact CD2-CG2 3.98Å; L348-V352 HydrophobicContact CD1-CG2 4.11Å; L348-V352 PolarHBondContact O-N 2.92Å; R349-V352 CarbonylContact O-C 3.58Å; V352-V433 CarbonylContact C-O 3.53Å; V352-V433 WeakPolarHBondContact CA-O 3.39Å; V352-V433 HydrophobicContact CB-CB 4.49Å; V352-V433 HydrophobicContact CG1-CB 4.1Å; V352-V433 HydrophobicContact CG1-CG1 4.18Å; V352-V433 HydrophobicContact CG2-CB 4.34Å; V352-L435 HydrophobicContact CG1-CD1 3.57Å; V352-L435 HydrophobicContact CG1-CD2 4.23Å; V352-L435 HydrophobicContact CG1-CG 3.73Å
353	G	91.9	Very high	88.8	Confident	3 Å²	3	56.8 Å²	56.8	3%	0.031	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	148.8	-178	0	0	0	0	0	112	V433 L435	G353-V433 PolarHBondContact N-O 3.15Å; G353-L435 VanDerWaalsContact O-CB 3.25Å; G353-L435 WeakPolarHBondContact O-CB 3.39Å; G353-L435 PolarHBondContact O-N 2.9Å
354	M	92.9	Very high	89.9	Confident	31 Å²	31	55.2 Å²	55.2	15%	0.153	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	137.6	-178.7	-172.7	163.2	-172.4	0	0	113.7	L312 R313 N316 F356 L435 D437	L312-M354 HydrophobicContact CD2-CE 3.9Å; R313-M354 HydrophobicContact CG-CE 3.74Å; R313-M354 HydrophobicContact CG-SD 4.17Å; N316-M354 WeakPolarHBondContact ND2-CB 3.35Å; M354-F356 HydrophobicContact CE-CD1 4.15Å; M354-F356 HydrophobicContact CE-CE1 4.06Å; M354-F356 HydrophobicContact CG-CE1 4.23Å; M354-F356 HydrophobicContact CG-CZ 4.41Å; M354-F356 HydrophobicContact SD-CE1 3.98Å; M354-F356 HydrophobicContact SD-CZ 4.46Å; M354-L435 CarbonylContact C-O 3.5Å; M354-L435 WeakPolarHBondContact CA-O 3.2Å; M354-L435 HydrophobicContact CB-CB 3.97Å; M354-L435 HydrophobicContact CB-CD1 4.37Å; M354-L435 HydrophobicContact CG-CB 3.92Å; M354-L435 HydrophobicContact SD-CD1 4.26Å; M354-D437 HydrophobicContact CE-CB 3.96Å
355	V	92.6	Very high	90.5	Very high	4 Å²	4	51 Å²	51	2%	0.024	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	130.3	172	-173.3	0	0	0	0	108.3	C422 I423 L434 L435 L436 D437	V355-C422 HydrophobicContact CG1-CB 4.06Å; V355-I423 HydrophobicContact CG1-CG1 3.96Å; V355-I423 HydrophobicContact CG2-CG1 4.22Å; V355-L434 HydrophobicContact CG2-CD1 4.3Å; V355-L435 PolarHBondContact N-O 2.87Å; V355-L436 HydrophobicContact CB-CD2 3.6Å; V355-L436 HydrophobicContact CG1-CD2 4.39Å; V355-L436 HydrophobicContact CG2-CD2 3.58Å; V355-D437 PolarHBondContact O-N 3.27Å
356	F	90.9	Very high	90.9	Very high	74 Å²	74	48.2 Å²	48.2	33%	0.325	25%	0.252	S	S	.	.			trans	-91.2	159.2	-175.2	-60.3	-77.2	0	0	0	112.3	M354 K358 Q419 D437	M354-F356 HydrophobicContact CE-CD1 4.15Å; M354-F356 HydrophobicContact CE-CE1 4.06Å; M354-F356 HydrophobicContact CG-CE1 4.23Å; M354-F356 HydrophobicContact CG-CZ 4.41Å; M354-F356 HydrophobicContact SD-CE1 3.98Å; M354-F356 HydrophobicContact SD-CZ 4.46Å; F356-K358 VanDerWaalsContact C-N 3.34Å; F356-K358 PolarHBondContact O-N 3.21Å; F356-Q419 PolarHBondContact O-NE2 3.49Å; F356-D437 CarbonylContact C-O 3.58Å
357	Q	88.2	Confident	91.4	Very high	78 Å²	78	47 Å²	47	36%	0.364	24%	0.237	S	C	.	.	S	Bend	trans	-56.1	-44.9	177.4	-179.2	-173.2	29.2	0	0	112.7	D437 E438 S441	Q357-D437 WeakPolarHBondContact CA-O 3.31Å; Q357-D437 WeakPolarHBondContact CB-O 3.49Å; Q357-D437 PolarHBondContact N-O 3.27Å; Q357-E438 HydrophobicContact CB-CB 4.27Å; Q357-E438 HydrophobicContact CG-CB 3.86Å; Q357-E438 PolarHBondContact NE2-OE2 3Å; Q357-S441 WeakPolarHBondContact CG-OG 3.16Å
358	K	89.2	Confident	91.9	Very high	165 Å²	165	44.7 Å²	44.7	72%	0.717	23%	0.225	S	C	*	.	S	Bend	trans	-90.4	123.5	175.4	-166.2	174.7	-177.3	177.7	0	109.2	F356 T360	F356-K358 VanDerWaalsContact C-N 3.34Å; F356-K358 PolarHBondContact O-N 3.21Å; K358-T360 PolarHBondContact O-N 3.07Å
359	P	88.2	Confident	92.2	Very high	31 Å²	31	44.2 Å²	44.2	20%	0.201	22%	0.223	C	C	.	.			trans	-59	124.3	176.2	12.2	-21.8	0	0	0	111.1	P361 Q418 Q419	P359-P361 VanDerWaalsContact C-CD 3.48Å; P359-Q418 HydrophobicContact CB-CB 3.76Å; P359-Q418 HydrophobicContact CG-CB 4.38Å; P359-Q419 HydrophobicContact CB-CB 4.31Å
360	T	90	Very high	92.4	Very high	68 Å²	68	41.1 Å²	41.1	42%	0.417	21%	0.211	S	C	.	.			trans	-126.9	72.6	178.2	53.6	0	0	0	0	110.7	K358 R425	K358-T360 PolarHBondContact O-N 3.07Å; T360-R425 PolarHBondContact O-NH1 3.4Å; T360-R425 VanDerWaalsContact O-NH1 3.09Å; T360-R425 PolarHBondContact O-NH2 3.25Å
361	P	91.7	Very high	92.7	Very high	4 Å²	4	40.3 Å²	40.3	3%	0.026	20%	0.204	C	C	.	.			trans	-62.8	144.1	166.3	26.8	-31.5	0	0	0	109.6	P359 Y411 Q418 L421	P359-P361 VanDerWaalsContact C-CD 3.48Å; P361-Y411 HydrophobicContact CG-CD1 3.98Å; P361-Y411 HydrophobicContact CG-CE1 4.07Å; P361-Y411 PolarHBondContact O-OH 3.06Å; P361-Q418 HydrophobicContact CG-CB 4.29Å; P361-Q418 HydrophobicContact CG-CG 4.14Å; P361-L421 HydrophobicContact CB-CD2 4.2Å
362	F	93.2	Very high	92.9	Very high	69 Å²	69	41.7 Å²	41.7	30%	0.303	21%	0.21	S	C	.	.			trans	-71.9	153.4	175.8	-61.5	-28.5	0	0	0	110.7	M364 N369 F372 R425	F362-M364 HydrophobicContact CB-CE 3.87Å; F362-M364 HydrophobicContact CB-CG 3.51Å; F362-M364 HydrophobicContact CB-SD 3.83Å; F362-M364 HydrophobicContact CD2-CE 4.31Å; F362-M364 HydrophobicContact CD2-SD 4.1Å; F362-M364 HydrophobicContact CG-CE 4.42Å; F362-M364 HydrophobicContact CG-SD 4.46Å; F362-M364 PolarHBondContact O-N 2.94Å; F362-N369 WeakPolarHBondContact CB-OD1 3.41Å; F362-N369 PolarHBondContact N-OD1 3.47Å; F362-N369 PolarHBondContact O-ND2 3.35Å; F362-F372 HydrophobicContact CD2-CD1 4.35Å; F362-F372 AromaticContact CE2-CD1 3.78Å; F362-F372 HydrophobicContact CE2-CD1 3.78Å; F362-F372 HydrophobicContact CE2-CE1 4.19Å; F362-F372 HydrophobicContact CE2-CG 4.39Å; F362-R425 VanDerWaalsContact CD1-NH1 3.33Å
363	P	91.6	Very high	92.7	Very high	103 Å²	103	42.2 Å²	42.2	67%	0.669	22%	0.215	S	C	*	.	S	Bend	trans	-72.7	56.1	179.9	33.1	-38.2	0	0	0	112.2	Y411	P363-Y411 HydrophobicContact CB-CE2 3.78Å
364	M	94.9	Very high	92.7	Very high	61 Å²	61	42 Å²	42	30%	0.3	21%	0.214	S	C	.	.	S	Bend	trans	-148.5	178.2	-175.7	47.2	-177.9	81.6	0	0	109	F362 D368 N369 F372 G410	F362-M364 HydrophobicContact CB-CE 3.87Å; F362-M364 HydrophobicContact CB-CG 3.51Å; F362-M364 HydrophobicContact CB-SD 3.83Å; F362-M364 HydrophobicContact CD2-CE 4.31Å; F362-M364 HydrophobicContact CD2-SD 4.1Å; F362-M364 HydrophobicContact CG-CE 4.42Å; F362-M364 HydrophobicContact CG-SD 4.46Å; F362-M364 PolarHBondContact O-N 2.94Å; M364-D368 HydrophobicContact CB-CB 4.12Å; M364-D368 HydrophobicContact CG-CB 4.3Å; M364-D368 HydrophobicContact SD-CB 4.15Å; M364-N369 PolarHBondContact O-ND2 3.31Å; M364-F372 HydrophobicContact CE-CD2 4.32Å; M364-F372 HydrophobicContact SD-CB 4.38Å; M364-F372 HydrophobicContact SD-CD2 4.45Å; M364-G410 PolarHBondContact O-N 2.9Å
365	S	96.2	Very high	92.6	Very high	12 Å²	12	47.5 Å²	47.5	8%	0.084	23%	0.232	C	C	.	.	B	Isolated β-bridge	trans	-65.7	163.9	-176.2	74.8	0	0	0	0	112.5	Y367 D368 N369 L406 Q408	S365-Y367 PolarHBondContact O-N 2.89Å; S365-D368 PolarHBondContact O-N 2.94Å; S365-D368 WeakPolarHBondContact OG-CB 3.24Å; S365-D368 VanDerWaalsContact OG-CG 3.25Å; S365-D368 PolarHBondContact OG-N 2.92Å; S365-D368 PolarHBondContact OG-OD2 2.88Å; S365-N369 WeakPolarHBondContact O-CB 3.35Å; S365-N369 PolarHBondContact O-N 3.15Å; S365-N369 PolarHBondContact O-ND2 2.87Å; S365-L406 WeakPolarHBondContact CB-O 3.5Å; S365-Q408 CarbonylContact C-O 3.59Å; S365-Q408 WeakPolarHBondContact CA-O 3.39Å
366	I	96	Very high	92.3	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-57.1	-43.5	172.5	-62.7	173.6	0	0	0	110	L393 T402 L406 Q408 L413 L421	I366-L393 HydrophobicContact CG2-CD1 4.39Å; I366-L393 HydrophobicContact CG2-CD2 4.2Å; I366-T402 HydrophobicContact CD1-CG2 3.94Å; I366-L406 HydrophobicContact CG2-CD2 4.22Å; I366-L406 PolarHBondContact N-O 3.44Å; I366-Q408 PolarHBondContact N-O 3.4Å; I366-L413 HydrophobicContact CD1-CD1 3.99Å; I366-L413 HydrophobicContact CD1-CD2 3.9Å; I366-L413 HydrophobicContact CD1-CG 4.09Å; I366-L413 HydrophobicContact CG1-CD1 4.13Å; I366-L421 HydrophobicContact CG1-CD2 4.45Å; I366-L421 HydrophobicContact CG2-CD1 3.88Å; I366-L421 HydrophobicContact CG2-CD2 4.47Å
367	Y	97.2	Very high	92	Very high	24 Å²	24	53.6 Å²	53.6	9%	0.094	26%	0.263	C	S	.	.	H	α-helix	trans	-60.9	-51.9	176.3	-175.4	-82.3	0	0	0	111.8	S365 N369 I370 A371 M385 D386 V389 L406	S365-Y367 PolarHBondContact O-N 2.89Å; Y367-N369 VanDerWaalsContact C-N 3.28Å; Y367-N369 PolarHBondContact O-N 2.95Å; Y367-I370 PolarHBondContact O-N 3.47Å; Y367-I370 VanDerWaalsContact O-N 3.16Å; Y367-A371 HydrophobicContact CD1-CB 4.1Å; Y367-A371 HydrophobicContact CE1-CB 3.87Å; Y367-A371 WeakPolarHBondContact O-CB 3.43Å; Y367-A371 PolarHBondContact O-N 3.08Å; Y367-M385 HydrophobicContact CE1-CG 4.32Å; Y367-M385 VanDerWaalsContact OH-CG 3.25Å; Y367-M385 WeakPolarHBondContact OH-CG 3.45Å; Y367-D386 WeakPolarHBondContact CE2-OD1 3.41Å; Y367-D386 PolarHBondContact OH-OD1 3.04Å; Y367-V389 HydrophobicContact CD2-CB 4.2Å; Y367-V389 HydrophobicContact CD2-CG1 3.77Å; Y367-V389 HydrophobicContact CD2-CG2 4.1Å; Y367-V389 HydrophobicContact CE1-CG2 4.49Å; Y367-V389 HydrophobicContact CE2-CB 4.09Å; Y367-V389 HydrophobicContact CE2-CG1 4.18Å; Y367-V389 HydrophobicContact CE2-CG2 3.9Å; Y367-V389 HydrophobicContact CG-CG1 4.41Å; Y367-V389 HydrophobicContact CG-CG2 4.5Å; Y367-L406 PolarHBondContact N-O 3.35Å
368	D	96.1	Very high	91.8	Very high	53 Å²	53	52.8 Å²	52.8	28%	0.283	26%	0.26	S	S	.	.	H	α-helix	trans	-68.5	-29.1	-175.9	-68.5	-55.7	0	0	0	112.2	M364 S365 I370 A371 F372 R375	M364-D368 HydrophobicContact CB-CB 4.12Å; M364-D368 HydrophobicContact CG-CB 4.3Å; M364-D368 HydrophobicContact SD-CB 4.15Å; S365-D368 PolarHBondContact O-N 2.94Å; S365-D368 WeakPolarHBondContact OG-CB 3.24Å; S365-D368 VanDerWaalsContact OG-CG 3.25Å; S365-D368 PolarHBondContact OG-N 2.92Å; S365-D368 PolarHBondContact OG-OD2 2.88Å; D368-I370 PolarHBondContact O-N 3.06Å; D368-A371 PolarHBondContact O-N 2.91Å; D368-F372 WeakPolarHBondContact O-CB 3.41Å; D368-F372 PolarHBondContact O-N 3.11Å; D368-R375 IonicContact OD1-NH1 3.3Å; D368-R375 PolarHBondContact OD1-NH1 3.37Å
369	N	95	Very high	91.6	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-55.5	-40.6	172.6	-100.6	-87.5	0	0	0	112.2	F362 M364 S365 Y367 L421 R425	F362-N369 WeakPolarHBondContact CB-OD1 3.41Å; F362-N369 PolarHBondContact N-OD1 3.47Å; F362-N369 PolarHBondContact O-ND2 3.35Å; M364-N369 PolarHBondContact O-ND2 3.31Å; S365-N369 WeakPolarHBondContact O-CB 3.35Å; S365-N369 PolarHBondContact O-N 3.15Å; S365-N369 PolarHBondContact O-ND2 2.87Å; Y367-N369 VanDerWaalsContact C-N 3.28Å; Y367-N369 PolarHBondContact O-N 2.95Å; N369-L421 HydrophobicContact CB-CD1 4.31Å; N369-L421 HydrophobicContact CB-CD2 4.28Å; N369-L421 HydrophobicContact CB-CG 4.44Å; N369-R425 WeakPolarHBondContact O-CD 3.34Å; N369-R425 VanDerWaalsContact O-CG 3.26Å; N369-R425 WeakPolarHBondContact O-CG 3.44Å; N369-R425 PolarHBondContact OD1-NH1 2.95Å
370	I	95	Very high	91.6	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-83.4	-47.9	179.8	-65.6	-176.3	0	0	0	110.6	Y367 D368 F372 G373 V389 A392 L393 L421 A424 A428	Y367-I370 PolarHBondContact O-N 3.47Å; Y367-I370 VanDerWaalsContact O-N 3.16Å; D368-I370 PolarHBondContact O-N 3.06Å; I370-F372 PolarHBondContact O-N 3.44Å; I370-G373 PolarHBondContact O-N 2.84Å; I370-V389 HydrophobicContact CB-CG2 4.23Å; I370-V389 HydrophobicContact CD1-CG1 4.48Å; I370-V389 HydrophobicContact CG2-CB 4.43Å; I370-V389 HydrophobicContact CG2-CG2 3.94Å; I370-A392 HydrophobicContact CD1-CB 4.28Å; I370-A392 HydrophobicContact CG2-CB 3.99Å; I370-L393 HydrophobicContact CD1-CD1 4.21Å; I370-L393 HydrophobicContact CD1-CD2 3.47Å; I370-L393 VanDerWaalsContact CD1-CD2 3.47Å; I370-L393 HydrophobicContact CD1-CG 3.45Å; I370-L393 VanDerWaalsContact CD1-CG 3.45Å; I370-L421 HydrophobicContact CD1-CD1 3.96Å; I370-L421 HydrophobicContact CG1-CD1 3.92Å; I370-A424 HydrophobicContact CD1-CB 3.7Å; I370-A424 HydrophobicContact CG1-CB 4.4Å; I370-A428 HydrophobicContact CG2-CB 3.44Å; I370-A428 VanDerWaalsContact CG2-CB 3.44Å
371	A	94.9	Very high	91.7	Very high	0 Å²	0	56 Å²	56	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-62.8	-26.8	-177.6	0	0	0	0	0	113.1	Y367 D368 G373 V374 R375 M385 V389	Y367-A371 HydrophobicContact CD1-CB 4.1Å; Y367-A371 HydrophobicContact CE1-CB 3.87Å; Y367-A371 WeakPolarHBondContact O-CB 3.43Å; Y367-A371 PolarHBondContact O-N 3.08Å; D368-A371 PolarHBondContact O-N 2.91Å; A371-G373 PolarHBondContact O-N 3.38Å; A371-V374 PolarHBondContact O-N 3.37Å; A371-R375 WeakPolarHBondContact O-CB 3.36Å; A371-R375 VanDerWaalsContact O-CG 3.28Å; A371-R375 WeakPolarHBondContact O-CG 3.39Å; A371-R375 PolarHBondContact O-N 2.96Å; A371-M385 HydrophobicContact CB-CG 4.16Å; A371-M385 HydrophobicContact CB-SD 3.68Å; A371-V389 HydrophobicContact CB-CG2 4.31Å
372	F	93.6	Very high	91.7	Very high	96 Å²	96	65.9 Å²	65.9	42%	0.421	31%	0.311	S	S	.	.	H	α-helix	trans	-55.3	-49.9	179.8	-179.3	-93	0	0	0	112.6	F362 M364 D368 I370 L376	F362-F372 HydrophobicContact CD2-CD1 4.35Å; F362-F372 AromaticContact CE2-CD1 3.78Å; F362-F372 HydrophobicContact CE2-CD1 3.78Å; F362-F372 HydrophobicContact CE2-CE1 4.19Å; F362-F372 HydrophobicContact CE2-CG 4.39Å; M364-F372 HydrophobicContact CE-CD2 4.32Å; M364-F372 HydrophobicContact SD-CB 4.38Å; M364-F372 HydrophobicContact SD-CD2 4.45Å; D368-F372 WeakPolarHBondContact O-CB 3.41Å; D368-F372 PolarHBondContact O-N 3.11Å; I370-F372 PolarHBondContact O-N 3.44Å; F372-L376 HydrophobicContact CD1-CD1 4.05Å; F372-L376 HydrophobicContact CE1-CD1 3.65Å; F372-L376 HydrophobicContact CZ-CD1 4.13Å
373	G	87.5	Confident	91.7	Very high	10 Å²	10	65.8 Å²	65.8	10%	0.103	32%	0.323	C	S	.	.	H	α-helix	trans	-64.4	-43.8	179.3	0	0	0	0	0	111.9	I370 A371 R375 L376 F377 I429	I370-G373 PolarHBondContact O-N 2.84Å; A371-G373 PolarHBondContact O-N 3.38Å; G373-R375 PolarHBondContact O-N 3.42Å; G373-L376 WeakPolarHBondContact O-CB 3.38Å; G373-L376 PolarHBondContact O-N 3.09Å; G373-F377 WeakPolarHBondContact O-CD2 3.32Å; G373-I429 WeakPolarHBondContact O-CG2 3.36Å
374	V	91	Very high	91.7	Very high	0 Å²	0	64.4 Å²	64.4	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-63.7	-42.6	-178.3	-175.2	0	0	0	0	111.3	A371 L376 F377 E378 L380 M385 R388 A428	A371-V374 PolarHBondContact O-N 3.37Å; V374-L376 PolarHBondContact O-N 3.36Å; V374-F377 PolarHBondContact O-N 2.71Å; V374-E378 HydrophobicContact CG1-CB 4.15Å; V374-E378 PolarHBondContact O-N 3.31Å; V374-L380 HydrophobicContact CG1-CD1 3.52Å; V374-L380 HydrophobicContact CG1-CG 4.32Å; V374-M385 HydrophobicContact CB-CE 4.08Å; V374-M385 HydrophobicContact CB-SD 4.03Å; V374-M385 HydrophobicContact CG1-CE 3.84Å; V374-M385 HydrophobicContact CG1-SD 4.03Å; V374-R388 HydrophobicContact CG1-CG 4.41Å; V374-R388 HydrophobicContact CG2-CG 3.96Å; V374-A428 HydrophobicContact CG2-CB 3.95Å
375	R	91.5	Very high	91.7	Very high	145 Å²	145	62 Å²	62	55%	0.547	30%	0.298	S	S	.	.	H	α-helix	trans	-63.4	-19.9	179.5	-74	174.5	178.9	159.4	4.3	114.2	D368 A371 G373 M385	D368-R375 IonicContact OD1-NH1 3.3Å; D368-R375 PolarHBondContact OD1-NH1 3.37Å; A371-R375 WeakPolarHBondContact O-CB 3.36Å; A371-R375 VanDerWaalsContact O-CG 3.28Å; A371-R375 WeakPolarHBondContact O-CG 3.39Å; A371-R375 PolarHBondContact O-N 2.96Å; G373-R375 PolarHBondContact O-N 3.42Å; R375-M385 HydrophobicContact CG-CE 3.63Å
376	L	87	Confident	91.7	Very high	110 Å²	110	64.8 Å²	64.8	58%	0.576	31%	0.312	S	S	*	.	H	α-helix	trans	-77.3	-31	177.7	-79.9	156.5	0	0	0	112.6	F372 G373 V374	F372-L376 HydrophobicContact CD1-CD1 4.05Å; F372-L376 HydrophobicContact CE1-CD1 3.65Å; F372-L376 HydrophobicContact CZ-CD1 4.13Å; G373-L376 WeakPolarHBondContact O-CB 3.38Å; G373-L376 PolarHBondContact O-N 3.09Å; V374-L376 PolarHBondContact O-N 3.36Å
377	F	83.1	Confident	91.6	Very high	97 Å²	97	71.3 Å²	71.3	43%	0.425	34%	0.343	S	S	.	.	H	α-helix	trans	-117.3	-20	-172	-57.5	-74.2	0	0	0	113.5	A350 G373 V374 I429	A350-F377 HydrophobicContact CB-CD1 4.18Å; A350-F377 HydrophobicContact CB-CD2 4.37Å; A350-F377 HydrophobicContact CB-CE1 3.69Å; A350-F377 HydrophobicContact CB-CE2 3.91Å; A350-F377 HydrophobicContact CB-CZ 3.55Å; G373-F377 WeakPolarHBondContact O-CD2 3.32Å; V374-F377 PolarHBondContact O-N 2.71Å; F377-I429 HydrophobicContact CD2-CG2 4.13Å
378	E	84.7	Confident	91.5	Very high	61 Å²	61	70.9 Å²	70.9	29%	0.285	34%	0.341	S	S	.	.			trans	-132.3	139.8	-176.3	-59.9	-178.2	-132.8	0	0	111.8	V374 L380 R388	V374-E378 HydrophobicContact CG1-CB 4.15Å; V374-E378 PolarHBondContact O-N 3.31Å; E378-L380 HydrophobicContact CB-CG 4.21Å; E378-R388 VanDerWaalsContact CD-NH2 3.33Å; E378-R388 IonicContact OE1-CZ 2.71Å; E378-R388 IonicContact OE1-NH1 3.54Å; E378-R388 PolarHBondContact OE1-NH1 3.07Å; E378-R388 IonicContact OE1-NH2 3.7Å; E378-R388 PolarHBondContact OE1-NH2 3.23Å; E378-R388 VanDerWaalsContact OE1-NH2 3.12Å; E378-R388 IonicContact OE2-CZ 2.67Å; E378-R388 IonicContact OE2-NH1 3.48Å; E378-R388 IonicContact OE2-NH2 3.22Å; E378-R388 PolarHBondContact OE2-NH2 3.21Å
379	K	85.7	Confident	91.4	Very high	216 Å²	216	68.4 Å²	68.4	94%	0.939	33%	0.328	S	S	*	.			trans	-99.9	97.9	167.1	-89.2	-175.4	176.7	177.2	0	109.5
380	L	87.1	Confident	91.5	Very high	56 Å²	56	72.5 Å²	72.5	29%	0.293	35%	0.347	S	S	.	.			trans	-101	151.5	178.3	-65	-178.7	0	0	0	111.6	V374 E378 D384 M385 R388	V374-L380 HydrophobicContact CG1-CD1 3.52Å; V374-L380 HydrophobicContact CG1-CG 4.32Å; E378-L380 HydrophobicContact CB-CG 4.21Å; L380-D384 HydrophobicContact CB-CB 4.06Å; L380-D384 HydrophobicContact CD2-CB 4.19Å; L380-D384 HydrophobicContact CG-CB 4.48Å; L380-M385 HydrophobicContact CB-CB 4.48Å; L380-M385 HydrophobicContact CB-CE 4.22Å; L380-M385 HydrophobicContact CD1-CE 4.29Å; L380-R388 HydrophobicContact CD1-CB 4.31Å
381	S	92.8	Very high	91.5	Very high	60 Å²	60	75.9 Å²	75.9	42%	0.42	36%	0.36	S	S	.	.			trans	-66.9	167	165.9	80.6	0	0	0	0	110.1	A383 D384 M385	S381-A383 VanDerWaalsContact C-N 3.29Å; S381-A383 PolarHBondContact O-N 3.1Å; S381-D384 VanDerWaalsContact CB-OD2 3.3Å; S381-D384 WeakPolarHBondContact CB-OD2 3.35Å; S381-D384 PolarHBondContact N-OD2 2.92Å; S381-D384 PolarHBondContact O-N 3.02Å; S381-D384 PolarHBondContact OG-N 3.48Å; S381-D384 PolarHBondContact OG-OD2 3.08Å; S381-M385 WeakPolarHBondContact O-CB 3.29Å; S381-M385 PolarHBondContact O-N 3.06Å
382	R	91.7	Very high	91.4	Very high	211 Å²	211	75.9 Å²	75.9	80%	0.796	36%	0.36	S	S	*	.	H	α-helix	trans	-62	-39.7	179.4	-158.1	177.1	-173.5	-178.5	1.7	111.7	M385 D386	R382-M385 PolarHBondContact O-N 3.16Å; R382-D386 PolarHBondContact O-N 3.39Å
383	A	92.9	Very high	91.4	Very high	67 Å²	67	71.3 Å²	71.3	55%	0.554	34%	0.34	S	S	*	.	H	α-helix	trans	-65.1	-45.5	177.2	0	0	0	0	0	111.8	S381 M385 D386 E387	S381-A383 VanDerWaalsContact C-N 3.29Å; S381-A383 PolarHBondContact O-N 3.1Å; A383-M385 VanDerWaalsContact C-N 3.3Å; A383-M385 PolarHBondContact O-N 2.97Å; A383-D386 PolarHBondContact O-N 3.45Å; A383-E387 PolarHBondContact O-N 3.14Å
384	D	92.7	Very high	91.7	Very high	73 Å²	73	74.4 Å²	74.4	39%	0.39	36%	0.357	S	S	.	.	H	α-helix	trans	-67.4	-32.8	179.5	-52.5	-41.6	0	0	0	111.9	L380 S381 R388	L380-D384 HydrophobicContact CB-CB 4.06Å; L380-D384 HydrophobicContact CD2-CB 4.19Å; L380-D384 HydrophobicContact CG-CB 4.48Å; S381-D384 VanDerWaalsContact CB-OD2 3.3Å; S381-D384 WeakPolarHBondContact CB-OD2 3.35Å; S381-D384 PolarHBondContact N-OD2 2.92Å; S381-D384 PolarHBondContact O-N 3.02Å; S381-D384 PolarHBondContact OG-N 3.48Å; S381-D384 PolarHBondContact OG-OD2 3.08Å; D384-R388 WeakPolarHBondContact O-CB 3.28Å; D384-R388 PolarHBondContact O-N 3.02Å
385	M	94.6	Very high	91.5	Very high	10 Å²	10	76.4 Å²	76.4	5%	0.049	37%	0.365	C	S	.	.	H	α-helix	trans	-67	-43.8	173.6	-174.2	66.7	68.4	0	0	111.2	Y367 A371 V374 R375 L380 S381 R382 A383 E387 R388 V389	Y367-M385 HydrophobicContact CE1-CG 4.32Å; Y367-M385 VanDerWaalsContact OH-CG 3.25Å; Y367-M385 WeakPolarHBondContact OH-CG 3.45Å; A371-M385 HydrophobicContact CB-CG 4.16Å; A371-M385 HydrophobicContact CB-SD 3.68Å; V374-M385 HydrophobicContact CB-CE 4.08Å; V374-M385 HydrophobicContact CB-SD 4.03Å; V374-M385 HydrophobicContact CG1-CE 3.84Å; V374-M385 HydrophobicContact CG1-SD 4.03Å; R375-M385 HydrophobicContact CG-CE 3.63Å; L380-M385 HydrophobicContact CB-CB 4.48Å; L380-M385 HydrophobicContact CB-CE 4.22Å; L380-M385 HydrophobicContact CD1-CE 4.29Å; S381-M385 WeakPolarHBondContact O-CB 3.29Å; S381-M385 PolarHBondContact O-N 3.06Å; R382-M385 PolarHBondContact O-N 3.16Å; A383-M385 VanDerWaalsContact C-N 3.3Å; A383-M385 PolarHBondContact O-N 2.97Å; M385-E387 VanDerWaalsContact C-N 3.29Å; M385-E387 PolarHBondContact O-N 3.14Å; M385-R388 PolarHBondContact O-N 2.89Å; M385-V389 HydrophobicContact CG-CG2 4.47Å; M385-V389 WeakPolarHBondContact O-CB 3.44Å; M385-V389 VanDerWaalsContact O-CG2 3.29Å; M385-V389 WeakPolarHBondContact O-CG2 3.42Å; M385-V389 PolarHBondContact O-N 3.42Å
386	D	95	Very high	91.4	Very high	72 Å²	72	69.5 Å²	69.5	39%	0.385	34%	0.339	S	S	.	.	H	α-helix	trans	-59.7	-43.4	176	-68	-17	0	0	0	110.6	Y367 R382 A383 V389 Q390	Y367-D386 WeakPolarHBondContact CE2-OD1 3.41Å; Y367-D386 PolarHBondContact OH-OD1 3.04Å; R382-D386 PolarHBondContact O-N 3.39Å; A383-D386 PolarHBondContact O-N 3.45Å; D386-V389 PolarHBondContact O-N 2.87Å; D386-Q390 WeakPolarHBondContact O-CB 3.27Å; D386-Q390 PolarHBondContact O-N 3.33Å
387	E	95.2	Very high	91.4	Very high	136 Å²	136	66.6 Å²	66.6	64%	0.636	33%	0.331	S	S	*	.	H	α-helix	trans	-65.5	-41.8	177	-157.3	-179.8	-149.8	0	0	111.9	A383 M385 Q390 W391	A383-E387 PolarHBondContact O-N 3.14Å; M385-E387 VanDerWaalsContact C-N 3.29Å; M385-E387 PolarHBondContact O-N 3.14Å; E387-Q390 PolarHBondContact O-N 2.99Å; E387-W391 WeakPolarHBondContact O-CB 3.33Å; E387-W391 PolarHBondContact O-N 2.85Å
388	R	93.4	Very high	91.8	Very high	16 Å²	16	62 Å²	62	6%	0.06	31%	0.311	C	S	.	.	H	α-helix	trans	-63.4	-42.3	175.2	-178.8	66.8	72.5	89.6	10.1	111.9	V374 E378 L380 D384 M385 W391 A392 A428	V374-R388 HydrophobicContact CG1-CG 4.41Å; V374-R388 HydrophobicContact CG2-CG 3.96Å; E378-R388 VanDerWaalsContact CD-NH2 3.33Å; E378-R388 IonicContact OE1-CZ 2.71Å; E378-R388 IonicContact OE1-NH1 3.54Å; E378-R388 PolarHBondContact OE1-NH1 3.07Å; E378-R388 IonicContact OE1-NH2 3.7Å; E378-R388 PolarHBondContact OE1-NH2 3.23Å; E378-R388 VanDerWaalsContact OE1-NH2 3.12Å; E378-R388 IonicContact OE2-CZ 2.67Å; E378-R388 IonicContact OE2-NH1 3.48Å; E378-R388 IonicContact OE2-NH2 3.22Å; E378-R388 PolarHBondContact OE2-NH2 3.21Å; L380-R388 HydrophobicContact CD1-CB 4.31Å; D384-R388 WeakPolarHBondContact O-CB 3.28Å; D384-R388 PolarHBondContact O-N 3.02Å; M385-R388 PolarHBondContact O-N 2.89Å; R388-W391 PolarHBondContact O-N 3.33Å; R388-A392 WeakPolarHBondContact O-CB 3.38Å; R388-A392 PolarHBondContact O-N 2.87Å; R388-A428 WeakPolarHBondContact CD-O 3.44Å; R388-A428 PolarHBondContact NH1-O 2.91Å
389	V	96	Very high	92.2	Very high	1 Å²	1	61.6 Å²	61.6	1%	0.006	31%	0.307	C	S	.	.	H	α-helix	trans	-65.1	-46.9	177.8	169.9	0	0	0	0	110.3	Y367 I370 A371 M385 D386 W391 A392 L393	Y367-V389 HydrophobicContact CD2-CB 4.2Å; Y367-V389 HydrophobicContact CD2-CG1 3.77Å; Y367-V389 HydrophobicContact CD2-CG2 4.1Å; Y367-V389 HydrophobicContact CE1-CG2 4.49Å; Y367-V389 HydrophobicContact CE2-CB 4.09Å; Y367-V389 HydrophobicContact CE2-CG1 4.18Å; Y367-V389 HydrophobicContact CE2-CG2 3.9Å; Y367-V389 HydrophobicContact CG-CG1 4.41Å; Y367-V389 HydrophobicContact CG-CG2 4.5Å; I370-V389 HydrophobicContact CB-CG2 4.23Å; I370-V389 HydrophobicContact CD1-CG1 4.48Å; I370-V389 HydrophobicContact CG2-CB 4.43Å; I370-V389 HydrophobicContact CG2-CG2 3.94Å; A371-V389 HydrophobicContact CB-CG2 4.31Å; M385-V389 HydrophobicContact CG-CG2 4.47Å; M385-V389 WeakPolarHBondContact O-CB 3.44Å; M385-V389 VanDerWaalsContact O-CG2 3.29Å; M385-V389 WeakPolarHBondContact O-CG2 3.42Å; M385-V389 PolarHBondContact O-N 3.42Å; D386-V389 PolarHBondContact O-N 2.87Å; V389-W391 VanDerWaalsContact C-N 3.34Å; V389-W391 PolarHBondContact O-N 3.47Å; V389-A392 PolarHBondContact O-N 2.87Å; V389-L393 HydrophobicContact CG1-CD1 3.87Å; V389-L393 WeakPolarHBondContact O-CB 3.38Å; V389-L393 WeakPolarHBondContact O-CG 3.27Å; V389-L393 PolarHBondContact O-N 3.48Å
390	Q	96.2	Very high	92.4	Very high	85 Å²	85	57.6 Å²	57.6	40%	0.397	30%	0.296	S	S	.	.	H	α-helix	trans	-59.4	-46.2	175.3	175.9	171.8	-1.4	0	0	111.2	D386 E387 A392 L393 T394 W399	D386-Q390 WeakPolarHBondContact O-CB 3.27Å; D386-Q390 PolarHBondContact O-N 3.33Å; E387-Q390 PolarHBondContact O-N 2.99Å; Q390-A392 PolarHBondContact O-N 2.91Å; Q390-L393 PolarHBondContact O-N 3.06Å; Q390-T394 VanDerWaalsContact O-CB 3.27Å; Q390-T394 WeakPolarHBondContact O-CB 3.35Å; Q390-T394 PolarHBondContact O-N 3.12Å; Q390-T394 PolarHBondContact O-OG1 3.06Å; Q390-W399 HydrophobicContact CB-CE3 4.13Å; Q390-W399 HydrophobicContact CB-CH2 3.84Å; Q390-W399 HydrophobicContact CB-CZ2 4.25Å; Q390-W399 HydrophobicContact CB-CZ3 3.78Å; Q390-W399 VanDerWaalsContact CD-CZ2 3.49Å; Q390-W399 HydrophobicContact CG-CD2 3.82Å; Q390-W399 HydrophobicContact CG-CE3 3.94Å; Q390-W399 HydrophobicContact CG-CH2 3.78Å; Q390-W399 HydrophobicContact CG-CZ2 3.66Å; Q390-W399 HydrophobicContact CG-CZ3 3.92Å
391	W	94.2	Very high	92.6	Very high	72 Å²	72	57.2 Å²	57.2	27%	0.273	29%	0.293	S	S	.	.	H	α-helix	trans	-59.2	-47.4	178.3	170.3	85.2	0	0	0	111.7	E387 R388 V389 T394 K395 I427 R430 Y462	E387-W391 WeakPolarHBondContact O-CB 3.33Å; E387-W391 PolarHBondContact O-N 2.85Å; R388-W391 PolarHBondContact O-N 3.33Å; V389-W391 VanDerWaalsContact C-N 3.34Å; V389-W391 PolarHBondContact O-N 3.47Å; W391-T394 PolarHBondContact O-N 3.04Å; W391-K395 HydrophobicContact CZ2-CG 4.22Å; W391-K395 WeakPolarHBondContact O-CB 3.21Å; W391-K395 PolarHBondContact O-N 3.07Å; W391-I427 HydrophobicContact CH2-CG2 3.54Å; W391-I427 HydrophobicContact CZ2-CG2 4.34Å; W391-I427 HydrophobicContact CZ3-CG2 3.83Å; W391-R430 HydrophobicContact CH2-CG 4.05Å; W391-R430 HydrophobicContact CZ3-CG 4.34Å; W391-Y462 VanDerWaalsContact CH2-OH 3.26Å; W391-Y462 WeakPolarHBondContact CH2-OH 3.21Å
392	A	93.5	Very high	92.7	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-64.7	-42.9	179.7	0	0	0	0	0	112.3	I370 R388 V389 Q390 T394 A396 A424 A428	I370-A392 HydrophobicContact CD1-CB 4.28Å; I370-A392 HydrophobicContact CG2-CB 3.99Å; R388-A392 WeakPolarHBondContact O-CB 3.38Å; R388-A392 PolarHBondContact O-N 2.87Å; V389-A392 PolarHBondContact O-N 2.87Å; Q390-A392 PolarHBondContact O-N 2.91Å; A392-T394 VanDerWaalsContact C-N 3.32Å; A392-A396 WeakPolarHBondContact O-CB 3.12Å; A392-A396 PolarHBondContact O-N 3.41Å; A392-A424 HydrophobicContact CB-CB 4.43Å; A392-A428 HydrophobicContact CB-CB 3.82Å
393	L	94.6	Very high	92.8	Very high	0 Å²	0	49 Å²	49	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-66.3	-34.5	175	-72.6	169.9	0	0	0	112.3	I366 I370 V389 Q390 A397 L398 W399 L406 L421 A424	I366-L393 HydrophobicContact CG2-CD1 4.39Å; I366-L393 HydrophobicContact CG2-CD2 4.2Å; I370-L393 HydrophobicContact CD1-CD1 4.21Å; I370-L393 HydrophobicContact CD1-CD2 3.47Å; I370-L393 VanDerWaalsContact CD1-CD2 3.47Å; I370-L393 HydrophobicContact CD1-CG 3.45Å; I370-L393 VanDerWaalsContact CD1-CG 3.45Å; V389-L393 HydrophobicContact CG1-CD1 3.87Å; V389-L393 WeakPolarHBondContact O-CB 3.38Å; V389-L393 WeakPolarHBondContact O-CG 3.27Å; V389-L393 PolarHBondContact O-N 3.48Å; Q390-L393 PolarHBondContact O-N 3.06Å; L393-A397 PolarHBondContact O-N 2.93Å; L393-L398 HydrophobicContact CD2-CB 4.2Å; L393-L398 HydrophobicContact CD2-CD2 3.85Å; L393-L398 HydrophobicContact CD2-CG 4.23Å; L393-L398 WeakPolarHBondContact O-CA 3.49Å; L393-L398 PolarHBondContact O-N 3.43Å; L393-W399 HydrophobicContact CB-CB 4.11Å; L393-W399 HydrophobicContact CB-CE3 3.98Å; L393-W399 HydrophobicContact CD1-CE3 3.79Å; L393-W399 HydrophobicContact CD1-CZ3 4.06Å; L393-W399 PolarHBondContact O-N 3.17Å; L393-L406 HydrophobicContact CD1-CD2 3.47Å; L393-L406 VanDerWaalsContact CD1-CD2 3.47Å; L393-L421 HydrophobicContact CD2-CD1 4.16Å; L393-A424 HydrophobicContact CD2-CB 4.38Å
394	T	92.1	Very high	92.8	Very high	75 Å²	75	52.3 Å²	52.3	46%	0.46	26%	0.264	S	S	.	.	H	α-helix	trans	-70.1	-47.9	177.8	-58.4	0	0	0	0	110.1	Q390 W391 A392 A396 A397 W399	Q390-T394 VanDerWaalsContact O-CB 3.27Å; Q390-T394 WeakPolarHBondContact O-CB 3.35Å; Q390-T394 PolarHBondContact O-N 3.12Å; Q390-T394 PolarHBondContact O-OG1 3.06Å; W391-T394 PolarHBondContact O-N 3.04Å; A392-T394 VanDerWaalsContact C-N 3.32Å; T394-A396 VanDerWaalsContact C-N 3.29Å; T394-A396 PolarHBondContact O-N 3.34Å; T394-A397 WeakPolarHBondContact O-CA 3.38Å; T394-A397 PolarHBondContact O-N 2.67Å; T394-W399 WeakPolarHBondContact OG1-CB 3.5Å
395	K	87.9	Confident	92.8	Very high	41 Å²	41	52.8 Å²	52.8	18%	0.178	26%	0.262	C	S	.	.	H	α-helix	trans	-54.7	-46.8	174.3	-86.4	-69.2	-164.5	168.5	0	110.5	W391 A397 L454 D461	W391-K395 HydrophobicContact CZ2-CG 4.22Å; W391-K395 WeakPolarHBondContact O-CB 3.21Å; W391-K395 PolarHBondContact O-N 3.07Å; K395-A397 PolarHBondContact O-N 3.47Å; K395-L454 WeakPolarHBondContact O-CD1 3.43Å; K395-D461 WeakPolarHBondContact CE-OD2 3.39Å; K395-D461 IonicContact NZ-OD2 2.84Å; K395-D461 PolarHBondContact NZ-OD2 3.01Å
396	A	89	Confident	92.8	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.6	14	176.8	0	0	0	0	0	115.3	A392 T394 L398 R420 A424 L454	A392-A396 WeakPolarHBondContact O-CB 3.12Å; A392-A396 PolarHBondContact O-N 3.41Å; T394-A396 VanDerWaalsContact C-N 3.29Å; T394-A396 PolarHBondContact O-N 3.34Å; A396-L398 PolarHBondContact O-N 2.99Å; A396-L398 VanDerWaalsContact O-N 3.12Å; A396-R420 WeakPolarHBondContact CB-O 3.37Å; A396-R420 WeakPolarHBondContact O-CD 3.45Å; A396-A424 HydrophobicContact CB-CB 3.64Å; A396-L454 HydrophobicContact CB-CD2 4.07Å
397	A	86.9	Confident	92.8	Very high	50 Å²	50	57.9 Å²	57.9	41%	0.413	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.8	30.8	-178.6	0	0	0	0	0	114.6	L393 T394 K395 R420	L393-A397 PolarHBondContact O-N 2.93Å; T394-A397 WeakPolarHBondContact O-CA 3.38Å; T394-A397 PolarHBondContact O-N 2.67Å; K395-A397 PolarHBondContact O-N 3.47Å; A397-R420 PolarHBondContact O-NH1 3.32Å
398	L	91.2	Very high	92.8	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	28%	0.276	C	S	.	.			trans	-111.5	-19	-174.7	-168.2	62.9	0	0	0	113.3	L393 A396 N400 E401 T402 L413 Q417 R420 L421	L393-L398 HydrophobicContact CD2-CB 4.2Å; L393-L398 HydrophobicContact CD2-CD2 3.85Å; L393-L398 HydrophobicContact CD2-CG 4.23Å; L393-L398 WeakPolarHBondContact O-CA 3.49Å; L393-L398 PolarHBondContact O-N 3.43Å; A396-L398 PolarHBondContact O-N 2.99Å; A396-L398 VanDerWaalsContact O-N 3.12Å; L398-N400 PolarHBondContact O-N 2.82Å; L398-E401 HydrophobicContact CD1-CB 4.4Å; L398-E401 PolarHBondContact O-N 2.94Å; L398-T402 HydrophobicContact CD1-CG2 3.96Å; L398-T402 HydrophobicContact CD2-CG2 4.11Å; L398-T402 HydrophobicContact CG-CG2 3.66Å; L398-T402 PolarHBondContact O-N 3.17Å; L398-T402 PolarHBondContact O-OG1 3.09Å; L398-T402 VanDerWaalsContact O-OG1 3.11Å; L398-L413 HydrophobicContact CD2-CD1 4.49Å; L398-Q417 HydrophobicContact CD1-CB 3.96Å; L398-Q417 HydrophobicContact CD1-CG 3.86Å; L398-R420 HydrophobicContact CB-CB 4.42Å; L398-R420 HydrophobicContact CD1-CB 4.44Å; L398-R420 HydrophobicContact CD2-CB 4.31Å; L398-L421 HydrophobicContact CD2-CB 3.84Å
399	W	93.7	Very high	92.8	Very high	52 Å²	52	57.6 Å²	57.6	20%	0.197	29%	0.289	C	S	.	.	H	α-helix	trans	-51.6	-50.5	-174.2	178	-112.6	0	0	0	114.4	Q390 L393 T394 E401 T402 K403 L406	Q390-W399 HydrophobicContact CB-CE3 4.13Å; Q390-W399 HydrophobicContact CB-CH2 3.84Å; Q390-W399 HydrophobicContact CB-CZ2 4.25Å; Q390-W399 HydrophobicContact CB-CZ3 3.78Å; Q390-W399 VanDerWaalsContact CD-CZ2 3.49Å; Q390-W399 HydrophobicContact CG-CD2 3.82Å; Q390-W399 HydrophobicContact CG-CE3 3.94Å; Q390-W399 HydrophobicContact CG-CH2 3.78Å; Q390-W399 HydrophobicContact CG-CZ2 3.66Å; Q390-W399 HydrophobicContact CG-CZ3 3.92Å; L393-W399 HydrophobicContact CB-CB 4.11Å; L393-W399 HydrophobicContact CB-CE3 3.98Å; L393-W399 HydrophobicContact CD1-CE3 3.79Å; L393-W399 HydrophobicContact CD1-CZ3 4.06Å; L393-W399 PolarHBondContact O-N 3.17Å; T394-W399 WeakPolarHBondContact OG1-CB 3.5Å; W399-E401 PolarHBondContact O-N 3.34Å; W399-E401 VanDerWaalsContact O-N 3.12Å; W399-T402 PolarHBondContact O-N 3.16Å; W399-T402 VanDerWaalsContact O-N 3.13Å; W399-K403 HydrophobicContact CD2-CB 4.08Å; W399-K403 HydrophobicContact CE3-CB 4.39Å; W399-K403 HydrophobicContact CH2-CB 4.24Å; W399-K403 HydrophobicContact CZ2-CB 3.9Å; W399-K403 HydrophobicContact CZ3-CB 4.47Å; W399-K403 WeakPolarHBondContact O-CB 3.22Å; W399-K403 PolarHBondContact O-N 3.23Å; W399-L406 HydrophobicContact CH2-CD1 4.13Å; W399-L406 HydrophobicContact CZ3-CD1 3.96Å; W399-L406 HydrophobicContact CZ3-CD2 4.19Å
400	N	90.9	Very high	92.5	Very high	133 Å²	133	57.6 Å²	57.6	71%	0.711	29%	0.288	S	S	*	.	H	α-helix	trans	-63	-22.7	-177.3	-71	-27.4	0	0	0	113.3	L398	L398-N400 PolarHBondContact O-N 2.82Å
401	E	90.8	Very high	92.2	Very high	48 Å²	48	59.8 Å²	59.8	22%	0.224	29%	0.294	C	S	.	.	H	α-helix	trans	-90.7	-21.6	-179.8	-62.6	174	-136.5	0	0	112.9	L398 W399 K405 Q417 R420 R450	L398-E401 HydrophobicContact CD1-CB 4.4Å; L398-E401 PolarHBondContact O-N 2.94Å; W399-E401 PolarHBondContact O-N 3.34Å; W399-E401 VanDerWaalsContact O-N 3.12Å; E401-K405 WeakPolarHBondContact O-CE 3.41Å; E401-K405 PolarHBondContact O-NZ 2.84Å; E401-K405 VanDerWaalsContact O-NZ 3.12Å; E401-Q417 WeakPolarHBondContact OE2-CG 3.39Å; E401-Q417 PolarHBondContact OE2-NE2 3.22Å; E401-R420 VanDerWaalsContact CD-NH2 3.31Å; E401-R420 IonicContact OE1-CZ 2.71Å; E401-R420 IonicContact OE1-NH1 3.15Å; E401-R420 PolarHBondContact OE1-NH1 3.3Å; E401-R420 IonicContact OE1-NH2 3.02Å; E401-R420 PolarHBondContact OE1-NH2 3.17Å; E401-R420 IonicContact OE2-CZ 3.53Å; E401-R420 IonicContact OE2-NH2 2.65Å; E401-R420 PolarHBondContact OE2-NH2 3.32Å; E401-R450 IonicContact OE1-CZ 2.93Å; E401-R450 IonicContact OE1-NH1 3.68Å; E401-R450 PolarHBondContact OE1-NH1 2.96Å
402	T	94.2	Very high	92.1	Very high	0 Å²	0	59.7 Å²	59.7	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-120.7	-10.5	-171	61.1	0	0	0	0	115.4	I366 L398 W399 D404 K405 L406 L413	I366-T402 HydrophobicContact CD1-CG2 3.94Å; L398-T402 HydrophobicContact CD1-CG2 3.96Å; L398-T402 HydrophobicContact CD2-CG2 4.11Å; L398-T402 HydrophobicContact CG-CG2 3.66Å; L398-T402 PolarHBondContact O-N 3.17Å; L398-T402 PolarHBondContact O-OG1 3.09Å; L398-T402 VanDerWaalsContact O-OG1 3.11Å; W399-T402 PolarHBondContact O-N 3.16Å; W399-T402 VanDerWaalsContact O-N 3.13Å; T402-D404 PolarHBondContact O-N 2.85Å; T402-D404 VanDerWaalsContact O-N 3.11Å; T402-K405 CarbonylContact O-C 3.43Å; T402-K405 WeakPolarHBondContact O-CA 3.38Å; T402-K405 PolarHBondContact O-N 3.21Å; T402-L406 PolarHBondContact O-N 3.49Å; T402-L413 HydrophobicContact CG2-CD2 3.88Å
403	K	93.1	Very high	91.9	Very high	98 Å²	98	60.2 Å²	60.2	43%	0.426	31%	0.307	S	S	.	.	G	3₁₀ helix	trans	-50.6	-38	-176.4	63.6	177.3	-172.7	177.1	0	113.7	W399 K405	W399-K403 HydrophobicContact CD2-CB 4.08Å; W399-K403 HydrophobicContact CE3-CB 4.39Å; W399-K403 HydrophobicContact CH2-CB 4.24Å; W399-K403 HydrophobicContact CZ2-CB 3.9Å; W399-K403 HydrophobicContact CZ3-CB 4.47Å; W399-K403 WeakPolarHBondContact O-CB 3.22Å; W399-K403 PolarHBondContact O-N 3.23Å; K403-K405 VanDerWaalsContact C-N 3.32Å; K403-K405 PolarHBondContact O-N 3.32Å
404	D	93.7	Very high	91.6	Very high	136 Å²	136	63 Å²	63	73%	0.727	33%	0.327	S	S	*	.	G	3₁₀ helix	trans	-90	2.8	-178	-52.5	-52.8	0	0	0	112.9	T402	T402-D404 PolarHBondContact O-N 2.85Å; T402-D404 VanDerWaalsContact O-N 3.11Å
405	K	93.6	Very high	91.3	Very high	84 Å²	84	61.3 Å²	61.3	37%	0.365	32%	0.324	S	S	.	.	G	3₁₀ helix	trans	-131.5	12.6	-169.8	-43	177.7	-167.5	161.9	0	113	E401 T402 K403 H407 Q408	E401-K405 WeakPolarHBondContact O-CE 3.41Å; E401-K405 PolarHBondContact O-NZ 2.84Å; E401-K405 VanDerWaalsContact O-NZ 3.12Å; T402-K405 CarbonylContact O-C 3.43Å; T402-K405 WeakPolarHBondContact O-CA 3.38Å; T402-K405 PolarHBondContact O-N 3.21Å; K403-K405 VanDerWaalsContact C-N 3.32Å; K403-K405 PolarHBondContact O-N 3.32Å; K405-H407 PolarHBondContact O-N 2.97Å; K405-Q408 HydrophobicContact CB-CG 4.25Å; K405-Q408 WeakPolarHBondContact O-CB 3.45Å; K405-Q408 PolarHBondContact O-N 3Å
406	L	94.5	Very high	91.2	Very high	27 Å²	27	59.5 Å²	59.5	14%	0.141	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.3	-28.8	-171.1	-71.3	172.7	0	0	0	114.3	S365 I366 Y367 L393 W399 T402	S365-L406 WeakPolarHBondContact CB-O 3.5Å; I366-L406 HydrophobicContact CG2-CD2 4.22Å; I366-L406 PolarHBondContact N-O 3.44Å; Y367-L406 PolarHBondContact N-O 3.35Å; L393-L406 HydrophobicContact CD1-CD2 3.47Å; L393-L406 VanDerWaalsContact CD1-CD2 3.47Å; W399-L406 HydrophobicContact CH2-CD1 4.13Å; W399-L406 HydrophobicContact CZ3-CD1 3.96Å; W399-L406 HydrophobicContact CZ3-CD2 4.19Å; T402-L406 PolarHBondContact O-N 3.49Å
407	H	94.6	Very high	91.3	Very high	162 Å²	162	61.1 Å²	61.1	75%	0.75	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.9	-3.9	179.8	-58.6	-54.6	0	0	0	114.5	K405	K405-H407 PolarHBondContact O-N 2.97Å
408	Q	94.5	Very high	91.6	Very high	98 Å²	98	60.3 Å²	60.3	46%	0.458	31%	0.312	S	S	.	.	S	Bend	trans	-76	156.2	172.4	-62.2	-172.3	5.7	0	0	110.8	S365 I366 K405	S365-Q408 CarbonylContact C-O 3.59Å; S365-Q408 WeakPolarHBondContact CA-O 3.39Å; I366-Q408 PolarHBondContact N-O 3.4Å; K405-Q408 HydrophobicContact CB-CG 4.25Å; K405-Q408 WeakPolarHBondContact O-CB 3.45Å; K405-Q408 PolarHBondContact O-N 3Å
409	S	93.9	Very high	91.6	Very high	48 Å²	48	60.5 Å²	60.5	34%	0.336	31%	0.313	S	S	.	.	B	Isolated β-bridge	trans	-61	139.4	177	-179	0	0	0	0	111.4	Y411 S412	S409-Y411 PolarHBondContact O-N 3.13Å; S409-Y411 PolarHBondContact OG-N 3.19Å; S409-S412 PolarHBondContact O-N 3.21Å; S409-S412 PolarHBondContact O-OG 2.86Å
410	G	88.7	Confident	91.4	Very high	0 Å²	0	58.2 Å²	58.2	0%	0	30%	0.304	C	S	.	.	G	3₁₀ helix	trans	-56.8	-21.7	172.7	0	0	0	0	0	114.1	M364 S412 L413	M364-G410 PolarHBondContact O-N 2.9Å; G410-S412 VanDerWaalsContact C-N 3.28Å; G410-S412 PolarHBondContact O-N 3.38Å; G410-L413 PolarHBondContact O-N 3.25Å
411	Y	91.7	Very high	91.6	Very high	131 Å²	131	51.9 Å²	51.9	51%	0.514	27%	0.271	S	S	.	.	G	3₁₀ helix	trans	-72.1	-14.7	175.7	-64.2	-53.1	0	0	0	114.5	P361 P363 S409 L413 Q418	P361-Y411 HydrophobicContact CG-CD1 3.98Å; P361-Y411 HydrophobicContact CG-CE1 4.07Å; P361-Y411 PolarHBondContact O-OH 3.06Å; P363-Y411 HydrophobicContact CB-CE2 3.78Å; S409-Y411 PolarHBondContact O-N 3.13Å; S409-Y411 PolarHBondContact OG-N 3.19Å; Y411-L413 PolarHBondContact O-N 3.45Å; Y411-Q418 PolarHBondContact O-NE2 2.88Å
412	S	90.5	Very high	91.8	Very high	70 Å²	70	49.9 Å²	49.9	49%	0.49	26%	0.262	S	S	.	.	G	3₁₀ helix	trans	-77.2	-10.1	177.4	69.8	0	0	0	0	113.6	S409 G410	S409-S412 PolarHBondContact O-N 3.21Å; S409-S412 PolarHBondContact O-OG 2.86Å; G410-S412 VanDerWaalsContact C-N 3.28Å; G410-S412 PolarHBondContact O-N 3.38Å
413	L	90.3	Very high	91.7	Very high	11 Å²	11	49.9 Å²	49.9	6%	0.058	26%	0.262	C	S	.	.	S	Bend	trans	-79	153.9	179.8	-66.5	179.1	0	0	0	112.3	I366 L398 T402 G410 Y411 Q417 Q418 L421	I366-L413 HydrophobicContact CD1-CD1 3.99Å; I366-L413 HydrophobicContact CD1-CD2 3.9Å; I366-L413 HydrophobicContact CD1-CG 4.09Å; I366-L413 HydrophobicContact CG1-CD1 4.13Å; L398-L413 HydrophobicContact CD2-CD1 4.49Å; T402-L413 HydrophobicContact CG2-CD2 3.88Å; G410-L413 PolarHBondContact O-N 3.25Å; Y411-L413 PolarHBondContact O-N 3.45Å; L413-Q417 HydrophobicContact CB-CB 3.73Å; L413-Q417 HydrophobicContact CD1-CB 4.3Å; L413-Q417 HydrophobicContact CD2-CB 4.18Å; L413-Q417 HydrophobicContact CG-CB 4.29Å; L413-Q418 HydrophobicContact CB-CG 3.7Å; L413-Q418 PolarHBondContact O-NE2 3.43Å; L413-L421 HydrophobicContact CD1-CB 4.21Å; L413-L421 HydrophobicContact CD1-CD2 3.78Å
414	S	88.4	Confident	91.8	Very high	59 Å²	59	45.2 Å²	45.2	41%	0.413	24%	0.242	S	C	.	.			trans	-66.6	163.1	171.3	77.1	0	0	0	0	111.9	G416 Q417 Q418	S414-G416 VanDerWaalsContact C-N 3.34Å; S414-G416 PolarHBondContact O-N 3.34Å; S414-Q417 CarbonylContact O-C 3.26Å; S414-Q417 WeakPolarHBondContact O-CA 3.35Å; S414-Q417 WeakPolarHBondContact O-CB 3.28Å; S414-Q417 PolarHBondContact O-N 2.94Å; S414-Q417 WeakPolarHBondContact OG-CG 3.42Å; S414-Q417 PolarHBondContact OG-N 2.87Å; S414-Q417 PolarHBondContact OG-OE1 2.93Å; S414-Q418 WeakPolarHBondContact O-CG 3.42Å; S414-Q418 PolarHBondContact O-N 2.88Å
415	G	85.5	Confident	91.8	Very high	39 Å²	39	40.5 Å²	40.5	40%	0.402	21%	0.214	S	C	.	.	H	α-helix	trans	-52.5	-46.9	-179.4	0	0	0	0	0	113.8	Q417 Q418 Q419	G415-Q417 PolarHBondContact O-N 3.48Å; G415-Q418 PolarHBondContact O-N 2.87Å; G415-Q419 PolarHBondContact O-N 3.22Å
416	G	85.3	Confident	91.7	Very high	3 Å²	3	36.9 Å²	36.9	3%	0.031	20%	0.201	C	C	.	.	H	α-helix	trans	-67.2	-32.2	176.1	0	0	0	0	0	114	S414 R420	S414-G416 VanDerWaalsContact C-N 3.34Å; S414-G416 PolarHBondContact O-N 3.34Å; G416-R420 WeakPolarHBondContact O-CG 3.19Å; G416-R420 PolarHBondContact O-N 3.47Å; G416-R420 VanDerWaalsContact O-N 3.11Å
417	Q	91	Very high	91.6	Very high	34 Å²	34	35.6 Å²	35.6	16%	0.159	19%	0.194	C	C	.	.	H	α-helix	trans	-72.5	-40.3	173.8	-72.7	173.3	-24.3	0	0	111.9	L398 E401 L413 S414 G415 Q419 R420 L421	L398-Q417 HydrophobicContact CD1-CB 3.96Å; L398-Q417 HydrophobicContact CD1-CG 3.86Å; E401-Q417 WeakPolarHBondContact OE2-CG 3.39Å; E401-Q417 PolarHBondContact OE2-NE2 3.22Å; L413-Q417 HydrophobicContact CB-CB 3.73Å; L413-Q417 HydrophobicContact CD1-CB 4.3Å; L413-Q417 HydrophobicContact CD2-CB 4.18Å; L413-Q417 HydrophobicContact CG-CB 4.29Å; S414-Q417 CarbonylContact O-C 3.26Å; S414-Q417 WeakPolarHBondContact O-CA 3.35Å; S414-Q417 WeakPolarHBondContact O-CB 3.28Å; S414-Q417 PolarHBondContact O-N 2.94Å; S414-Q417 WeakPolarHBondContact OG-CG 3.42Å; S414-Q417 PolarHBondContact OG-N 2.87Å; S414-Q417 PolarHBondContact OG-OE1 2.93Å; G415-Q417 PolarHBondContact O-N 3.48Å; Q417-Q419 VanDerWaalsContact C-N 3.29Å; Q417-Q419 PolarHBondContact O-N 2.67Å; Q417-R420 PolarHBondContact O-N 3.21Å; Q417-L421 WeakPolarHBondContact O-CB 3.46Å; Q417-L421 PolarHBondContact O-N 3.27Å
418	Q	92.5	Very high	91.5	Very high	34 Å²	34	27.9 Å²	27.9	16%	0.159	16%	0.158	C	C	.	.	H	α-helix	trans	-62.7	-39.1	175.3	-69.2	-178.6	8.5	0	0	111.2	P359 P361 Y411 L413 S414 G415 L421 C422	P359-Q418 HydrophobicContact CB-CB 3.76Å; P359-Q418 HydrophobicContact CG-CB 4.38Å; P361-Q418 HydrophobicContact CG-CB 4.29Å; P361-Q418 HydrophobicContact CG-CG 4.14Å; Y411-Q418 PolarHBondContact O-NE2 2.88Å; L413-Q418 HydrophobicContact CB-CG 3.7Å; L413-Q418 PolarHBondContact O-NE2 3.43Å; S414-Q418 WeakPolarHBondContact O-CG 3.42Å; S414-Q418 PolarHBondContact O-N 2.88Å; G415-Q418 PolarHBondContact O-N 2.87Å; Q418-L421 WeakPolarHBondContact O-CB 3.29Å; Q418-L421 PolarHBondContact O-N 2.99Å; Q418-C422 PolarHBondContact O-N 3.28Å; Q418-C422 PolarHBondContact O-SG 2.71Å
419	Q	91.5	Very high	91.4	Very high	3 Å²	3	24.9 Å²	24.9	1%	0.014	15%	0.145	C	C	.	.	H	α-helix	trans	-66.2	-47.3	176.6	-166.6	67.4	-7.2	0	0	111.4	F356 P359 G415 Q417 L421 C422 I423 P439 L443 I451	F356-Q419 PolarHBondContact O-NE2 3.49Å; P359-Q419 HydrophobicContact CB-CB 4.31Å; G415-Q419 PolarHBondContact O-N 3.22Å; Q417-Q419 VanDerWaalsContact C-N 3.29Å; Q417-Q419 PolarHBondContact O-N 2.67Å; Q419-L421 VanDerWaalsContact C-N 3.27Å; Q419-L421 PolarHBondContact O-N 3.27Å; Q419-C422 WeakPolarHBondContact O-CB 3.47Å; Q419-C422 PolarHBondContact O-N 3.44Å; Q419-I423 WeakPolarHBondContact O-CG1 3.37Å; Q419-I423 PolarHBondContact O-N 3.34Å; Q419-P439 WeakPolarHBondContact CG-O 3.11Å; Q419-P439 PolarHBondContact NE2-O 3.01Å; Q419-L443 HydrophobicContact CB-CD1 4.46Å; Q419-L443 HydrophobicContact CG-CD1 4.43Å; Q419-I451 HydrophobicContact CB-CD1 4.16Å; Q419-I451 HydrophobicContact CG-CD1 3.74Å
420	R	91.2	Very high	91.2	Very high	4 Å²	4	29.2 Å²	29.2	2%	0.015	15%	0.154	C	C	.	.	H	α-helix	trans	-59.6	-35	173	-74.8	-175	-69.5	160.7	2.3	112.6	A396 A397 L398 E401 G416 Q417 I423 A424 R450 I451	A396-R420 WeakPolarHBondContact CB-O 3.37Å; A396-R420 WeakPolarHBondContact O-CD 3.45Å; A397-R420 PolarHBondContact O-NH1 3.32Å; L398-R420 HydrophobicContact CB-CB 4.42Å; L398-R420 HydrophobicContact CD1-CB 4.44Å; L398-R420 HydrophobicContact CD2-CB 4.31Å; E401-R420 VanDerWaalsContact CD-NH2 3.31Å; E401-R420 IonicContact OE1-CZ 2.71Å; E401-R420 IonicContact OE1-NH1 3.15Å; E401-R420 PolarHBondContact OE1-NH1 3.3Å; E401-R420 IonicContact OE1-NH2 3.02Å; E401-R420 PolarHBondContact OE1-NH2 3.17Å; E401-R420 IonicContact OE2-CZ 3.53Å; E401-R420 IonicContact OE2-NH2 2.65Å; E401-R420 PolarHBondContact OE2-NH2 3.32Å; G416-R420 WeakPolarHBondContact O-CG 3.19Å; G416-R420 PolarHBondContact O-N 3.47Å; G416-R420 VanDerWaalsContact O-N 3.11Å; Q417-R420 PolarHBondContact O-N 3.21Å; R420-I423 PolarHBondContact O-N 3.38Å; R420-A424 WeakPolarHBondContact O-CB 3.39Å; R420-A424 PolarHBondContact O-N 3.15Å; R420-R450 VanDerWaalsContact NH1-NH1 3.18Å; R420-I451 HydrophobicContact CG-CD1 4.35Å; R420-I451 HydrophobicContact CG-CG1 3.99Å
421	L	94.5	Very high	91.3	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-65.1	-41.3	172.8	178	60	0	0	0	112	P361 I366 N369 I370 L393 L398 L413 Q417 Q418 Q419 I423 A424 R425	P361-L421 HydrophobicContact CB-CD2 4.2Å; I366-L421 HydrophobicContact CG1-CD2 4.45Å; I366-L421 HydrophobicContact CG2-CD1 3.88Å; I366-L421 HydrophobicContact CG2-CD2 4.47Å; N369-L421 HydrophobicContact CB-CD1 4.31Å; N369-L421 HydrophobicContact CB-CD2 4.28Å; N369-L421 HydrophobicContact CB-CG 4.44Å; I370-L421 HydrophobicContact CD1-CD1 3.96Å; I370-L421 HydrophobicContact CG1-CD1 3.92Å; L393-L421 HydrophobicContact CD2-CD1 4.16Å; L398-L421 HydrophobicContact CD2-CB 3.84Å; L413-L421 HydrophobicContact CD1-CB 4.21Å; L413-L421 HydrophobicContact CD1-CD2 3.78Å; Q417-L421 WeakPolarHBondContact O-CB 3.46Å; Q417-L421 PolarHBondContact O-N 3.27Å; Q418-L421 WeakPolarHBondContact O-CB 3.29Å; Q418-L421 PolarHBondContact O-N 2.99Å; Q419-L421 VanDerWaalsContact C-N 3.27Å; Q419-L421 PolarHBondContact O-N 3.27Å; L421-I423 VanDerWaalsContact C-N 3.33Å; L421-A424 PolarHBondContact O-N 3.48Å; L421-R425 WeakPolarHBondContact O-CB 3.32Å; L421-R425 PolarHBondContact O-N 3.24Å
422	C	94.3	Very high	91.2	Very high	6 Å²	6	26.6 Å²	26.6	4%	0.041	15%	0.147	C	C	.	.	H	α-helix	trans	-64.8	-38.7	175.6	-66.5	0	0	0	0	111.7	V355 Q418 Q419 R425 G426	V355-C422 HydrophobicContact CG1-CB 4.06Å; Q418-C422 PolarHBondContact O-N 3.28Å; Q418-C422 PolarHBondContact O-SG 2.71Å; Q419-C422 WeakPolarHBondContact O-CB 3.47Å; Q419-C422 PolarHBondContact O-N 3.44Å; C422-R425 PolarHBondContact O-N 2.84Å; C422-G426 PolarHBondContact O-N 2.95Å; C422-G426 VanDerWaalsContact O-N 3.1Å
423	I	92.8	Very high	91.3	Very high	1 Å²	1	23.5 Å²	23.5	1%	0.005	13%	0.125	C	C	.	.	H	α-helix	trans	-64.3	-48	173.1	-62.9	168.1	0	0	0	110.3	V355 Q419 R420 L421 R425 G426 I427 L436 I451 L454 L458	V355-I423 HydrophobicContact CG1-CG1 3.96Å; V355-I423 HydrophobicContact CG2-CG1 4.22Å; Q419-I423 WeakPolarHBondContact O-CG1 3.37Å; Q419-I423 PolarHBondContact O-N 3.34Å; R420-I423 PolarHBondContact O-N 3.38Å; L421-I423 VanDerWaalsContact C-N 3.33Å; I423-R425 VanDerWaalsContact C-N 3.29Å; I423-R425 PolarHBondContact O-N 3.18Å; I423-G426 WeakPolarHBondContact O-CA 3.48Å; I423-G426 PolarHBondContact O-N 3.33Å; I423-I427 HydrophobicContact CG2-CD1 3.51Å; I423-I427 HydrophobicContact CG2-CG1 4.19Å; I423-I427 WeakPolarHBondContact O-CD1 3.49Å; I423-I427 VanDerWaalsContact O-CG1 3.29Å; I423-I427 WeakPolarHBondContact O-CG1 3.47Å; I423-I427 PolarHBondContact O-N 3.13Å; I423-L436 HydrophobicContact CG1-CD2 4.42Å; I423-I451 HydrophobicContact CD1-CD1 4.06Å; I423-I451 HydrophobicContact CD1-CG1 4.29Å; I423-I451 HydrophobicContact CD1-CG2 4.14Å; I423-L454 HydrophobicContact CB-CD2 4.25Å; I423-L454 HydrophobicContact CD1-CD2 4Å; I423-L454 HydrophobicContact CG2-CD2 3.61Å; I423-L454 HydrophobicContact CG2-CG 4.37Å; I423-L458 HydrophobicContact CG2-CD1 4.25Å
424	A	93.9	Very high	91.5	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-54.9	-43.9	175.7	0	0	0	0	0	112.1	I370 A392 L393 A396 R420 L421 G426 I427 A428	I370-A424 HydrophobicContact CD1-CB 3.7Å; I370-A424 HydrophobicContact CG1-CB 4.4Å; A392-A424 HydrophobicContact CB-CB 4.43Å; L393-A424 HydrophobicContact CD2-CB 4.38Å; A396-A424 HydrophobicContact CB-CB 3.64Å; R420-A424 WeakPolarHBondContact O-CB 3.39Å; R420-A424 PolarHBondContact O-N 3.15Å; L421-A424 PolarHBondContact O-N 3.48Å; A424-G426 VanDerWaalsContact C-N 3.33Å; A424-G426 PolarHBondContact O-N 3.31Å; A424-I427 PolarHBondContact O-N 3.13Å; A424-A428 WeakPolarHBondContact O-CB 3.35Å; A424-A428 PolarHBondContact O-N 3.21Å
425	R	94.3	Very high	91.8	Very high	36 Å²	36	20.2 Å²	20.2	14%	0.136	10%	0.103	C	C	.	.	H	α-helix	trans	-59.9	-41.6	175.3	177.1	178.1	66.5	-160.3	-2.4	112.1	T360 F362 N369 L421 C422 I423	T360-R425 PolarHBondContact O-NH1 3.4Å; T360-R425 VanDerWaalsContact O-NH1 3.09Å; T360-R425 PolarHBondContact O-NH2 3.25Å; F362-R425 VanDerWaalsContact CD1-NH1 3.33Å; N369-R425 WeakPolarHBondContact O-CD 3.34Å; N369-R425 VanDerWaalsContact O-CG 3.26Å; N369-R425 WeakPolarHBondContact O-CG 3.44Å; N369-R425 PolarHBondContact OD1-NH1 2.95Å; L421-R425 WeakPolarHBondContact O-CB 3.32Å; L421-R425 PolarHBondContact O-N 3.24Å; C422-R425 PolarHBondContact O-N 2.84Å; I423-R425 VanDerWaalsContact C-N 3.29Å; I423-R425 PolarHBondContact O-N 3.18Å
426	G	91.8	Very high	92.1	Very high	9 Å²	9	18.4 Å²	18.4	9%	0.093	8%	0.084	C	C	.	.	H	α-helix	trans	-64.9	-43.2	175.5	0	0	0	0	0	112.6	C422 I423 A424 A428 I429 P431	C422-G426 PolarHBondContact O-N 2.95Å; C422-G426 VanDerWaalsContact O-N 3.1Å; I423-G426 WeakPolarHBondContact O-CA 3.48Å; I423-G426 PolarHBondContact O-N 3.33Å; A424-G426 VanDerWaalsContact C-N 3.33Å; A424-G426 PolarHBondContact O-N 3.31Å; G426-A428 VanDerWaalsContact C-N 3.33Å; G426-A428 PolarHBondContact O-N 2.93Å; G426-I429 WeakPolarHBondContact O-CG1 3.26Å; G426-P431 VanDerWaalsContact O-CD 3.27Å; G426-P431 WeakPolarHBondContact O-CD 3.3Å
427	I	92.4	Very high	92.4	Very high	0 Å²	0	18.3 Å²	18.3	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-69.5	-31.6	179.9	-60.7	158	0	0	0	111.9	W391 I423 A424 I429 R430 L434 L458 Y462	W391-I427 HydrophobicContact CH2-CG2 3.54Å; W391-I427 HydrophobicContact CZ2-CG2 4.34Å; W391-I427 HydrophobicContact CZ3-CG2 3.83Å; I423-I427 HydrophobicContact CG2-CD1 3.51Å; I423-I427 HydrophobicContact CG2-CG1 4.19Å; I423-I427 WeakPolarHBondContact O-CD1 3.49Å; I423-I427 VanDerWaalsContact O-CG1 3.29Å; I423-I427 WeakPolarHBondContact O-CG1 3.47Å; I423-I427 PolarHBondContact O-N 3.13Å; A424-I427 PolarHBondContact O-N 3.13Å; I427-I429 PolarHBondContact O-N 3.29Å; I427-R430 WeakPolarHBondContact O-CA 3.37Å; I427-R430 PolarHBondContact O-N 3.49Å; I427-L434 HydrophobicContact CG1-CD2 4.24Å; I427-L458 HydrophobicContact CD1-CD1 3.96Å; I427-L458 HydrophobicContact CD1-CD2 3.5Å; I427-L458 HydrophobicContact CD1-CG 4.33Å; I427-L458 HydrophobicContact CG1-CD1 4.39Å; I427-L458 HydrophobicContact CG1-CD2 3.78Å; I427-L458 HydrophobicContact CG2-CD2 4.38Å; I427-Y462 HydrophobicContact CG2-CE2 3.83Å
428	A	92.8	Very high	92.2	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-60.6	-29.6	-173.6	0	0	0	0	0	114.4	I370 V374 R388 A392 A424 G426 R430	I370-A428 HydrophobicContact CG2-CB 3.44Å; I370-A428 VanDerWaalsContact CG2-CB 3.44Å; V374-A428 HydrophobicContact CG2-CB 3.95Å; R388-A428 WeakPolarHBondContact CD-O 3.44Å; R388-A428 PolarHBondContact NH1-O 2.91Å; A392-A428 HydrophobicContact CB-CB 3.82Å; A424-A428 WeakPolarHBondContact O-CB 3.35Å; A424-A428 PolarHBondContact O-N 3.21Å; G426-A428 VanDerWaalsContact C-N 3.33Å; G426-A428 PolarHBondContact O-N 2.93Å; A428-R430 VanDerWaalsContact C-N 3.29Å
429	I	91.1	Very high	91.9	Very high	35 Å²	35	16.3 Å²	16.3	18%	0.179	7%	0.073	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.7	1.7	174.6	46.5	171.5	0	0	0	113.4	G373 F377 G426 I427	G373-I429 WeakPolarHBondContact O-CG2 3.36Å; F377-I429 HydrophobicContact CD2-CG2 4.13Å; G426-I429 WeakPolarHBondContact O-CG1 3.26Å; I427-I429 PolarHBondContact O-N 3.29Å
430	R	90.5	Very high	91.5	Very high	138 Å²	138	17.6 Å²	17.6	52%	0.521	8%	0.083	S	C	.	.			trans	51.5	61.6	178.4	-60.6	177.5	176.4	171.3	-1.1	112.6	W391 I427 A428	W391-R430 HydrophobicContact CH2-CG 4.05Å; W391-R430 HydrophobicContact CZ3-CG 4.34Å; I427-R430 WeakPolarHBondContact O-CA 3.37Å; I427-R430 PolarHBondContact O-N 3.49Å; A428-R430 VanDerWaalsContact C-N 3.29Å
431	P	92	Very high	90.9	Very high	5 Å²	5	19.1 Å²	19.1	3%	0.032	9%	0.094	C	C	.	.			trans	-65.1	163.2	177.8	31.8	-35.8	0	0	0	110.5	K351 G426 V433 L434 Y462	K351-P431 WeakPolarHBondContact O-CB 3.45Å; G426-P431 VanDerWaalsContact O-CD 3.27Å; G426-P431 WeakPolarHBondContact O-CD 3.3Å; P431-V433 WeakPolarHBondContact CB-O 3.35Å; P431-L434 HydrophobicContact CG-CD1 4.25Å; P431-Y462 WeakPolarHBondContact O-CD1 3.22Å; P431-Y462 VanDerWaalsContact O-CE1 3.26Å; P431-Y462 WeakPolarHBondContact O-CE1 3.44Å
432	E	89.5	Confident	89.7	Confident	71 Å²	71	24.2 Å²	24.2	33%	0.332	14%	0.136	S	C	.	.	S	Bend	trans	-84.4	-31.5	169.8	-67.9	173.6	-169.8	0	0	110.8	W269 K351 T463	W269-E432 HydrophobicContact CH2-CB 4.34Å; W269-E432 HydrophobicContact CZ2-CB 4Å; W269-E432 WeakPolarHBondContact CZ2-OE2 3.37Å; K351-E432 WeakPolarHBondContact CE-OE1 3.38Å; K351-E432 HydrophobicContact CG-CG 4.46Å; K351-E432 IonicContact NZ-OE1 3.59Å; K351-E432 PolarHBondContact NZ-OE1 2.94Å; K351-E432 IonicContact NZ-OE2 2.77Å; K351-E432 PolarHBondContact NZ-OE2 2.9Å; K351-E432 PolarHBondContact O-N 3.13Å; E432-T463 PolarHBondContact O-N 3.34Å; E432-T463 VanDerWaalsContact O-N 3.16Å
433	V	92.1	Very high	88.8	Confident	6 Å²	6	25.4 Å²	25.4	4%	0.036	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	132	175.9	-176.8	0	0	0	0	110.3	W269 K351 V352 G353 P431 L435 T463	W269-V433 HydrophobicContact CE3-CG2 4.26Å; W269-V433 HydrophobicContact CH2-CB 4.49Å; W269-V433 HydrophobicContact CH2-CG2 3.06Å; W269-V433 HydrophobicContact CZ2-CG2 4.24Å; W269-V433 HydrophobicContact CZ3-CG2 3.07Å; K351-V433 PolarHBondContact O-N 3.31Å; K351-V433 VanDerWaalsContact O-N 3.1Å; V352-V433 CarbonylContact C-O 3.53Å; V352-V433 WeakPolarHBondContact CA-O 3.39Å; V352-V433 HydrophobicContact CB-CB 4.49Å; V352-V433 HydrophobicContact CG1-CB 4.1Å; V352-V433 HydrophobicContact CG1-CG1 4.18Å; V352-V433 HydrophobicContact CG2-CB 4.34Å; G353-V433 PolarHBondContact N-O 3.15Å; P431-V433 WeakPolarHBondContact CB-O 3.35Å; V433-L435 HydrophobicContact CG1-CD2 3.81Å; V433-L435 HydrophobicContact CG1-CG 4.36Å; V433-T463 CarbonylContact C-O 3.51Å; V433-T463 VanDerWaalsContact CA-O 3.29Å; V433-T463 WeakPolarHBondContact CA-O 3.5Å
434	L	93.8	Very high	87.8	Confident	1 Å²	1	28.8 Å²	28.8	1%	0.005	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	114.7	171.7	-168.7	68	0	0	0	110.4	V355 I427 P431 L436 L458 T463 V464 E465	V355-L434 HydrophobicContact CG2-CD1 4.3Å; I427-L434 HydrophobicContact CG1-CD2 4.24Å; P431-L434 HydrophobicContact CG-CD1 4.25Å; L434-L436 HydrophobicContact CD2-CD2 4.01Å; L434-L436 HydrophobicContact CD2-CG 4.48Å; L434-L436 HydrophobicContact CG-CD2 3.97Å; L434-L436 HydrophobicContact CG-CG 4.35Å; L434-L458 HydrophobicContact CD2-CD1 3.85Å; L434-T463 PolarHBondContact N-O 3.35Å; L434-V464 WeakPolarHBondContact O-CA 3.3Å; L434-E465 PolarHBondContact O-N 3.01Å
435	L	94.6	Very high	86.6	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	122.3	177.5	-64.5	-173.1	0	0	0	110.2	L312 F315 N316 V352 G353 M354 V355 V433 E465	L312-L435 HydrophobicContact CD2-CB 3.47Å; L312-L435 VanDerWaalsContact CD2-CB 3.47Å; L312-L435 HydrophobicContact CD2-CD1 4.32Å; L312-L435 HydrophobicContact CD2-CD2 4.07Å; L312-L435 HydrophobicContact CD2-CG 4.15Å; L312-L435 HydrophobicContact CG-CD2 4.38Å; L312-L435 WeakPolarHBondContact O-CD1 3.39Å; F315-L435 HydrophobicContact CB-CD1 4Å; F315-L435 HydrophobicContact CB-CD2 4.2Å; F315-L435 HydrophobicContact CD2-CD2 4.29Å; N316-L435 HydrophobicContact CB-CD1 4.23Å; V352-L435 HydrophobicContact CG1-CD1 3.57Å; V352-L435 HydrophobicContact CG1-CD2 4.23Å; V352-L435 HydrophobicContact CG1-CG 3.73Å; G353-L435 VanDerWaalsContact O-CB 3.25Å; G353-L435 WeakPolarHBondContact O-CB 3.39Å; G353-L435 PolarHBondContact O-N 2.9Å; M354-L435 CarbonylContact C-O 3.5Å; M354-L435 WeakPolarHBondContact CA-O 3.2Å; M354-L435 HydrophobicContact CB-CB 3.97Å; M354-L435 HydrophobicContact CB-CD1 4.37Å; M354-L435 HydrophobicContact CG-CB 3.92Å; M354-L435 HydrophobicContact SD-CD1 4.26Å; V355-L435 PolarHBondContact N-O 2.87Å; V433-L435 HydrophobicContact CG1-CD2 3.81Å; V433-L435 HydrophobicContact CG1-CG 4.36Å; L435-E465 CarbonylContact C-O 3.49Å; L435-E465 WeakPolarHBondContact CA-O 3.46Å; L435-E465 HydrophobicContact CD2-CB 3.67Å; L435-E465 HydrophobicContact CD2-CG 4.32Å
436	L	92.9	Very high	85.5	Confident	1 Å²	1	38.2 Å²	38.2	1%	0.005	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	104.1	-179.1	-57	176.1	0	0	0	111.1	V355 I423 L434 E438 P439 I455 V464 E465 C466 V467	V355-L436 HydrophobicContact CB-CD2 3.6Å; V355-L436 HydrophobicContact CG1-CD2 4.39Å; V355-L436 HydrophobicContact CG2-CD2 3.58Å; I423-L436 HydrophobicContact CG1-CD2 4.42Å; L434-L436 HydrophobicContact CD2-CD2 4.01Å; L434-L436 HydrophobicContact CD2-CG 4.48Å; L434-L436 HydrophobicContact CG-CD2 3.97Å; L434-L436 HydrophobicContact CG-CG 4.35Å; L436-E438 PolarHBondContact O-N 3.41Å; L436-P439 HydrophobicContact CB-CB 4.21Å; L436-P439 HydrophobicContact CB-CG 3.95Å; L436-P439 HydrophobicContact CD1-CG 4.36Å; L436-I455 HydrophobicContact CD1-CD1 3.8Å; L436-I455 HydrophobicContact CD1-CG1 3.61Å; L436-V464 HydrophobicContact CD1-CG1 3.75Å; L436-V464 HydrophobicContact CG-CG1 4.28Å; L436-E465 PolarHBondContact N-O 3.39Å; L436-C466 HydrophobicContact CB-CB 3.82Å; L436-C466 CarbonylContact O-C 3.59Å; L436-C466 WeakPolarHBondContact O-CA 3.35Å; L436-V467 PolarHBondContact O-N 2.87Å
437	D	91.4	Very high	84.5	Confident	1 Å²	1	38.3 Å²	38.3	1%	0.005	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	102	178.1	-163.9	13.8	0	0	0	109.4	S309 R313 M354 V355 F356 Q357	S309-D437 VanDerWaalsContact CB-OD1 3.25Å; S309-D437 WeakPolarHBondContact CB-OD1 3.09Å; S309-D437 WeakPolarHBondContact CB-OD2 3.49Å; S309-D437 PolarHBondContact OG-OD1 3.03Å; R313-D437 IonicContact NH2-OD2 3.12Å; M354-D437 HydrophobicContact CE-CB 3.96Å; V355-D437 PolarHBondContact O-N 3.27Å; F356-D437 CarbonylContact C-O 3.58Å; Q357-D437 WeakPolarHBondContact CA-O 3.31Å; Q357-D437 WeakPolarHBondContact CB-O 3.49Å; Q357-D437 PolarHBondContact N-O 3.27Å
438	E	87.1	Confident	83.7	Confident	22 Å²	22	39.7 Å²	39.7	10%	0.103	23%	0.226	C	C	.	.	S	Bend	trans	45.7	59.9	179.3	-69	-179.6	-149.6	0	0	114	Q357 L436 C440 S441 V467	Q357-E438 HydrophobicContact CB-CB 4.27Å; Q357-E438 HydrophobicContact CG-CB 3.86Å; Q357-E438 PolarHBondContact NE2-OE2 3Å; L436-E438 PolarHBondContact O-N 3.41Å; E438-C440 PolarHBondContact O-N 3.11Å; E438-S441 PolarHBondContact O-N 2.99Å; E438-S441 VanDerWaalsContact O-N 3.1Å; E438-V467 VanDerWaalsContact CA-O 3.24Å; E438-V467 WeakPolarHBondContact CA-O 3.29Å; E438-V467 HydrophobicContact CG-CB 3.9Å; E438-V467 HydrophobicContact CG-CG1 3.55Å; E438-V467 PolarHBondContact N-O 2.8Å
439	P	85.5	Confident	82.8	Confident	3 Å²	3	41 Å²	41	2%	0.019	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-16.7	-168.6	29.2	-36.7	0	0	0	114	Q419 L436 I451 I455	Q419-P439 WeakPolarHBondContact CG-O 3.11Å; Q419-P439 PolarHBondContact NE2-O 3.01Å; L436-P439 HydrophobicContact CB-CB 4.21Å; L436-P439 HydrophobicContact CB-CG 3.95Å; L436-P439 HydrophobicContact CD1-CG 4.36Å; P439-I451 HydrophobicContact CB-CG2 4.08Å; P439-I451 HydrophobicContact CG-CG2 4.36Å; P439-I455 HydrophobicContact CG-CD1 3.88Å
440	C	83	Confident	82	Confident	31 Å²	31	43.9 Å²	43.9	21%	0.209	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.1	4.3	-179.5	-58.1	0	0	0	0	113.7	E438 A442 L443 T448	E438-C440 PolarHBondContact O-N 3.11Å; C440-A442 PolarHBondContact O-N 3.36Å; C440-L443 PolarHBondContact O-N 3.24Å; C440-T448 HydrophobicContact CB-CG2 3.86Å
441	S	77.9	Confident	81.6	Confident	35 Å²	35	37.3 Å²	37.3	25%	0.245	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	135.6	-177.8	121.1	0	0	0	0	111	Q357 E438 L443	Q357-S441 WeakPolarHBondContact CG-OG 3.16Å; E438-S441 PolarHBondContact O-N 2.99Å; E438-S441 VanDerWaalsContact O-N 3.1Å; S441-L443 PolarHBondContact O-N 3.09Å
442	A	70.7	Confident	81	Confident	108 Å²	108	38 Å²	38	89%	0.893	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.1	25.8	177.5	0	0	0	0	0	115.2	C440	C440-A442 PolarHBondContact O-N 3.36Å
443	L	73.7	Confident	80.5	Confident	31 Å²	31	39.8 Å²	39.8	16%	0.162	23%	0.234	C	C	.	.			trans	-99.7	155.4	173.3	-63.8	-173.8	0	0	0	112.1	Q419 C440 S441 I451	Q419-L443 HydrophobicContact CB-CD1 4.46Å; Q419-L443 HydrophobicContact CG-CD1 4.43Å; C440-L443 PolarHBondContact O-N 3.24Å; S441-L443 PolarHBondContact O-N 3.09Å; L443-I451 HydrophobicContact CD1-CD1 3.41Å; L443-I451 VanDerWaalsContact CD1-CD1 3.41Å; L443-I451 HydrophobicContact CD1-CG1 4.47Å
444	D	73	Confident	80.1	Confident	72 Å²	72	39.7 Å²	39.7	39%	0.385	23%	0.233	S	C	.	.			trans	-69.3	159.7	169.8	68.4	89.5	0	0	0	111	I446 S447 T448	D444-I446 VanDerWaalsContact C-N 3.26Å; D444-I446 PolarHBondContact O-N 2.98Å; D444-I446 WeakPolarHBondContact OD1-CA 3.43Å; D444-I446 WeakPolarHBondContact OD1-CB 3.34Å; D444-I446 PolarHBondContact OD1-N 3.27Å; D444-S447 PolarHBondContact O-N 3.06Å; D444-S447 PolarHBondContact OD1-N 2.95Å; D444-S447 PolarHBondContact OD1-OG 3.45Å; D444-S447 WeakPolarHBondContact OD2-CB 3.33Å; D444-S447 PolarHBondContact OD2-OG 3.43Å; D444-T448 WeakPolarHBondContact O-CB 3.23Å; D444-T448 PolarHBondContact O-N 2.86Å; D444-T448 PolarHBondContact O-OG1 3.39Å
445	P	68.1	Low	79.8	Confident	113 Å²	113	39.8 Å²	39.8	73%	0.734	23%	0.234	S	C	*	.	H	α-helix	trans	-59	-31.9	-177.4	-26	35.1	0	0	0	114.6	G449	P445-G449 PolarHBondContact O-N 3.45Å; P445-G449 VanDerWaalsContact O-N 3.08Å
446	I	70.6	Confident	79.1	Confident	121 Å²	121	41.9 Å²	41.9	62%	0.621	25%	0.247	S	C	*	.	H	α-helix	trans	-73.2	-47.1	-179.1	-58.1	171.6	0	0	0	109.5	D444 T448 G449 R450	D444-I446 VanDerWaalsContact C-N 3.26Å; D444-I446 PolarHBondContact O-N 2.98Å; D444-I446 WeakPolarHBondContact OD1-CA 3.43Å; D444-I446 WeakPolarHBondContact OD1-CB 3.34Å; D444-I446 PolarHBondContact OD1-N 3.27Å; I446-T448 VanDerWaalsContact C-N 3.28Å; I446-T448 PolarHBondContact O-N 3.35Å; I446-G449 PolarHBondContact O-N 2.89Å; I446-R450 PolarHBondContact O-N 3.32Å; I446-R450 VanDerWaalsContact O-N 3.13Å
447	S	72.1	Confident	78.7	Confident	11 Å²	11	46.9 Å²	46.9	8%	0.077	27%	0.27	C	S	.	.	H	α-helix	trans	-60.8	-39.2	174.8	-66	0	0	0	0	111.9	D444 R450 I451	D444-S447 PolarHBondContact O-N 3.06Å; D444-S447 PolarHBondContact OD1-N 2.95Å; D444-S447 PolarHBondContact OD1-OG 3.45Å; D444-S447 WeakPolarHBondContact OD2-CB 3.33Å; D444-S447 PolarHBondContact OD2-OG 3.43Å; S447-R450 PolarHBondContact O-N 3.39Å; S447-I451 PolarHBondContact O-N 3.32Å
448	T	76	Confident	78.5	Confident	29 Å²	29	46.9 Å²	46.9	18%	0.178	27%	0.27	C	S	.	.	H	α-helix	trans	-59.1	-51.3	175.4	-59.5	0	0	0	0	111.2	C440 D444 I446 R450 I451 E452	C440-T448 HydrophobicContact CB-CG2 3.86Å; D444-T448 WeakPolarHBondContact O-CB 3.23Å; D444-T448 PolarHBondContact O-N 2.86Å; D444-T448 PolarHBondContact O-OG1 3.39Å; I446-T448 VanDerWaalsContact C-N 3.28Å; I446-T448 PolarHBondContact O-N 3.35Å; T448-R450 VanDerWaalsContact C-N 3.29Å; T448-R450 PolarHBondContact O-N 3.23Å; T448-I451 PolarHBondContact O-N 3.17Å; T448-I451 VanDerWaalsContact O-N 3.12Å; T448-E452 WeakPolarHBondContact O-CG 3.41Å; T448-E452 PolarHBondContact O-N 2.62Å
449	G	72.3	Confident	78.3	Confident	27 Å²	27	50.3 Å²	50.3	28%	0.278	28%	0.284	S	S	.	.	H	α-helix	trans	-58.6	-40	178.7	0	0	0	0	0	113	P445 I446 E452 E453	P445-G449 PolarHBondContact O-N 3.45Å; P445-G449 VanDerWaalsContact O-N 3.08Å; I446-G449 PolarHBondContact O-N 2.89Å; G449-E452 PolarHBondContact O-N 2.95Å; G449-E453 PolarHBondContact O-N 3.16Å
450	R	76.3	Confident	78.1	Confident	95 Å²	95	56.8 Å²	56.8	36%	0.358	32%	0.315	S	S	.	.	H	α-helix	trans	-66.3	-36.1	176.2	-71.1	-179	177.3	-172.7	-2.8	113.4	E401 R420 I446 S447 T448 L454	E401-R450 IonicContact OE1-CZ 2.93Å; E401-R450 IonicContact OE1-NH1 3.68Å; E401-R450 PolarHBondContact OE1-NH1 2.96Å; R420-R450 VanDerWaalsContact NH1-NH1 3.18Å; I446-R450 PolarHBondContact O-N 3.32Å; I446-R450 VanDerWaalsContact O-N 3.13Å; S447-R450 PolarHBondContact O-N 3.39Å; T448-R450 VanDerWaalsContact C-N 3.29Å; T448-R450 PolarHBondContact O-N 3.23Å; R450-L454 VanDerWaalsContact O-CB 3.29Å; R450-L454 WeakPolarHBondContact O-CB 3.49Å; R450-L454 PolarHBondContact O-N 3.28Å
451	I	81.8	Confident	78.2	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-71	-37.2	174.6	-70.4	-172.5	0	0	0	110.7	Q419 R420 I423 P439 L443 S447 T448 L454 I455	Q419-I451 HydrophobicContact CB-CD1 4.16Å; Q419-I451 HydrophobicContact CG-CD1 3.74Å; R420-I451 HydrophobicContact CG-CD1 4.35Å; R420-I451 HydrophobicContact CG-CG1 3.99Å; I423-I451 HydrophobicContact CD1-CD1 4.06Å; I423-I451 HydrophobicContact CD1-CG1 4.29Å; I423-I451 HydrophobicContact CD1-CG2 4.14Å; P439-I451 HydrophobicContact CB-CG2 4.08Å; P439-I451 HydrophobicContact CG-CG2 4.36Å; L443-I451 HydrophobicContact CD1-CD1 3.41Å; L443-I451 VanDerWaalsContact CD1-CD1 3.41Å; L443-I451 HydrophobicContact CD1-CG1 4.47Å; S447-I451 PolarHBondContact O-N 3.32Å; T448-I451 PolarHBondContact O-N 3.17Å; T448-I451 VanDerWaalsContact O-N 3.12Å; I451-L454 WeakPolarHBondContact O-CB 3.3Å; I451-L454 PolarHBondContact O-N 3.03Å; I451-I455 HydrophobicContact CG2-CD1 3.95Å; I451-I455 HydrophobicContact CG2-CG1 4.4Å; I451-I455 VanDerWaalsContact O-CG1 3.28Å; I451-I455 WeakPolarHBondContact O-CG1 3.26Å; I451-I455 PolarHBondContact O-N 3.23Å
452	E	79.6	Confident	78.7	Confident	21 Å²	21	57.8 Å²	57.8	10%	0.098	31%	0.314	C	S	.	.	H	α-helix	trans	-65.7	-39.6	174.6	-70	178.3	168	0	0	112.3	T448 G449 I455 T456	T448-E452 WeakPolarHBondContact O-CG 3.41Å; T448-E452 PolarHBondContact O-N 2.62Å; G449-E452 PolarHBondContact O-N 2.95Å; E452-I455 PolarHBondContact O-N 2.83Å; E452-T456 PolarHBondContact O-N 3.46Å; E452-T456 VanDerWaalsContact O-N 3.13Å; E452-T456 PolarHBondContact O-OG1 2.96Å
453	E	77.8	Confident	79.6	Confident	108 Å²	108	52.7 Å²	52.7	51%	0.505	27%	0.272	S	S	.	.	H	α-helix	trans	-54.9	-51.8	168	-83.2	176.2	177.5	0	0	111.4	G449 I455 T456 E457 H476	G449-E453 PolarHBondContact O-N 3.16Å; E453-I455 PolarHBondContact O-N 3.04Å; E453-T456 WeakPolarHBondContact O-CB 3.37Å; E453-T456 PolarHBondContact O-N 3.29Å; E453-T456 VanDerWaalsContact O-N 3.09Å; E453-E457 PolarHBondContact O-N 3.32Å; E453-H476 WeakPolarHBondContact CA-NE2 3.3Å; E453-H476 WeakPolarHBondContact CG-CE1 3.36Å; E453-H476 WeakPolarHBondContact CG-NE2 3.38Å; E453-H476 PolarHBondContact N-NE2 3Å; E453-H476 VanDerWaalsContact N-NE2 3.14Å; E453-H476 IonicContact OE1-CE1 2.69Å
454	L	84	Confident	80.4	Confident	4 Å²	4	51.2 Å²	51.2	2%	0.021	26%	0.264	C	S	.	.	H	α-helix	trans	-57.1	-49.1	180	175.5	57.4	0	0	0	111.7	K395 A396 I423 R450 I451 T456 E457 L458	K395-L454 WeakPolarHBondContact O-CD1 3.43Å; A396-L454 HydrophobicContact CB-CD2 4.07Å; I423-L454 HydrophobicContact CB-CD2 4.25Å; I423-L454 HydrophobicContact CD1-CD2 4Å; I423-L454 HydrophobicContact CG2-CD2 3.61Å; I423-L454 HydrophobicContact CG2-CG 4.37Å; R450-L454 VanDerWaalsContact O-CB 3.29Å; R450-L454 WeakPolarHBondContact O-CB 3.49Å; R450-L454 PolarHBondContact O-N 3.28Å; I451-L454 WeakPolarHBondContact O-CB 3.3Å; I451-L454 PolarHBondContact O-N 3.03Å; L454-T456 PolarHBondContact O-N 3.32Å; L454-E457 PolarHBondContact O-N 2.86Å; L454-L458 HydrophobicContact CD1-CD1 3.88Å; L454-L458 HydrophobicContact CD1-CD2 4.31Å; L454-L458 HydrophobicContact CD1-CG 3.89Å; L454-L458 HydrophobicContact CG-CD1 3.78Å; L454-L458 HydrophobicContact CG-CG 4.26Å; L454-L458 WeakPolarHBondContact O-CB 3.36Å; L454-L458 WeakPolarHBondContact O-CG 3.48Å; L454-L458 PolarHBondContact O-N 2.93Å
455	I	87	Confident	81.2	Confident	2 Å²	2	47.8 Å²	47.8	1%	0.01	25%	0.246	C	C	.	.	H	α-helix	trans	-57.8	-39.2	178	-70.5	167.9	0	0	0	111.1	V297 L436 P439 I451 E452 E453 L458 K459 V464 M468	V297-I455 HydrophobicContact CB-CG2 4.43Å; V297-I455 HydrophobicContact CG1-CG2 3.67Å; V297-I455 HydrophobicContact CG2-CG2 3.86Å; L436-I455 HydrophobicContact CD1-CD1 3.8Å; L436-I455 HydrophobicContact CD1-CG1 3.61Å; P439-I455 HydrophobicContact CG-CD1 3.88Å; I451-I455 HydrophobicContact CG2-CD1 3.95Å; I451-I455 HydrophobicContact CG2-CG1 4.4Å; I451-I455 VanDerWaalsContact O-CG1 3.28Å; I451-I455 WeakPolarHBondContact O-CG1 3.26Å; I451-I455 PolarHBondContact O-N 3.23Å; E452-I455 PolarHBondContact O-N 2.83Å; E453-I455 PolarHBondContact O-N 3.04Å; I455-L458 PolarHBondContact O-N 2.85Å; I455-K459 PolarHBondContact O-N 3.46Å; I455-V464 HydrophobicContact CG2-CG1 4.26Å; I455-M468 HydrophobicContact CD1-CE 4.01Å
456	T	81.4	Confident	82.3	Confident	45 Å²	45	42.4 Å²	42.4	28%	0.276	21%	0.211	S	C	.	.	H	α-helix	trans	-69.2	-39	-180	-53.3	0	0	0	0	112.2	E452 E453 L454 K459	E452-T456 PolarHBondContact O-N 3.46Å; E452-T456 VanDerWaalsContact O-N 3.13Å; E452-T456 PolarHBondContact O-OG1 2.96Å; E453-T456 WeakPolarHBondContact O-CB 3.37Å; E453-T456 PolarHBondContact O-N 3.29Å; E453-T456 VanDerWaalsContact O-N 3.09Å; L454-T456 PolarHBondContact O-N 3.32Å; T456-K459 WeakPolarHBondContact O-CG 3.22Å
457	E	83.8	Confident	83	Confident	106 Å²	106	36.7 Å²	36.7	50%	0.495	18%	0.182	S	C	.	.	H	α-helix	trans	-68	-42.1	172.5	-87.1	-167	160.6	0	0	112.2	E453 L454 K459 Q460	E453-E457 PolarHBondContact O-N 3.32Å; L454-E457 PolarHBondContact O-N 2.86Å; E457-K459 PolarHBondContact O-N 2.94Å; E457-Q460 WeakPolarHBondContact O-CB 3.48Å; E457-Q460 PolarHBondContact O-N 3.47Å; E457-Q460 VanDerWaalsContact O-N 3.09Å
458	L	86.2	Confident	83.2	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-60.6	-29.2	-176.9	-73.3	171.4	0	0	0	112.6	I423 I427 L434 L454 I455 Q460 D461 Y462 V464	I423-L458 HydrophobicContact CG2-CD1 4.25Å; I427-L458 HydrophobicContact CD1-CD1 3.96Å; I427-L458 HydrophobicContact CD1-CD2 3.5Å; I427-L458 HydrophobicContact CD1-CG 4.33Å; I427-L458 HydrophobicContact CG1-CD1 4.39Å; I427-L458 HydrophobicContact CG1-CD2 3.78Å; I427-L458 HydrophobicContact CG2-CD2 4.38Å; L434-L458 HydrophobicContact CD2-CD1 3.85Å; L454-L458 HydrophobicContact CD1-CD1 3.88Å; L454-L458 HydrophobicContact CD1-CD2 4.31Å; L454-L458 HydrophobicContact CD1-CG 3.89Å; L454-L458 HydrophobicContact CG-CD1 3.78Å; L454-L458 HydrophobicContact CG-CG 4.26Å; L454-L458 WeakPolarHBondContact O-CB 3.36Å; L454-L458 WeakPolarHBondContact O-CG 3.48Å; L454-L458 PolarHBondContact O-N 2.93Å; I455-L458 PolarHBondContact O-N 2.85Å; L458-Q460 PolarHBondContact O-N 2.87Å; L458-Q460 VanDerWaalsContact O-N 3.11Å; L458-D461 PolarHBondContact O-N 3.13Å; L458-Y462 HydrophobicContact CB-CD2 4.1Å; L458-Y462 HydrophobicContact CD2-CD2 3.6Å; L458-Y462 HydrophobicContact CD2-CE2 3.63Å; L458-Y462 HydrophobicContact CG-CD2 4.43Å; L458-Y462 WeakPolarHBondContact O-CD2 3.43Å; L458-Y462 PolarHBondContact O-N 3.3Å; L458-V464 HydrophobicContact CB-CG2 4.23Å
459	K	84.2	Confident	82.6	Confident	94 Å²	94	40.4 Å²	40.4	41%	0.409	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-23.5	177.8	95.3	-173.7	-179.5	175.7	0	113.5	N295 V297 I455 T456 E457 D461 Y462	N295-K459 CarbonylContact C-O 3.51Å; N295-K459 WeakPolarHBondContact CA-O 3.48Å; N295-K459 WeakPolarHBondContact CB-O 3.25Å; V297-K459 HydrophobicContact CG2-CB 3.6Å; V297-K459 HydrophobicContact CG2-CD 4.2Å; I455-K459 PolarHBondContact O-N 3.46Å; T456-K459 WeakPolarHBondContact O-CG 3.22Å; E457-K459 PolarHBondContact O-N 2.94Å; K459-D461 VanDerWaalsContact C-N 3.26Å; K459-D461 PolarHBondContact O-N 3.48Å; K459-Y462 WeakPolarHBondContact CA-O 3.35Å
460	Q	81.6	Confident	81.6	Confident	140 Å²	140	42.3 Å²	42.3	65%	0.654	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65	-36.3	176.9	-66.6	-174	-3.7	0	0	111.4	N295 E457 L458	N295-Q460 PolarHBondContact ND2-O 3.06Å; E457-Q460 WeakPolarHBondContact O-CB 3.48Å; E457-Q460 PolarHBondContact O-N 3.47Å; E457-Q460 VanDerWaalsContact O-N 3.09Å; L458-Q460 PolarHBondContact O-N 2.87Å; L458-Q460 VanDerWaalsContact O-N 3.11Å
461	D	84.6	Confident	80.2	Confident	74 Å²	74	43 Å²	43	40%	0.396	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.8	-28.8	-172.9	-60.8	-42.6	0	0	0	112.2	K395 L458 K459	K395-D461 WeakPolarHBondContact CE-OD2 3.39Å; K395-D461 IonicContact NZ-OD2 2.84Å; K395-D461 PolarHBondContact NZ-OD2 3.01Å; L458-D461 PolarHBondContact O-N 3.13Å; K459-D461 VanDerWaalsContact C-N 3.26Å; K459-D461 PolarHBondContact O-N 3.48Å
462	Y	88.4	Confident	78.3	Confident	13 Å²	13	46.5 Å²	46.5	5%	0.051	24%	0.237	C	C	.	.	S	Bend	trans	-132.9	151.3	-167.6	-52.2	-64.2	0	0	0	112.9	N295 W391 I427 P431 L458 K459	N295-Y462 WeakPolarHBondContact CA-O 3.28Å; W391-Y462 VanDerWaalsContact CH2-OH 3.26Å; W391-Y462 WeakPolarHBondContact CH2-OH 3.21Å; I427-Y462 HydrophobicContact CG2-CE2 3.83Å; P431-Y462 WeakPolarHBondContact O-CD1 3.22Å; P431-Y462 VanDerWaalsContact O-CE1 3.26Å; P431-Y462 WeakPolarHBondContact O-CE1 3.44Å; L458-Y462 HydrophobicContact CB-CD2 4.1Å; L458-Y462 HydrophobicContact CD2-CD2 3.6Å; L458-Y462 HydrophobicContact CD2-CE2 3.63Å; L458-Y462 HydrophobicContact CG-CD2 4.43Å; L458-Y462 WeakPolarHBondContact O-CD2 3.43Å; L458-Y462 PolarHBondContact O-N 3.3Å; K459-Y462 WeakPolarHBondContact CA-O 3.35Å
463	T	88.9	Confident	76.4	Confident	1 Å²	1	48.1 Å²	48.1	1%	0.006	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	127.3	162.2	-52.2	0	0	0	0	108.9	I292 A293 K294 N295 E432 V433 L434	I292-T463 HydrophobicContact CG2-CG2 3.64Å; A293-T463 VanDerWaalsContact O-CG2 3.24Å; A293-T463 WeakPolarHBondContact O-CG2 3.38Å; K294-T463 WeakPolarHBondContact CA-OG1 3.44Å; N295-T463 PolarHBondContact N-OG1 2.85Å; E432-T463 PolarHBondContact O-N 3.34Å; E432-T463 VanDerWaalsContact O-N 3.16Å; V433-T463 CarbonylContact C-O 3.51Å; V433-T463 VanDerWaalsContact CA-O 3.29Å; V433-T463 WeakPolarHBondContact CA-O 3.5Å; L434-T463 PolarHBondContact N-O 3.35Å
464	V	90.6	Very high	74.4	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	121.6	-175.9	-175.3	0	0	0	0	109.9	Q296 V297 T298 L434 L436 I455 L458	Q296-V464 PolarHBondContact O-N 3.11Å; V297-V464 CarbonylContact C-O 3.58Å; V297-V464 VanDerWaalsContact CA-O 3.3Å; V297-V464 WeakPolarHBondContact CA-O 3.42Å; V297-V464 HydrophobicContact CB-CB 4.47Å; V297-V464 HydrophobicContact CG1-CB 4.36Å; V297-V464 HydrophobicContact CG1-CG1 4.32Å; V297-V464 HydrophobicContact CG2-CB 4.16Å; T298-V464 PolarHBondContact N-O 3.15Å; L434-V464 WeakPolarHBondContact O-CA 3.3Å; L436-V464 HydrophobicContact CD1-CG1 3.75Å; L436-V464 HydrophobicContact CG-CG1 4.28Å; I455-V464 HydrophobicContact CG2-CG1 4.26Å; L458-V464 HydrophobicContact CB-CG2 4.23Å
465	E	90.6	Very high	72.2	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	121.7	172.5	-74.3	-69.9	147.8	0	0	108	I292 T298 F300 L434 L435 L436	I292-E465 HydrophobicContact CD1-CG 3.92Å; I292-E465 WeakPolarHBondContact CD1-OE1 3.29Å; I292-E465 VanDerWaalsContact CG1-OE1 3.27Å; I292-E465 WeakPolarHBondContact CG1-OE1 3.38Å; I292-E465 HydrophobicContact CG2-CG 4.37Å; I292-E465 VanDerWaalsContact CG2-OE1 3.24Å; I292-E465 WeakPolarHBondContact CG2-OE1 3.44Å; T298-E465 WeakPolarHBondContact CB-OE1 3.45Å; T298-E465 WeakPolarHBondContact CB-OE2 3.15Å; T298-E465 PolarHBondContact OG1-OE1 2.91Å; F300-E465 WeakPolarHBondContact CE2-OE2 3.16Å; F300-E465 WeakPolarHBondContact CZ-OE2 3.45Å; L434-E465 PolarHBondContact O-N 3.01Å; L435-E465 CarbonylContact C-O 3.49Å; L435-E465 WeakPolarHBondContact CA-O 3.46Å; L435-E465 HydrophobicContact CD2-CB 3.67Å; L435-E465 HydrophobicContact CD2-CG 4.32Å; L436-E465 PolarHBondContact N-O 3.39Å
466	C	89.7	Confident	69.8	Low	0 Å²	0	57 Å²	57	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	147.9	-174.2	66.5	0	0	0	0	113.7	T298 A299 F300 L436	T298-C466 PolarHBondContact O-N 2.68Å; T298-C466 PolarHBondContact O-SG 3.06Å; T298-C466 VanDerWaalsContact O-SG 3.34Å; A299-C466 CarbonylContact C-O 3.57Å; A299-C466 VanDerWaalsContact CA-O 3.31Å; A299-C466 WeakPolarHBondContact CA-O 3.21Å; F300-C466 PolarHBondContact N-O 3.19Å; L436-C466 HydrophobicContact CB-CB 3.82Å; L436-C466 CarbonylContact O-C 3.59Å; L436-C466 WeakPolarHBondContact O-CA 3.35Å
467	V	85.7	Confident	67.9	Low	0 Å²	0	59.3 Å²	59.3	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	133.6	164.3	-176.8	0	0	0	0	108.5	K308 L312 L436 E438	K308-V467 HydrophobicContact CB-CB 4.41Å; K308-V467 HydrophobicContact CB-CG1 3.7Å; K308-V467 HydrophobicContact CB-CG2 3.74Å; K308-V467 HydrophobicContact CD-CG1 3.78Å; K308-V467 HydrophobicContact CG-CG1 4.35Å; L312-V467 HydrophobicContact CB-CG2 4.42Å; L312-V467 HydrophobicContact CD1-CB 4.4Å; L312-V467 HydrophobicContact CD1-CG2 3.4Å; L312-V467 HydrophobicContact CG-CG2 4.45Å; L436-V467 PolarHBondContact O-N 2.87Å; E438-V467 VanDerWaalsContact CA-O 3.24Å; E438-V467 WeakPolarHBondContact CA-O 3.29Å; E438-V467 HydrophobicContact CG-CB 3.9Å; E438-V467 HydrophobicContact CG-CG1 3.55Å; E438-V467 PolarHBondContact N-O 2.8Å
468	M	76	Confident	66.2	Low	15 Å²	15	57.1 Å²	57.1	7%	0.074	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	143.1	173.5	-66.8	-170.1	171.3	0	0	111.2	A299 F300 I301 I455 L473	A299-M468 HydrophobicContact CB-CG 4.45Å; A299-M468 HydrophobicContact CB-SD 4.3Å; F300-M468 PolarHBondContact O-N 3.46Å; F300-M468 VanDerWaalsContact O-N 3.08Å; I301-M468 HydrophobicContact CG1-CB 4.46Å; I455-M468 HydrophobicContact CD1-CE 4.01Å; M468-L473 HydrophobicContact CE-CD1 3.96Å; M468-L473 HydrophobicContact SD-CD1 3.73Å
469	D	64.4	Low	64.7	Low	104 Å²	104	59 Å²	59	56%	0.556	31%	0.314	S	S	*	.	S	Bend	trans	-80.3	-26.1	176.3	-77	-27.3	0	0	0	113.1
470	S	51.3	Low	63.3	Low	66 Å²	66	60.2 Å²	60.2	46%	0.462	32%	0.322	S	S	.	.	S	Bend	trans	-153.3	140.4	172.9	73.1	0	0	0	0	110.9	N472	S470-N472 VanDerWaalsContact C-N 3.32Å; S470-N472 PolarHBondContact O-N 2.93Å
471	L	45.7	Very low	62.4	Low	110 Å²	110	54 Å²	54	58%	0.576	29%	0.292	S	S	*	.			trans	-71.4	86.9	171.6	-109.7	160	0	0	0	109.1	I301 L473	I301-L471 HydrophobicContact CD1-CB 4.03Å; I301-L471 HydrophobicContact CD1-CD1 3.13Å; I301-L471 HydrophobicContact CD1-CD2 4.48Å; I301-L471 HydrophobicContact CD1-CG 3.27Å; L471-L473 HydrophobicContact CD2-CB 4.02Å; L471-L473 HydrophobicContact CD2-CD1 3.94Å
472	N	43.5	Very low	61.6	Low	73 Å²	73	54.9 Å²	54.9	39%	0.39	30%	0.297	S	S	.	.			trans	-99.7	18.3	166.1	-86.9	-27.6	0	0	0	112.7	S470 N474 K475	S470-N472 VanDerWaalsContact C-N 3.32Å; S470-N472 PolarHBondContact O-N 2.93Å; N472-N474 PolarHBondContact O-N 3.22Å; N472-K475 WeakPolarHBondContact O-CB 3.48Å; N472-K475 PolarHBondContact O-N 3.27Å
473	L	40	Very low	60.9	Low	56 Å²	56	57.1 Å²	57.1	29%	0.293	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-16.3	173.5	-96.7	107.5	0	0	0	113.9	M468 L471 K475 H476	M468-L473 HydrophobicContact CE-CD1 3.96Å; M468-L473 HydrophobicContact SD-CD1 3.73Å; L471-L473 HydrophobicContact CD2-CB 4.02Å; L471-L473 HydrophobicContact CD2-CD1 3.94Å; L473-K475 PolarHBondContact O-N 3.39Å; L473-H476 PolarHBondContact O-N 2.94Å
474	N	34.9	Very low	60.5	Low	123 Å²	123	59.9 Å²	59.9	66%	0.658	33%	0.332	S	S	*	.	H	α-helix	trans	-71.1	-13	172.2	-76.7	-18.2	0	0	0	113.6	N472 H476 I477 S478	N472-N474 PolarHBondContact O-N 3.22Å; N474-H476 PolarHBondContact O-N 3.34Å; N474-I477 PolarHBondContact O-N 3.35Å; N474-S478 PolarHBondContact O-N 3.33Å; N474-S478 VanDerWaalsContact O-N 3.16Å
475	K	36.9	Very low	60	Low	130 Å²	130	60.2 Å²	60.2	57%	0.565	33%	0.333	S	S	*	.	H	α-helix	trans	-68	-20.6	172.4	-83.6	-173.1	176.1	179.4	0	113.2	N472 L473 S478 G479	N472-K475 WeakPolarHBondContact O-CB 3.48Å; N472-K475 PolarHBondContact O-N 3.27Å; L473-K475 PolarHBondContact O-N 3.39Å; K475-S478 CarbonylContact O-C 3.53Å; K475-S478 PolarHBondContact O-N 2.92Å; K475-G479 WeakPolarHBondContact O-CA 3.18Å; K475-G479 PolarHBondContact O-N 3.47Å
476	H	37.8	Very low	59.6	Low	48 Å²	48	64.4 Å²	64.4	22%	0.222	35%	0.353	C	S	.	.	H	α-helix	trans	-70.8	-39.1	177.1	-112	-42.1	0	0	0	113.3	E453 L473 N474 Q480	E453-H476 WeakPolarHBondContact CA-NE2 3.3Å; E453-H476 WeakPolarHBondContact CG-CE1 3.36Å; E453-H476 WeakPolarHBondContact CG-NE2 3.38Å; E453-H476 PolarHBondContact N-NE2 3Å; E453-H476 VanDerWaalsContact N-NE2 3.14Å; E453-H476 IonicContact OE1-CE1 2.69Å; L473-H476 PolarHBondContact O-N 2.94Å; N474-H476 PolarHBondContact O-N 3.34Å; H476-Q480 PolarHBondContact O-N 3.43Å
477	I	41.6	Very low	59.5	Low	93 Å²	93	67.3 Å²	67.3	48%	0.477	37%	0.373	S	S	.	.	H	α-helix	trans	-66.5	-46.2	170.9	-60.9	179.3	0	0	0	108.8	N474 G479 F481	N474-I477 PolarHBondContact O-N 3.35Å; I477-G479 VanDerWaalsContact C-N 3.33Å; I477-G479 PolarHBondContact O-N 3.22Å; I477-F481 WeakPolarHBondContact O-CB 3.39Å; I477-F481 PolarHBondContact O-N 2.89Å
478	S	46.9	Very low	59.6	Low	59 Å²	59	67.5 Å²	67.5	41%	0.413	37%	0.374	S	S	.	.	H	α-helix	trans	-66.8	-26.6	178	-72	0	0	0	0	114.6	N474 K475 N482	N474-S478 PolarHBondContact O-N 3.33Å; N474-S478 VanDerWaalsContact O-N 3.16Å; K475-S478 CarbonylContact O-C 3.53Å; K475-S478 PolarHBondContact O-N 2.92Å; S478-N482 WeakPolarHBondContact O-CA 3.27Å; S478-N482 WeakPolarHBondContact O-CB 3.42Å; S478-N482 PolarHBondContact O-N 3.48Å
479	G	55.3	Low	60.2	Low	39 Å²	39	69.9 Å²	69.9	40%	0.402	38%	0.382	S	S	.	.	H	α-helix	trans	-77	-51.5	-176.8	0	0	0	0	0	111.6	K475 I477 F481 N482 A483	K475-G479 WeakPolarHBondContact O-CA 3.18Å; K475-G479 PolarHBondContact O-N 3.47Å; I477-G479 VanDerWaalsContact C-N 3.33Å; I477-G479 PolarHBondContact O-N 3.22Å; G479-F481 VanDerWaalsContact C-N 3.27Å; G479-F481 PolarHBondContact O-N 2.86Å; G479-N482 PolarHBondContact O-N 3.35Å; G479-A483 WeakPolarHBondContact O-CB 3.4Å; G479-A483 PolarHBondContact O-N 2.94Å
480	Q	55.3	Low	61.4	Low	120 Å²	120	68.8 Å²	68.8	56%	0.561	38%	0.379	S	S	*	.	H	α-helix	trans	-62.8	-37.6	169.1	-86.8	-170.9	-12.8	0	0	111.6	H476 A483 E484	H476-Q480 PolarHBondContact O-N 3.43Å; Q480-A483 PolarHBondContact O-N 3.32Å; Q480-E484 WeakPolarHBondContact O-CB 3.39Å; Q480-E484 VanDerWaalsContact O-CG 3.31Å; Q480-E484 WeakPolarHBondContact O-CG 3.35Å; Q480-E484 PolarHBondContact O-N 2.91Å
481	F	62.7	Low	63.4	Low	9 Å²	9	69 Å²	69	4%	0.039	37%	0.373	C	S	.	.	H	α-helix	trans	-66.1	-41.7	176.9	177.6	-128.6	0	0	0	111.9	I477 G479 A483 E484 L485 I542 R546 P548 D552	I477-F481 WeakPolarHBondContact O-CB 3.39Å; I477-F481 PolarHBondContact O-N 2.89Å; G479-F481 VanDerWaalsContact C-N 3.27Å; G479-F481 PolarHBondContact O-N 2.86Å; F481-A483 VanDerWaalsContact C-N 3.33Å; F481-A483 PolarHBondContact O-N 3.5Å; F481-E484 PolarHBondContact O-N 3.12Å; F481-L485 HydrophobicContact CD1-CD1 4.16Å; F481-L485 HydrophobicContact CD2-CD1 4.34Å; F481-L485 HydrophobicContact CD2-CG 4.19Å; F481-L485 HydrophobicContact CE1-CD1 3.72Å; F481-L485 HydrophobicContact CE1-CG 4.49Å; F481-L485 HydrophobicContact CE2-CD1 3.85Å; F481-L485 HydrophobicContact CE2-CD2 3.96Å; F481-L485 HydrophobicContact CE2-CG 3.72Å; F481-L485 HydrophobicContact CG-CD1 4.45Å; F481-L485 HydrophobicContact CZ-CD1 3.53Å; F481-L485 HydrophobicContact CZ-CD2 4.09Å; F481-L485 HydrophobicContact CZ-CG 3.92Å; F481-L485 WeakPolarHBondContact O-CB 3.22Å; F481-L485 VanDerWaalsContact O-CG 3.3Å; F481-L485 WeakPolarHBondContact O-CG 3.43Å; F481-L485 PolarHBondContact O-N 3.13Å; F481-I542 HydrophobicContact CD2-CG2 4.23Å; F481-I542 HydrophobicContact CE2-CD1 4.31Å; F481-I542 HydrophobicContact CE2-CG2 3.44Å; F481-I542 VanDerWaalsContact CE2-CG2 3.44Å; F481-I542 HydrophobicContact CZ-CG2 4.33Å; F481-R546 HydrophobicContact CD2-CB 4.04Å; F481-R546 HydrophobicContact CD2-CG 3.83Å; F481-R546 HydrophobicContact CE2-CB 4.31Å; F481-R546 HydrophobicContact CE2-CG 4.47Å; F481-R546 HydrophobicContact CG-CG 4.41Å; F481-P548 HydrophobicContact CE1-CB 4.21Å; F481-P548 HydrophobicContact CE2-CB 4.32Å; F481-P548 HydrophobicContact CZ-CB 3.57Å; F481-D552 HydrophobicContact CE1-CB 3.47Å; F481-D552 VanDerWaalsContact CE1-CB 3.47Å; F481-D552 WeakPolarHBondContact CE1-OD2 3.44Å; F481-D552 HydrophobicContact CZ-CB 3.46Å; F481-D552 VanDerWaalsContact CZ-CB 3.46Å
482	N	68.4	Low	65.7	Low	93 Å²	93	63.8 Å²	63.8	50%	0.497	35%	0.346	S	S	.	.	H	α-helix	trans	-63.9	-38.7	171.2	-95	15	0	0	0	111.6	S478 G479 E484 L485 E486	S478-N482 WeakPolarHBondContact O-CA 3.27Å; S478-N482 WeakPolarHBondContact O-CB 3.42Å; S478-N482 PolarHBondContact O-N 3.48Å; G479-N482 PolarHBondContact O-N 3.35Å; N482-E484 VanDerWaalsContact C-N 3.34Å; N482-L485 PolarHBondContact O-N 3.15Å; N482-E486 WeakPolarHBondContact O-CB 3.25Å; N482-E486 WeakPolarHBondContact O-CG 3.39Å; N482-E486 PolarHBondContact O-N 3.47Å
483	A	73.6	Confident	68.1	Low	60 Å²	60	63 Å²	63	50%	0.496	34%	0.341	S	S	.	.	H	α-helix	trans	-65.5	-39.6	175.7	0	0	0	0	0	111.5	G479 Q480 F481 S487	G479-A483 WeakPolarHBondContact O-CB 3.4Å; G479-A483 PolarHBondContact O-N 2.94Å; Q480-A483 PolarHBondContact O-N 3.32Å; F481-A483 VanDerWaalsContact C-N 3.33Å; F481-A483 PolarHBondContact O-N 3.5Å; A483-S487 WeakPolarHBondContact O-CB 3.33Å; A483-S487 PolarHBondContact O-N 3.38Å
484	E	78.6	Confident	70.7	Confident	60 Å²	60	64.1 Å²	64.1	28%	0.28	35%	0.349	S	S	.	.	H	α-helix	trans	-63.4	-46.9	172.3	-76.2	170.2	-168.6	0	0	110.2	Q480 F481 N482 S487 I488 I542 R546	Q480-E484 WeakPolarHBondContact O-CB 3.39Å; Q480-E484 VanDerWaalsContact O-CG 3.31Å; Q480-E484 WeakPolarHBondContact O-CG 3.35Å; Q480-E484 PolarHBondContact O-N 2.91Å; F481-E484 PolarHBondContact O-N 3.12Å; N482-E484 VanDerWaalsContact C-N 3.34Å; E484-S487 WeakPolarHBondContact O-CB 3.36Å; E484-S487 PolarHBondContact O-N 3.49Å; E484-I488 VanDerWaalsContact O-CG1 3.27Å; E484-I488 WeakPolarHBondContact O-CG1 3.31Å; E484-I488 PolarHBondContact O-N 2.88Å; E484-I542 HydrophobicContact CB-CD1 3.83Å; E484-I542 HydrophobicContact CB-CG1 4.3Å; E484-R546 IonicContact OE1-CZ 2.62Å; E484-R546 IonicContact OE1-NE 3.84Å; E484-R546 IonicContact OE1-NH2 3.2Å; E484-R546 PolarHBondContact OE1-NH2 2.75Å; E484-R546 IonicContact OE2-CZ 2.72Å; E484-R546 IonicContact OE2-NE 3.8Å; E484-R546 PolarHBondContact OE2-NE 3.42Å; E484-R546 IonicContact OE2-NH2 2.65Å
485	L	80.9	Confident	73.6	Confident	7 Å²	7	58.2 Å²	58.2	4%	0.037	32%	0.318	C	S	.	.	H	α-helix	trans	-60.7	-46.3	176.5	-73.6	171.6	0	0	0	112.4	F481 N482 S487 I488 R489 I542 D552 L555 V556	F481-L485 HydrophobicContact CD1-CD1 4.16Å; F481-L485 HydrophobicContact CD2-CD1 4.34Å; F481-L485 HydrophobicContact CD2-CG 4.19Å; F481-L485 HydrophobicContact CE1-CD1 3.72Å; F481-L485 HydrophobicContact CE1-CG 4.49Å; F481-L485 HydrophobicContact CE2-CD1 3.85Å; F481-L485 HydrophobicContact CE2-CD2 3.96Å; F481-L485 HydrophobicContact CE2-CG 3.72Å; F481-L485 HydrophobicContact CG-CD1 4.45Å; F481-L485 HydrophobicContact CZ-CD1 3.53Å; F481-L485 HydrophobicContact CZ-CD2 4.09Å; F481-L485 HydrophobicContact CZ-CG 3.92Å; F481-L485 WeakPolarHBondContact O-CB 3.22Å; F481-L485 VanDerWaalsContact O-CG 3.3Å; F481-L485 WeakPolarHBondContact O-CG 3.43Å; F481-L485 PolarHBondContact O-N 3.13Å; N482-L485 PolarHBondContact O-N 3.15Å; L485-S487 VanDerWaalsContact C-N 3.34Å; L485-I488 PolarHBondContact O-N 3.41Å; L485-R489 WeakPolarHBondContact O-CB 3.38Å; L485-R489 PolarHBondContact O-N 3.47Å; L485-I542 HydrophobicContact CD2-CD1 4.15Å; L485-D552 HydrophobicContact CD1-CB 4.31Å; L485-L555 HydrophobicContact CB-CD2 4.45Å; L485-L555 HydrophobicContact CD1-CD2 4.29Å; L485-L555 HydrophobicContact CD2-CD2 4.1Å; L485-L555 HydrophobicContact CD2-CG 4.47Å; L485-V556 HydrophobicContact CD2-CG2 3.59Å
486	E	82.1	Confident	76.4	Confident	87 Å²	87	52 Å²	52	41%	0.407	29%	0.291	S	S	.	.	H	α-helix	trans	-66	-37	176.6	-78.9	-60.5	163.2	0	0	112.1	N482 R489 T490	N482-E486 WeakPolarHBondContact O-CB 3.25Å; N482-E486 WeakPolarHBondContact O-CG 3.39Å; N482-E486 PolarHBondContact O-N 3.47Å; E486-R489 PolarHBondContact O-N 2.74Å; E486-R489 IonicContact OE1-CZ 2.98Å; E486-R489 IonicContact OE1-NE 2.88Å; E486-R489 PolarHBondContact OE1-NE 2.92Å; E486-R489 IonicContact OE1-NH2 3.18Å; E486-R489 PolarHBondContact OE1-NH2 2.86Å; E486-R489 IonicContact OE2-CZ 3.4Å; E486-R489 IonicContact OE2-NE 3.03Å; E486-R489 PolarHBondContact OE2-NE 3.2Å; E486-R489 IonicContact OE2-NH2 2.86Å; E486-R489 PolarHBondContact OE2-NH2 3.47Å; E486-T490 WeakPolarHBondContact O-CB 3.43Å; E486-T490 PolarHBondContact O-N 2.98Å; E486-T490 PolarHBondContact O-OG1 2.8Å
487	S	86.9	Confident	79.1	Confident	61 Å²	61	51.5 Å²	51.5	43%	0.427	30%	0.298	S	S	.	.	H	α-helix	trans	-60.5	-47.1	173.1	177.7	0	0	0	0	110.9	A483 E484 L485 T490 Q491	A483-S487 WeakPolarHBondContact O-CB 3.33Å; A483-S487 PolarHBondContact O-N 3.38Å; E484-S487 WeakPolarHBondContact O-CB 3.36Å; E484-S487 PolarHBondContact O-N 3.49Å; L485-S487 VanDerWaalsContact C-N 3.34Å; S487-T490 PolarHBondContact O-N 3.27Å; S487-Q491 WeakPolarHBondContact O-CG 3.3Å; S487-Q491 PolarHBondContact O-N 3.35Å
488	I	89.4	Confident	81.6	Confident	5 Å²	5	49.9 Å²	49.9	3%	0.026	29%	0.289	C	S	.	.	H	α-helix	trans	-65.6	-43.5	178.7	-63.6	179.2	0	0	0	110.1	E484 L485 T490 Q491 V492 I535 A538 I542 I559	E484-I488 VanDerWaalsContact O-CG1 3.27Å; E484-I488 WeakPolarHBondContact O-CG1 3.31Å; E484-I488 PolarHBondContact O-N 2.88Å; L485-I488 PolarHBondContact O-N 3.41Å; I488-T490 VanDerWaalsContact C-N 3.28Å; I488-T490 PolarHBondContact O-N 2.79Å; I488-Q491 WeakPolarHBondContact O-CB 3.35Å; I488-Q491 PolarHBondContact O-N 2.78Å; I488-V492 WeakPolarHBondContact O-CG2 3.49Å; I488-V492 PolarHBondContact O-N 2.63Å; I488-I535 HydrophobicContact CG2-CG2 3.72Å; I488-A538 HydrophobicContact CD1-CB 3.73Å; I488-A538 HydrophobicContact CG1-CB 3.89Å; I488-I542 HydrophobicContact CD1-CD1 3.2Å; I488-I542 HydrophobicContact CD1-CG1 3.98Å; I488-I542 HydrophobicContact CG1-CD1 4.31Å; I488-I559 HydrophobicContact CG2-CD1 4.01Å; I488-I559 HydrophobicContact CG2-CG2 3.62Å
489	R	87.9	Confident	84	Confident	65 Å²	65	47 Å²	47	25%	0.245	27%	0.27	C	S	.	.	H	α-helix	trans	-58.5	-41.5	176.4	-163.8	174.2	72.3	121.5	3.5	111.9	L485 E486 Q491 V492 M493 A614	L485-R489 WeakPolarHBondContact O-CB 3.38Å; L485-R489 PolarHBondContact O-N 3.47Å; E486-R489 PolarHBondContact O-N 2.74Å; E486-R489 IonicContact OE1-CZ 2.98Å; E486-R489 IonicContact OE1-NE 2.88Å; E486-R489 PolarHBondContact OE1-NE 2.92Å; E486-R489 IonicContact OE1-NH2 3.18Å; E486-R489 PolarHBondContact OE1-NH2 2.86Å; E486-R489 IonicContact OE2-CZ 3.4Å; E486-R489 IonicContact OE2-NE 3.03Å; E486-R489 PolarHBondContact OE2-NE 3.2Å; E486-R489 IonicContact OE2-NH2 2.86Å; E486-R489 PolarHBondContact OE2-NH2 3.47Å; R489-Q491 VanDerWaalsContact C-N 3.34Å; R489-Q491 PolarHBondContact O-N 3.21Å; R489-V492 WeakPolarHBondContact O-CB 3.32Å; R489-V492 PolarHBondContact O-N 2.79Å; R489-M493 WeakPolarHBondContact O-CG 3.44Å; R489-M493 PolarHBondContact O-N 2.8Å; R489-A614 PolarHBondContact NH1-O 3.11Å
490	T	89.4	Confident	85.9	Confident	81 Å²	81	47.3 Å²	47.3	50%	0.497	26%	0.261	S	S	.	.	H	α-helix	trans	-63.2	-39.6	175	-56.7	0	0	0	0	111.7	E486 S487 I488 M493 T494	E486-T490 WeakPolarHBondContact O-CB 3.43Å; E486-T490 PolarHBondContact O-N 2.98Å; E486-T490 PolarHBondContact O-OG1 2.8Å; S487-T490 PolarHBondContact O-N 3.27Å; I488-T490 VanDerWaalsContact C-N 3.28Å; I488-T490 PolarHBondContact O-N 2.79Å; T490-M493 PolarHBondContact O-N 2.88Å; T490-T494 PolarHBondContact O-N 2.8Å; T490-T494 PolarHBondContact O-OG1 2.96Å
491	Q	92.8	Very high	87.8	Confident	71 Å²	71	46.7 Å²	46.7	33%	0.332	26%	0.258	S	S	.	.	H	α-helix	trans	-65.5	-40.5	175.6	-71.9	177.3	-16.2	0	0	112.1	S487 I488 R489 T494 M495 M531 I535	S487-Q491 WeakPolarHBondContact O-CG 3.3Å; S487-Q491 PolarHBondContact O-N 3.35Å; I488-Q491 WeakPolarHBondContact O-CB 3.35Å; I488-Q491 PolarHBondContact O-N 2.78Å; R489-Q491 VanDerWaalsContact C-N 3.34Å; R489-Q491 PolarHBondContact O-N 3.21Å; Q491-T494 WeakPolarHBondContact O-CB 3.34Å; Q491-T494 PolarHBondContact O-N 3.45Å; Q491-M495 PolarHBondContact O-N 3.13Å; Q491-M531 WeakPolarHBondContact O-CE 3.48Å; Q491-I535 HydrophobicContact CB-CD1 3.92Å; Q491-I535 HydrophobicContact CB-CG1 3.79Å
492	V	94.5	Very high	89.3	Confident	0 Å²	0	47 Å²	47	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-59.4	-46.5	173	176.1	0	0	0	0	110.7	I488 R489 T494 M495 G496 I535 I559 T562 I563 L566 F613	I488-V492 WeakPolarHBondContact O-CG2 3.49Å; I488-V492 PolarHBondContact O-N 2.63Å; R489-V492 WeakPolarHBondContact O-CB 3.32Å; R489-V492 PolarHBondContact O-N 2.79Å; V492-T494 VanDerWaalsContact C-N 3.28Å; V492-T494 PolarHBondContact O-N 3.42Å; V492-M495 WeakPolarHBondContact O-CB 3.16Å; V492-M495 PolarHBondContact O-N 2.96Å; V492-G496 PolarHBondContact O-N 2.91Å; V492-I535 HydrophobicContact CG2-CD1 4.38Å; V492-I535 HydrophobicContact CG2-CG2 4.06Å; V492-I559 HydrophobicContact CG2-CB 4.46Å; V492-I559 HydrophobicContact CG2-CG1 4.42Å; V492-I559 HydrophobicContact CG2-CG2 3.52Å; V492-T562 HydrophobicContact CG1-CG2 4.2Å; V492-I563 HydrophobicContact CG2-CG2 3.82Å; V492-L566 HydrophobicContact CG1-CD1 4.02Å; V492-F613 HydrophobicContact CB-CE1 4.44Å; V492-F613 HydrophobicContact CG1-CD1 4.41Å; V492-F613 HydrophobicContact CG1-CE1 3.81Å; V492-F613 HydrophobicContact CG1-CZ 4.29Å
493	M	94.8	Very high	90.6	Very high	57 Å²	57	42.5 Å²	42.5	28%	0.281	24%	0.235	S	C	.	.	H	α-helix	trans	-62.9	-36.5	177.2	-66.6	-52.4	-59.8	0	0	112.4	R489 T490 G496 G497 L610 F613 A614	R489-M493 WeakPolarHBondContact O-CG 3.44Å; R489-M493 PolarHBondContact O-N 2.8Å; T490-M493 PolarHBondContact O-N 2.88Å; M493-G496 PolarHBondContact O-N 3.45Å; M493-G497 PolarHBondContact O-N 3.47Å; M493-L610 HydrophobicContact CE-CB 4.11Å; M493-F613 HydrophobicContact SD-CD1 4.29Å; M493-A614 HydrophobicContact CE-CB 3.81Å; M493-A614 HydrophobicContact SD-CB 3.83Å
494	T	94.3	Very high	91.7	Very high	78 Å²	78	41.9 Å²	41.9	48%	0.479	23%	0.227	S	C	.	.	H	α-helix	trans	-66.4	-40.1	175.6	-53.5	0	0	0	0	111.3	T490 Q491 V492 M498 M531	T490-T494 PolarHBondContact O-N 2.8Å; T490-T494 PolarHBondContact O-OG1 2.96Å; Q491-T494 WeakPolarHBondContact O-CB 3.34Å; Q491-T494 PolarHBondContact O-N 3.45Å; V492-T494 VanDerWaalsContact C-N 3.28Å; V492-T494 PolarHBondContact O-N 3.42Å; T494-M498 PolarHBondContact O-N 3.28Å; T494-M498 VanDerWaalsContact O-N 3.13Å; T494-M531 HydrophobicContact CG2-CE 3.89Å
495	M	95.6	Very high	92.5	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-64.9	-46.6	175.1	-174.1	-178	175.9	0	0	110.5	Q491 V492 G497 M498 V499 V528 M531 E532 I535 I563 L566 E567	Q491-M495 PolarHBondContact O-N 3.13Å; V492-M495 WeakPolarHBondContact O-CB 3.16Å; V492-M495 PolarHBondContact O-N 2.96Å; M495-G497 PolarHBondContact O-N 3.47Å; M495-M498 WeakPolarHBondContact O-CB 3.4Å; M495-M498 PolarHBondContact O-N 3.49Å; M495-M498 VanDerWaalsContact O-N 3.15Å; M495-V499 WeakPolarHBondContact O-CG2 3.37Å; M495-V499 PolarHBondContact O-N 2.93Å; M495-V528 HydrophobicContact CE-CG1 3.49Å; M495-V528 VanDerWaalsContact CE-CG1 3.49Å; M495-V528 HydrophobicContact CG-CG1 4.37Å; M495-M531 HydrophobicContact CB-CB 4.46Å; M495-M531 HydrophobicContact CB-CE 3.76Å; M495-M531 HydrophobicContact CB-SD 4.17Å; M495-M531 HydrophobicContact CG-CB 4.24Å; M495-M531 HydrophobicContact SD-CB 4.31Å; M495-E532 HydrophobicContact CE-CB 3.97Å; M495-I535 HydrophobicContact CB-CD1 4.33Å; M495-I535 HydrophobicContact SD-CD1 4.05Å; M495-I563 WeakPolarHBondContact CE-O 3.36Å; M495-I563 HydrophobicContact SD-CB 4.17Å; M495-I563 HydrophobicContact SD-CG2 4.1Å; M495-L566 HydrophobicContact CE-CB 3.97Å; M495-L566 HydrophobicContact CG-CD1 4.5Å; M495-L566 HydrophobicContact SD-CB 4.3Å; M495-L566 HydrophobicContact SD-CD1 4.47Å; M495-E567 HydrophobicContact CE-CB 3.95Å
496	G	95.5	Very high	93.2	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-57.1	-49.3	177.1	0	0	0	0	0	112.6	V492 M493 M498 V499 E500	V492-G496 PolarHBondContact O-N 2.91Å; M493-G496 PolarHBondContact O-N 3.45Å; G496-M498 VanDerWaalsContact C-N 3.28Å; G496-M498 PolarHBondContact O-N 2.81Å; G496-V499 PolarHBondContact O-N 3.27Å; G496-E500 WeakPolarHBondContact O-CB 3.34Å; G496-E500 PolarHBondContact O-N 2.85Å
497	G	94.4	Very high	93.8	Very high	36 Å²	36	37 Å²	37	37%	0.371	21%	0.206	S	C	.	.	H	α-helix	trans	-63	-32.2	176.7	0	0	0	0	0	113.5	M493 M495 Q501	M493-G497 PolarHBondContact O-N 3.47Å; M495-G497 PolarHBondContact O-N 3.47Å; G497-Q501 WeakPolarHBondContact O-CB 2.92Å; G497-Q501 PolarHBondContact O-N 3.28Å; G497-Q501 VanDerWaalsContact O-N 3.08Å
498	M	94.9	Very high	94.1	Very high	59 Å²	59	36.6 Å²	36.6	29%	0.291	20%	0.201	S	C	.	.	H	α-helix	trans	-69	-44	173.8	-173.6	177.8	-64	0	0	111.9	T494 M495 G496 Q501 Q502 N527 V528 M531	T494-M498 PolarHBondContact O-N 3.28Å; T494-M498 VanDerWaalsContact O-N 3.13Å; M495-M498 WeakPolarHBondContact O-CB 3.4Å; M495-M498 PolarHBondContact O-N 3.49Å; M495-M498 VanDerWaalsContact O-N 3.15Å; G496-M498 VanDerWaalsContact C-N 3.28Å; G496-M498 PolarHBondContact O-N 2.81Å; M498-Q501 PolarHBondContact O-N 3.48Å; M498-Q502 WeakPolarHBondContact O-CG 3.31Å; M498-Q502 PolarHBondContact O-N 3.31Å; M498-N527 HydrophobicContact CE-CB 4.32Å; M498-N527 HydrophobicContact SD-CB 3.66Å; M498-V528 HydrophobicContact CG-CG2 4.31Å; M498-V528 HydrophobicContact SD-CG2 4.08Å; M498-M531 HydrophobicContact CE-SD 4.15Å
499	V	96.3	Very high	94.3	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-64	-42.6	177.4	170.7	0	0	0	0	110.9	M495 G496 Q501 Q502 L503 V528 I569 L606	M495-V499 WeakPolarHBondContact O-CG2 3.37Å; M495-V499 PolarHBondContact O-N 2.93Å; G496-V499 PolarHBondContact O-N 3.27Å; V499-Q501 PolarHBondContact O-N 3.28Å; V499-Q502 PolarHBondContact O-N 2.86Å; V499-L503 HydrophobicContact CG1-CD1 4.34Å; V499-L503 PolarHBondContact O-N 2.74Å; V499-V528 HydrophobicContact CG2-CG1 3.79Å; V499-V528 HydrophobicContact CG2-CG2 3.93Å; V499-I569 HydrophobicContact CG1-CB 3.96Å; V499-I569 HydrophobicContact CG1-CG2 3.46Å; V499-I569 VanDerWaalsContact CG1-CG2 3.46Å; V499-L606 HydrophobicContact CG1-CD2 4.1Å
500	E	95.9	Very high	94.4	Very high	45 Å²	45	33.3 Å²	33.3	21%	0.21	19%	0.188	C	C	.	.	H	α-helix	trans	-59.7	-46.1	175.6	-165.6	-170.6	159.4	0	0	111.3	G496 L503 S504 I603 L606 H607	G496-E500 WeakPolarHBondContact O-CB 3.34Å; G496-E500 PolarHBondContact O-N 2.85Å; E500-L503 PolarHBondContact O-N 3.31Å; E500-S504 PolarHBondContact O-N 2.95Å; E500-I603 HydrophobicContact CG-CG2 4Å; E500-L606 HydrophobicContact CB-CD2 4.15Å; E500-L606 HydrophobicContact CG-CD2 4.46Å; E500-H607 WeakPolarHBondContact OE1-CB 3.27Å; E500-H607 IonicContact OE1-CE1 3.13Å; E500-H607 IonicContact OE1-CG 3.83Å; E500-H607 IonicContact OE1-ND1 3.93Å; E500-H607 PolarHBondContact OE1-ND1 3.41Å; E500-H607 IonicContact OE2-ND1 2.86Å; E500-H607 PolarHBondContact OE2-ND1 2.81Å
501	Q	94.5	Very high	94.4	Very high	107 Å²	107	32.4 Å²	32.4	50%	0.5	18%	0.178	S	C	.	.	H	α-helix	trans	-62	-44.8	175.7	-177.4	63.7	36.5	0	0	111.9	G497 M498 V499 L503 S504 D505	G497-Q501 WeakPolarHBondContact O-CB 2.92Å; G497-Q501 PolarHBondContact O-N 3.28Å; G497-Q501 VanDerWaalsContact O-N 3.08Å; M498-Q501 PolarHBondContact O-N 3.48Å; V499-Q501 PolarHBondContact O-N 3.28Å; Q501-L503 VanDerWaalsContact C-N 3.35Å; Q501-L503 PolarHBondContact O-N 2.88Å; Q501-S504 PolarHBondContact O-N 2.82Å; Q501-D505 PolarHBondContact NE2-OD1 3.22Å; Q501-D505 VanDerWaalsContact NE2-OD1 3.15Å; Q501-D505 PolarHBondContact NE2-OD2 3.46Å; Q501-D505 VanDerWaalsContact NE2-OD2 3.11Å; Q501-D505 WeakPolarHBondContact O-CB 3.48Å; Q501-D505 PolarHBondContact O-N 3.33Å
502	Q	94.5	Very high	94.3	Very high	14 Å²	14	34 Å²	34	7%	0.065	19%	0.189	C	C	.	.	H	α-helix	trans	-61.8	-41.1	178.2	-79.1	-179.6	-10.5	0	0	112.4	M498 V499 D505 A506 V521 G524 A573	M498-Q502 WeakPolarHBondContact O-CG 3.31Å; M498-Q502 PolarHBondContact O-N 3.31Å; V499-Q502 PolarHBondContact O-N 2.86Å; Q502-D505 PolarHBondContact O-N 2.97Å; Q502-A506 VanDerWaalsContact O-CB 3.25Å; Q502-A506 WeakPolarHBondContact O-CB 3.45Å; Q502-A506 PolarHBondContact O-N 3.48Å; Q502-V521 HydrophobicContact CB-CG1 4.2Å; Q502-V521 HydrophobicContact CG-CG1 4.43Å; Q502-G524 PolarHBondContact NE2-O 3.42Å; Q502-A573 HydrophobicContact CB-CB 4.23Å
503	L	95.8	Very high	93.9	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-64.4	-45	174.7	-83.5	169.4	0	0	0	112	V499 E500 Q501 D505 A506 I507 I569 V572 A573 I576 I603 L606 I669	V499-L503 HydrophobicContact CG1-CD1 4.34Å; V499-L503 PolarHBondContact O-N 2.74Å; E500-L503 PolarHBondContact O-N 3.31Å; Q501-L503 VanDerWaalsContact C-N 3.35Å; Q501-L503 PolarHBondContact O-N 2.88Å; L503-D505 VanDerWaalsContact C-N 3.32Å; L503-D505 PolarHBondContact O-N 3.33Å; L503-A506 PolarHBondContact O-N 3.46Å; L503-I507 WeakPolarHBondContact O-CG1 3.24Å; L503-I507 PolarHBondContact O-N 3.2Å; L503-I569 HydrophobicContact CD1-CG2 3.43Å; L503-I569 VanDerWaalsContact CD1-CG2 3.43Å; L503-I569 HydrophobicContact CG-CG2 4.46Å; L503-V572 HydrophobicContact CD2-CB 4.5Å; L503-V572 HydrophobicContact CD2-CG1 4.32Å; L503-A573 HydrophobicContact CD2-CB 4.36Å; L503-I576 HydrophobicContact CD2-CD1 3.78Å; L503-I603 HydrophobicContact CB-CD1 4.03Å; L503-I603 HydrophobicContact CB-CG1 3.85Å; L503-I603 HydrophobicContact CD1-CG1 4.49Å; L503-L606 HydrophobicContact CD1-CD2 3.79Å; L503-I669 HydrophobicContact CD1-CD1 3.88Å; L503-I669 HydrophobicContact CD1-CG2 4.5Å; L503-I669 HydrophobicContact CD2-CD1 3.48Å; L503-I669 VanDerWaalsContact CD2-CD1 3.48Å; L503-I669 HydrophobicContact CG-CD1 4.35Å
504	S	96	Very high	93.7	Very high	47 Å²	47	37.2 Å²	37.2	33%	0.329	21%	0.205	S	C	.	.	H	α-helix	trans	-58.9	-45.1	176.4	178.1	0	0	0	0	111.6	E500 Q501 T508	E500-S504 PolarHBondContact O-N 2.95Å; Q501-S504 PolarHBondContact O-N 2.82Å; S504-T508 WeakPolarHBondContact O-CB 3.26Å; S504-T508 PolarHBondContact O-N 3.42Å; S504-T508 PolarHBondContact O-OG1 2.88Å
505	D	95.4	Very high	93.4	Very high	46 Å²	46	36 Å²	36	25%	0.246	20%	0.2	C	C	.	.	H	α-helix	trans	-67	-37	177	-70.3	-22.1	0	0	0	111.6	Q501 Q502 L503 T508 A509 L517 V521	Q501-D505 PolarHBondContact NE2-OD1 3.22Å; Q501-D505 VanDerWaalsContact NE2-OD1 3.15Å; Q501-D505 PolarHBondContact NE2-OD2 3.46Å; Q501-D505 VanDerWaalsContact NE2-OD2 3.11Å; Q501-D505 WeakPolarHBondContact O-CB 3.48Å; Q501-D505 PolarHBondContact O-N 3.33Å; Q502-D505 PolarHBondContact O-N 2.97Å; L503-D505 VanDerWaalsContact C-N 3.32Å; L503-D505 PolarHBondContact O-N 3.33Å; D505-T508 PolarHBondContact O-N 2.9Å; D505-A509 VanDerWaalsContact O-CB 3.27Å; D505-A509 WeakPolarHBondContact O-CB 3.48Å; D505-A509 PolarHBondContact O-N 2.85Å; D505-L517 HydrophobicContact CB-CD1 4.2Å; D505-L517 HydrophobicContact CB-CG 4.44Å; D505-L517 WeakPolarHBondContact O-CD2 3.18Å; D505-V521 HydrophobicContact CB-CG2 3.53Å
506	A	95.4	Very high	93.3	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-65.7	-46	176.3	0	0	0	0	0	112.5	Q502 L503 T508 A509 M510 V521 A573 I576	Q502-A506 VanDerWaalsContact O-CB 3.25Å; Q502-A506 WeakPolarHBondContact O-CB 3.45Å; Q502-A506 PolarHBondContact O-N 3.48Å; L503-A506 PolarHBondContact O-N 3.46Å; A506-T508 VanDerWaalsContact C-N 3.32Å; A506-T508 PolarHBondContact O-N 3.4Å; A506-A509 PolarHBondContact O-N 3.41Å; A506-M510 WeakPolarHBondContact O-CB 3.42Å; A506-M510 PolarHBondContact O-N 2.88Å; A506-V521 HydrophobicContact CB-CG1 4.27Å; A506-A573 HydrophobicContact CB-CB 4.08Å; A506-I576 HydrophobicContact CB-CB 3.97Å; A506-I576 HydrophobicContact CB-CD1 4.49Å; A506-I576 HydrophobicContact CB-CG2 3.81Å; A506-I576 WeakPolarHBondContact O-CG2 3.05Å
507	I	94.8	Very high	93.2	Very high	4 Å²	4	42.2 Å²	42.2	2%	0.021	23%	0.233	C	C	.	.	H	α-helix	trans	-62	-42.9	175.7	-69.5	-66	0	0	0	110.3	L503 M510 H511 I576 E596 I603 I666	L503-I507 WeakPolarHBondContact O-CG1 3.24Å; L503-I507 PolarHBondContact O-N 3.2Å; I507-M510 HydrophobicContact CD1-CE 3.84Å; I507-M510 PolarHBondContact O-N 2.97Å; I507-H511 WeakPolarHBondContact O-CB 3.31Å; I507-H511 PolarHBondContact O-N 3.44Å; I507-I576 HydrophobicContact CD1-CD1 3.97Å; I507-I576 HydrophobicContact CD1-CG2 4.26Å; I507-I576 HydrophobicContact CG1-CD1 4.41Å; I507-E596 HydrophobicContact CG2-CB 4.32Å; I507-E596 HydrophobicContact CG2-CG 3.7Å; I507-I603 HydrophobicContact CB-CD1 4.48Å; I507-I603 HydrophobicContact CG1-CD1 3.93Å; I507-I666 HydrophobicContact CD1-CD1 3.87Å; I507-I666 HydrophobicContact CD1-CG1 4.47Å
508	T	93.8	Very high	93.1	Very high	53 Å²	53	40.5 Å²	40.5	33%	0.325	22%	0.216	S	C	.	.	H	α-helix	trans	-62.8	-43	176.3	-58.1	0	0	0	0	111.5	S504 D505 A506 H511 N512 L517	S504-T508 WeakPolarHBondContact O-CB 3.26Å; S504-T508 PolarHBondContact O-N 3.42Å; S504-T508 PolarHBondContact O-OG1 2.88Å; D505-T508 PolarHBondContact O-N 2.9Å; A506-T508 VanDerWaalsContact C-N 3.32Å; A506-T508 PolarHBondContact O-N 3.4Å; T508-H511 PolarHBondContact O-N 3.26Å; T508-N512 WeakPolarHBondContact CG2-ND2 3.35Å; T508-N512 WeakPolarHBondContact O-CB 3.33Å; T508-N512 PolarHBondContact O-N 2.91Å; T508-N512 PolarHBondContact O-ND2 3.16Å; T508-L517 HydrophobicContact CG2-CD2 4.1Å
509	A	93	Very high	93	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-62.9	-42.2	176.6	0	0	0	0	0	111.7	D505 A506 Q513 D514 L517 A518 A580	D505-A509 VanDerWaalsContact O-CB 3.27Å; D505-A509 WeakPolarHBondContact O-CB 3.48Å; D505-A509 PolarHBondContact O-N 2.85Å; A506-A509 PolarHBondContact O-N 3.41Å; A509-Q513 CarbonylContact O-C 3.47Å; A509-Q513 VanDerWaalsContact O-CA 3.23Å; A509-Q513 WeakPolarHBondContact O-CA 3.34Å; A509-Q513 PolarHBondContact O-N 3.36Å; A509-D514 PolarHBondContact O-N 3.39Å; A509-L517 HydrophobicContact CB-CB 4.01Å; A509-L517 HydrophobicContact CB-CD2 4.01Å; A509-L517 HydrophobicContact CB-CG 3.99Å; A509-A518 HydrophobicContact CB-CB 4.08Å; A509-A580 HydrophobicContact CB-CB 4.29Å
510	M	91.5	Very high	92.7	Very high	1 Å²	1	50.7 Å²	50.7	1%	0.005	25%	0.254	C	S	.	.	H	α-helix	trans	-64.9	-47.1	177	177.4	-173.6	67.1	0	0	112	A506 I507 Q513 I576 T579 A580 L592 L595	A506-M510 WeakPolarHBondContact O-CB 3.42Å; A506-M510 PolarHBondContact O-N 2.88Å; I507-M510 HydrophobicContact CD1-CE 3.84Å; I507-M510 PolarHBondContact O-N 2.97Å; M510-Q513 PolarHBondContact O-N 2.73Å; M510-I576 HydrophobicContact CB-CG2 3.92Å; M510-I576 HydrophobicContact CE-CG2 4.45Å; M510-I576 HydrophobicContact SD-CG2 4.01Å; M510-T579 HydrophobicContact CG-CG2 4.35Å; M510-T579 HydrophobicContact SD-CG2 4.23Å; M510-A580 HydrophobicContact CB-CB 4.23Å; M510-L592 HydrophobicContact CG-CD2 3.88Å; M510-L592 HydrophobicContact SD-CD2 4.46Å; M510-L595 HydrophobicContact CE-CB 3.58Å; M510-L595 HydrophobicContact CE-CD1 4.48Å; M510-L595 HydrophobicContact SD-CB 4.17Å; M510-L595 HydrophobicContact SD-CD1 3.98Å
511	H	89.8	Confident	92.6	Very high	63 Å²	63	48.9 Å²	48.9	29%	0.292	25%	0.246	S	C	.	.	H	α-helix	trans	-63.4	-46.4	179.9	-178.4	90.1	0	0	0	111.9	I507 T508 Q513 E596	I507-H511 WeakPolarHBondContact O-CB 3.31Å; I507-H511 PolarHBondContact O-N 3.44Å; T508-H511 PolarHBondContact O-N 3.26Å; H511-Q513 VanDerWaalsContact C-N 3.3Å; H511-Q513 PolarHBondContact O-N 3.36Å; H511-E596 HydrophobicContact CB-CG 4.49Å; H511-E596 IonicContact CE1-OE2 3.66Å; H511-E596 PolarHBondContact CE1-OE2 3.22Å; H511-E596 IonicContact CG-OE2 3.69Å; H511-E596 IonicContact ND1-OE2 2.83Å; H511-E596 PolarHBondContact ND1-OE2 3.11Å; H511-E596 IonicContact NE2-OE2 3.84Å
512	N	89.2	Confident	92.4	Very high	103 Å²	103	46.4 Å²	46.4	55%	0.551	24%	0.235	S	C	*	.	H	α-helix	trans	-82.4	-5.9	-178.3	-67.1	-36.3	0	0	0	113.7	T508 D514	T508-N512 WeakPolarHBondContact CG2-ND2 3.35Å; T508-N512 WeakPolarHBondContact O-CB 3.33Å; T508-N512 PolarHBondContact O-N 2.91Å; T508-N512 PolarHBondContact O-ND2 3.16Å; N512-D514 HydrophobicContact CB-CB 4.33Å; N512-D514 PolarHBondContact O-N 3.28Å
513	Q	85.8	Confident	92	Very high	66 Å²	66	52.8 Å²	52.8	31%	0.308	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.5	36.9	-168.6	-58.7	-178.2	-11.9	0	0	112.4	A509 M510 H511 S515 L592	A509-Q513 CarbonylContact O-C 3.47Å; A509-Q513 VanDerWaalsContact O-CA 3.23Å; A509-Q513 WeakPolarHBondContact O-CA 3.34Å; A509-Q513 PolarHBondContact O-N 3.36Å; M510-Q513 PolarHBondContact O-N 2.73Å; H511-Q513 VanDerWaalsContact C-N 3.3Å; H511-Q513 PolarHBondContact O-N 3.36Å; Q513-S515 PolarHBondContact O-N 3.03Å; Q513-L592 HydrophobicContact CG-CD1 4.28Å
514	D	90.6	Very high	91.5	Very high	59 Å²	59	53.5 Å²	53.5	32%	0.316	27%	0.273	S	S	.	.			trans	-81.9	98.1	-179.8	-173.7	-17.4	0	0	0	110.3	A509 N512 D516 L517 A518	A509-D514 PolarHBondContact O-N 3.39Å; N512-D514 HydrophobicContact CB-CB 4.33Å; N512-D514 PolarHBondContact O-N 3.28Å; D514-D516 VanDerWaalsContact C-N 3.29Å; D514-D516 PolarHBondContact O-N 2.69Å; D514-D516 PolarHBondContact OD1-N 3.39Å; D514-L517 HydrophobicContact CB-CB 4.02Å; D514-L517 PolarHBondContact OD1-N 3.28Å; D514-A518 WeakPolarHBondContact O-CB 3.43Å; D514-A518 PolarHBondContact O-N 2.94Å
515	S	89.7	Confident	91.1	Very high	53 Å²	53	52.5 Å²	52.5	37%	0.371	26%	0.264	S	S	.	.	H	α-helix	trans	-66.3	-28.4	-179.8	-57.8	0	0	0	0	113.6	Q513 K519	Q513-S515 PolarHBondContact O-N 3.03Å; S515-K519 WeakPolarHBondContact O-CG 3.43Å; S515-K519 PolarHBondContact O-N 3.29Å; S515-K519 VanDerWaalsContact O-N 3.14Å
516	D	92	Very high	90.8	Very high	111 Å²	111	57.5 Å²	57.5	59%	0.594	28%	0.284	S	S	*	.	H	α-helix	trans	-80.9	-37.5	-177.6	-71.9	-32.8	0	0	0	110.9	D514 R520	D514-D516 VanDerWaalsContact C-N 3.29Å; D514-D516 PolarHBondContact O-N 2.69Å; D514-D516 PolarHBondContact OD1-N 3.39Å; D516-R520 WeakPolarHBondContact O-CG 3.32Å; D516-R520 PolarHBondContact O-N 3.35Å; D516-R520 PolarHBondContact O-NE 3.25Å
517	L	93.9	Very high	90.6	Very high	20 Å²	20	61.1 Å²	61.1	11%	0.105	30%	0.303	C	S	.	.	H	α-helix	trans	-63.8	-44.6	168.9	-173.4	60.9	0	0	0	111	D505 T508 A509 D514 K519 R520 V521	D505-L517 HydrophobicContact CB-CD1 4.2Å; D505-L517 HydrophobicContact CB-CG 4.44Å; D505-L517 WeakPolarHBondContact O-CD2 3.18Å; T508-L517 HydrophobicContact CG2-CD2 4.1Å; A509-L517 HydrophobicContact CB-CB 4.01Å; A509-L517 HydrophobicContact CB-CD2 4.01Å; A509-L517 HydrophobicContact CB-CG 3.99Å; D514-L517 HydrophobicContact CB-CB 4.02Å; D514-L517 PolarHBondContact OD1-N 3.28Å; L517-K519 PolarHBondContact O-N 2.91Å; L517-R520 PolarHBondContact O-N 2.65Å; L517-R520 VanDerWaalsContact O-N 3.14Å; L517-V521 WeakPolarHBondContact O-CG2 3.49Å; L517-V521 PolarHBondContact O-N 2.88Å
518	A	92.6	Very high	90.5	Very high	0 Å²	0	60.9 Å²	60.9	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-56	-46.6	177.6	0	0	0	0	0	112.4	A509 D514 R520 V521 I522 C577 A580 L581	A509-A518 HydrophobicContact CB-CB 4.08Å; D514-A518 WeakPolarHBondContact O-CB 3.43Å; D514-A518 PolarHBondContact O-N 2.94Å; A518-R520 PolarHBondContact O-N 3.47Å; A518-V521 PolarHBondContact O-N 2.78Å; A518-I522 VanDerWaalsContact O-CG1 3.26Å; A518-I522 WeakPolarHBondContact O-CG1 3.09Å; A518-I522 PolarHBondContact O-N 2.79Å; A518-I522 VanDerWaalsContact O-N 3.14Å; A518-C577 HydrophobicContact CB-CB 3.95Å; A518-A580 HydrophobicContact CB-CB 3.98Å; A518-L581 HydrophobicContact CB-CD2 4.29Å; A518-L581 HydrophobicContact CB-CG 4.29Å
519	K	91.8	Very high	90.5	Very high	117 Å²	117	61 Å²	61	51%	0.509	30%	0.3	S	S	.	.	H	α-helix	trans	-63.4	-38.6	177.4	-75.3	174.2	-175.3	169.2	0	113.2	S515 L517 I522 E523	S515-K519 WeakPolarHBondContact O-CG 3.43Å; S515-K519 PolarHBondContact O-N 3.29Å; S515-K519 VanDerWaalsContact O-N 3.14Å; L517-K519 PolarHBondContact O-N 2.91Å; K519-I522 PolarHBondContact O-N 2.96Å; K519-E523 PolarHBondContact O-N 3.27Å
520	R	91.4	Very high	90.5	Very high	155 Å²	155	66.7 Å²	66.7	59%	0.585	33%	0.328	S	S	*	.	H	α-helix	trans	-64.3	-40.3	177.8	-77.9	-175.3	-71	158.8	-3.3	112.1	D516 L517 A518 E523 G524	D516-R520 WeakPolarHBondContact O-CG 3.32Å; D516-R520 PolarHBondContact O-N 3.35Å; D516-R520 PolarHBondContact O-NE 3.25Å; L517-R520 PolarHBondContact O-N 2.65Å; L517-R520 VanDerWaalsContact O-N 3.14Å; A518-R520 PolarHBondContact O-N 3.47Å; R520-E523 PolarHBondContact O-N 2.84Å; R520-G524 PolarHBondContact O-N 2.9Å; R520-G524 VanDerWaalsContact O-N 3.14Å
521	V	93	Very high	90.7	Very high	8 Å²	8	68.4 Å²	68.4	5%	0.048	34%	0.337	C	S	.	.	H	α-helix	trans	-63.2	-45.4	175.9	175.2	0	0	0	0	110.5	Q502 D505 A506 L517 A518 E523 G524 D525 A573	Q502-V521 HydrophobicContact CB-CG1 4.2Å; Q502-V521 HydrophobicContact CG-CG1 4.43Å; D505-V521 HydrophobicContact CB-CG2 3.53Å; A506-V521 HydrophobicContact CB-CG1 4.27Å; L517-V521 WeakPolarHBondContact O-CG2 3.49Å; L517-V521 PolarHBondContact O-N 2.88Å; A518-V521 PolarHBondContact O-N 2.78Å; V521-E523 VanDerWaalsContact C-N 3.3Å; V521-E523 PolarHBondContact O-N 2.9Å; V521-G524 PolarHBondContact O-N 3.31Å; V521-D525 PolarHBondContact O-N 2.83Å; V521-A573 HydrophobicContact CG1-CB 3.95Å
522	I	89.6	Confident	91	Very high	54 Å²	54	67.9 Å²	67.9	28%	0.277	34%	0.335	S	S	.	.	H	α-helix	trans	-59.4	-39.5	177.8	-64.2	170.8	0	0	0	111.8	A518 K519 G524 D574 C577 L581	A518-I522 VanDerWaalsContact O-CG1 3.26Å; A518-I522 WeakPolarHBondContact O-CG1 3.09Å; A518-I522 PolarHBondContact O-N 2.79Å; A518-I522 VanDerWaalsContact O-N 3.14Å; K519-I522 PolarHBondContact O-N 2.96Å; I522-G524 VanDerWaalsContact C-N 3.32Å; I522-D574 WeakPolarHBondContact CG1-OD1 3.38Å; I522-C577 HydrophobicContact CD1-CB 3.81Å; I522-C577 HydrophobicContact CG1-CB 3.73Å; I522-L581 HydrophobicContact CD1-CD1 4.16Å
523	E	87.3	Confident	91.3	Very high	148 Å²	148	67 Å²	67	69%	0.692	33%	0.333	S	S	*	.	H	α-helix	trans	-69.3	-30.3	176.5	-74.7	-178.3	171.6	0	0	113.1	K519 R520 V521 D525	K519-E523 PolarHBondContact O-N 3.27Å; R520-E523 PolarHBondContact O-N 2.84Å; V521-E523 VanDerWaalsContact C-N 3.3Å; V521-E523 PolarHBondContact O-N 2.9Å; E523-D525 VanDerWaalsContact C-N 3.32Å; E523-D525 PolarHBondContact O-N 3.09Å
524	G	85	Confident	91.6	Very high	16 Å²	16	66 Å²	66	17%	0.165	34%	0.336	C	S	.	.	H	α-helix	trans	-70.5	-23.3	-179.9	0	0	0	0	0	114.5	Q502 R520 V521 I522 K526 N527	Q502-G524 PolarHBondContact NE2-O 3.42Å; R520-G524 PolarHBondContact O-N 2.9Å; R520-G524 VanDerWaalsContact O-N 3.14Å; V521-G524 PolarHBondContact O-N 3.31Å; I522-G524 VanDerWaalsContact C-N 3.32Å; G524-K526 PolarHBondContact O-N 3.46Å; G524-K526 VanDerWaalsContact O-N 3.16Å; G524-N527 WeakPolarHBondContact O-CB 3.18Å; G524-N527 PolarHBondContact O-N 3.37Å
525	D	87.8	Confident	91.8	Very high	25 Å²	25	63.2 Å²	63.2	13%	0.134	32%	0.321	C	S	.	.	H	α-helix	trans	-56	-32.7	-177.1	-172.6	62.4	0	0	0	113	V521 E523 N527 V528 N529	V521-D525 PolarHBondContact O-N 2.83Å; E523-D525 VanDerWaalsContact C-N 3.32Å; E523-D525 PolarHBondContact O-N 3.09Å; D525-N527 PolarHBondContact O-N 3.35Å; D525-N527 VanDerWaalsContact O-N 3.08Å; D525-V528 WeakPolarHBondContact O-CB 3.49Å; D525-V528 PolarHBondContact O-N 2.84Å; D525-N529 PolarHBondContact O-N 3.36Å
526	K	89.7	Confident	92.1	Very high	152 Å²	152	63.8 Å²	63.8	66%	0.661	32%	0.319	S	S	*	.	H	α-helix	trans	-56	-31.3	174.8	-71.3	-179.3	-179.5	172.4	0	113.7	G524 M530	G524-K526 PolarHBondContact O-N 3.46Å; G524-K526 VanDerWaalsContact O-N 3.16Å; K526-M530 WeakPolarHBondContact O-CG 3.44Å; K526-M530 PolarHBondContact O-N 2.91Å; K526-M530 VanDerWaalsContact O-N 3.07Å
527	N	91.2	Very high	92.2	Very high	75 Å²	75	63.2 Å²	63.2	40%	0.401	31%	0.313	S	S	.	.	H	α-helix	trans	-70	-38.3	179.5	-65	-32.6	0	0	0	111.3	M498 G524 D525 M530 M531	M498-N527 HydrophobicContact CE-CB 4.32Å; M498-N527 HydrophobicContact SD-CB 3.66Å; G524-N527 WeakPolarHBondContact O-CB 3.18Å; G524-N527 PolarHBondContact O-N 3.37Å; D525-N527 PolarHBondContact O-N 3.35Å; D525-N527 VanDerWaalsContact O-N 3.08Å; N527-M530 PolarHBondContact O-N 3.45Å; N527-M530 VanDerWaalsContact OD1-CE 3.32Å; N527-M530 WeakPolarHBondContact OD1-CE 3.37Å; N527-M531 WeakPolarHBondContact O-CG 3.32Å; N527-M531 PolarHBondContact O-N 3.18Å
528	V	92.8	Very high	92	Very high	0 Å²	0	63 Å²	63	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-62.7	-46.4	176.4	179.7	0	0	0	0	109.6	M495 M498 V499 D525 M530 M531 E532	M495-V528 HydrophobicContact CE-CG1 3.49Å; M495-V528 VanDerWaalsContact CE-CG1 3.49Å; M495-V528 HydrophobicContact CG-CG1 4.37Å; M498-V528 HydrophobicContact CG-CG2 4.31Å; M498-V528 HydrophobicContact SD-CG2 4.08Å; V499-V528 HydrophobicContact CG2-CG1 3.79Å; V499-V528 HydrophobicContact CG2-CG2 3.93Å; D525-V528 WeakPolarHBondContact O-CB 3.49Å; D525-V528 PolarHBondContact O-N 2.84Å; V528-M530 VanDerWaalsContact C-N 3.34Å; V528-M530 PolarHBondContact O-N 3.21Å; V528-M531 WeakPolarHBondContact O-CB 3.35Å; V528-M531 PolarHBondContact O-N 3.01Å; V528-M531 VanDerWaalsContact O-N 3.1Å; V528-E532 PolarHBondContact O-N 3.34Å
529	N	93.2	Very high	92.1	Very high	54 Å²	54	63.1 Å²	63.1	29%	0.289	32%	0.315	S	S	.	.	H	α-helix	trans	-63.6	-37.9	178.8	-61.8	-3.2	0	0	0	112.4	D525 V533	D525-N529 PolarHBondContact O-N 3.36Å; N529-V533 WeakPolarHBondContact O-CG2 3.25Å; N529-V533 PolarHBondContact O-N 3.35Å
530	M	93.6	Very high	92	Very high	120 Å²	120	61.6 Å²	61.6	59%	0.591	32%	0.315	S	S	*	.	H	α-helix	trans	-67.5	-37.2	174.3	-73.6	-172.6	-60.6	0	0	112.3	K526 N527 V528 A534	K526-M530 WeakPolarHBondContact O-CG 3.44Å; K526-M530 PolarHBondContact O-N 2.91Å; K526-M530 VanDerWaalsContact O-N 3.07Å; N527-M530 PolarHBondContact O-N 3.45Å; N527-M530 VanDerWaalsContact OD1-CE 3.32Å; N527-M530 WeakPolarHBondContact OD1-CE 3.37Å; V528-M530 VanDerWaalsContact C-N 3.34Å; V528-M530 PolarHBondContact O-N 3.21Å; M530-A534 WeakPolarHBondContact O-CB 3.06Å; M530-A534 PolarHBondContact O-N 2.86Å; M530-A534 VanDerWaalsContact O-N 3.09Å
531	M	94.4	Very high	91.8	Very high	38 Å²	38	59.9 Å²	59.9	19%	0.187	31%	0.309	C	S	.	.	H	α-helix	trans	-67	-41.9	176.4	-73.9	-173.6	76.7	0	0	111.7	Q491 T494 M495 M498 N527 V528 V533 A534 I535	Q491-M531 WeakPolarHBondContact O-CE 3.48Å; T494-M531 HydrophobicContact CG2-CE 3.89Å; M495-M531 HydrophobicContact CB-CB 4.46Å; M495-M531 HydrophobicContact CB-CE 3.76Å; M495-M531 HydrophobicContact CB-SD 4.17Å; M495-M531 HydrophobicContact CG-CB 4.24Å; M495-M531 HydrophobicContact SD-CB 4.31Å; M498-M531 HydrophobicContact CE-SD 4.15Å; N527-M531 WeakPolarHBondContact O-CG 3.32Å; N527-M531 PolarHBondContact O-N 3.18Å; V528-M531 WeakPolarHBondContact O-CB 3.35Å; V528-M531 PolarHBondContact O-N 3.01Å; V528-M531 VanDerWaalsContact O-N 3.1Å; M531-V533 PolarHBondContact O-N 2.76Å; M531-A534 PolarHBondContact O-N 3.12Å; M531-I535 HydrophobicContact CB-CD1 4.47Å; M531-I535 WeakPolarHBondContact O-CB 3.31Å; M531-I535 WeakPolarHBondContact O-CG1 3.18Å; M531-I535 PolarHBondContact O-N 3.14Å
532	E	96	Very high	91.3	Very high	52 Å²	52	59.8 Å²	59.8	24%	0.243	31%	0.308	C	S	.	.	H	α-helix	trans	-53.3	-54.9	175.4	-172.9	-159.4	-169.6	0	0	110.7	M495 V528 A534 I535 D536 I563 E567	M495-E532 HydrophobicContact CE-CB 3.97Å; V528-E532 PolarHBondContact O-N 3.34Å; E532-A534 VanDerWaalsContact C-N 3.33Å; E532-A534 PolarHBondContact O-N 3.25Å; E532-I535 PolarHBondContact O-N 2.91Å; E532-D536 WeakPolarHBondContact O-CB 3.43Å; E532-D536 PolarHBondContact O-N 3.21Å; E532-I563 HydrophobicContact CG-CD1 4.37Å; E532-E567 HydrophobicContact CG-CB 4.32Å
533	V	94.9	Very high	91.1	Very high	84 Å²	84	60.7 Å²	60.7	51%	0.509	31%	0.313	S	S	.	.	H	α-helix	trans	-60.1	-42.6	179.8	175.7	0	0	0	0	111.6	N529 M531 D536 E537	N529-V533 WeakPolarHBondContact O-CG2 3.25Å; N529-V533 PolarHBondContact O-N 3.35Å; M531-V533 PolarHBondContact O-N 2.76Å; V533-D536 PolarHBondContact O-N 3.17Å; V533-E537 WeakPolarHBondContact O-CB 3.23Å; V533-E537 WeakPolarHBondContact O-CG 3.47Å; V533-E537 PolarHBondContact O-N 3.09Å
534	A	93.4	Very high	90.7	Very high	45 Å²	45	57.4 Å²	57.4	37%	0.372	31%	0.311	S	S	.	.	H	α-helix	trans	-65.5	-41.6	-178.9	0	0	0	0	0	112.6	M530 M531 E532 A538	M530-A534 WeakPolarHBondContact O-CB 3.06Å; M530-A534 PolarHBondContact O-N 2.86Å; M530-A534 VanDerWaalsContact O-N 3.09Å; M531-A534 PolarHBondContact O-N 3.12Å; E532-A534 VanDerWaalsContact C-N 3.33Å; E532-A534 PolarHBondContact O-N 3.25Å; A534-A538 PolarHBondContact O-N 3.11Å; A534-A538 VanDerWaalsContact O-N 3.13Å
535	I	94.6	Very high	90.1	Very high	1 Å²	1	64.1 Å²	64.1	1%	0.005	34%	0.336	C	S	.	.	H	α-helix	trans	-70.9	-41.4	178.9	-62.5	166	0	0	0	110.1	I488 Q491 V492 M495 M531 E532 A538 C539 I559 I563	I488-I535 HydrophobicContact CG2-CG2 3.72Å; Q491-I535 HydrophobicContact CB-CD1 3.92Å; Q491-I535 HydrophobicContact CB-CG1 3.79Å; V492-I535 HydrophobicContact CG2-CD1 4.38Å; V492-I535 HydrophobicContact CG2-CG2 4.06Å; M495-I535 HydrophobicContact CB-CD1 4.33Å; M495-I535 HydrophobicContact SD-CD1 4.05Å; M531-I535 HydrophobicContact CB-CD1 4.47Å; M531-I535 WeakPolarHBondContact O-CB 3.31Å; M531-I535 WeakPolarHBondContact O-CG1 3.18Å; M531-I535 PolarHBondContact O-N 3.14Å; E532-I535 PolarHBondContact O-N 2.91Å; I535-A538 WeakPolarHBondContact O-CB 3.45Å; I535-A538 PolarHBondContact O-N 3.24Å; I535-A538 VanDerWaalsContact O-N 3.13Å; I535-C539 PolarHBondContact O-N 3.36Å; I535-C539 PolarHBondContact O-SG 3.07Å; I535-I559 HydrophobicContact CG2-CG2 3.94Å; I535-I563 HydrophobicContact CB-CD1 4.04Å; I535-I563 HydrophobicContact CB-CG2 4.17Å; I535-I563 HydrophobicContact CD1-CG2 3.93Å; I535-I563 HydrophobicContact CG2-CD1 3.98Å; I535-I563 HydrophobicContact CG2-CG2 3.74Å
536	D	95.2	Very high	89.3	Confident	64 Å²	64	65.5 Å²	65.5	34%	0.342	34%	0.339	S	S	.	.	H	α-helix	trans	-64.8	-43.8	178.8	-161.8	55.4	0	0	0	111.5	E532 V533 A538 C539 V540 S560 I563	E532-D536 WeakPolarHBondContact O-CB 3.43Å; E532-D536 PolarHBondContact O-N 3.21Å; V533-D536 PolarHBondContact O-N 3.17Å; D536-A538 VanDerWaalsContact C-N 3.26Å; D536-A538 PolarHBondContact O-N 3.41Å; D536-C539 WeakPolarHBondContact O-CB 3.32Å; D536-C539 PolarHBondContact O-N 3.26Å; D536-C539 VanDerWaalsContact O-N 3.13Å; D536-V540 WeakPolarHBondContact O-CG2 3.46Å; D536-V540 PolarHBondContact O-N 3.27Å; D536-S560 PolarHBondContact OD1-OG 3.05Å; D536-I563 HydrophobicContact CB-CD1 3.78Å
537	E	94.5	Very high	88.4	Confident	99 Å²	99	66.5 Å²	66.5	46%	0.463	35%	0.346	S	S	.	.	H	α-helix	trans	-60	-36.1	172.2	-78.9	-165.5	173.4	0	0	112.7	V533 R541	V533-E537 WeakPolarHBondContact O-CB 3.23Å; V533-E537 WeakPolarHBondContact O-CG 3.47Å; V533-E537 PolarHBondContact O-N 3.09Å; E537-R541 VanDerWaalsContact CB-NH2 3.31Å; E537-R541 WeakPolarHBondContact O-CB 3.49Å; E537-R541 WeakPolarHBondContact O-CG 3.34Å; E537-R541 PolarHBondContact O-N 3.36Å; E537-R541 PolarHBondContact O-NE 3.35Å; E537-R541 IonicContact OE2-CZ 3.43Å; E537-R541 IonicContact OE2-NH1 3.73Å; E537-R541 PolarHBondContact OE2-NH1 2.89Å; E537-R541 IonicContact OE2-NH2 3.93Å; E537-R541 PolarHBondContact OE2-NH2 2.85Å; E537-R541 VanDerWaalsContact OE2-NH2 3.12Å
538	A	90.7	Very high	87.5	Confident	16 Å²	16	63.8 Å²	63.8	13%	0.132	33%	0.333	C	S	.	.	H	α-helix	trans	-65.7	-41.9	176	0	0	0	0	0	111.1	I488 A534 I535 D536 R541 I542	I488-A538 HydrophobicContact CD1-CB 3.73Å; I488-A538 HydrophobicContact CG1-CB 3.89Å; A534-A538 PolarHBondContact O-N 3.11Å; A534-A538 VanDerWaalsContact O-N 3.13Å; I535-A538 WeakPolarHBondContact O-CB 3.45Å; I535-A538 PolarHBondContact O-N 3.24Å; I535-A538 VanDerWaalsContact O-N 3.13Å; D536-A538 VanDerWaalsContact C-N 3.26Å; D536-A538 PolarHBondContact O-N 3.41Å; A538-R541 PolarHBondContact O-N 3Å; A538-I542 WeakPolarHBondContact O-CG1 3.22Å; A538-I542 PolarHBondContact O-N 3.02Å
539	C	93.1	Very high	86.7	Confident	2 Å²	2	68.1 Å²	68.1	1%	0.014	36%	0.359	C	S	.	.	H	α-helix	trans	-60	-48.4	174.1	-66.9	0	0	0	0	111.5	I535 D536 R541 I542 I543 V556	I535-C539 PolarHBondContact O-N 3.36Å; I535-C539 PolarHBondContact O-SG 3.07Å; D536-C539 WeakPolarHBondContact O-CB 3.32Å; D536-C539 PolarHBondContact O-N 3.26Å; D536-C539 VanDerWaalsContact O-N 3.13Å; C539-R541 VanDerWaalsContact C-N 3.34Å; C539-R541 PolarHBondContact O-N 3.2Å; C539-I542 PolarHBondContact O-N 2.96Å; C539-I543 WeakPolarHBondContact O-CG1 3.44Å; C539-I543 PolarHBondContact O-N 3.08Å; C539-V556 HydrophobicContact CB-CG1 3.64Å
540	V	91.6	Very high	85.8	Confident	85 Å²	85	69 Å²	69	52%	0.515	37%	0.374	S	S	.	.	H	α-helix	trans	-60.9	-43	177.1	174.5	0	0	0	0	111.2	D536 I542 I543 A544	D536-V540 WeakPolarHBondContact O-CG2 3.46Å; D536-V540 PolarHBondContact O-N 3.27Å; V540-I542 PolarHBondContact O-N 3.09Å; V540-I543 PolarHBondContact O-N 3.3Å; V540-A544 VanDerWaalsContact O-CB 3.3Å; V540-A544 WeakPolarHBondContact O-CB 3.16Å; V540-A544 PolarHBondContact O-N 2.91Å
541	R	86.8	Confident	84.9	Confident	120 Å²	120	65.6 Å²	65.6	45%	0.453	36%	0.362	S	S	.	.	H	α-helix	trans	-60.5	-43	175.9	-86.1	-175.5	-74.8	-99.8	-0.6	112.1	E537 A538 C539 K545	E537-R541 VanDerWaalsContact CB-NH2 3.31Å; E537-R541 WeakPolarHBondContact O-CB 3.49Å; E537-R541 WeakPolarHBondContact O-CG 3.34Å; E537-R541 PolarHBondContact O-N 3.36Å; E537-R541 PolarHBondContact O-NE 3.35Å; E537-R541 IonicContact OE2-CZ 3.43Å; E537-R541 IonicContact OE2-NH1 3.73Å; E537-R541 PolarHBondContact OE2-NH1 2.89Å; E537-R541 IonicContact OE2-NH2 3.93Å; E537-R541 PolarHBondContact OE2-NH2 2.85Å; E537-R541 VanDerWaalsContact OE2-NH2 3.12Å; A538-R541 PolarHBondContact O-N 3Å; C539-R541 VanDerWaalsContact C-N 3.34Å; C539-R541 PolarHBondContact O-N 3.2Å; R541-K545 VanDerWaalsContact O-CB 3.26Å; R541-K545 WeakPolarHBondContact O-CB 3.3Å; R541-K545 WeakPolarHBondContact O-CG 3.5Å; R541-K545 PolarHBondContact O-N 3.45Å
542	I	83.1	Confident	84.4	Confident	5 Å²	5	65.4 Å²	65.4	3%	0.026	36%	0.362	C	S	.	.	H	α-helix	trans	-60.4	-50.9	176.3	-80.2	-169.7	0	0	0	110.7	F481 E484 L485 I488 A538 C539 V540 A544 K545 R546 V556	F481-I542 HydrophobicContact CD2-CG2 4.23Å; F481-I542 HydrophobicContact CE2-CD1 4.31Å; F481-I542 HydrophobicContact CE2-CG2 3.44Å; F481-I542 VanDerWaalsContact CE2-CG2 3.44Å; F481-I542 HydrophobicContact CZ-CG2 4.33Å; E484-I542 HydrophobicContact CB-CD1 3.83Å; E484-I542 HydrophobicContact CB-CG1 4.3Å; L485-I542 HydrophobicContact CD2-CD1 4.15Å; I488-I542 HydrophobicContact CD1-CD1 3.2Å; I488-I542 HydrophobicContact CD1-CG1 3.98Å; I488-I542 HydrophobicContact CG1-CD1 4.31Å; A538-I542 WeakPolarHBondContact O-CG1 3.22Å; A538-I542 PolarHBondContact O-N 3.02Å; C539-I542 PolarHBondContact O-N 2.96Å; V540-I542 PolarHBondContact O-N 3.09Å; I542-A544 VanDerWaalsContact C-N 3.31Å; I542-A544 PolarHBondContact O-N 3.33Å; I542-K545 PolarHBondContact O-N 3.02Å; I542-R546 WeakPolarHBondContact O-CB 3.21Å; I542-R546 PolarHBondContact O-N 3.22Å; I542-V556 HydrophobicContact CG2-CG2 3.79Å
543	I	84.9	Confident	84	Confident	74 Å²	74	66.1 Å²	66.1	38%	0.379	37%	0.367	S	S	.	.	H	α-helix	trans	-59.6	-46.3	-178.2	-66.6	167	0	0	0	109.9	C539 V540 Q547 L553 V556	C539-I543 WeakPolarHBondContact O-CG1 3.44Å; C539-I543 PolarHBondContact O-N 3.08Å; V540-I543 PolarHBondContact O-N 3.3Å; I543-Q547 PolarHBondContact O-N 3.21Å; I543-L553 HydrophobicContact CD1-CD1 4.31Å; I543-L553 HydrophobicContact CG1-CD1 4.11Å; I543-V556 HydrophobicContact CD1-CG1 3.82Å; I543-V556 HydrophobicContact CG1-CG1 3.86Å
544	A	79.1	Confident	83.7	Confident	79 Å²	79	65.2 Å²	65.2	65%	0.653	35%	0.354	S	S	*	.	H	α-helix	trans	-68.1	-37.5	-178.1	0	0	0	0	0	113.3	V540 I542	V540-A544 VanDerWaalsContact O-CB 3.3Å; V540-A544 WeakPolarHBondContact O-CB 3.16Å; V540-A544 PolarHBondContact O-N 2.91Å; I542-A544 VanDerWaalsContact C-N 3.31Å; I542-A544 PolarHBondContact O-N 3.33Å
545	K	72.3	Confident	83.5	Confident	157 Å²	157	64 Å²	64	68%	0.683	34%	0.341	S	S	*	.	H	α-helix	trans	-87.6	-37.2	-175.7	-76.1	-174.7	174.7	-177.3	0	114.4	R541 I542	R541-K545 VanDerWaalsContact O-CB 3.26Å; R541-K545 WeakPolarHBondContact O-CB 3.3Å; R541-K545 WeakPolarHBondContact O-CG 3.5Å; R541-K545 PolarHBondContact O-N 3.45Å; I542-K545 PolarHBondContact O-N 3.02Å
546	R	69.9	Low	83.4	Confident	54 Å²	54	64 Å²	64	20%	0.204	34%	0.341	C	S	.	.	H	α-helix	trans	-107.2	-16.1	-163.6	-60.1	-76.5	-173.8	-177.1	-6.8	114	F481 E484 I542	F481-R546 HydrophobicContact CD2-CB 4.04Å; F481-R546 HydrophobicContact CD2-CG 3.83Å; F481-R546 HydrophobicContact CE2-CB 4.31Å; F481-R546 HydrophobicContact CE2-CG 4.47Å; F481-R546 HydrophobicContact CG-CG 4.41Å; E484-R546 IonicContact OE1-CZ 2.62Å; E484-R546 IonicContact OE1-NE 3.84Å; E484-R546 IonicContact OE1-NH2 3.2Å; E484-R546 PolarHBondContact OE1-NH2 2.75Å; E484-R546 IonicContact OE2-CZ 2.72Å; E484-R546 IonicContact OE2-NE 3.8Å; E484-R546 PolarHBondContact OE2-NE 3.42Å; E484-R546 IonicContact OE2-NH2 2.65Å; I542-R546 WeakPolarHBondContact O-CB 3.21Å; I542-R546 PolarHBondContact O-N 3.22Å
547	Q	70.3	Confident	83.2	Confident	172 Å²	172	64.2 Å²	64.2	80%	0.804	34%	0.341	S	S	*	.			trans	45.7	60.9	-172.9	-66.2	-177.9	-6.8	0	0	111.8	I543	I543-Q547 PolarHBondContact O-N 3.21Å
548	P	73.1	Confident	83.2	Confident	19 Å²	19	59.5 Å²	59.5	12%	0.123	32%	0.319	C	S	.	.			trans	-57.4	146.7	-171.6	23.1	-33.6	0	0	0	112.7	F481 D552 L553	F481-P548 HydrophobicContact CE1-CB 4.21Å; F481-P548 HydrophobicContact CE2-CB 4.32Å; F481-P548 HydrophobicContact CZ-CB 3.57Å; P548-D552 HydrophobicContact CB-CB 3.9Å; P548-L553 HydrophobicContact CB-CB 4.36Å; P548-L553 HydrophobicContact CG-CB 4.14Å; P548-L553 HydrophobicContact CG-CD1 4.04Å
549	T	75.9	Confident	83.3	Confident	90 Å²	90	58.8 Å²	58.8	55%	0.552	31%	0.313	S	S	*	.			trans	-72.1	172	177.1	72.3	0	0	0	0	111.2	S551 D552 L553	T549-S551 VanDerWaalsContact C-N 3.32Å; T549-S551 PolarHBondContact O-N 3.41Å; T549-D552 PolarHBondContact O-N 2.67Å; T549-D552 PolarHBondContact OG1-OD2 2.77Å; T549-L553 WeakPolarHBondContact O-CB 3.47Å; T549-L553 PolarHBondContact O-N 3.2Å
550	A	73.5	Confident	83.4	Confident	74 Å²	74	60.5 Å²	60.5	61%	0.612	33%	0.325	S	S	*	.	H	α-helix	trans	-57	-34.6	-170.4	0	0	0	0	0	115.3	R554	A550-R554 WeakPolarHBondContact O-CG 3.28Å; A550-R554 PolarHBondContact O-N 3.4Å; A550-R554 PolarHBondContact O-NE 3.08Å
551	S	76	Confident	83.6	Confident	47 Å²	47	60.1 Å²	60.1	33%	0.329	32%	0.317	S	S	.	.	H	α-helix	trans	-68.4	-46	174.1	49.5	0	0	0	0	111.6	T549 R554 L555	T549-S551 VanDerWaalsContact C-N 3.32Å; T549-S551 PolarHBondContact O-N 3.41Å; S551-R554 WeakPolarHBondContact O-CB 3.17Å; S551-R554 PolarHBondContact O-N 2.86Å; S551-L555 PolarHBondContact O-N 3.14Å
552	D	82.8	Confident	84.1	Confident	34 Å²	34	54.4 Å²	54.4	18%	0.182	30%	0.295	C	S	.	.	H	α-helix	trans	-77.4	-34	-170.7	-37.8	-41	0	0	0	110.5	F481 L485 P548 T549 R554 L555 V556	F481-D552 HydrophobicContact CE1-CB 3.47Å; F481-D552 VanDerWaalsContact CE1-CB 3.47Å; F481-D552 WeakPolarHBondContact CE1-OD2 3.44Å; F481-D552 HydrophobicContact CZ-CB 3.46Å; F481-D552 VanDerWaalsContact CZ-CB 3.46Å; L485-D552 HydrophobicContact CD1-CB 4.31Å; P548-D552 HydrophobicContact CB-CB 3.9Å; T549-D552 PolarHBondContact O-N 2.67Å; T549-D552 PolarHBondContact OG1-OD2 2.77Å; D552-R554 VanDerWaalsContact C-N 3.3Å; D552-R554 PolarHBondContact O-N 2.84Å; D552-L555 WeakPolarHBondContact O-CB 3.37Å; D552-L555 PolarHBondContact O-N 2.88Å; D552-V556 VanDerWaalsContact O-CG2 3.3Å; D552-V556 WeakPolarHBondContact O-CG2 2.99Å; D552-V556 PolarHBondContact O-N 3.43Å
553	L	87.5	Confident	84.7	Confident	68 Å²	68	54.2 Å²	54.2	36%	0.356	29%	0.294	S	S	.	.	H	α-helix	trans	-63.4	-37.7	170.9	-177.5	63.1	0	0	0	111.3	I543 P548 T549 V556 M557	I543-L553 HydrophobicContact CD1-CD1 4.31Å; I543-L553 HydrophobicContact CG1-CD1 4.11Å; P548-L553 HydrophobicContact CB-CB 4.36Å; P548-L553 HydrophobicContact CG-CB 4.14Å; P548-L553 HydrophobicContact CG-CD1 4.04Å; T549-L553 WeakPolarHBondContact O-CB 3.47Å; T549-L553 PolarHBondContact O-N 3.2Å; L553-V556 PolarHBondContact O-N 2.93Å; L553-M557 PolarHBondContact O-N 3.25Å
554	R	89.2	Confident	85.2	Confident	65 Å²	65	52 Å²	52	25%	0.245	29%	0.287	C	S	.	.	H	α-helix	trans	-62.7	-45.2	172.4	-80.8	-176	-74.3	-178.7	-2.7	111	A550 S551 D552 V556 M557 V558 Y682 Y683	A550-R554 WeakPolarHBondContact O-CG 3.28Å; A550-R554 PolarHBondContact O-N 3.4Å; A550-R554 PolarHBondContact O-NE 3.08Å; S551-R554 WeakPolarHBondContact O-CB 3.17Å; S551-R554 PolarHBondContact O-N 2.86Å; D552-R554 VanDerWaalsContact C-N 3.3Å; D552-R554 PolarHBondContact O-N 2.84Å; R554-V556 VanDerWaalsContact C-N 3.35Å; R554-V556 PolarHBondContact O-N 2.6Å; R554-M557 PolarHBondContact O-N 2.75Å; R554-V558 VanDerWaalsContact O-CB 3.27Å; R554-V558 WeakPolarHBondContact O-CB 3.31Å; R554-V558 WeakPolarHBondContact O-CG2 3.17Å; R554-V558 PolarHBondContact O-N 2.77Å; R554-Y682 HydrophobicContact CB-CE1 4.26Å; R554-Y682 HydrophobicContact CG-CE1 3.71Å; R554-Y683 HydrophobicContact CB-CD2 4.15Å
555	L	90	Very high	86.1	Confident	18 Å²	18	49 Å²	49	9%	0.094	26%	0.259	C	S	.	.	H	α-helix	trans	-57.4	-47.7	176.1	-177.5	55.8	0	0	0	111.6	L485 S551 D552 V558 I559 M616 Y683	L485-L555 HydrophobicContact CB-CD2 4.45Å; L485-L555 HydrophobicContact CD1-CD2 4.29Å; L485-L555 HydrophobicContact CD2-CD2 4.1Å; L485-L555 HydrophobicContact CD2-CG 4.47Å; S551-L555 PolarHBondContact O-N 3.14Å; D552-L555 WeakPolarHBondContact O-CB 3.37Å; D552-L555 PolarHBondContact O-N 2.88Å; L555-V558 PolarHBondContact O-N 2.88Å; L555-I559 HydrophobicContact CD1-CD1 4.1Å; L555-I559 HydrophobicContact CD1-CG1 4.34Å; L555-I559 HydrophobicContact CG-CD1 4Å; L555-I559 WeakPolarHBondContact O-CG1 3.36Å; L555-I559 PolarHBondContact O-N 2.96Å; L555-M616 HydrophobicContact CD1-CE 3.38Å; L555-Y683 HydrophobicContact CB-CD2 4.11Å; L555-Y683 HydrophobicContact CB-CE2 3.62Å; L555-Y683 HydrophobicContact CD1-CD2 4.44Å; L555-Y683 HydrophobicContact CD1-CE2 4.13Å; L555-Y683 HydrophobicContact CG-CE2 4.36Å
556	V	91.4	Very high	87.2	Confident	1 Å²	1	41.5 Å²	41.5	1%	0.006	23%	0.227	C	C	.	.	H	α-helix	trans	-64	-42.8	-179.9	178.1	0	0	0	0	111.6	L485 C539 I542 I543 D552 L553 R554 I559 S560	L485-V556 HydrophobicContact CD2-CG2 3.59Å; C539-V556 HydrophobicContact CB-CG1 3.64Å; I542-V556 HydrophobicContact CG2-CG2 3.79Å; I543-V556 HydrophobicContact CD1-CG1 3.82Å; I543-V556 HydrophobicContact CG1-CG1 3.86Å; D552-V556 VanDerWaalsContact O-CG2 3.3Å; D552-V556 WeakPolarHBondContact O-CG2 2.99Å; D552-V556 PolarHBondContact O-N 3.43Å; L553-V556 PolarHBondContact O-N 2.93Å; R554-V556 VanDerWaalsContact C-N 3.35Å; R554-V556 PolarHBondContact O-N 2.6Å; V556-I559 PolarHBondContact O-N 3.12Å; V556-S560 WeakPolarHBondContact O-CB 3.42Å; V556-S560 PolarHBondContact O-N 3.45Å
557	M	92.1	Very high	88.5	Confident	69 Å²	69	40.7 Å²	40.7	34%	0.34	23%	0.225	S	C	.	.	H	α-helix	trans	-63.9	-41.5	174.3	-80.6	-155.3	-35.8	0	0	112.4	L553 R554 I559 S560 K561 Y682	L553-M557 PolarHBondContact O-N 3.25Å; R554-M557 PolarHBondContact O-N 2.75Å; M557-I559 VanDerWaalsContact C-N 3.34Å; M557-S560 PolarHBondContact O-N 2.89Å; M557-K561 WeakPolarHBondContact O-CG 2.99Å; M557-K561 PolarHBondContact O-N 3.3Å; M557-Y682 HydrophobicContact CE-CE1 3.53Å; M557-Y682 VanDerWaalsContact CE-OH 3.29Å; M557-Y682 WeakPolarHBondContact CE-OH 3.17Å
558	V	93.5	Very high	89.7	Confident	1 Å²	1	37.8 Å²	37.8	1%	0.006	21%	0.207	C	C	.	.	H	α-helix	trans	-64	-43.4	-179.7	160.7	0	0	0	0	109.8	R554 L555 K561 T562 F613 F679 Y682	R554-V558 VanDerWaalsContact O-CB 3.27Å; R554-V558 WeakPolarHBondContact O-CB 3.31Å; R554-V558 WeakPolarHBondContact O-CG2 3.17Å; R554-V558 PolarHBondContact O-N 2.77Å; L555-V558 PolarHBondContact O-N 2.88Å; V558-K561 PolarHBondContact O-N 3.34Å; V558-T562 WeakPolarHBondContact O-CB 3.3Å; V558-T562 PolarHBondContact O-N 2.88Å; V558-T562 PolarHBondContact O-OG1 3.28Å; V558-F613 HydrophobicContact CG1-CE2 3.67Å; V558-F613 HydrophobicContact CG1-CZ 4.39Å; V558-F679 HydrophobicContact CG1-CB 3.97Å; V558-F679 HydrophobicContact CG2-CB 4.27Å; V558-F679 WeakPolarHBondContact CG2-O 3.33Å; V558-Y682 HydrophobicContact CG2-CD1 3.77Å; V558-Y682 HydrophobicContact CG2-CE1 4.38Å
559	I	94.3	Very high	90.8	Very high	1 Å²	1	36.9 Å²	36.9	1%	0.005	20%	0.201	C	C	.	.	H	α-helix	trans	-57.2	-52.8	171.1	-73	166.8	0	0	0	111.7	I488 V492 I535 L555 V556 M557 K561 T562 I563 F613	I488-I559 HydrophobicContact CG2-CD1 4.01Å; I488-I559 HydrophobicContact CG2-CG2 3.62Å; V492-I559 HydrophobicContact CG2-CB 4.46Å; V492-I559 HydrophobicContact CG2-CG1 4.42Å; V492-I559 HydrophobicContact CG2-CG2 3.52Å; I535-I559 HydrophobicContact CG2-CG2 3.94Å; L555-I559 HydrophobicContact CD1-CD1 4.1Å; L555-I559 HydrophobicContact CD1-CG1 4.34Å; L555-I559 HydrophobicContact CG-CD1 4Å; L555-I559 WeakPolarHBondContact O-CG1 3.36Å; L555-I559 PolarHBondContact O-N 2.96Å; V556-I559 PolarHBondContact O-N 3.12Å; M557-I559 VanDerWaalsContact C-N 3.34Å; I559-K561 VanDerWaalsContact C-N 3.25Å; I559-K561 PolarHBondContact O-N 3.31Å; I559-T562 PolarHBondContact O-N 3.13Å; I559-T562 VanDerWaalsContact O-N 3.12Å; I559-I563 PolarHBondContact O-N 2.65Å; I559-F613 HydrophobicContact CG1-CZ 3.95Å
560	S	94.9	Very high	91.6	Very high	38 Å²	38	32.6 Å²	32.6	27%	0.266	18%	0.175	S	C	.	.	H	α-helix	trans	-60.3	-34.6	-178.2	175.2	0	0	0	0	112.2	D536 V556 M557 I563	D536-S560 PolarHBondContact OD1-OG 3.05Å; V556-S560 WeakPolarHBondContact O-CB 3.42Å; V556-S560 PolarHBondContact O-N 3.45Å; M557-S560 PolarHBondContact O-N 2.89Å; S560-I563 WeakPolarHBondContact O-CG1 3.29Å
561	K	95.5	Very high	92.5	Very high	77 Å²	77	31.6 Å²	31.6	34%	0.335	16%	0.159	S	C	.	.	H	α-helix	trans	-74.4	-39.5	173.4	-70.9	-173.8	174.4	-163.3	0	113.1	M557 V558 I559 A564 E565 F679	M557-K561 WeakPolarHBondContact O-CG 2.99Å; M557-K561 PolarHBondContact O-N 3.3Å; V558-K561 PolarHBondContact O-N 3.34Å; I559-K561 VanDerWaalsContact C-N 3.25Å; I559-K561 PolarHBondContact O-N 3.31Å; K561-A564 PolarHBondContact O-N 3.38Å; K561-E565 PolarHBondContact O-N 3.13Å; K561-F679 HydrophobicContact CB-CD2 3.84Å; K561-F679 HydrophobicContact CB-CE1 4.32Å; K561-F679 HydrophobicContact CB-CE2 3.58Å; K561-F679 HydrophobicContact CB-CG 4.34Å; K561-F679 HydrophobicContact CB-CZ 3.84Å; K561-F679 HydrophobicContact CD-CD1 4.26Å; K561-F679 HydrophobicContact CD-CE1 3.98Å; K561-F679 HydrophobicContact CD-CZ 4.21Å
562	T	96.4	Very high	93.4	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-64.1	-41	178.9	-64.9	0	0	0	0	111.7	V492 V558 I559 A564 E565 L566 F613 I676	V492-T562 HydrophobicContact CG1-CG2 4.2Å; V558-T562 WeakPolarHBondContact O-CB 3.3Å; V558-T562 PolarHBondContact O-N 2.88Å; V558-T562 PolarHBondContact O-OG1 3.28Å; I559-T562 PolarHBondContact O-N 3.13Å; I559-T562 VanDerWaalsContact O-N 3.12Å; T562-A564 VanDerWaalsContact C-N 3.3Å; T562-A564 PolarHBondContact O-N 2.83Å; T562-E565 PolarHBondContact O-N 3.09Å; T562-E565 VanDerWaalsContact O-N 3.14Å; T562-L566 HydrophobicContact CG2-CD1 4.14Å; T562-L566 HydrophobicContact CG2-CG 4.27Å; T562-L566 WeakPolarHBondContact O-CG 3.24Å; T562-L566 PolarHBondContact O-N 3.47Å; T562-F613 HydrophobicContact CG2-CD2 4.29Å; T562-F613 HydrophobicContact CG2-CE2 4.01Å; T562-F613 HydrophobicContact CG2-CZ 4.29Å; T562-F613 VanDerWaalsContact OG1-CE2 3.29Å; T562-F613 WeakPolarHBondContact OG1-CE2 3.33Å; T562-I676 HydrophobicContact CG2-CD1 4.21Å; T562-I676 HydrophobicContact CG2-CG1 4.19Å; T562-I676 HydrophobicContact CG2-CG2 4.14Å
563	I	96.3	Very high	93.8	Very high	1 Å²	1	28 Å²	28	1%	0.005	14%	0.137	C	C	.	.	H	α-helix	trans	-62.7	-36.8	178.7	57.7	173.4	0	0	0	112.8	V492 M495 E532 I535 D536 I559 S560 E565 L566 E567	V492-I563 HydrophobicContact CG2-CG2 3.82Å; M495-I563 WeakPolarHBondContact CE-O 3.36Å; M495-I563 HydrophobicContact SD-CB 4.17Å; M495-I563 HydrophobicContact SD-CG2 4.1Å; E532-I563 HydrophobicContact CG-CD1 4.37Å; I535-I563 HydrophobicContact CB-CD1 4.04Å; I535-I563 HydrophobicContact CB-CG2 4.17Å; I535-I563 HydrophobicContact CD1-CG2 3.93Å; I535-I563 HydrophobicContact CG2-CD1 3.98Å; I535-I563 HydrophobicContact CG2-CG2 3.74Å; D536-I563 HydrophobicContact CB-CD1 3.78Å; I559-I563 PolarHBondContact O-N 2.65Å; S560-I563 WeakPolarHBondContact O-CG1 3.29Å; I563-E565 VanDerWaalsContact C-N 3.3Å; I563-E565 PolarHBondContact O-N 3.33Å; I563-L566 PolarHBondContact O-N 3.43Å; I563-E567 PolarHBondContact O-N 2.72Å
564	A	96.1	Very high	93.9	Very high	28 Å²	28	26.1 Å²	26.1	23%	0.231	13%	0.127	C	C	.	.	H	α-helix	trans	-66.9	-34.3	176.6	0	0	0	0	0	111.3	K561 T562 R568	K561-A564 PolarHBondContact O-N 3.38Å; T562-A564 VanDerWaalsContact C-N 3.3Å; T562-A564 PolarHBondContact O-N 2.83Å; A564-R568 WeakPolarHBondContact O-CD 3.26Å; A564-R568 WeakPolarHBondContact O-CG 3.06Å; A564-R568 PolarHBondContact O-N 3.28Å
565	E	96.7	Very high	93.9	Very high	14 Å²	14	26.6 Å²	26.6	7%	0.065	13%	0.131	C	C	.	.	H	α-helix	trans	-73.4	-38	173.3	-64.7	-56.2	126.2	0	0	111.5	K561 T562 I563 R568 I569 R672 N675 I676 F679	K561-E565 PolarHBondContact O-N 3.13Å; T562-E565 PolarHBondContact O-N 3.09Å; T562-E565 VanDerWaalsContact O-N 3.14Å; I563-E565 VanDerWaalsContact C-N 3.3Å; I563-E565 PolarHBondContact O-N 3.33Å; E565-R568 PolarHBondContact O-N 3.43Å; E565-R568 IonicContact OE1-CZ 2.89Å; E565-R568 IonicContact OE1-NH1 3.61Å; E565-R568 PolarHBondContact OE1-NH1 2.87Å; E565-I569 VanDerWaalsContact O-CG1 3.25Å; E565-I569 WeakPolarHBondContact O-CG1 3.34Å; E565-I569 PolarHBondContact O-N 3.21Å; E565-R672 IonicContact OE1-NH1 2.84Å; E565-R672 WeakPolarHBondContact OE2-CG 3.29Å; E565-R672 IonicContact OE2-CZ 2.77Å; E565-R672 IonicContact OE2-NH1 3.36Å; E565-R672 PolarHBondContact OE2-NH1 3.26Å; E565-N675 HydrophobicContact CG-CB 4.18Å; E565-N675 PolarHBondContact OE2-ND2 3.48Å; E565-I676 HydrophobicContact CB-CD1 4.34Å; E565-I676 HydrophobicContact CB-CG1 4.15Å; E565-F679 HydrophobicContact CG-CE2 3.91Å; E565-F679 HydrophobicContact CG-CZ 4.34Å
566	L	96.9	Very high	94	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-63.1	-41.9	174.8	-71	176	0	0	0	112.9	V492 M495 T562 I563 R568 I569 G570 L606 L610 I676	V492-L566 HydrophobicContact CG1-CD1 4.02Å; M495-L566 HydrophobicContact CE-CB 3.97Å; M495-L566 HydrophobicContact CG-CD1 4.5Å; M495-L566 HydrophobicContact SD-CB 4.3Å; M495-L566 HydrophobicContact SD-CD1 4.47Å; T562-L566 HydrophobicContact CG2-CD1 4.14Å; T562-L566 HydrophobicContact CG2-CG 4.27Å; T562-L566 WeakPolarHBondContact O-CG 3.24Å; T562-L566 PolarHBondContact O-N 3.47Å; I563-L566 PolarHBondContact O-N 3.43Å; L566-R568 VanDerWaalsContact C-N 3.34Å; L566-I569 PolarHBondContact O-N 3.02Å; L566-G570 PolarHBondContact O-N 2.88Å; L566-L606 HydrophobicContact CD2-CD1 4.02Å; L566-L610 HydrophobicContact CD1-CD2 4.38Å; L566-L610 HydrophobicContact CD2-CD2 4.06Å; L566-I676 HydrophobicContact CD2-CD1 4.29Å
567	E	96	Very high	94	Very high	37 Å²	37	25.7 Å²	25.7	17%	0.173	13%	0.126	C	C	.	.	H	α-helix	trans	-57.6	-50.4	173.5	179.4	-91.3	177.7	0	0	110.2	M495 E532 I563 I569 G570 D571	M495-E567 HydrophobicContact CE-CB 3.95Å; E532-E567 HydrophobicContact CG-CB 4.32Å; I563-E567 PolarHBondContact O-N 2.72Å; E567-I569 PolarHBondContact O-N 2.97Å; E567-I569 VanDerWaalsContact O-N 3.17Å; E567-G570 WeakPolarHBondContact O-CA 3.42Å; E567-G570 PolarHBondContact O-N 3.25Å; E567-D571 WeakPolarHBondContact O-CB 3.47Å; E567-D571 PolarHBondContact O-N 2.84Å
568	R	95.6	Very high	93.6	Very high	111 Å²	111	29.6 Å²	29.6	42%	0.419	14%	0.137	S	C	.	.	H	α-helix	trans	-66.7	-20.8	-179.6	-64	171	178.2	-175.2	-8.9	114	A564 E565 L566 R672	A564-R568 WeakPolarHBondContact O-CD 3.26Å; A564-R568 WeakPolarHBondContact O-CG 3.06Å; A564-R568 PolarHBondContact O-N 3.28Å; E565-R568 PolarHBondContact O-N 3.43Å; E565-R568 IonicContact OE1-CZ 2.89Å; E565-R568 IonicContact OE1-NH1 3.61Å; E565-R568 PolarHBondContact OE1-NH1 2.87Å; L566-R568 VanDerWaalsContact C-N 3.34Å; R568-R672 VanDerWaalsContact CD-CZ 3.43Å; R568-R672 PolarHBondContact O-NE 3.34Å
569	I	95.6	Very high	93.2	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-75.8	-44.8	168.7	-68.8	173.3	0	0	0	109.9	V499 L503 E565 L566 E567 D571 V572 L606 I669 R672 I676	V499-I569 HydrophobicContact CG1-CB 3.96Å; V499-I569 HydrophobicContact CG1-CG2 3.46Å; V499-I569 VanDerWaalsContact CG1-CG2 3.46Å; L503-I569 HydrophobicContact CD1-CG2 3.43Å; L503-I569 VanDerWaalsContact CD1-CG2 3.43Å; L503-I569 HydrophobicContact CG-CG2 4.46Å; E565-I569 VanDerWaalsContact O-CG1 3.25Å; E565-I569 WeakPolarHBondContact O-CG1 3.34Å; E565-I569 PolarHBondContact O-N 3.21Å; L566-I569 PolarHBondContact O-N 3.02Å; E567-I569 PolarHBondContact O-N 2.97Å; E567-I569 VanDerWaalsContact O-N 3.17Å; I569-D571 PolarHBondContact O-N 3.26Å; I569-V572 VanDerWaalsContact O-CB 3.25Å; I569-V572 WeakPolarHBondContact O-CB 3.4Å; I569-V572 PolarHBondContact O-N 3.2Å; I569-L606 HydrophobicContact CD1-CD1 3.83Å; I569-L606 HydrophobicContact CG2-CD2 4Å; I569-I669 HydrophobicContact CD1-CG2 4.43Å; I569-I669 HydrophobicContact CG1-CG2 4.44Å; I569-I669 HydrophobicContact CG2-CG1 4.37Å; I569-I669 HydrophobicContact CG2-CG2 4.05Å; I569-R672 HydrophobicContact CD1-CB 3.75Å; I569-R672 HydrophobicContact CG1-CB 3.7Å; I569-R672 VanDerWaalsContact CG1-CD 3.47Å; I569-R672 HydrophobicContact CG1-CG 4.21Å; I569-I676 HydrophobicContact CD1-CD1 4.49Å
570	G	92.8	Very high	92.7	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-55.1	-40.1	173.1	0	0	0	0	0	112.1	L566 E567 V572 A573	L566-G570 PolarHBondContact O-N 2.88Å; E567-G570 WeakPolarHBondContact O-CA 3.42Å; E567-G570 PolarHBondContact O-N 3.25Å; G570-V572 PolarHBondContact O-N 3.41Å; G570-A573 WeakPolarHBondContact O-CA 3.24Å; G570-A573 WeakPolarHBondContact O-CB 3.36Å; G570-A573 PolarHBondContact O-N 3.44Å
571	D	93.4	Very high	92.1	Very high	54 Å²	54	31.8 Å²	31.8	29%	0.289	15%	0.146	S	C	.	.	H	α-helix	trans	-61.4	-15	175.6	-146.6	48.7	0	0	0	114.2	E567 I569 K575	E567-D571 WeakPolarHBondContact O-CB 3.47Å; E567-D571 PolarHBondContact O-N 2.84Å; I569-D571 PolarHBondContact O-N 3.26Å; D571-K575 PolarHBondContact O-NZ 3.47Å; D571-K575 IonicContact OD2-NZ 2.95Å; D571-K575 PolarHBondContact OD2-NZ 2.91Å
572	V	93.8	Very high	91.4	Very high	4 Å²	4	31.7 Å²	31.7	2%	0.024	15%	0.147	C	C	.	.	H	α-helix	trans	-80.7	-31.9	170.9	173.8	0	0	0	0	111	L503 I569 G570 D574 K575 I576 S665 I669	L503-V572 HydrophobicContact CD2-CB 4.5Å; L503-V572 HydrophobicContact CD2-CG1 4.32Å; I569-V572 VanDerWaalsContact O-CB 3.25Å; I569-V572 WeakPolarHBondContact O-CB 3.4Å; I569-V572 PolarHBondContact O-N 3.2Å; G570-V572 PolarHBondContact O-N 3.41Å; V572-D574 VanDerWaalsContact C-N 3.34Å; V572-D574 PolarHBondContact O-N 3.18Å; V572-K575 WeakPolarHBondContact O-CA 3.35Å; V572-K575 WeakPolarHBondContact O-CB 2.88Å; V572-K575 PolarHBondContact O-N 3.09Å; V572-I576 HydrophobicContact CG1-CD1 3.81Å; V572-I576 HydrophobicContact CG1-CG1 4.08Å; V572-I576 WeakPolarHBondContact O-CG1 3.42Å; V572-I576 PolarHBondContact O-N 2.92Å; V572-S665 VanDerWaalsContact CG1-O 3.26Å; V572-S665 WeakPolarHBondContact CG1-O 3.37Å; V572-S665 WeakPolarHBondContact CG2-O 3.48Å; V572-I669 HydrophobicContact CB-CD1 4.34Å; V572-I669 HydrophobicContact CB-CG1 4.21Å; V572-I669 HydrophobicContact CG1-CD1 3.8Å; V572-I669 HydrophobicContact CG1-CG1 3.99Å; V572-I669 HydrophobicContact CG2-CG1 4.15Å
573	A	92.6	Very high	90.2	Very high	1 Å²	1	41.3 Å²	41.3	1%	0.008	19%	0.189	C	C	.	.	H	α-helix	trans	-59.7	-42.2	177.8	0	0	0	0	0	111.5	Q502 L503 A506 V521 G570 K575 I576 C577	Q502-A573 HydrophobicContact CB-CB 4.23Å; L503-A573 HydrophobicContact CD2-CB 4.36Å; A506-A573 HydrophobicContact CB-CB 4.08Å; V521-A573 HydrophobicContact CG1-CB 3.95Å; G570-A573 WeakPolarHBondContact O-CA 3.24Å; G570-A573 WeakPolarHBondContact O-CB 3.36Å; G570-A573 PolarHBondContact O-N 3.44Å; A573-K575 VanDerWaalsContact C-N 3.31Å; A573-K575 PolarHBondContact O-N 2.75Å; A573-I576 PolarHBondContact O-N 2.68Å; A573-C577 WeakPolarHBondContact O-CB 3.32Å; A573-C577 PolarHBondContact O-N 3.2Å; A573-C577 PolarHBondContact O-SG 2.9Å
574	D	89.3	Confident	89.1	Confident	29 Å²	29	42 Å²	42	16%	0.155	19%	0.191	C	C	.	.	H	α-helix	trans	-58.1	-43.5	172.6	-179.5	33.5	0	0	0	111.3	I522 V572 I576 C577 R578	I522-D574 WeakPolarHBondContact CG1-OD1 3.38Å; V572-D574 VanDerWaalsContact C-N 3.34Å; V572-D574 PolarHBondContact O-N 3.18Å; D574-I576 PolarHBondContact O-N 3.2Å; D574-C577 PolarHBondContact O-N 3.34Å; D574-R578 WeakPolarHBondContact O-CG 3.35Å; D574-R578 PolarHBondContact O-N 3.1Å; D574-R578 IonicContact OD1-CZ 3.94Å; D574-R578 IonicContact OD1-NE 3.36Å; D574-R578 PolarHBondContact OD1-NE 3.04Å; D574-R578 IonicContact OD1-NH2 3.25Å; D574-R578 IonicContact OD2-CZ 2.88Å; D574-R578 IonicContact OD2-NE 3.52Å; D574-R578 PolarHBondContact OD2-NE 3.43Å; D574-R578 IonicContact OD2-NH2 2.65Å; D574-R578 PolarHBondContact OD2-NH2 3.47Å
575	K	89.2	Confident	87.8	Confident	75 Å²	75	43.2 Å²	43.2	33%	0.326	20%	0.199	S	C	.	.	H	α-helix	trans	-64.4	-39.3	179.2	-63.9	171.6	-171.1	110.5	0	112	D571 V572 A573 R578 T579	D571-K575 PolarHBondContact O-NZ 3.47Å; D571-K575 IonicContact OD2-NZ 2.95Å; D571-K575 PolarHBondContact OD2-NZ 2.91Å; V572-K575 WeakPolarHBondContact O-CA 3.35Å; V572-K575 WeakPolarHBondContact O-CB 2.88Å; V572-K575 PolarHBondContact O-N 3.09Å; A573-K575 VanDerWaalsContact C-N 3.31Å; A573-K575 PolarHBondContact O-N 2.75Å; K575-R578 PolarHBondContact O-N 3.48Å; K575-T579 PolarHBondContact O-N 3.13Å; K575-T579 PolarHBondContact O-OG1 3Å
576	I	92.3	Very high	86.6	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-66	-45.4	174.1	-64.3	166.8	0	0	0	110.1	L503 A506 I507 M510 V572 A573 D574 R578 T579 A580 I666	L503-I576 HydrophobicContact CD2-CD1 3.78Å; A506-I576 HydrophobicContact CB-CB 3.97Å; A506-I576 HydrophobicContact CB-CD1 4.49Å; A506-I576 HydrophobicContact CB-CG2 3.81Å; A506-I576 WeakPolarHBondContact O-CG2 3.05Å; I507-I576 HydrophobicContact CD1-CD1 3.97Å; I507-I576 HydrophobicContact CD1-CG2 4.26Å; I507-I576 HydrophobicContact CG1-CD1 4.41Å; M510-I576 HydrophobicContact CB-CG2 3.92Å; M510-I576 HydrophobicContact CE-CG2 4.45Å; M510-I576 HydrophobicContact SD-CG2 4.01Å; V572-I576 HydrophobicContact CG1-CD1 3.81Å; V572-I576 HydrophobicContact CG1-CG1 4.08Å; V572-I576 WeakPolarHBondContact O-CG1 3.42Å; V572-I576 PolarHBondContact O-N 2.92Å; A573-I576 PolarHBondContact O-N 2.68Å; D574-I576 PolarHBondContact O-N 3.2Å; I576-R578 VanDerWaalsContact C-N 3.29Å; I576-R578 PolarHBondContact O-N 3.46Å; I576-T579 WeakPolarHBondContact O-CA 3.32Å; I576-T579 VanDerWaalsContact O-CB 3.22Å; I576-T579 WeakPolarHBondContact O-CB 3.46Å; I576-T579 PolarHBondContact O-N 3.45Å; I576-A580 PolarHBondContact O-N 3.24Å; I576-A580 VanDerWaalsContact O-N 3.16Å; I576-I666 HydrophobicContact CD1-CD1 4.43Å; I576-I666 HydrophobicContact CD1-CG1 3.85Å; I576-I666 HydrophobicContact CG1-CD1 4.46Å; I576-I666 HydrophobicContact CG1-CG1 4.04Å
577	C	90.8	Very high	85.3	Confident	0 Å²	0	58 Å²	58	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-62.1	-33.5	178.6	-71.7	0	0	0	0	113	A518 I522 A573 D574 T579 A580 L581	A518-C577 HydrophobicContact CB-CB 3.95Å; I522-C577 HydrophobicContact CD1-CB 3.81Å; I522-C577 HydrophobicContact CG1-CB 3.73Å; A573-C577 WeakPolarHBondContact O-CB 3.32Å; A573-C577 PolarHBondContact O-N 3.2Å; A573-C577 PolarHBondContact O-SG 2.9Å; D574-C577 PolarHBondContact O-N 3.34Å; C577-T579 PolarHBondContact O-N 3.47Å; C577-A580 WeakPolarHBondContact O-CB 3.41Å; C577-A580 PolarHBondContact O-N 3.4Å; C577-A580 VanDerWaalsContact O-N 3.12Å; C577-L581 WeakPolarHBondContact O-CG 3.14Å; C577-L581 PolarHBondContact O-N 3.27Å; C577-L581 VanDerWaalsContact O-N 3.13Å
578	R	84	Confident	84.2	Confident	150 Å²	150	56.5 Å²	56.5	57%	0.566	26%	0.261	S	S	*	.	H	α-helix	trans	-61.3	-34.8	171.6	-71.6	169.8	-171	-93.4	-1.2	112.5	D574 K575 I576 L581 E582	D574-R578 WeakPolarHBondContact O-CG 3.35Å; D574-R578 PolarHBondContact O-N 3.1Å; D574-R578 IonicContact OD1-CZ 3.94Å; D574-R578 IonicContact OD1-NE 3.36Å; D574-R578 PolarHBondContact OD1-NE 3.04Å; D574-R578 IonicContact OD1-NH2 3.25Å; D574-R578 IonicContact OD2-CZ 2.88Å; D574-R578 IonicContact OD2-NE 3.52Å; D574-R578 PolarHBondContact OD2-NE 3.43Å; D574-R578 IonicContact OD2-NH2 2.65Å; D574-R578 PolarHBondContact OD2-NH2 3.47Å; K575-R578 PolarHBondContact O-N 3.48Å; I576-R578 VanDerWaalsContact C-N 3.29Å; I576-R578 PolarHBondContact O-N 3.46Å; R578-L581 PolarHBondContact O-N 3.41Å; R578-E582 PolarHBondContact O-N 3.11Å
579	T	84.5	Confident	83.3	Confident	5 Å²	5	54.8 Å²	54.8	3%	0.031	26%	0.257	C	S	.	.	H	α-helix	trans	-68	-37	174.2	-50.5	0	0	0	0	111.1	M510 K575 I576 C577 L581 E582 F584 T658 C662	M510-T579 HydrophobicContact CG-CG2 4.35Å; M510-T579 HydrophobicContact SD-CG2 4.23Å; K575-T579 PolarHBondContact O-N 3.13Å; K575-T579 PolarHBondContact O-OG1 3Å; I576-T579 WeakPolarHBondContact O-CA 3.32Å; I576-T579 VanDerWaalsContact O-CB 3.22Å; I576-T579 WeakPolarHBondContact O-CB 3.46Å; I576-T579 PolarHBondContact O-N 3.45Å; C577-T579 PolarHBondContact O-N 3.47Å; T579-L581 VanDerWaalsContact C-N 3.25Å; T579-L581 PolarHBondContact O-N 2.87Å; T579-E582 PolarHBondContact O-N 3.43Å; T579-F584 HydrophobicContact CG2-CE2 3.71Å; T579-F584 HydrophobicContact CG2-CZ 4.13Å; T579-T658 HydrophobicContact CG2-CG2 4.14Å; T579-C662 HydrophobicContact CG2-CB 4.14Å; T579-C662 WeakPolarHBondContact OG1-CB 3.35Å
580	A	83.2	Confident	82.8	Confident	4 Å²	4	57.7 Å²	57.7	3%	0.033	28%	0.276	C	S	.	.	H	α-helix	trans	-65.1	-26.6	174.5	0	0	0	0	0	113.7	A509 M510 A518 I576 C577	A509-A580 HydrophobicContact CB-CB 4.29Å; M510-A580 HydrophobicContact CB-CB 4.23Å; A518-A580 HydrophobicContact CB-CB 3.98Å; I576-A580 PolarHBondContact O-N 3.24Å; I576-A580 VanDerWaalsContact O-N 3.16Å; C577-A580 WeakPolarHBondContact O-CB 3.41Å; C577-A580 PolarHBondContact O-N 3.4Å; C577-A580 VanDerWaalsContact O-N 3.12Å
581	L	83	Confident	82.3	Confident	77 Å²	77	57.9 Å²	57.9	40%	0.403	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-10.6	178	-66.2	171.6	0	0	0	113.2	A518 I522 C577 R578 T579	A518-L581 HydrophobicContact CB-CD2 4.29Å; A518-L581 HydrophobicContact CB-CG 4.29Å; I522-L581 HydrophobicContact CD1-CD1 4.16Å; C577-L581 WeakPolarHBondContact O-CG 3.14Å; C577-L581 PolarHBondContact O-N 3.27Å; C577-L581 VanDerWaalsContact O-N 3.13Å; R578-L581 PolarHBondContact O-N 3.41Å; T579-L581 VanDerWaalsContact C-N 3.25Å; T579-L581 PolarHBondContact O-N 2.87Å
582	E	80	Confident	81.9	Confident	76 Å²	76	55.4 Å²	55.4	36%	0.355	26%	0.264	S	S	.	.	S	Bend	trans	-82	144.6	172.3	-82.4	-160.5	168.7	0	0	112.4	R578 T579 F584 T658	R578-E582 PolarHBondContact O-N 3.11Å; T579-E582 PolarHBondContact O-N 3.43Å; E582-F584 HydrophobicContact CB-CD2 4.44Å; E582-F584 HydrophobicContact CB-CE2 4.22Å; E582-F584 PolarHBondContact O-N 2.87Å; E582-T658 HydrophobicContact CG-CG2 4.34Å; E582-T658 PolarHBondContact OE1-OG1 3Å; E582-T658 WeakPolarHBondContact OE2-CB 3.45Å; E582-T658 VanDerWaalsContact OE2-CG2 3.28Å; E582-T658 WeakPolarHBondContact OE2-CG2 3.49Å; E582-T658 PolarHBondContact OE2-OG1 2.7Å
583	K	71.8	Confident	81.6	Confident	202 Å²	202	58.9 Å²	58.9	88%	0.878	29%	0.285	S	S	*	.			trans	-81.7	95.3	175.1	-74.6	-173.2	176.3	-177	0	110.7
584	F	73.8	Confident	81.5	Confident	14 Å²	14	60.1 Å²	60.1	6%	0.061	29%	0.294	C	S	.	.			trans	-78.9	131.9	166	-79.1	-87.4	0	0	0	110.9	T579 E582 H588 L592 S655 A659	T579-F584 HydrophobicContact CG2-CE2 3.71Å; T579-F584 HydrophobicContact CG2-CZ 4.13Å; E582-F584 HydrophobicContact CB-CD2 4.44Å; E582-F584 HydrophobicContact CB-CE2 4.22Å; E582-F584 PolarHBondContact O-N 2.87Å; F584-H588 HydrophobicContact CB-CB 4.29Å; F584-H588 HydrophobicContact CD1-CB 3.59Å; F584-H588 HydrophobicContact CE1-CB 4.45Å; F584-H588 HydrophobicContact CG-CB 4.4Å; F584-L592 HydrophobicContact CD2-CD2 4.34Å; F584-L592 HydrophobicContact CE2-CD2 4.43Å; F584-S655 VanDerWaalsContact CE1-O 3.3Å; F584-S655 WeakPolarHBondContact CE1-O 3.46Å; F584-S655 VanDerWaalsContact CZ-O 3.27Å; F584-S655 WeakPolarHBondContact CZ-O 3.38Å; F584-A659 HydrophobicContact CE1-CB 4.23Å; F584-A659 HydrophobicContact CZ-CB 4.05Å
585	S	69.1	Low	81.7	Confident	55 Å²	55	58.8 Å²	58.8	39%	0.385	29%	0.286	S	S	.	.			trans	-71.9	159.6	171.6	75.5	0	0	0	0	111.2	Q587 H588	S585-Q587 PolarHBondContact O-N 2.83Å; S585-H588 WeakPolarHBondContact O-CB 3.4Å; S585-H588 PolarHBondContact O-N 2.92Å; S585-H588 PolarHBondContact OG-CE1 2.89Å; S585-H588 PolarHBondContact OG-ND1 2.73Å
586	Q	70.9	Confident	81.9	Confident	179 Å²	179	56.5 Å²	56.5	84%	0.836	28%	0.277	S	S	*	.	G	3₁₀ helix	trans	-53.8	-27.9	179.3	-85.5	-168.6	-15.7	0	0	114.5	H588 Q589	Q586-H588 PolarHBondContact O-N 2.92Å; Q586-Q589 PolarHBondContact O-N 3.11Å
587	Q	69	Low	82	Confident	144 Å²	144	59.4 Å²	59.4	67%	0.673	30%	0.297	S	S	*	.	G	3₁₀ helix	trans	-66.5	-19	177.2	-78.9	177.5	-35.3	0	0	113.2	S585	S585-Q587 PolarHBondContact O-N 2.83Å
588	H	74.3	Confident	82.2	Confident	7 Å²	7	59.4 Å²	59.4	3%	0.032	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	-100.4	-2.3	-177.4	-55.8	108.4	0	0	0	113.7	F584 S585 Q586 P590 L591 T652	F584-H588 HydrophobicContact CB-CB 4.29Å; F584-H588 HydrophobicContact CD1-CB 3.59Å; F584-H588 HydrophobicContact CE1-CB 4.45Å; F584-H588 HydrophobicContact CG-CB 4.4Å; S585-H588 WeakPolarHBondContact O-CB 3.4Å; S585-H588 PolarHBondContact O-N 2.92Å; S585-H588 PolarHBondContact OG-CE1 2.89Å; S585-H588 PolarHBondContact OG-ND1 2.73Å; Q586-H588 PolarHBondContact O-N 2.92Å; H588-P590 VanDerWaalsContact C-N 3.27Å; H588-L591 HydrophobicContact CB-CD1 4.15Å; H588-L591 VanDerWaalsContact O-CB 3.28Å; H588-L591 WeakPolarHBondContact O-CB 3.27Å; H588-L591 PolarHBondContact O-N 3.43Å; H588-T652 WeakPolarHBondContact NE2-CB 3.49Å; H588-T652 WeakPolarHBondContact NE2-CG2 3.43Å
589	Q	76.8	Confident	82.7	Confident	74 Å²	74	52.3 Å²	52.3	35%	0.346	27%	0.271	S	S	.	.	H	α-helix	trans	-50.3	-39.4	175.5	-123.2	80.7	14.6	0	0	113.8	Q586 L591 L592 V593	Q586-Q589 PolarHBondContact O-N 3.11Å; Q589-L591 PolarHBondContact O-N 3.02Å; Q589-L592 PolarHBondContact O-N 2.76Å; Q589-L592 VanDerWaalsContact O-N 3.11Å; Q589-V593 PolarHBondContact O-N 3.03Å
590	P	83.3	Confident	83.3	Confident	62 Å²	62	59.6 Å²	59.6	40%	0.403	30%	0.298	S	S	.	.	H	α-helix	trans	-60.8	-27.3	176.7	-24.5	34.9	0	0	0	114.4	H588 V593 S594	H588-P590 VanDerWaalsContact C-N 3.27Å; P590-V593 PolarHBondContact O-N 2.73Å; P590-S594 PolarHBondContact O-N 2.73Å; P590-S594 PolarHBondContact O-OG 3.09Å
591	L	82.8	Confident	83.9	Confident	3 Å²	3	61.6 Å²	61.6	2%	0.016	31%	0.306	C	S	.	.	H	α-helix	trans	-68.6	-41.4	175.6	-65.5	172.2	0	0	0	110.9	H588 Q589 V593 S594 L595 L642 Y645 V656	H588-L591 HydrophobicContact CB-CD1 4.15Å; H588-L591 VanDerWaalsContact O-CB 3.28Å; H588-L591 WeakPolarHBondContact O-CB 3.27Å; H588-L591 PolarHBondContact O-N 3.43Å; Q589-L591 PolarHBondContact O-N 3.02Å; L591-V593 VanDerWaalsContact C-N 3.29Å; L591-V593 PolarHBondContact O-N 3.12Å; L591-S594 PolarHBondContact O-N 3.37Å; L591-L595 WeakPolarHBondContact O-CG 3.24Å; L591-L595 PolarHBondContact O-N 2.85Å; L591-L642 HydrophobicContact CD1-CD2 3.8Å; L591-L642 HydrophobicContact CD2-CD2 3.44Å; L591-L642 VanDerWaalsContact CD2-CD2 3.44Å; L591-L642 HydrophobicContact CD2-CG 4.12Å; L591-L642 HydrophobicContact CG-CD2 4.11Å; L591-Y645 HydrophobicContact CD1-CD2 4.14Å; L591-Y645 HydrophobicContact CD1-CE2 4.36Å; L591-Y645 HydrophobicContact CD1-CG 4.47Å; L591-Y645 HydrophobicContact CD2-CD2 3.64Å; L591-Y645 HydrophobicContact CD2-CE2 3.57Å; L591-Y645 HydrophobicContact CG-CD2 4.14Å; L591-Y645 HydrophobicContact CG-CE2 3.94Å; L591-V656 HydrophobicContact CD1-CG2 4.41Å
592	L	84.7	Confident	84.5	Confident	2 Å²	2	57.9 Å²	57.9	1%	0.01	29%	0.287	C	S	.	.	H	α-helix	trans	-64.5	-34.8	177.4	-61.3	175.4	0	0	0	111.7	M510 Q513 F584 Q589 L595 E596	M510-L592 HydrophobicContact CG-CD2 3.88Å; M510-L592 HydrophobicContact SD-CD2 4.46Å; Q513-L592 HydrophobicContact CG-CD1 4.28Å; F584-L592 HydrophobicContact CD2-CD2 4.34Å; F584-L592 HydrophobicContact CE2-CD2 4.43Å; Q589-L592 PolarHBondContact O-N 2.76Å; Q589-L592 VanDerWaalsContact O-N 3.11Å; L592-L595 HydrophobicContact CD2-CD1 4.43Å; L592-L595 PolarHBondContact O-N 3.13Å; L592-E596 WeakPolarHBondContact O-CB 3.39Å; L592-E596 PolarHBondContact O-N 3.12Å
593	V	88.9	Confident	85.3	Confident	78 Å²	78	55.3 Å²	55.3	47%	0.473	28%	0.275	S	S	.	.	H	α-helix	trans	-64.2	-41.8	174.3	177.4	0	0	0	0	111.3	Q589 P590 L591 E596 S597	Q589-V593 PolarHBondContact O-N 3.03Å; P590-V593 PolarHBondContact O-N 2.73Å; L591-V593 VanDerWaalsContact C-N 3.29Å; L591-V593 PolarHBondContact O-N 3.12Å; V593-E596 PolarHBondContact O-N 2.79Å; V593-S597 PolarHBondContact O-N 2.93Å
594	S	90.4	Very high	86.5	Confident	26 Å²	26	50.5 Å²	50.5	18%	0.182	26%	0.256	C	S	.	.	H	α-helix	trans	-69.5	-39.3	179.5	-49.7	0	0	0	0	111.2	P590 L591 E596 S597 L598 I638	P590-S594 PolarHBondContact O-N 2.73Å; P590-S594 PolarHBondContact O-OG 3.09Å; L591-S594 PolarHBondContact O-N 3.37Å; S594-E596 VanDerWaalsContact C-N 3.34Å; S594-S597 WeakPolarHBondContact O-CB 3.43Å; S594-S597 PolarHBondContact O-N 3.07Å; S594-L598 PolarHBondContact O-N 3.28Å; S594-I638 WeakPolarHBondContact O-CD1 3.48Å
595	L	92.8	Very high	87.6	Confident	1 Å²	1	50 Å²	50	1%	0.005	25%	0.254	C	S	.	.	H	α-helix	trans	-64.4	-37.3	172.7	-70.5	173.5	0	0	0	112.5	M510 L591 L592 G599 I638 A659 C662 A663 I666	M510-L595 HydrophobicContact CE-CB 3.58Å; M510-L595 HydrophobicContact CE-CD1 4.48Å; M510-L595 HydrophobicContact SD-CB 4.17Å; M510-L595 HydrophobicContact SD-CD1 3.98Å; L591-L595 WeakPolarHBondContact O-CG 3.24Å; L591-L595 PolarHBondContact O-N 2.85Å; L592-L595 HydrophobicContact CD2-CD1 4.43Å; L592-L595 PolarHBondContact O-N 3.13Å; L595-G599 PolarHBondContact O-N 2.95Å; L595-I638 HydrophobicContact CD2-CG2 4.4Å; L595-A659 HydrophobicContact CD1-CB 4.09Å; L595-C662 HydrophobicContact CD1-CB 4.4Å; L595-A663 HydrophobicContact CD2-CB 3.57Å; L595-I666 HydrophobicContact CD2-CD1 4.37Å
596	E	93.5	Very high	88.9	Confident	28 Å²	28	47.4 Å²	47.4	13%	0.131	24%	0.235	C	C	.	.	H	α-helix	trans	-64.1	-42.5	175.4	-172.4	-163	177.2	0	0	111.4	I507 H511 L592 V593 S594 G599 R600	I507-E596 HydrophobicContact CG2-CB 4.32Å; I507-E596 HydrophobicContact CG2-CG 3.7Å; H511-E596 HydrophobicContact CB-CG 4.49Å; H511-E596 IonicContact CE1-OE2 3.66Å; H511-E596 PolarHBondContact CE1-OE2 3.22Å; H511-E596 IonicContact CG-OE2 3.69Å; H511-E596 IonicContact ND1-OE2 2.83Å; H511-E596 PolarHBondContact ND1-OE2 3.11Å; H511-E596 IonicContact NE2-OE2 3.84Å; L592-E596 WeakPolarHBondContact O-CB 3.39Å; L592-E596 PolarHBondContact O-N 3.12Å; V593-E596 PolarHBondContact O-N 2.79Å; S594-E596 VanDerWaalsContact C-N 3.34Å; E596-G599 PolarHBondContact O-N 2.82Å; E596-R600 HydrophobicContact CG-CG 4.44Å; E596-R600 WeakPolarHBondContact O-CG 2.92Å; E596-R600 PolarHBondContact O-N 3.04Å; E596-R600 IonicContact OE1-CZ 2.7Å; E596-R600 IonicContact OE1-NE 2.72Å; E596-R600 PolarHBondContact OE1-NE 3.16Å; E596-R600 IonicContact OE1-NH2 3.56Å; E596-R600 PolarHBondContact OE1-NH2 3.02Å
597	S	94.2	Very high	90.2	Very high	60 Å²	60	42.4 Å²	42.4	42%	0.42	21%	0.212	S	C	.	.	H	α-helix	trans	-56	-53.3	175.4	-174.8	0	0	0	0	111.2	V593 S594 G599 R600 H601 E634	V593-S597 PolarHBondContact O-N 2.93Å; S594-S597 WeakPolarHBondContact O-CB 3.43Å; S594-S597 PolarHBondContact O-N 3.07Å; S597-G599 VanDerWaalsContact C-N 3.31Å; S597-G599 PolarHBondContact O-N 3.03Å; S597-R600 PolarHBondContact O-N 2.86Å; S597-H601 WeakPolarHBondContact O-CB 3.46Å; S597-H601 PolarHBondContact O-N 2.65Å; S597-E634 WeakPolarHBondContact CB-OE1 3.41Å; S597-E634 PolarHBondContact OG-OE1 3.48Å
598	L	95.4	Very high	91.5	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-60.5	-41.7	177.3	-172.4	73	0	0	0	111.7	S594 H601 T602 V631 E634 I638 I666	S594-L598 PolarHBondContact O-N 3.28Å; L598-H601 PolarHBondContact O-N 2.82Å; L598-T602 WeakPolarHBondContact O-CG2 3.35Å; L598-T602 PolarHBondContact O-N 2.88Å; L598-T602 PolarHBondContact O-OG1 3.24Å; L598-T602 VanDerWaalsContact O-OG1 3.07Å; L598-V631 HydrophobicContact CD1-CG1 3.88Å; L598-E634 HydrophobicContact CD1-CB 3.82Å; L598-E634 HydrophobicContact CD1-CG 3.92Å; L598-I638 HydrophobicContact CB-CD1 3.8Å; L598-I638 HydrophobicContact CD2-CD1 3.96Å; L598-I638 HydrophobicContact CG-CD1 4.34Å; L598-I666 HydrophobicContact CB-CG2 4.25Å; L598-I666 HydrophobicContact CD2-CB 4.07Å; L598-I666 HydrophobicContact CD2-CG2 3.77Å; L598-I666 HydrophobicContact CG-CG2 3.66Å
599	G	95.4	Very high	92.6	Very high	1 Å²	1	36.5 Å²	36.5	1%	0.01	19%	0.185	C	C	.	.	H	α-helix	trans	-60.1	-48.6	176.7	0	0	0	0	0	113	L595 E596 S597 H601 T602 I603	L595-G599 PolarHBondContact O-N 2.95Å; E596-G599 PolarHBondContact O-N 2.82Å; S597-G599 VanDerWaalsContact C-N 3.31Å; S597-G599 PolarHBondContact O-N 3.03Å; G599-H601 VanDerWaalsContact C-N 3.31Å; G599-H601 PolarHBondContact O-N 3.11Å; G599-T602 PolarHBondContact O-N 3.01Å; G599-T602 PolarHBondContact O-OG1 2.83Å; G599-I603 WeakPolarHBondContact O-CB 3.49Å; G599-I603 WeakPolarHBondContact O-CD1 3.48Å; G599-I603 VanDerWaalsContact O-CG1 3.22Å; G599-I603 WeakPolarHBondContact O-CG1 3.49Å; G599-I603 PolarHBondContact O-N 2.69Å
600	R	95.5	Very high	93.5	Very high	159 Å²	159	33.2 Å²	33.2	60%	0.6	17%	0.17	S	C	*	.	H	α-helix	trans	-63.7	-38.1	176.9	-73.3	-178.3	-177.5	-136.3	9.1	112.1	E596 S597 I603 Q604	E596-R600 HydrophobicContact CG-CG 4.44Å; E596-R600 WeakPolarHBondContact O-CG 2.92Å; E596-R600 PolarHBondContact O-N 3.04Å; E596-R600 IonicContact OE1-CZ 2.7Å; E596-R600 IonicContact OE1-NE 2.72Å; E596-R600 PolarHBondContact OE1-NE 3.16Å; E596-R600 IonicContact OE1-NH2 3.56Å; E596-R600 PolarHBondContact OE1-NH2 3.02Å; S597-R600 PolarHBondContact O-N 2.86Å; R600-I603 PolarHBondContact O-N 2.8Å; R600-Q604 PolarHBondContact O-N 2.72Å
601	H	96	Very high	94.1	Very high	45 Å²	45	33.2 Å²	33.2	21%	0.208	17%	0.167	C	C	.	.	H	α-helix	trans	-63.2	-47	177.2	-166	175.6	0	0	0	111.5	S597 L598 G599 Q604 M605 E634	S597-H601 WeakPolarHBondContact O-CB 3.46Å; S597-H601 PolarHBondContact O-N 2.65Å; L598-H601 PolarHBondContact O-N 2.82Å; G599-H601 VanDerWaalsContact C-N 3.31Å; G599-H601 PolarHBondContact O-N 3.11Å; H601-Q604 PolarHBondContact O-N 3.36Å; H601-M605 PolarHBondContact O-N 2.93Å; H601-E634 IonicContact CE1-OE2 2.8Å; H601-E634 IonicContact CG-OE2 3.66Å; H601-E634 IonicContact ND1-OE2 3.2Å; H601-E634 PolarHBondContact ND1-OE2 3.16Å
602	T	96.8	Very high	94.7	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-68.6	-34.1	177.7	53.5	0	0	0	0	113.4	L598 G599 Q604 M605 L606 V631 I666 I669	L598-T602 WeakPolarHBondContact O-CG2 3.35Å; L598-T602 PolarHBondContact O-N 2.88Å; L598-T602 PolarHBondContact O-OG1 3.24Å; L598-T602 VanDerWaalsContact O-OG1 3.07Å; G599-T602 PolarHBondContact O-N 3.01Å; G599-T602 PolarHBondContact O-OG1 2.83Å; T602-Q604 VanDerWaalsContact C-N 3.34Å; T602-M605 WeakPolarHBondContact O-CB 3.29Å; T602-M605 PolarHBondContact O-N 3.25Å; T602-L606 PolarHBondContact O-N 2.85Å; T602-V631 HydrophobicContact CG2-CG1 3.64Å; T602-V631 HydrophobicContact CG2-CG2 4.2Å; T602-I666 HydrophobicContact CG2-CG2 3.98Å; T602-I666 WeakPolarHBondContact OG1-CG2 3.47Å; T602-I669 HydrophobicContact CG2-CB 4.42Å
603	I	96.7	Very high	95.1	Very high	22 Å²	22	33 Å²	33	11%	0.113	17%	0.165	C	C	.	.	H	α-helix	trans	-62.4	-42.4	171.1	-70	164.3	0	0	0	110.7	E500 L503 I507 G599 R600 L606 H607	E500-I603 HydrophobicContact CG-CG2 4Å; L503-I603 HydrophobicContact CB-CD1 4.03Å; L503-I603 HydrophobicContact CB-CG1 3.85Å; L503-I603 HydrophobicContact CD1-CG1 4.49Å; I507-I603 HydrophobicContact CB-CD1 4.48Å; I507-I603 HydrophobicContact CG1-CD1 3.93Å; G599-I603 WeakPolarHBondContact O-CB 3.49Å; G599-I603 WeakPolarHBondContact O-CD1 3.48Å; G599-I603 VanDerWaalsContact O-CG1 3.22Å; G599-I603 WeakPolarHBondContact O-CG1 3.49Å; G599-I603 PolarHBondContact O-N 2.69Å; R600-I603 PolarHBondContact O-N 2.8Å; I603-L606 WeakPolarHBondContact O-CB 3.46Å; I603-L606 PolarHBondContact O-N 2.97Å; I603-H607 PolarHBondContact O-N 2.89Å
604	Q	96.3	Very high	95.2	Very high	101 Å²	101	30.4 Å²	30.4	47%	0.472	15%	0.153	S	C	.	.	H	α-helix	trans	-64.3	-40.5	175.5	-171.5	63.1	57.4	0	0	111.6	R600 H601 T602 L606 H607 D608	R600-Q604 PolarHBondContact O-N 2.72Å; H601-Q604 PolarHBondContact O-N 3.36Å; T602-Q604 VanDerWaalsContact C-N 3.34Å; Q604-L606 VanDerWaalsContact C-N 3.31Å; Q604-L606 PolarHBondContact O-N 3.31Å; Q604-H607 WeakPolarHBondContact O-CB 3.37Å; Q604-H607 PolarHBondContact O-N 3.32Å; Q604-D608 PolarHBondContact NE2-OD1 2.85Å; Q604-D608 WeakPolarHBondContact O-CB 3.46Å; Q604-D608 PolarHBondContact O-N 2.95Å
605	M	96.5	Very high	95.2	Very high	3 Å²	3	35.8 Å²	35.8	2%	0.015	17%	0.169	C	C	.	.	H	α-helix	trans	-59.7	-40.9	172.3	-98.1	-178.1	76	0	0	112.3	H601 T602 D608 V609 I624 E627 D628 V631 C673	H601-M605 PolarHBondContact O-N 2.93Å; T602-M605 WeakPolarHBondContact O-CB 3.29Å; T602-M605 PolarHBondContact O-N 3.25Å; M605-D608 PolarHBondContact O-N 3.17Å; M605-V609 WeakPolarHBondContact O-CB 3.29Å; M605-V609 PolarHBondContact O-N 3.2Å; M605-I624 HydrophobicContact CE-CG2 4.13Å; M605-I624 HydrophobicContact CG-CG2 4.29Å; M605-E627 HydrophobicContact CG-CB 4.28Å; M605-E627 HydrophobicContact CG-CG 3.99Å; M605-E627 HydrophobicContact SD-CB 4.09Å; M605-E627 HydrophobicContact SD-CG 4.08Å; M605-D628 HydrophobicContact CE-CB 3.82Å; M605-V631 HydrophobicContact SD-CG2 3.57Å; M605-V631 VanDerWaalsContact SD-CG2 3.57Å; M605-C673 HydrophobicContact CE-CB 3.94Å
606	L	97.3	Very high	95	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-63.6	-43.5	175.9	177.7	61.4	0	0	0	111.5	V499 E500 L503 L566 I569 T602 I603 Q604 V609 L610	V499-L606 HydrophobicContact CG1-CD2 4.1Å; E500-L606 HydrophobicContact CB-CD2 4.15Å; E500-L606 HydrophobicContact CG-CD2 4.46Å; L503-L606 HydrophobicContact CD1-CD2 3.79Å; L566-L606 HydrophobicContact CD2-CD1 4.02Å; I569-L606 HydrophobicContact CD1-CD1 3.83Å; I569-L606 HydrophobicContact CG2-CD2 4Å; T602-L606 PolarHBondContact O-N 2.85Å; I603-L606 WeakPolarHBondContact O-CB 3.46Å; I603-L606 PolarHBondContact O-N 2.97Å; Q604-L606 VanDerWaalsContact C-N 3.31Å; Q604-L606 PolarHBondContact O-N 3.31Å; L606-V609 HydrophobicContact CD1-CG1 4.24Å; L606-V609 WeakPolarHBondContact O-CG1 3.26Å; L606-V609 PolarHBondContact O-N 3.15Å; L606-L610 HydrophobicContact CD1-CD1 4.11Å; L606-L610 HydrophobicContact CD1-CG 4.17Å; L606-L610 HydrophobicContact CG-CD1 4.07Å; L606-L610 WeakPolarHBondContact O-CB 3.42Å; L606-L610 VanDerWaalsContact O-CG 3.25Å; L606-L610 WeakPolarHBondContact O-CG 3.48Å; L606-L610 PolarHBondContact O-N 2.65Å
607	H	97.5	Very high	94.8	Very high	74 Å²	74	38.4 Å²	38.4	34%	0.343	18%	0.183	S	C	.	.	H	α-helix	trans	-58.3	-51.9	175.5	-170.5	84.4	0	0	0	111.1	E500 I603 Q604 V609 L610 D611	E500-H607 WeakPolarHBondContact OE1-CB 3.27Å; E500-H607 IonicContact OE1-CE1 3.13Å; E500-H607 IonicContact OE1-CG 3.83Å; E500-H607 IonicContact OE1-ND1 3.93Å; E500-H607 PolarHBondContact OE1-ND1 3.41Å; E500-H607 IonicContact OE2-ND1 2.86Å; E500-H607 PolarHBondContact OE2-ND1 2.81Å; I603-H607 PolarHBondContact O-N 2.89Å; Q604-H607 WeakPolarHBondContact O-CB 3.37Å; Q604-H607 PolarHBondContact O-N 3.32Å; H607-V609 VanDerWaalsContact C-N 3.33Å; H607-V609 PolarHBondContact O-N 3.34Å; H607-L610 PolarHBondContact O-N 3.04Å; H607-D611 PolarHBondContact O-N 3.49Å
608	D	96.7	Very high	94.5	Very high	27 Å²	27	37.1 Å²	37.1	14%	0.144	17%	0.171	C	C	.	.	H	α-helix	trans	-61.7	-40.4	-178.4	-72.2	9.4	0	0	0	111.4	Q604 M605 D611 A612 R623 I624	Q604-D608 PolarHBondContact NE2-OD1 2.85Å; Q604-D608 WeakPolarHBondContact O-CB 3.46Å; Q604-D608 PolarHBondContact O-N 2.95Å; M605-D608 PolarHBondContact O-N 3.17Å; D608-D611 PolarHBondContact O-N 2.95Å; D608-A612 WeakPolarHBondContact O-CB 3.42Å; D608-A612 PolarHBondContact O-N 2.92Å; D608-R623 IonicContact OD2-NH2 3.04Å; D608-R623 PolarHBondContact OD2-NH2 3.36Å; D608-R623 VanDerWaalsContact OD2-NH2 3.15Å; D608-I624 HydrophobicContact CB-CD1 3.67Å; D608-I624 HydrophobicContact CB-CG1 3.88Å; D608-I624 WeakPolarHBondContact O-CD1 2.97Å
609	V	96.9	Very high	94.2	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-71.7	-34.4	179.9	82.7	0	0	0	0	112.4	M605 L606 H607 D611 A612 F613 I624 C673 I676 C677 I680	M605-V609 WeakPolarHBondContact O-CB 3.29Å; M605-V609 PolarHBondContact O-N 3.2Å; L606-V609 HydrophobicContact CD1-CG1 4.24Å; L606-V609 WeakPolarHBondContact O-CG1 3.26Å; L606-V609 PolarHBondContact O-N 3.15Å; H607-V609 VanDerWaalsContact C-N 3.33Å; H607-V609 PolarHBondContact O-N 3.34Å; V609-D611 VanDerWaalsContact C-N 3.32Å; V609-A612 PolarHBondContact O-N 2.99Å; V609-F613 VanDerWaalsContact O-CB 3.29Å; V609-F613 WeakPolarHBondContact O-CB 3.48Å; V609-F613 PolarHBondContact O-N 2.78Å; V609-I624 HydrophobicContact CB-CD1 4.3Å; V609-I624 HydrophobicContact CB-CG2 4.32Å; V609-C673 HydrophobicContact CG1-CB 4.16Å; V609-I676 HydrophobicContact CG1-CB 4.5Å; V609-I676 HydrophobicContact CG1-CD1 4.28Å; V609-I676 HydrophobicContact CG1-CG2 4.41Å; V609-I676 HydrophobicContact CG2-CB 3.87Å; V609-I676 HydrophobicContact CG2-CG2 3.68Å; V609-C677 WeakPolarHBondContact CG2-SG 3.34Å; V609-I680 HydrophobicContact CG2-CD1 4.4Å
610	L	96.4	Very high	94.1	Very high	5 Å²	5	45.2 Å²	45.2	3%	0.026	21%	0.213	C	C	.	.	H	α-helix	trans	-65	-39.2	172	-74	172.5	0	0	0	111	M493 L566 L606 H607 F613 A614	M493-L610 HydrophobicContact CE-CB 4.11Å; L566-L610 HydrophobicContact CD1-CD2 4.38Å; L566-L610 HydrophobicContact CD2-CD2 4.06Å; L606-L610 HydrophobicContact CD1-CD1 4.11Å; L606-L610 HydrophobicContact CD1-CG 4.17Å; L606-L610 HydrophobicContact CG-CD1 4.07Å; L606-L610 WeakPolarHBondContact O-CB 3.42Å; L606-L610 VanDerWaalsContact O-CG 3.25Å; L606-L610 WeakPolarHBondContact O-CG 3.48Å; L606-L610 PolarHBondContact O-N 2.65Å; H607-L610 PolarHBondContact O-N 3.04Å; L610-F613 PolarHBondContact O-N 3.01Å; L610-A614 WeakPolarHBondContact O-CB 3.47Å; L610-A614 PolarHBondContact O-N 3.21Å
611	D	95.2	Very high	93.9	Very high	62 Å²	62	37.8 Å²	37.8	33%	0.332	19%	0.186	S	C	.	.	H	α-helix	trans	-70.8	-35.4	178	-136.9	28.3	0	0	0	111.8	H607 D608 V609 R615	H607-D611 PolarHBondContact O-N 3.49Å; D608-D611 PolarHBondContact O-N 2.95Å; V609-D611 VanDerWaalsContact C-N 3.32Å; D611-R615 PolarHBondContact O-N 2.99Å; D611-R615 PolarHBondContact O-NE 2.63Å; D611-R615 VanDerWaalsContact O-NE 3.16Å; D611-R615 IonicContact OD1-NH2 3.93Å; D611-R615 IonicContact OD2-CZ 2.79Å; D611-R615 VanDerWaalsContact OD2-CZ 3.3Å; D611-R615 IonicContact OD2-NH1 3.76Å; D611-R615 PolarHBondContact OD2-NH1 2.99Å; D611-R615 IonicContact OD2-NH2 2.84Å; D611-R615 PolarHBondContact OD2-NH2 3.29Å
612	A	95	Very high	93.6	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-64.9	-44.4	169.4	0	0	0	0	0	111.4	D608 V609 A614 R615 M616 D617 E620 I624 I680	D608-A612 WeakPolarHBondContact O-CB 3.42Å; D608-A612 PolarHBondContact O-N 2.92Å; V609-A612 PolarHBondContact O-N 2.99Å; A612-A614 PolarHBondContact O-N 3.03Å; A612-R615 CarbonylContact O-C 3.59Å; A612-R615 PolarHBondContact O-N 3.4Å; A612-M616 WeakPolarHBondContact O-CA 3.33Å; A612-M616 PolarHBondContact O-N 3.35Å; A612-D617 PolarHBondContact O-N 3.44Å; A612-E620 HydrophobicContact CB-CB 3.94Å; A612-E620 HydrophobicContact CB-CG 3.88Å; A612-I624 HydrophobicContact CB-CD1 3.99Å; A612-I680 HydrophobicContact CB-CD1 3.98Å
613	F	94.5	Very high	93.4	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-62.9	-42	177.1	-174.9	-89.8	0	0	0	112	V492 M493 V558 I559 T562 V609 L610 R615 M616 I676 I680	V492-F613 HydrophobicContact CB-CE1 4.44Å; V492-F613 HydrophobicContact CG1-CD1 4.41Å; V492-F613 HydrophobicContact CG1-CE1 3.81Å; V492-F613 HydrophobicContact CG1-CZ 4.29Å; M493-F613 HydrophobicContact SD-CD1 4.29Å; V558-F613 HydrophobicContact CG1-CE2 3.67Å; V558-F613 HydrophobicContact CG1-CZ 4.39Å; I559-F613 HydrophobicContact CG1-CZ 3.95Å; T562-F613 HydrophobicContact CG2-CD2 4.29Å; T562-F613 HydrophobicContact CG2-CE2 4.01Å; T562-F613 HydrophobicContact CG2-CZ 4.29Å; T562-F613 VanDerWaalsContact OG1-CE2 3.29Å; T562-F613 WeakPolarHBondContact OG1-CE2 3.33Å; V609-F613 VanDerWaalsContact O-CB 3.29Å; V609-F613 WeakPolarHBondContact O-CB 3.48Å; V609-F613 PolarHBondContact O-N 2.78Å; L610-F613 PolarHBondContact O-N 3.01Å; F613-R615 PolarHBondContact O-N 2.86Å; F613-M616 HydrophobicContact CD1-CE 4.45Å; F613-M616 HydrophobicContact CD2-CE 4.31Å; F613-M616 HydrophobicContact CE1-CE 4.18Å; F613-M616 HydrophobicContact CE2-CE 4.04Å; F613-M616 HydrophobicContact CZ-CE 3.97Å; F613-M616 PolarHBondContact O-N 2.95Å; F613-M616 VanDerWaalsContact O-N 3.16Å; F613-I676 HydrophobicContact CD2-CG2 4.23Å; F613-I680 HydrophobicContact CB-CD1 3.98Å; F613-I680 HydrophobicContact CB-CG1 4.39Å; F613-I680 HydrophobicContact CD2-CD1 4.42Å; F613-I680 HydrophobicContact CD2-CG1 3.99Å
614	A	90.5	Very high	93.3	Very high	25 Å²	25	40.4 Å²	40.4	21%	0.207	19%	0.194	C	C	.	.	H	α-helix	trans	-61.9	-26.1	177.2	0	0	0	0	0	113	R489 M493 L610 A612	R489-A614 PolarHBondContact NH1-O 3.11Å; M493-A614 HydrophobicContact CE-CB 3.81Å; M493-A614 HydrophobicContact SD-CB 3.83Å; L610-A614 WeakPolarHBondContact O-CB 3.47Å; L610-A614 PolarHBondContact O-N 3.21Å; A612-A614 PolarHBondContact O-N 3.03Å
615	R	89.9	Confident	93	Very high	139 Å²	139	37.1 Å²	37.1	53%	0.525	18%	0.178	S	C	.	.	H	α-helix	trans	-104.8	-6.4	177.4	-68.8	177.3	-73.2	-137.1	2.2	113.1	D611 A612 F613 D617	D611-R615 PolarHBondContact O-N 2.99Å; D611-R615 PolarHBondContact O-NE 2.63Å; D611-R615 VanDerWaalsContact O-NE 3.16Å; D611-R615 IonicContact OD1-NH2 3.93Å; D611-R615 IonicContact OD2-CZ 2.79Å; D611-R615 VanDerWaalsContact OD2-CZ 3.3Å; D611-R615 IonicContact OD2-NH1 3.76Å; D611-R615 PolarHBondContact OD2-NH1 2.99Å; D611-R615 IonicContact OD2-NH2 2.84Å; D611-R615 PolarHBondContact OD2-NH2 3.29Å; A612-R615 CarbonylContact O-C 3.59Å; A612-R615 PolarHBondContact O-N 3.4Å; F613-R615 PolarHBondContact O-N 2.86Å; R615-D617 HydrophobicContact CB-CB 4.04Å; R615-D617 PolarHBondContact O-N 3.29Å
616	M	88	Confident	92.6	Very high	30 Å²	30	43.1 Å²	43.1	15%	0.148	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	48.6	42	-166.3	-63.2	-69.9	173.1	0	0	111.1	L555 A612 F613 I618 Y683	L555-M616 HydrophobicContact CD1-CE 3.38Å; A612-M616 WeakPolarHBondContact O-CA 3.33Å; A612-M616 PolarHBondContact O-N 3.35Å; F613-M616 HydrophobicContact CD1-CE 4.45Å; F613-M616 HydrophobicContact CD2-CE 4.31Å; F613-M616 HydrophobicContact CE1-CE 4.18Å; F613-M616 HydrophobicContact CE2-CE 4.04Å; F613-M616 HydrophobicContact CZ-CE 3.97Å; F613-M616 PolarHBondContact O-N 2.95Å; F613-M616 VanDerWaalsContact O-N 3.16Å; M616-I618 PolarHBondContact O-N 2.98Å; M616-Y683 HydrophobicContact CB-CD1 3.94Å; M616-Y683 HydrophobicContact CB-CE1 3.83Å; M616-Y683 HydrophobicContact CE-CD1 4.46Å; M616-Y683 HydrophobicContact CG-CD1 3.74Å; M616-Y683 HydrophobicContact CG-CE1 3.54Å; M616-Y683 HydrophobicContact SD-CD1 3.41Å; M616-Y683 WeakPolarHBondContact SD-CD1 3.39Å; M616-Y683 HydrophobicContact SD-CE1 3.79Å; M616-Y683 HydrophobicContact SD-CG 4.1Å
617	D	89.7	Confident	92.3	Very high	54 Å²	54	44.9 Å²	44.9	29%	0.289	21%	0.208	S	C	.	.			trans	-85	107.5	-174.4	-167.6	-31.9	0	0	0	110	A612 R615 D619 E620 A621	A612-D617 PolarHBondContact O-N 3.44Å; R615-D617 HydrophobicContact CB-CB 4.04Å; R615-D617 PolarHBondContact O-N 3.29Å; D617-D619 PolarHBondContact OD1-N 3.06Å; D617-E620 HydrophobicContact CB-CB 3.92Å; D617-E620 PolarHBondContact OD1-N 3.38Å; D617-E620 VanDerWaalsContact OD1-N 3.12Å; D617-A621 WeakPolarHBondContact O-CB 3.2Å; D617-A621 PolarHBondContact O-N 2.94Å; D617-A621 VanDerWaalsContact O-N 3.11Å
618	I	89.3	Confident	91.9	Very high	32 Å²	32	41.5 Å²	41.5	16%	0.164	19%	0.193	C	C	.	.	H	α-helix	trans	-71.7	-35.7	-177.5	-162.9	171.3	0	0	0	112.2	M616 E620 A621 V622 F681 V684 K685	M616-I618 PolarHBondContact O-N 2.98Å; I618-E620 VanDerWaalsContact C-N 3.33Å; I618-A621 PolarHBondContact O-N 2.81Å; I618-V622 HydrophobicContact CG1-CG2 4.48Å; I618-V622 WeakPolarHBondContact O-CG2 3.46Å; I618-V622 PolarHBondContact O-N 3.46Å; I618-F681 HydrophobicContact CD1-CD2 3.6Å; I618-F681 HydrophobicContact CD1-CE2 3.87Å; I618-F681 HydrophobicContact CD1-CG 4.16Å; I618-F681 HydrophobicContact CG1-CD2 3.81Å; I618-F681 HydrophobicContact CG1-CE2 4.39Å; I618-V684 HydrophobicContact CB-CG1 4.43Å; I618-V684 HydrophobicContact CD1-CB 4.12Å; I618-V684 HydrophobicContact CD1-CG1 3.97Å; I618-K685 HydrophobicContact CD1-CD 4.48Å; I618-K685 HydrophobicContact CD1-CG 3.64Å
619	D	88.9	Confident	91.7	Very high	130 Å²	130	47.4 Å²	47.4	70%	0.695	22%	0.217	S	C	*	.	H	α-helix	trans	-69.6	-40.5	-176.8	-68.3	-41.9	0	0	0	109.7	D617 V622 R623	D617-D619 PolarHBondContact OD1-N 3.06Å; D619-V622 PolarHBondContact O-N 2.97Å; D619-R623 PolarHBondContact O-N 2.94Å; D619-R623 VanDerWaalsContact O-N 3.11Å
620	E	92.2	Very high	91.5	Very high	42 Å²	42	52.5 Å²	52.5	20%	0.196	24%	0.24	C	C	.	.	H	α-helix	trans	-64.3	-46.3	174	-163.6	70.5	171.2	0	0	111.7	A612 D617 I618 V622 R623 I624	A612-E620 HydrophobicContact CB-CB 3.94Å; A612-E620 HydrophobicContact CB-CG 3.88Å; D617-E620 HydrophobicContact CB-CB 3.92Å; D617-E620 PolarHBondContact OD1-N 3.38Å; D617-E620 VanDerWaalsContact OD1-N 3.12Å; I618-E620 VanDerWaalsContact C-N 3.33Å; E620-V622 VanDerWaalsContact C-N 3.31Å; E620-V622 PolarHBondContact O-N 3.24Å; E620-R623 WeakPolarHBondContact O-CB 3.46Å; E620-R623 PolarHBondContact O-N 2.89Å; E620-R623 VanDerWaalsContact O-N 3.11Å; E620-R623 IonicContact OE1-CZ 3.82Å; E620-R623 IonicContact OE1-NH1 3.86Å; E620-R623 PolarHBondContact OE1-NH1 2.8Å; E620-R623 IonicContact OE1-NH2 2.72Å; E620-R623 PolarHBondContact OE1-NH2 3.02Å; E620-R623 IonicContact OE2-CZ 3.85Å; E620-R623 IonicContact OE2-NH1 2.88Å; E620-R623 PolarHBondContact OE2-NH1 2.84Å; E620-R623 IonicContact OE2-NH2 3.43Å; E620-I624 HydrophobicContact CG-CD1 4.01Å; E620-I624 WeakPolarHBondContact O-CD1 3.37Å; E620-I624 VanDerWaalsContact O-CG1 3.3Å; E620-I624 WeakPolarHBondContact O-CG1 3.36Å; E620-I624 PolarHBondContact O-N 3.31Å
621	A	92.5	Very high	91.4	Very high	3 Å²	3	52.3 Å²	52.3	3%	0.025	24%	0.238	C	C	.	.	H	α-helix	trans	-59.1	-40.1	176.5	0	0	0	0	0	112.4	D617 I618 R623 I624 Y625 C677 I680	D617-A621 WeakPolarHBondContact O-CB 3.2Å; D617-A621 PolarHBondContact O-N 2.94Å; D617-A621 VanDerWaalsContact O-N 3.11Å; I618-A621 PolarHBondContact O-N 2.81Å; A621-R623 VanDerWaalsContact C-N 3.34Å; A621-R623 PolarHBondContact O-N 2.75Å; A621-I624 PolarHBondContact O-N 3.32Å; A621-Y625 VanDerWaalsContact O-CB 3.31Å; A621-Y625 WeakPolarHBondContact O-CB 3.48Å; A621-Y625 PolarHBondContact O-N 3.33Å; A621-C677 HydrophobicContact CB-CB 4.13Å; A621-C677 PolarHBondContact O-SG 2.87Å; A621-C677 VanDerWaalsContact O-SG 3.41Å; A621-I680 HydrophobicContact CB-CB 4.15Å; A621-I680 HydrophobicContact CB-CD1 4.04Å; A621-I680 HydrophobicContact CB-CG2 4.04Å
622	V	89.8	Confident	91.3	Very high	17 Å²	17	52.1 Å²	52.1	10%	0.103	24%	0.237	C	C	.	.	H	α-helix	trans	-64.9	-37.8	176.4	171.7	0	0	0	0	111.4	I618 D619 E620 R626 L701	I618-V622 HydrophobicContact CG1-CG2 4.48Å; I618-V622 WeakPolarHBondContact O-CG2 3.46Å; I618-V622 PolarHBondContact O-N 3.46Å; D619-V622 PolarHBondContact O-N 2.97Å; E620-V622 VanDerWaalsContact C-N 3.31Å; E620-V622 PolarHBondContact O-N 3.24Å; V622-R626 WeakPolarHBondContact O-CG 3.35Å; V622-R626 PolarHBondContact O-N 3.12Å; V622-L701 HydrophobicContact CB-CD2 4.43Å; V622-L701 HydrophobicContact CG1-CB 4.03Å; V622-L701 HydrophobicContact CG1-CD2 4.16Å; V622-L701 HydrophobicContact CG2-CD2 3.76Å
623	R	91.8	Very high	91.3	Very high	105 Å²	105	58.7 Å²	58.7	40%	0.396	27%	0.268	S	S	.	.	H	α-helix	trans	-63.3	-49.8	175.6	-170.6	-166.7	75.8	-143.8	0.7	110.7	D608 D619 E620 A621 Y625 R626 E627	D608-R623 IonicContact OD2-NH2 3.04Å; D608-R623 PolarHBondContact OD2-NH2 3.36Å; D608-R623 VanDerWaalsContact OD2-NH2 3.15Å; D619-R623 PolarHBondContact O-N 2.94Å; D619-R623 VanDerWaalsContact O-N 3.11Å; E620-R623 WeakPolarHBondContact O-CB 3.46Å; E620-R623 PolarHBondContact O-N 2.89Å; E620-R623 VanDerWaalsContact O-N 3.11Å; E620-R623 IonicContact OE1-CZ 3.82Å; E620-R623 IonicContact OE1-NH1 3.86Å; E620-R623 PolarHBondContact OE1-NH1 2.8Å; E620-R623 IonicContact OE1-NH2 2.72Å; E620-R623 PolarHBondContact OE1-NH2 3.02Å; E620-R623 IonicContact OE2-CZ 3.85Å; E620-R623 IonicContact OE2-NH1 2.88Å; E620-R623 PolarHBondContact OE2-NH1 2.84Å; E620-R623 IonicContact OE2-NH2 3.43Å; A621-R623 VanDerWaalsContact C-N 3.34Å; A621-R623 PolarHBondContact O-N 2.75Å; R623-Y625 VanDerWaalsContact C-N 3.34Å; R623-Y625 PolarHBondContact O-N 2.93Å; R623-R626 WeakPolarHBondContact O-CB 3.45Å; R623-R626 PolarHBondContact O-N 3.38Å; R623-R626 VanDerWaalsContact O-N 3.14Å; R623-E627 PolarHBondContact O-N 3.45Å
624	I	93.4	Very high	91.3	Very high	0 Å²	0	61.2 Å²	61.2	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-64.4	-40.5	-178.1	-60.9	156.6	0	0	0	110.7	M605 D608 V609 A612 E620 A621 R626 E627	M605-I624 HydrophobicContact CE-CG2 4.13Å; M605-I624 HydrophobicContact CG-CG2 4.29Å; D608-I624 HydrophobicContact CB-CD1 3.67Å; D608-I624 HydrophobicContact CB-CG1 3.88Å; D608-I624 WeakPolarHBondContact O-CD1 2.97Å; V609-I624 HydrophobicContact CB-CD1 4.3Å; V609-I624 HydrophobicContact CB-CG2 4.32Å; A612-I624 HydrophobicContact CB-CD1 3.99Å; E620-I624 HydrophobicContact CG-CD1 4.01Å; E620-I624 WeakPolarHBondContact O-CD1 3.37Å; E620-I624 VanDerWaalsContact O-CG1 3.3Å; E620-I624 WeakPolarHBondContact O-CG1 3.36Å; E620-I624 PolarHBondContact O-N 3.31Å; A621-I624 PolarHBondContact O-N 3.32Å; I624-R626 PolarHBondContact O-N 3.1Å; I624-R626 VanDerWaalsContact O-N 3.14Å; I624-E627 WeakPolarHBondContact O-CB 3.25Å; I624-E627 PolarHBondContact O-N 3.11Å
625	Y	91.9	Very high	91.5	Very high	32 Å²	32	61.1 Å²	61.1	13%	0.125	27%	0.274	C	S	.	.	H	α-helix	trans	-55.1	-34.5	175.5	-173.7	-85.6	0	0	0	112.7	A621 R623 Q674 C677 E678 F689 L697 L701	A621-Y625 VanDerWaalsContact O-CB 3.31Å; A621-Y625 WeakPolarHBondContact O-CB 3.48Å; A621-Y625 PolarHBondContact O-N 3.33Å; R623-Y625 VanDerWaalsContact C-N 3.34Å; R623-Y625 PolarHBondContact O-N 2.93Å; Y625-Q674 HydrophobicContact CD2-CB 4.16Å; Y625-Q674 HydrophobicContact CD2-CG 3.56Å; Y625-Q674 HydrophobicContact CE2-CB 4.16Å; Y625-Q674 HydrophobicContact CE2-CG 3.69Å; Y625-Q674 HydrophobicContact CG-CG 4.11Å; Y625-Q674 PolarHBondContact O-NE2 2.97Å; Y625-C677 HydrophobicContact CD2-CB 4.16Å; Y625-E678 HydrophobicContact CD2-CG 4.31Å; Y625-E678 HydrophobicContact CE2-CG 3.83Å; Y625-F689 HydrophobicContact CD2-CE2 4.29Å; Y625-F689 HydrophobicContact CD2-CZ 4.28Å; Y625-F689 AromaticContact CE2-CE2 3.71Å; Y625-F689 HydrophobicContact CE2-CE2 3.71Å; Y625-F689 HydrophobicContact CE2-CZ 4.13Å; Y625-F689 AromaticContact CZ-CE2 3.86Å; Y625-L697 HydrophobicContact CE1-CD2 4.04Å; Y625-L701 HydrophobicContact CD1-CD1 4.29Å; Y625-L701 HydrophobicContact CE1-CD1 4.5Å
626	R	88.1	Confident	91.8	Very high	128 Å²	128	59.5 Å²	59.5	48%	0.483	27%	0.273	S	S	.	.	H	α-helix	trans	-81.7	-21.6	176.9	-68.9	174.2	170.1	165.9	-1	113.5	V622 R623 I624 D628 D698	V622-R626 WeakPolarHBondContact O-CG 3.35Å; V622-R626 PolarHBondContact O-N 3.12Å; R623-R626 WeakPolarHBondContact O-CB 3.45Å; R623-R626 PolarHBondContact O-N 3.38Å; R623-R626 VanDerWaalsContact O-N 3.14Å; I624-R626 PolarHBondContact O-N 3.1Å; I624-R626 VanDerWaalsContact O-N 3.14Å; R626-D628 VanDerWaalsContact C-N 3.27Å; R626-D628 PolarHBondContact O-N 3.25Å; R626-D698 IonicContact NH2-OD1 3.9Å
627	E	89.1	Confident	92.1	Very high	37 Å²	37	59.5 Å²	59.5	17%	0.173	28%	0.281	C	S	.	.	H	α-helix	trans	-64.5	-33.8	178.7	-162.1	104.5	-127.5	0	0	111.5	M605 R623 I624 K629 K630	M605-E627 HydrophobicContact CG-CB 4.28Å; M605-E627 HydrophobicContact CG-CG 3.99Å; M605-E627 HydrophobicContact SD-CB 4.09Å; M605-E627 HydrophobicContact SD-CG 4.08Å; R623-E627 PolarHBondContact O-N 3.45Å; I624-E627 WeakPolarHBondContact O-CB 3.25Å; I624-E627 PolarHBondContact O-N 3.11Å; E627-K629 PolarHBondContact O-N 2.87Å; E627-K629 VanDerWaalsContact O-N 3.12Å; E627-K630 VanDerWaalsContact O-CB 3.27Å; E627-K630 WeakPolarHBondContact O-CB 3.39Å; E627-K630 PolarHBondContact O-N 2.9Å; E627-K630 IonicContact OE1-NZ 3.21Å; E627-K630 PolarHBondContact OE1-NZ 3.18Å
628	D	90.9	Very high	92.2	Very high	4 Å²	4	57.3 Å²	57.3	2%	0.021	27%	0.269	C	S	.	.	H	α-helix	trans	-54.3	-33.9	-177.7	-167.5	55.2	0	0	0	113.9	M605 R626 K630 V631 D632 G670 Q674	M605-D628 HydrophobicContact CE-CB 3.82Å; R626-D628 VanDerWaalsContact C-N 3.27Å; R626-D628 PolarHBondContact O-N 3.25Å; D628-K630 PolarHBondContact O-N 3.1Å; D628-V631 WeakPolarHBondContact O-CA 3.42Å; D628-V631 WeakPolarHBondContact O-CB 3.45Å; D628-V631 PolarHBondContact O-N 2.85Å; D628-D632 PolarHBondContact O-N 3.41Å; D628-G670 WeakPolarHBondContact OD1-CA 3.45Å; D628-Q674 HydrophobicContact CB-CG 3.93Å
629	K	90.6	Very high	92.4	Very high	151 Å²	151	57.3 Å²	57.3	66%	0.657	27%	0.27	S	S	*	.	H	α-helix	trans	-56.2	-28.5	172.6	-83.9	-176.4	177	174.1	0	113.8	E627 Q633	E627-K629 PolarHBondContact O-N 2.87Å; E627-K629 VanDerWaalsContact O-N 3.12Å; K629-Q633 VanDerWaalsContact O-CG 3.25Å; K629-Q633 WeakPolarHBondContact O-CG 3.47Å; K629-Q633 PolarHBondContact O-N 3.49Å
630	K	93.4	Very high	92.6	Very high	107 Å²	107	58.1 Å²	58.1	47%	0.465	26%	0.263	S	S	.	.	H	α-helix	trans	-75.9	-38.7	175.7	-59.4	178.1	-170.5	162.2	0	110.7	E627 D628 D632 Q633 E634	E627-K630 VanDerWaalsContact O-CB 3.27Å; E627-K630 WeakPolarHBondContact O-CB 3.39Å; E627-K630 PolarHBondContact O-N 2.9Å; E627-K630 IonicContact OE1-NZ 3.21Å; E627-K630 PolarHBondContact OE1-NZ 3.18Å; D628-K630 PolarHBondContact O-N 3.1Å; K630-D632 VanDerWaalsContact C-N 3.33Å; K630-Q633 PolarHBondContact O-N 3.38Å; K630-E634 WeakPolarHBondContact O-CB 3.39Å; K630-E634 PolarHBondContact O-N 2.84Å
631	V	93.9	Very high	92.4	Very high	0 Å²	0	60.1 Å²	60.1	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-60.9	-45	174.6	178.1	0	0	0	0	109.8	L598 T602 M605 D628 Q633 E634 Y635	L598-V631 HydrophobicContact CD1-CG1 3.88Å; T602-V631 HydrophobicContact CG2-CG1 3.64Å; T602-V631 HydrophobicContact CG2-CG2 4.2Å; M605-V631 HydrophobicContact SD-CG2 3.57Å; M605-V631 VanDerWaalsContact SD-CG2 3.57Å; D628-V631 WeakPolarHBondContact O-CA 3.42Å; D628-V631 WeakPolarHBondContact O-CB 3.45Å; D628-V631 PolarHBondContact O-N 2.85Å; V631-Q633 VanDerWaalsContact C-N 3.35Å; V631-Q633 PolarHBondContact O-N 2.92Å; V631-E634 PolarHBondContact O-N 3.28Å; V631-Y635 WeakPolarHBondContact O-CB 3.44Å; V631-Y635 PolarHBondContact O-N 2.91Å
632	D	94.2	Very high	92.2	Very high	58 Å²	58	60 Å²	60	31%	0.31	27%	0.272	S	S	.	.	H	α-helix	trans	-56.8	-45.8	174.5	-74.3	-19.8	0	0	0	112.8	D628 K630 Y635 E636	D628-D632 PolarHBondContact O-N 3.41Å; K630-D632 VanDerWaalsContact C-N 3.33Å; D632-Y635 PolarHBondContact O-N 2.99Å; D632-E636 PolarHBondContact O-N 2.81Å
633	Q	94.8	Very high	92.1	Very high	138 Å²	138	63.9 Å²	63.9	65%	0.645	29%	0.29	S	S	*	.	H	α-helix	trans	-65.5	-40	179.4	-75	173	12.3	0	0	112	K629 K630 V631 G637	K629-Q633 VanDerWaalsContact O-CG 3.25Å; K629-Q633 WeakPolarHBondContact O-CG 3.47Å; K629-Q633 PolarHBondContact O-N 3.49Å; K630-Q633 PolarHBondContact O-N 3.38Å; V631-Q633 VanDerWaalsContact C-N 3.35Å; V631-Q633 PolarHBondContact O-N 2.92Å; Q633-G637 PolarHBondContact O-N 3.43Å
634	E	94.1	Very high	91.9	Very high	53 Å²	53	62.8 Å²	62.8	25%	0.248	30%	0.295	C	S	.	.	H	α-helix	trans	-67.3	-42.7	177.1	-165.9	170.5	-172.2	0	0	110.7	S597 L598 H601 K630 V631 G637 I638	S597-E634 WeakPolarHBondContact CB-OE1 3.41Å; S597-E634 PolarHBondContact OG-OE1 3.48Å; L598-E634 HydrophobicContact CD1-CB 3.82Å; L598-E634 HydrophobicContact CD1-CG 3.92Å; H601-E634 IonicContact CE1-OE2 2.8Å; H601-E634 IonicContact CG-OE2 3.66Å; H601-E634 IonicContact ND1-OE2 3.2Å; H601-E634 PolarHBondContact ND1-OE2 3.16Å; K630-E634 WeakPolarHBondContact O-CB 3.39Å; K630-E634 PolarHBondContact O-N 2.84Å; V631-E634 PolarHBondContact O-N 3.28Å; E634-G637 PolarHBondContact O-N 2.9Å; E634-I638 WeakPolarHBondContact O-CG1 3.44Å; E634-I638 PolarHBondContact O-N 3.09Å
635	Y	95.9	Very high	91.5	Very high	24 Å²	24	65.4 Å²	65.4	9%	0.094	31%	0.305	C	S	.	.	H	α-helix	trans	-59.2	-50.7	172.4	169.5	-110.5	0	0	0	112.2	V631 D632 G637 I638 V639 A663 R664 E667	V631-Y635 WeakPolarHBondContact O-CB 3.44Å; V631-Y635 PolarHBondContact O-N 2.91Å; D632-Y635 PolarHBondContact O-N 2.99Å; Y635-G637 PolarHBondContact O-N 2.89Å; Y635-I638 PolarHBondContact O-N 3.5Å; Y635-I638 VanDerWaalsContact O-N 3.09Å; Y635-V639 HydrophobicContact CD1-CG2 4.34Å; Y635-V639 HydrophobicContact CD2-CG2 4Å; Y635-V639 HydrophobicContact CE1-CG2 3.91Å; Y635-V639 HydrophobicContact CE2-CG2 3.51Å; Y635-V639 HydrophobicContact CG-CG2 4.38Å; Y635-V639 VanDerWaalsContact CZ-CG2 3.47Å; Y635-V639 WeakPolarHBondContact O-CG2 3.25Å; Y635-V639 PolarHBondContact O-N 2.69Å; Y635-A663 HydrophobicContact CD2-CB 3.99Å; Y635-A663 HydrophobicContact CE2-CB 3.91Å; Y635-R664 HydrophobicContact CE2-CB 4.12Å; Y635-R664 PolarHBondContact OH-NE 3.07Å; Y635-E667 HydrophobicContact CD1-CB 4.44Å; Y635-E667 HydrophobicContact CD1-CG 4.05Å; Y635-E667 HydrophobicContact CD2-CB 3.94Å; Y635-E667 HydrophobicContact CD2-CG 4.44Å; Y635-E667 HydrophobicContact CG-CB 3.88Å; Y635-E667 HydrophobicContact CG-CG 3.93Å
636	E	95.3	Very high	91.1	Very high	104 Å²	104	66 Å²	66	49%	0.486	31%	0.31	S	S	.	.	H	α-helix	trans	-57.6	-39	176.1	-83.9	-161.4	175.3	0	0	112	D632 V639 R640	D632-E636 PolarHBondContact O-N 2.81Å; E636-V639 PolarHBondContact O-N 3.44Å; E636-R640 WeakPolarHBondContact O-CG 3.29Å; E636-R640 PolarHBondContact O-N 2.88Å; E636-R640 IonicContact OE2-CZ 3.32Å; E636-R640 IonicContact OE2-NH2 2.73Å; E636-R640 PolarHBondContact OE2-NH2 3.37Å
637	G	93.9	Very high	91.1	Very high	31 Å²	31	68 Å²	68	32%	0.32	33%	0.326	S	S	.	.	H	α-helix	trans	-57.4	-49.9	173.7	0	0	0	0	0	111.9	Q633 E634 Y635 V639 R640 Q641	Q633-G637 PolarHBondContact O-N 3.43Å; E634-G637 PolarHBondContact O-N 2.9Å; Y635-G637 PolarHBondContact O-N 2.89Å; G637-V639 PolarHBondContact O-N 2.96Å; G637-R640 PolarHBondContact O-N 3.21Å; G637-Q641 PolarHBondContact O-N 3.16Å; G637-Q641 VanDerWaalsContact O-N 3.11Å
638	I	92.7	Very high	91	Very high	8 Å²	8	73.6 Å²	73.6	4%	0.041	35%	0.353	C	S	.	.	H	α-helix	trans	-62.6	-43.1	178.3	-68.1	165.6	0	0	0	111	S594 L595 L598 E634 Y635 R640 Q641 L642 A663	S594-I638 WeakPolarHBondContact O-CD1 3.48Å; L595-I638 HydrophobicContact CD2-CG2 4.4Å; L598-I638 HydrophobicContact CB-CD1 3.8Å; L598-I638 HydrophobicContact CD2-CD1 3.96Å; L598-I638 HydrophobicContact CG-CD1 4.34Å; E634-I638 WeakPolarHBondContact O-CG1 3.44Å; E634-I638 PolarHBondContact O-N 3.09Å; Y635-I638 PolarHBondContact O-N 3.5Å; Y635-I638 VanDerWaalsContact O-N 3.09Å; I638-R640 PolarHBondContact O-N 2.79Å; I638-Q641 WeakPolarHBondContact O-CB 3.4Å; I638-Q641 PolarHBondContact O-N 2.91Å; I638-Q641 VanDerWaalsContact O-N 3.15Å; I638-L642 HydrophobicContact CG2-CD1 3.73Å; I638-L642 HydrophobicContact CG2-CG 4.17Å; I638-L642 VanDerWaalsContact O-CG 3.32Å; I638-L642 WeakPolarHBondContact O-CG 3.48Å; I638-L642 PolarHBondContact O-N 2.82Å; I638-A663 HydrophobicContact CG2-CB 4.16Å
639	V	93.3	Very high	90.6	Very high	31 Å²	31	75.2 Å²	75.2	19%	0.188	36%	0.362	C	S	.	.	H	α-helix	trans	-59.2	-45.2	177.9	173	0	0	0	0	111.2	Y635 E636 G637 Q641 L642 M643 L660	Y635-V639 HydrophobicContact CD1-CG2 4.34Å; Y635-V639 HydrophobicContact CD2-CG2 4Å; Y635-V639 HydrophobicContact CE1-CG2 3.91Å; Y635-V639 HydrophobicContact CE2-CG2 3.51Å; Y635-V639 HydrophobicContact CG-CG2 4.38Å; Y635-V639 VanDerWaalsContact CZ-CG2 3.47Å; Y635-V639 WeakPolarHBondContact O-CG2 3.25Å; Y635-V639 PolarHBondContact O-N 2.69Å; E636-V639 PolarHBondContact O-N 3.44Å; G637-V639 PolarHBondContact O-N 2.96Å; V639-Q641 VanDerWaalsContact C-N 3.29Å; V639-Q641 PolarHBondContact O-N 3.38Å; V639-L642 PolarHBondContact O-N 2.81Å; V639-M643 WeakPolarHBondContact O-CG 3.22Å; V639-M643 PolarHBondContact O-N 3.31Å; V639-L660 HydrophobicContact CB-CD1 4.36Å; V639-L660 HydrophobicContact CG1-CD1 4.18Å; V639-L660 HydrophobicContact CG2-CD1 3.83Å
640	R	92.4	Very high	90.4	Very high	147 Å²	147	72.2 Å²	72.2	56%	0.555	36%	0.359	S	S	*	.	H	α-helix	trans	-62.1	-39.2	177.1	-68.8	174.3	-154.6	159.5	6.8	111.5	E636 G637 I638 M643 T644	E636-R640 WeakPolarHBondContact O-CG 3.29Å; E636-R640 PolarHBondContact O-N 2.88Å; E636-R640 IonicContact OE2-CZ 3.32Å; E636-R640 IonicContact OE2-NH2 2.73Å; E636-R640 PolarHBondContact OE2-NH2 3.37Å; G637-R640 PolarHBondContact O-N 3.21Å; I638-R640 PolarHBondContact O-N 2.79Å; R640-M643 PolarHBondContact O-N 3.28Å; R640-T644 PolarHBondContact O-N 3.43Å; R640-T644 VanDerWaalsContact O-N 3.13Å; R640-T644 PolarHBondContact O-OG1 2.93Å
641	Q	88.9	Confident	90	Very high	85 Å²	85	76.6 Å²	76.6	40%	0.397	37%	0.373	S	S	.	.	H	α-helix	trans	-65.1	-47.4	176.9	-134.1	174.8	-9.2	0	0	111.3	G637 I638 V639 M643 T644 Y645	G637-Q641 PolarHBondContact O-N 3.16Å; G637-Q641 VanDerWaalsContact O-N 3.11Å; I638-Q641 WeakPolarHBondContact O-CB 3.4Å; I638-Q641 PolarHBondContact O-N 2.91Å; I638-Q641 VanDerWaalsContact O-N 3.15Å; V639-Q641 VanDerWaalsContact C-N 3.29Å; V639-Q641 PolarHBondContact O-N 3.38Å; Q641-M643 PolarHBondContact O-N 3.45Å; Q641-T644 WeakPolarHBondContact O-CB 3.07Å; Q641-T644 PolarHBondContact O-N 3.49Å; Q641-T644 VanDerWaalsContact O-N 3.11Å; Q641-Y645 WeakPolarHBondContact O-CD2 3.48Å; Q641-Y645 PolarHBondContact O-N 3.1Å
642	L	88.3	Confident	89.4	Confident	0 Å²	0	77 Å²	77	0%	0	38%	0.376	C	S	.	.	H	α-helix	trans	-60.1	-42.1	176.1	-70.4	167.6	0	0	0	111.8	L591 I638 V639 T644 Y645 M646 V656 A659 L660	L591-L642 HydrophobicContact CD1-CD2 3.8Å; L591-L642 HydrophobicContact CD2-CD2 3.44Å; L591-L642 VanDerWaalsContact CD2-CD2 3.44Å; L591-L642 HydrophobicContact CD2-CG 4.12Å; L591-L642 HydrophobicContact CG-CD2 4.11Å; I638-L642 HydrophobicContact CG2-CD1 3.73Å; I638-L642 HydrophobicContact CG2-CG 4.17Å; I638-L642 VanDerWaalsContact O-CG 3.32Å; I638-L642 WeakPolarHBondContact O-CG 3.48Å; I638-L642 PolarHBondContact O-N 2.82Å; V639-L642 PolarHBondContact O-N 2.81Å; L642-T644 VanDerWaalsContact C-N 3.28Å; L642-T644 PolarHBondContact O-N 3.41Å; L642-Y645 PolarHBondContact O-N 3.19Å; L642-M646 PolarHBondContact O-N 3.03Å; L642-M646 VanDerWaalsContact O-N 3.1Å; L642-V656 HydrophobicContact CB-CG1 3.77Å; L642-V656 HydrophobicContact CD2-CG1 3.74Å; L642-V656 HydrophobicContact CG-CG1 4.33Å; L642-V656 WeakPolarHBondContact O-CG1 3.26Å; L642-A659 HydrophobicContact CD2-CB 3.77Å; L642-L660 HydrophobicContact CD1-CB 4.04Å; L642-L660 HydrophobicContact CD1-CD1 3.76Å
643	M	87.9	Confident	89	Confident	98 Å²	98	77.3 Å²	77.3	48%	0.483	38%	0.377	S	S	.	.	H	α-helix	trans	-60.9	-37.8	174.7	-72.8	-154.5	-60	0	0	112.5	V639 R640 Q641 Y645 M646 M647	V639-M643 WeakPolarHBondContact O-CG 3.22Å; V639-M643 PolarHBondContact O-N 3.31Å; R640-M643 PolarHBondContact O-N 3.28Å; Q641-M643 PolarHBondContact O-N 3.45Å; M643-Y645 PolarHBondContact O-N 3.27Å; M643-M646 HydrophobicContact CB-CE 4.37Å; M643-M646 HydrophobicContact CG-CE 3.94Å; M643-M646 PolarHBondContact O-N 3.22Å; M643-M647 WeakPolarHBondContact O-CG 3.38Å; M643-M647 PolarHBondContact O-N 3.38Å; M643-M647 VanDerWaalsContact O-N 3.07Å
644	T	87.5	Confident	88.6	Confident	82 Å²	82	74.7 Å²	74.7	50%	0.503	37%	0.371	S	S	.	.	H	α-helix	trans	-62.1	-44.3	177.3	-52	0	0	0	0	110.9	R640 Q641 L642 M646 M647 E648	R640-T644 PolarHBondContact O-N 3.43Å; R640-T644 VanDerWaalsContact O-N 3.13Å; R640-T644 PolarHBondContact O-OG1 2.93Å; Q641-T644 WeakPolarHBondContact O-CB 3.07Å; Q641-T644 PolarHBondContact O-N 3.49Å; Q641-T644 VanDerWaalsContact O-N 3.11Å; L642-T644 VanDerWaalsContact C-N 3.28Å; L642-T644 PolarHBondContact O-N 3.41Å; T644-M646 PolarHBondContact O-N 3Å; T644-M647 PolarHBondContact O-N 3.34Å; T644-E648 PolarHBondContact O-N 3.06Å
645	Y	83.9	Confident	88	Confident	55 Å²	55	73.3 Å²	73.3	22%	0.216	37%	0.368	C	S	.	.	H	α-helix	trans	-61.4	-41.5	175.2	-81	-74.7	0	0	0	113.3	L591 Q641 L642 M643 M647 E648 D649 T652	L591-Y645 HydrophobicContact CD1-CD2 4.14Å; L591-Y645 HydrophobicContact CD1-CE2 4.36Å; L591-Y645 HydrophobicContact CD1-CG 4.47Å; L591-Y645 HydrophobicContact CD2-CD2 3.64Å; L591-Y645 HydrophobicContact CD2-CE2 3.57Å; L591-Y645 HydrophobicContact CG-CD2 4.14Å; L591-Y645 HydrophobicContact CG-CE2 3.94Å; Q641-Y645 WeakPolarHBondContact O-CD2 3.48Å; Q641-Y645 PolarHBondContact O-N 3.1Å; L642-Y645 PolarHBondContact O-N 3.19Å; M643-Y645 PolarHBondContact O-N 3.27Å; Y645-M647 VanDerWaalsContact C-N 3.26Å; Y645-M647 PolarHBondContact O-N 3Å; Y645-E648 PolarHBondContact O-N 3.09Å; Y645-D649 PolarHBondContact O-N 3.04Å; Y645-D649 VanDerWaalsContact O-N 3.12Å; Y645-T652 PolarHBondContact O-OG1 3.33Å
646	M	85.2	Confident	87.6	Confident	45 Å²	45	72.2 Å²	72.2	22%	0.222	36%	0.363	C	S	.	.	H	α-helix	trans	-63.5	-32.5	175.9	-69	-171.5	-72.5	0	0	112.7	L642 M643 T644 I653 V656	L642-M646 PolarHBondContact O-N 3.03Å; L642-M646 VanDerWaalsContact O-N 3.1Å; M643-M646 HydrophobicContact CB-CE 4.37Å; M643-M646 HydrophobicContact CG-CE 3.94Å; M643-M646 PolarHBondContact O-N 3.22Å; T644-M646 PolarHBondContact O-N 3Å; M646-I653 HydrophobicContact CB-CG1 4.18Å; M646-I653 HydrophobicContact CG-CG1 4.13Å; M646-I653 HydrophobicContact SD-CG2 4.49Å; M646-V656 HydrophobicContact CE-CG1 4.32Å; M646-V656 HydrophobicContact CG-CB 3.81Å; M646-V656 HydrophobicContact CG-CG1 3.43Å; M646-V656 VanDerWaalsContact CG-CG1 3.43Å; M646-V656 HydrophobicContact CG-CG2 4.36Å; M646-V656 HydrophobicContact SD-CB 4.42Å; M646-V656 HydrophobicContact SD-CG1 3.93Å
647	M	87.5	Confident	87.3	Confident	169 Å²	169	70.3 Å²	70.3	83%	0.833	36%	0.356	S	S	*	.	H	α-helix	trans	-75.9	-31.2	176.3	-69.6	179.1	67	0	0	112.5	M643 T644 Y645	M643-M647 WeakPolarHBondContact O-CG 3.38Å; M643-M647 PolarHBondContact O-N 3.38Å; M643-M647 VanDerWaalsContact O-N 3.07Å; T644-M647 PolarHBondContact O-N 3.34Å; Y645-M647 VanDerWaalsContact C-N 3.26Å; Y645-M647 PolarHBondContact O-N 3Å
648	E	86.3	Confident	87	Confident	156 Å²	156	70.2 Å²	70.2	73%	0.729	35%	0.349	S	S	*	.	H	α-helix	trans	-74.5	-42.7	-179.8	-121.9	179.1	176.2	0	0	112.8	T644 Y645	T644-E648 PolarHBondContact O-N 3.06Å; Y645-E648 PolarHBondContact O-N 3.09Å
649	D	83.1	Confident	86.8	Confident	38 Å²	38	69.8 Å²	69.8	20%	0.203	35%	0.347	C	S	.	.			trans	-143.5	109.7	177.5	-173.9	-8.2	0	0	0	112.2	Y645 R651 T652	Y645-D649 PolarHBondContact O-N 3.04Å; Y645-D649 VanDerWaalsContact O-N 3.12Å; D649-R651 PolarHBondContact O-N 3.1Å; D649-R651 VanDerWaalsContact OD1-CB 3.26Å; D649-R651 WeakPolarHBondContact OD1-CB 3.01Å; D649-R651 WeakPolarHBondContact OD1-CG 3.45Å; D649-R651 IonicContact OD1-CZ 3.75Å; D649-R651 PolarHBondContact OD1-N 3.38Å; D649-R651 IonicContact OD1-NE 2.93Å; D649-R651 PolarHBondContact OD1-NE 2.92Å; D649-R651 IonicContact OD1-NH2 3.69Å; D649-R651 IonicContact OD2-CZ 3.32Å; D649-R651 IonicContact OD2-NE 3.13Å; D649-R651 PolarHBondContact OD2-NE 3.45Å; D649-R651 VanDerWaalsContact OD2-NE 3.13Å; D649-R651 IonicContact OD2-NH2 2.72Å; D649-R651 PolarHBondContact OD2-NH2 2.91Å; D649-T652 HydrophobicContact CB-CG2 3.91Å; D649-T652 WeakPolarHBondContact O-CB 3.27Å; D649-T652 PolarHBondContact O-N 2.98Å; D649-T652 PolarHBondContact O-OG1 3.2Å
650	S	86.1	Confident	86.6	Confident	87 Å²	87	70.1 Å²	70.1	61%	0.608	35%	0.348	S	S	*	.	G	3₁₀ helix	trans	-61.7	-18.2	-179.7	65.6	0	0	0	0	114.1	T652 I653	S650-T652 PolarHBondContact O-N 3.13Å; S650-I653 WeakPolarHBondContact O-CD1 3.37Å; S650-I653 WeakPolarHBondContact O-CG1 3.33Å
651	R	84.6	Confident	86.6	Confident	199 Å²	199	69.2 Å²	69.2	75%	0.751	35%	0.348	S	S	*	.	G	3₁₀ helix	trans	-72.6	-19.3	177	-61.2	171.3	-67	-178.6	3.2	112.4	D649	D649-R651 PolarHBondContact O-N 3.1Å; D649-R651 VanDerWaalsContact OD1-CB 3.26Å; D649-R651 WeakPolarHBondContact OD1-CB 3.01Å; D649-R651 WeakPolarHBondContact OD1-CG 3.45Å; D649-R651 IonicContact OD1-CZ 3.75Å; D649-R651 PolarHBondContact OD1-N 3.38Å; D649-R651 IonicContact OD1-NE 2.93Å; D649-R651 PolarHBondContact OD1-NE 2.92Å; D649-R651 IonicContact OD1-NH2 3.69Å; D649-R651 IonicContact OD2-CZ 3.32Å; D649-R651 IonicContact OD2-NE 3.13Å; D649-R651 PolarHBondContact OD2-NE 3.45Å; D649-R651 VanDerWaalsContact OD2-NE 3.13Å; D649-R651 IonicContact OD2-NH2 2.72Å; D649-R651 PolarHBondContact OD2-NH2 2.91Å
652	T	81.1	Confident	86.8	Confident	10 Å²	10	65.2 Å²	65.2	6%	0.061	33%	0.33	C	S	.	.	G	3₁₀ helix	trans	-85.1	-13	-178.9	68.4	0	0	0	0	113.2	H588 Y645 D649 S650 P654 S655 V656	H588-T652 WeakPolarHBondContact NE2-CB 3.49Å; H588-T652 WeakPolarHBondContact NE2-CG2 3.43Å; Y645-T652 PolarHBondContact O-OG1 3.33Å; D649-T652 HydrophobicContact CB-CG2 3.91Å; D649-T652 WeakPolarHBondContact O-CB 3.27Å; D649-T652 PolarHBondContact O-N 2.98Å; D649-T652 PolarHBondContact O-OG1 3.2Å; S650-T652 PolarHBondContact O-N 3.13Å; T652-P654 VanDerWaalsContact C-CD 3.43Å; T652-P654 VanDerWaalsContact C-N 3.33Å; T652-P654 VanDerWaalsContact O-N 3.14Å; T652-S655 PolarHBondContact O-N 2.88Å; T652-V656 WeakPolarHBondContact O-CG2 3.26Å; T652-V656 PolarHBondContact O-N 2.88Å
653	I	86.5	Confident	87.1	Confident	64 Å²	64	65.2 Å²	65.2	33%	0.328	33%	0.33	S	S	.	.	H	α-helix	trans	-47.5	-46.1	-175.2	-67.6	171.9	0	0	0	113.2	M646 S650 V656 L657	M646-I653 HydrophobicContact CB-CG1 4.18Å; M646-I653 HydrophobicContact CG-CG1 4.13Å; M646-I653 HydrophobicContact SD-CG2 4.49Å; S650-I653 WeakPolarHBondContact O-CD1 3.37Å; S650-I653 WeakPolarHBondContact O-CG1 3.33Å; I653-V656 PolarHBondContact O-N 3.43Å; I653-L657 HydrophobicContact CG2-CD1 3.78Å; I653-L657 HydrophobicContact CG2-CG 4.23Å; I653-L657 WeakPolarHBondContact O-CB 3.19Å; I653-L657 VanDerWaalsContact O-CG 3.31Å; I653-L657 WeakPolarHBondContact O-CG 3.37Å; I653-L657 PolarHBondContact O-N 3.24Å
654	P	86.2	Confident	87.4	Confident	82 Å²	82	66.7 Å²	66.7	53%	0.532	33%	0.33	S	S	.	.	H	α-helix	trans	-60.3	-49.3	179.3	-23.2	34.6	0	0	0	112.8	T652 V656 L657 T658	T652-P654 VanDerWaalsContact C-CD 3.43Å; T652-P654 VanDerWaalsContact C-N 3.33Å; T652-P654 VanDerWaalsContact O-N 3.14Å; P654-V656 VanDerWaalsContact C-N 3.34Å; P654-V656 PolarHBondContact O-N 3Å; P654-L657 PolarHBondContact O-N 2.98Å; P654-T658 PolarHBondContact O-N 3.5Å; P654-T658 VanDerWaalsContact O-N 3.09Å; P654-T658 PolarHBondContact O-OG1 3.28Å
655	S	82.3	Confident	87.8	Confident	25 Å²	25	63.6 Å²	63.6	18%	0.175	31%	0.312	C	S	.	.	H	α-helix	trans	-64.1	-40.8	179.8	-42.4	0	0	0	0	111.6	F584 T652 T658 A659	F584-S655 VanDerWaalsContact CE1-O 3.3Å; F584-S655 WeakPolarHBondContact CE1-O 3.46Å; F584-S655 VanDerWaalsContact CZ-O 3.27Å; F584-S655 WeakPolarHBondContact CZ-O 3.38Å; T652-S655 PolarHBondContact O-N 2.88Å; S655-T658 PolarHBondContact O-N 3.48Å; S655-A659 PolarHBondContact O-N 2.79Å
656	V	86.4	Confident	88.3	Confident	0 Å²	0	61 Å²	61	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-68.8	-35.4	179	176.9	0	0	0	0	111.4	L591 L642 M646 T652 I653 P654 A659 L660	L591-V656 HydrophobicContact CD1-CG2 4.41Å; L642-V656 HydrophobicContact CB-CG1 3.77Å; L642-V656 HydrophobicContact CD2-CG1 3.74Å; L642-V656 HydrophobicContact CG-CG1 4.33Å; L642-V656 WeakPolarHBondContact O-CG1 3.26Å; M646-V656 HydrophobicContact CE-CG1 4.32Å; M646-V656 HydrophobicContact CG-CB 3.81Å; M646-V656 HydrophobicContact CG-CG1 3.43Å; M646-V656 VanDerWaalsContact CG-CG1 3.43Å; M646-V656 HydrophobicContact CG-CG2 4.36Å; M646-V656 HydrophobicContact SD-CB 4.42Å; M646-V656 HydrophobicContact SD-CG1 3.93Å; T652-V656 WeakPolarHBondContact O-CG2 3.26Å; T652-V656 PolarHBondContact O-N 2.88Å; I653-V656 PolarHBondContact O-N 3.43Å; P654-V656 VanDerWaalsContact C-N 3.34Å; P654-V656 PolarHBondContact O-N 3Å; V656-A659 PolarHBondContact O-N 2.82Å; V656-L660 WeakPolarHBondContact O-CB 3.41Å; V656-L660 PolarHBondContact O-N 3.4Å
657	L	88.8	Confident	88.8	Confident	65 Å²	65	60.2 Å²	60.2	34%	0.34	30%	0.297	S	S	.	.	H	α-helix	trans	-64.6	-41.9	172.3	-79.7	171.4	0	0	0	111.7	I653 P654 A659 L660 F661	I653-L657 HydrophobicContact CG2-CD1 3.78Å; I653-L657 HydrophobicContact CG2-CG 4.23Å; I653-L657 WeakPolarHBondContact O-CB 3.19Å; I653-L657 VanDerWaalsContact O-CG 3.31Å; I653-L657 WeakPolarHBondContact O-CG 3.37Å; I653-L657 PolarHBondContact O-N 3.24Å; P654-L657 PolarHBondContact O-N 2.98Å; L657-A659 VanDerWaalsContact C-N 3.33Å; L657-A659 PolarHBondContact O-N 2.84Å; L657-L660 HydrophobicContact CD2-CD2 4.27Å; L657-L660 WeakPolarHBondContact O-CB 3.45Å; L657-L660 PolarHBondContact O-N 2.73Å; L657-F661 HydrophobicContact CB-CE2 4.34Å; L657-F661 WeakPolarHBondContact O-CD2 3.16Å; L657-F661 PolarHBondContact O-N 2.88Å
658	T	87.6	Confident	89.2	Confident	28 Å²	28	58.3 Å²	58.3	17%	0.172	28%	0.281	C	S	.	.	H	α-helix	trans	-60.1	-45.7	174.3	-52.9	0	0	0	0	111	T579 E582 P654 S655 L660 F661 C662	T579-T658 HydrophobicContact CG2-CG2 4.14Å; E582-T658 HydrophobicContact CG-CG2 4.34Å; E582-T658 PolarHBondContact OE1-OG1 3Å; E582-T658 WeakPolarHBondContact OE2-CB 3.45Å; E582-T658 VanDerWaalsContact OE2-CG2 3.28Å; E582-T658 WeakPolarHBondContact OE2-CG2 3.49Å; E582-T658 PolarHBondContact OE2-OG1 2.7Å; P654-T658 PolarHBondContact O-N 3.5Å; P654-T658 VanDerWaalsContact O-N 3.09Å; P654-T658 PolarHBondContact O-OG1 3.28Å; S655-T658 PolarHBondContact O-N 3.48Å; T658-L660 VanDerWaalsContact C-N 3.31Å; T658-L660 PolarHBondContact O-N 2.88Å; T658-F661 PolarHBondContact O-N 3.44Å; T658-C662 WeakPolarHBondContact O-CB 3.46Å; T658-C662 PolarHBondContact O-N 3.43Å
659	A	88.4	Confident	89.7	Confident	0 Å²	0	51 Å²	51	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-61	-37.8	174.5	0	0	0	0	0	112.6	F584 L595 L642 S655 V656 L657 C662 A663	F584-A659 HydrophobicContact CE1-CB 4.23Å; F584-A659 HydrophobicContact CZ-CB 4.05Å; L595-A659 HydrophobicContact CD1-CB 4.09Å; L642-A659 HydrophobicContact CD2-CB 3.77Å; S655-A659 PolarHBondContact O-N 2.79Å; V656-A659 PolarHBondContact O-N 2.82Å; L657-A659 VanDerWaalsContact C-N 3.33Å; L657-A659 PolarHBondContact O-N 2.84Å; A659-C662 WeakPolarHBondContact O-CB 3.22Å; A659-C662 PolarHBondContact O-N 3.12Å; A659-A663 WeakPolarHBondContact O-CB 3.39Å; A659-A663 PolarHBondContact O-N 2.77Å
660	L	90.8	Very high	90.2	Very high	37 Å²	37	49.1 Å²	49.1	19%	0.194	24%	0.237	C	C	.	.	H	α-helix	trans	-65.6	-43.1	175.8	-173.1	75.6	0	0	0	112.1	V639 L642 V656 L657 T658 C662 A663 R664	V639-L660 HydrophobicContact CB-CD1 4.36Å; V639-L660 HydrophobicContact CG1-CD1 4.18Å; V639-L660 HydrophobicContact CG2-CD1 3.83Å; L642-L660 HydrophobicContact CD1-CB 4.04Å; L642-L660 HydrophobicContact CD1-CD1 3.76Å; V656-L660 WeakPolarHBondContact O-CB 3.41Å; V656-L660 PolarHBondContact O-N 3.4Å; L657-L660 HydrophobicContact CD2-CD2 4.27Å; L657-L660 WeakPolarHBondContact O-CB 3.45Å; L657-L660 PolarHBondContact O-N 2.73Å; T658-L660 VanDerWaalsContact C-N 3.31Å; T658-L660 PolarHBondContact O-N 2.88Å; L660-C662 VanDerWaalsContact C-N 3.3Å; L660-A663 PolarHBondContact O-N 3.38Å; L660-R664 PolarHBondContact O-N 3.28Å
661	F	91.9	Very high	90.6	Very high	129 Å²	129	47.9 Å²	47.9	57%	0.566	22%	0.223	S	C	*	.	H	α-helix	trans	-66.1	-35.1	175.2	-72.1	-58.9	0	0	0	111.7	L657 T658 S665	L657-F661 HydrophobicContact CB-CE2 4.34Å; L657-F661 WeakPolarHBondContact O-CD2 3.16Å; L657-F661 PolarHBondContact O-N 2.88Å; T658-F661 PolarHBondContact O-N 3.44Å; F661-S665 WeakPolarHBondContact O-CB 3.44Å; F661-S665 PolarHBondContact O-N 3.41Å; F661-S665 PolarHBondContact O-OG 2.97Å
662	C	92.6	Very high	91.1	Very high	1 Å²	1	40.4 Å²	40.4	1%	0.007	20%	0.195	C	C	.	.	H	α-helix	trans	-63.1	-51.4	171.2	-166.1	0	0	0	0	110.9	T579 L595 T658 A659 L660 R664 S665 I666	T579-C662 HydrophobicContact CG2-CB 4.14Å; T579-C662 WeakPolarHBondContact OG1-CB 3.35Å; L595-C662 HydrophobicContact CD1-CB 4.4Å; T658-C662 WeakPolarHBondContact O-CB 3.46Å; T658-C662 PolarHBondContact O-N 3.43Å; A659-C662 WeakPolarHBondContact O-CB 3.22Å; A659-C662 PolarHBondContact O-N 3.12Å; L660-C662 VanDerWaalsContact C-N 3.3Å; C662-R664 VanDerWaalsContact C-N 3.31Å; C662-R664 PolarHBondContact O-N 2.71Å; C662-S665 WeakPolarHBondContact O-CA 3.4Å; C662-S665 WeakPolarHBondContact O-CB 3.42Å; C662-S665 PolarHBondContact O-N 2.9Å; C662-I666 WeakPolarHBondContact O-CG1 3.37Å; C662-I666 PolarHBondContact O-N 3.06Å
663	A	93.7	Very high	91.8	Very high	0 Å²	0	40 Å²	40	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-53.4	-46.8	177.4	0	0	0	0	0	112.1	L595 Y635 I638 A659 L660 S665 I666 E667	L595-A663 HydrophobicContact CD2-CB 3.57Å; Y635-A663 HydrophobicContact CD2-CB 3.99Å; Y635-A663 HydrophobicContact CE2-CB 3.91Å; I638-A663 HydrophobicContact CG2-CB 4.16Å; A659-A663 WeakPolarHBondContact O-CB 3.39Å; A659-A663 PolarHBondContact O-N 2.77Å; L660-A663 PolarHBondContact O-N 3.38Å; A663-S665 VanDerWaalsContact C-N 3.33Å; A663-S665 PolarHBondContact O-N 3.03Å; A663-I666 PolarHBondContact O-N 3.23Å; A663-E667 PolarHBondContact O-N 2.74Å
664	R	95.5	Very high	92.2	Very high	129 Å²	129	38.6 Å²	38.6	49%	0.487	18%	0.184	S	C	.	.	H	α-helix	trans	-67.1	-32.5	176.7	174.8	168	-82.2	171.5	-5.3	112.8	Y635 L660 C662 R668	Y635-R664 HydrophobicContact CE2-CB 4.12Å; Y635-R664 PolarHBondContact OH-NE 3.07Å; L660-R664 PolarHBondContact O-N 3.28Å; C662-R664 VanDerWaalsContact C-N 3.31Å; C662-R664 PolarHBondContact O-N 2.71Å; R664-R668 WeakPolarHBondContact O-CG 3.26Å; R664-R668 PolarHBondContact O-N 3.19Å
665	S	94.7	Very high	92.6	Very high	17 Å²	17	37 Å²	37	12%	0.119	17%	0.171	C	C	.	.	H	α-helix	trans	-71.3	-37.9	176.6	-56.7	0	0	0	0	110.7	V572 F661 C662 A663	V572-S665 VanDerWaalsContact CG1-O 3.26Å; V572-S665 WeakPolarHBondContact CG1-O 3.37Å; V572-S665 WeakPolarHBondContact CG2-O 3.48Å; F661-S665 WeakPolarHBondContact O-CB 3.44Å; F661-S665 PolarHBondContact O-N 3.41Å; F661-S665 PolarHBondContact O-OG 2.97Å; C662-S665 WeakPolarHBondContact O-CA 3.4Å; C662-S665 WeakPolarHBondContact O-CB 3.42Å; C662-S665 PolarHBondContact O-N 2.9Å; A663-S665 VanDerWaalsContact C-N 3.33Å; A663-S665 PolarHBondContact O-N 3.03Å
666	I	95.8	Very high	93.2	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-65.9	-48.3	174.3	-65	169.7	0	0	0	110.8	I507 I576 L595 L598 T602 C662 A663 R668 I669	I507-I666 HydrophobicContact CD1-CD1 3.87Å; I507-I666 HydrophobicContact CD1-CG1 4.47Å; I576-I666 HydrophobicContact CD1-CD1 4.43Å; I576-I666 HydrophobicContact CD1-CG1 3.85Å; I576-I666 HydrophobicContact CG1-CD1 4.46Å; I576-I666 HydrophobicContact CG1-CG1 4.04Å; L595-I666 HydrophobicContact CD2-CD1 4.37Å; L598-I666 HydrophobicContact CB-CG2 4.25Å; L598-I666 HydrophobicContact CD2-CB 4.07Å; L598-I666 HydrophobicContact CD2-CG2 3.77Å; L598-I666 HydrophobicContact CG-CG2 3.66Å; T602-I666 HydrophobicContact CG2-CG2 3.98Å; T602-I666 WeakPolarHBondContact OG1-CG2 3.47Å; C662-I666 WeakPolarHBondContact O-CG1 3.37Å; C662-I666 PolarHBondContact O-N 3.06Å; A663-I666 PolarHBondContact O-N 3.23Å; I666-R668 VanDerWaalsContact C-N 3.27Å; I666-R668 PolarHBondContact O-N 3.02Å; I666-I669 WeakPolarHBondContact O-CB 3.45Å; I666-I669 WeakPolarHBondContact O-CG1 3.1Å; I666-I669 PolarHBondContact O-N 3.39Å
667	E	95.7	Very high	93.6	Very high	28 Å²	28	35.9 Å²	35.9	13%	0.131	16%	0.164	C	C	.	.	H	α-helix	trans	-57.8	-39.5	178	166.8	-96.7	-159.5	0	0	112.1	Y635 A663 I669 G670	Y635-E667 HydrophobicContact CD1-CB 4.44Å; Y635-E667 HydrophobicContact CD1-CG 4.05Å; Y635-E667 HydrophobicContact CD2-CB 3.94Å; Y635-E667 HydrophobicContact CD2-CG 4.44Å; Y635-E667 HydrophobicContact CG-CB 3.88Å; Y635-E667 HydrophobicContact CG-CG 3.93Å; A663-E667 PolarHBondContact O-N 2.74Å; E667-I669 PolarHBondContact O-N 2.62Å; E667-G670 WeakPolarHBondContact O-CA 3.45Å; E667-G670 PolarHBondContact O-N 3.03Å
668	R	95.3	Very high	93.8	Very high	130 Å²	130	33.8 Å²	33.8	49%	0.491	15%	0.152	S	C	.	.	H	α-helix	trans	-57.5	-18.2	171.7	-82.2	178.9	162.6	-169.5	-5.8	115	R664 I666 G670 R672	R664-R668 WeakPolarHBondContact O-CG 3.26Å; R664-R668 PolarHBondContact O-N 3.19Å; I666-R668 VanDerWaalsContact C-N 3.27Å; I666-R668 PolarHBondContact O-N 3.02Å; R668-G670 VanDerWaalsContact C-N 3.3Å; R668-R672 VanDerWaalsContact O-CG 3.23Å; R668-R672 WeakPolarHBondContact O-CG 3.15Å; R668-R672 PolarHBondContact O-N 3.32Å
669	I	96.5	Very high	94.1	Very high	1 Å²	1	33.2 Å²	33.2	1%	0.005	15%	0.147	C	C	.	.	H	α-helix	trans	-66.9	-38.5	171.4	-58.6	169	0	0	0	109.7	L503 I569 V572 T602 I666 E667 R672 C673	L503-I669 HydrophobicContact CD1-CD1 3.88Å; L503-I669 HydrophobicContact CD1-CG2 4.5Å; L503-I669 HydrophobicContact CD2-CD1 3.48Å; L503-I669 VanDerWaalsContact CD2-CD1 3.48Å; L503-I669 HydrophobicContact CG-CD1 4.35Å; I569-I669 HydrophobicContact CD1-CG2 4.43Å; I569-I669 HydrophobicContact CG1-CG2 4.44Å; I569-I669 HydrophobicContact CG2-CG1 4.37Å; I569-I669 HydrophobicContact CG2-CG2 4.05Å; V572-I669 HydrophobicContact CB-CD1 4.34Å; V572-I669 HydrophobicContact CB-CG1 4.21Å; V572-I669 HydrophobicContact CG1-CD1 3.8Å; V572-I669 HydrophobicContact CG1-CG1 3.99Å; V572-I669 HydrophobicContact CG2-CG1 4.15Å; T602-I669 HydrophobicContact CG2-CB 4.42Å; I666-I669 WeakPolarHBondContact O-CB 3.45Å; I666-I669 WeakPolarHBondContact O-CG1 3.1Å; I666-I669 PolarHBondContact O-N 3.39Å; E667-I669 PolarHBondContact O-N 2.62Å; I669-R672 PolarHBondContact O-N 3.48Å; I669-C673 PolarHBondContact O-N 3.02Å; I669-C673 PolarHBondContact O-SG 3.06Å
670	G	94.8	Very high	94.3	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-58.4	-53.8	175.1	0	0	0	0	0	112.2	D628 E667 R668 R672 C673 Q674	D628-G670 WeakPolarHBondContact OD1-CA 3.45Å; E667-G670 WeakPolarHBondContact O-CA 3.45Å; E667-G670 PolarHBondContact O-N 3.03Å; R668-G670 VanDerWaalsContact C-N 3.3Å; G670-R672 PolarHBondContact O-N 3.16Å; G670-R672 VanDerWaalsContact O-N 3.14Å; G670-C673 CarbonylContact O-C 3.6Å; G670-C673 WeakPolarHBondContact O-CA 3.31Å; G670-C673 WeakPolarHBondContact O-CB 3.34Å; G670-C673 PolarHBondContact O-N 3.31Å; G670-Q674 PolarHBondContact O-N 3.27Å
671	D	93.7	Very high	94.3	Very high	61 Å²	61	31.8 Å²	31.8	33%	0.326	14%	0.139	S	C	.	.	H	α-helix	trans	-49.1	-43	173.5	-78.2	-18.4	0	0	0	112.4	Q674 N675	D671-Q674 WeakPolarHBondContact O-CB 3.48Å; D671-Q674 PolarHBondContact O-N 2.95Å; D671-N675 PolarHBondContact O-N 2.89Å
672	R	95.7	Very high	94.2	Very high	42 Å²	42	28.7 Å²	28.7	16%	0.158	12%	0.124	C	C	.	.	H	α-helix	trans	-73	-36.7	-179.1	-66.2	-169.8	-171.4	-59.1	-2.2	112.5	E565 R568 I569 R668 I669 G670 Q674 N675 I676	E565-R672 IonicContact OE1-NH1 2.84Å; E565-R672 WeakPolarHBondContact OE2-CG 3.29Å; E565-R672 IonicContact OE2-CZ 2.77Å; E565-R672 IonicContact OE2-NH1 3.36Å; E565-R672 PolarHBondContact OE2-NH1 3.26Å; R568-R672 VanDerWaalsContact CD-CZ 3.43Å; R568-R672 PolarHBondContact O-NE 3.34Å; I569-R672 HydrophobicContact CD1-CB 3.75Å; I569-R672 HydrophobicContact CG1-CB 3.7Å; I569-R672 VanDerWaalsContact CG1-CD 3.47Å; I569-R672 HydrophobicContact CG1-CG 4.21Å; R668-R672 VanDerWaalsContact O-CG 3.23Å; R668-R672 WeakPolarHBondContact O-CG 3.15Å; R668-R672 PolarHBondContact O-N 3.32Å; I669-R672 PolarHBondContact O-N 3.48Å; G670-R672 PolarHBondContact O-N 3.16Å; G670-R672 VanDerWaalsContact O-N 3.14Å; R672-Q674 VanDerWaalsContact C-N 3.29Å; R672-N675 WeakPolarHBondContact O-CB 3.49Å; R672-N675 PolarHBondContact O-N 3.34Å; R672-I676 WeakPolarHBondContact O-CG1 3.19Å; R672-I676 PolarHBondContact O-N 3.2Å; R672-I676 VanDerWaalsContact O-N 3.07Å
673	C	96.2	Very high	94.1	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-63.4	-38.6	171.4	-65.2	0	0	0	0	110.8	M605 V609 I669 G670 I676 C677	M605-C673 HydrophobicContact CE-CB 3.94Å; V609-C673 HydrophobicContact CG1-CB 4.16Å; I669-C673 PolarHBondContact O-N 3.02Å; I669-C673 PolarHBondContact O-SG 3.06Å; G670-C673 CarbonylContact O-C 3.6Å; G670-C673 WeakPolarHBondContact O-CA 3.31Å; G670-C673 WeakPolarHBondContact O-CB 3.34Å; G670-C673 PolarHBondContact O-N 3.31Å; C673-I676 PolarHBondContact O-N 3.31Å; C673-C677 PolarHBondContact O-N 2.77Å; C673-C677 PolarHBondContact O-SG 3.35Å
674	Q	93.3	Very high	93.8	Very high	36 Å²	36	34.3 Å²	34.3	17%	0.168	15%	0.153	C	C	.	.	H	α-helix	trans	-56.9	-50.5	170.2	-103.4	-161.6	-7.4	0	0	111.4	Y625 D628 G670 D671 R672 I676 C677 E678	Y625-Q674 HydrophobicContact CD2-CB 4.16Å; Y625-Q674 HydrophobicContact CD2-CG 3.56Å; Y625-Q674 HydrophobicContact CE2-CB 4.16Å; Y625-Q674 HydrophobicContact CE2-CG 3.69Å; Y625-Q674 HydrophobicContact CG-CG 4.11Å; Y625-Q674 PolarHBondContact O-NE2 2.97Å; D628-Q674 HydrophobicContact CB-CG 3.93Å; G670-Q674 PolarHBondContact O-N 3.27Å; D671-Q674 WeakPolarHBondContact O-CB 3.48Å; D671-Q674 PolarHBondContact O-N 2.95Å; R672-Q674 VanDerWaalsContact C-N 3.29Å; Q674-I676 VanDerWaalsContact C-N 3.25Å; Q674-I676 PolarHBondContact O-N 3.27Å; Q674-C677 WeakPolarHBondContact O-CA 3.2Å; Q674-C677 VanDerWaalsContact O-CB 3.27Å; Q674-C677 WeakPolarHBondContact O-CB 3.46Å; Q674-C677 PolarHBondContact O-N 2.73Å; Q674-E678 WeakPolarHBondContact O-CG 3.18Å; Q674-E678 PolarHBondContact O-N 3.02Å
675	N	94.5	Very high	93.3	Very high	47 Å²	47	31.9 Å²	31.9	25%	0.251	15%	0.146	S	C	.	.	H	α-helix	trans	-54.4	-42.2	177.6	-66.4	-27.7	0	0	0	111.9	E565 D671 R672 C677 E678 F679	E565-N675 HydrophobicContact CG-CB 4.18Å; E565-N675 PolarHBondContact OE2-ND2 3.48Å; D671-N675 PolarHBondContact O-N 2.89Å; R672-N675 WeakPolarHBondContact O-CB 3.49Å; R672-N675 PolarHBondContact O-N 3.34Å; N675-C677 PolarHBondContact O-N 3.28Å; N675-E678 WeakPolarHBondContact O-CB 3.44Å; N675-E678 PolarHBondContact O-N 3.47Å; N675-F679 HydrophobicContact CB-CE2 4.29Å; N675-F679 HydrophobicContact CB-CZ 4.04Å; N675-F679 VanDerWaalsContact O-CD1 3.26Å; N675-F679 WeakPolarHBondContact O-CD1 3.39Å; N675-F679 WeakPolarHBondContact O-CD2 3.26Å; N675-F679 WeakPolarHBondContact O-CG 3.35Å; N675-F679 PolarHBondContact O-N 3.16Å
676	I	95.6	Very high	92.6	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-65	-39.4	177.4	-61.6	169	0	0	0	110.9	T562 E565 L566 I569 V609 F613 R672 C673 Q674 E678 F679 I680	T562-I676 HydrophobicContact CG2-CD1 4.21Å; T562-I676 HydrophobicContact CG2-CG1 4.19Å; T562-I676 HydrophobicContact CG2-CG2 4.14Å; E565-I676 HydrophobicContact CB-CD1 4.34Å; E565-I676 HydrophobicContact CB-CG1 4.15Å; L566-I676 HydrophobicContact CD2-CD1 4.29Å; I569-I676 HydrophobicContact CD1-CD1 4.49Å; V609-I676 HydrophobicContact CG1-CB 4.5Å; V609-I676 HydrophobicContact CG1-CD1 4.28Å; V609-I676 HydrophobicContact CG1-CG2 4.41Å; V609-I676 HydrophobicContact CG2-CB 3.87Å; V609-I676 HydrophobicContact CG2-CG2 3.68Å; F613-I676 HydrophobicContact CD2-CG2 4.23Å; R672-I676 WeakPolarHBondContact O-CG1 3.19Å; R672-I676 PolarHBondContact O-N 3.2Å; R672-I676 VanDerWaalsContact O-N 3.07Å; C673-I676 PolarHBondContact O-N 3.31Å; Q674-I676 VanDerWaalsContact C-N 3.25Å; Q674-I676 PolarHBondContact O-N 3.27Å; I676-E678 VanDerWaalsContact C-N 3.32Å; I676-E678 PolarHBondContact O-N 3.3Å; I676-F679 WeakPolarHBondContact O-CB 3.43Å; I676-F679 PolarHBondContact O-N 3.36Å; I676-F679 VanDerWaalsContact O-N 3.15Å; I676-I680 HydrophobicContact CG2-CD1 4.44Å; I676-I680 WeakPolarHBondContact O-CG1 3.28Å; I676-I680 PolarHBondContact O-N 2.91Å
677	C	94.4	Very high	91.8	Very high	3 Å²	3	37.5 Å²	37.5	2%	0.02	18%	0.178	C	C	.	.	H	α-helix	trans	-59.5	-42.2	173.4	-62.6	0	0	0	0	111.8	V609 A621 Y625 C673 Q674 N675 F679 I680 F681	V609-C677 WeakPolarHBondContact CG2-SG 3.34Å; A621-C677 HydrophobicContact CB-CB 4.13Å; A621-C677 PolarHBondContact O-SG 2.87Å; A621-C677 VanDerWaalsContact O-SG 3.41Å; Y625-C677 HydrophobicContact CD2-CB 4.16Å; C673-C677 PolarHBondContact O-N 2.77Å; C673-C677 PolarHBondContact O-SG 3.35Å; Q674-C677 WeakPolarHBondContact O-CA 3.2Å; Q674-C677 VanDerWaalsContact O-CB 3.27Å; Q674-C677 WeakPolarHBondContact O-CB 3.46Å; Q674-C677 PolarHBondContact O-N 2.73Å; N675-C677 PolarHBondContact O-N 3.28Å; C677-F679 VanDerWaalsContact C-N 3.29Å; C677-F679 PolarHBondContact O-N 2.92Å; C677-I680 PolarHBondContact O-N 3.48Å; C677-F681 PolarHBondContact O-N 2.97Å
678	E	92.4	Very high	90.7	Very high	20 Å²	20	39.9 Å²	39.9	9%	0.093	19%	0.192	C	C	.	.	H	α-helix	trans	-61	-39.2	175.5	-59	-178.7	157.9	0	0	111.5	Y625 Q674 N675 I676 F681 Y682 F689 R690	Y625-E678 HydrophobicContact CD2-CG 4.31Å; Y625-E678 HydrophobicContact CE2-CG 3.83Å; Q674-E678 WeakPolarHBondContact O-CG 3.18Å; Q674-E678 PolarHBondContact O-N 3.02Å; N675-E678 WeakPolarHBondContact O-CB 3.44Å; N675-E678 PolarHBondContact O-N 3.47Å; I676-E678 VanDerWaalsContact C-N 3.32Å; I676-E678 PolarHBondContact O-N 3.3Å; E678-F681 PolarHBondContact O-N 3.35Å; E678-Y682 WeakPolarHBondContact O-CB 3.44Å; E678-Y682 PolarHBondContact O-N 3.4Å; E678-F689 HydrophobicContact CB-CE1 4.42Å; E678-F689 HydrophobicContact CB-CE2 4.42Å; E678-F689 HydrophobicContact CB-CZ 4.04Å; E678-F689 HydrophobicContact CG-CD2 4.47Å; E678-F689 HydrophobicContact CG-CE1 4.42Å; E678-F689 HydrophobicContact CG-CE2 3.62Å; E678-F689 HydrophobicContact CG-CZ 3.59Å; E678-R690 WeakPolarHBondContact OE2-CD 3.46Å; E678-R690 WeakPolarHBondContact OE2-CG 3.44Å
679	F	94.4	Very high	89.9	Confident	17 Å²	17	33.9 Å²	33.9	8%	0.075	17%	0.169	C	C	.	.	H	α-helix	trans	-67.2	-38.6	177.8	-54.8	-23.6	0	0	0	112.2	V558 K561 E565 N675 I676 C677 F681 Y682 Y683	V558-F679 HydrophobicContact CG1-CB 3.97Å; V558-F679 HydrophobicContact CG2-CB 4.27Å; V558-F679 WeakPolarHBondContact CG2-O 3.33Å; K561-F679 HydrophobicContact CB-CD2 3.84Å; K561-F679 HydrophobicContact CB-CE1 4.32Å; K561-F679 HydrophobicContact CB-CE2 3.58Å; K561-F679 HydrophobicContact CB-CG 4.34Å; K561-F679 HydrophobicContact CB-CZ 3.84Å; K561-F679 HydrophobicContact CD-CD1 4.26Å; K561-F679 HydrophobicContact CD-CE1 3.98Å; K561-F679 HydrophobicContact CD-CZ 4.21Å; E565-F679 HydrophobicContact CG-CE2 3.91Å; E565-F679 HydrophobicContact CG-CZ 4.34Å; N675-F679 HydrophobicContact CB-CE2 4.29Å; N675-F679 HydrophobicContact CB-CZ 4.04Å; N675-F679 VanDerWaalsContact O-CD1 3.26Å; N675-F679 WeakPolarHBondContact O-CD1 3.39Å; N675-F679 WeakPolarHBondContact O-CD2 3.26Å; N675-F679 WeakPolarHBondContact O-CG 3.35Å; N675-F679 PolarHBondContact O-N 3.16Å; I676-F679 WeakPolarHBondContact O-CB 3.43Å; I676-F679 PolarHBondContact O-N 3.36Å; I676-F679 VanDerWaalsContact O-N 3.15Å; C677-F679 VanDerWaalsContact C-N 3.29Å; C677-F679 PolarHBondContact O-N 2.92Å; F679-F681 VanDerWaalsContact C-N 3.35Å; F679-Y682 PolarHBondContact O-N 3.49Å; F679-Y683 PolarHBondContact O-N 3.14Å
680	I	92.7	Very high	88.6	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-61.3	-45.6	173.4	-64.3	166	0	0	0	110	V609 A612 F613 A621 I676 C677 Y682 Y683 V684	V609-I680 HydrophobicContact CG2-CD1 4.4Å; A612-I680 HydrophobicContact CB-CD1 3.98Å; F613-I680 HydrophobicContact CB-CD1 3.98Å; F613-I680 HydrophobicContact CB-CG1 4.39Å; F613-I680 HydrophobicContact CD2-CD1 4.42Å; F613-I680 HydrophobicContact CD2-CG1 3.99Å; A621-I680 HydrophobicContact CB-CB 4.15Å; A621-I680 HydrophobicContact CB-CD1 4.04Å; A621-I680 HydrophobicContact CB-CG2 4.04Å; I676-I680 HydrophobicContact CG2-CD1 4.44Å; I676-I680 WeakPolarHBondContact O-CG1 3.28Å; I676-I680 PolarHBondContact O-N 2.91Å; C677-I680 PolarHBondContact O-N 3.48Å; I680-Y682 PolarHBondContact O-N 3.09Å; I680-Y683 WeakPolarHBondContact O-CB 3.42Å; I680-Y683 PolarHBondContact O-N 3.07Å; I680-V684 WeakPolarHBondContact O-CG2 3.18Å; I680-V684 PolarHBondContact O-N 3.25Å
681	F	90.9	Very high	87.1	Confident	7 Å²	7	48.3 Å²	48.3	3%	0.031	23%	0.232	C	C	.	.	H	α-helix	trans	-63.2	-44	177.7	-168.5	-79	0	0	0	112	I618 C677 E678 F679 Y683 V684 K685 Q687 F689 L700 L701	I618-F681 HydrophobicContact CD1-CD2 3.6Å; I618-F681 HydrophobicContact CD1-CE2 3.87Å; I618-F681 HydrophobicContact CD1-CG 4.16Å; I618-F681 HydrophobicContact CG1-CD2 3.81Å; I618-F681 HydrophobicContact CG1-CE2 4.39Å; C677-F681 PolarHBondContact O-N 2.97Å; E678-F681 PolarHBondContact O-N 3.35Å; F679-F681 VanDerWaalsContact C-N 3.35Å; F681-Y683 VanDerWaalsContact C-N 3.28Å; F681-Y683 PolarHBondContact O-N 2.65Å; F681-V684 PolarHBondContact O-N 3.35Å; F681-K685 HydrophobicContact CD1-CB 3.96Å; F681-K685 HydrophobicContact CD1-CG 4.24Å; F681-K685 HydrophobicContact CE1-CB 3.71Å; F681-K685 HydrophobicContact CE1-CG 3.86Å; F681-K685 HydrophobicContact CE2-CG 4.35Å; F681-K685 HydrophobicContact CZ-CB 4.28Å; F681-K685 HydrophobicContact CZ-CG 3.91Å; F681-K685 WeakPolarHBondContact O-CB 3.44Å; F681-K685 PolarHBondContact O-N 2.95Å; F681-Q687 HydrophobicContact CE1-CB 4.4Å; F681-F689 HydrophobicContact CB-CD1 4.14Å; F681-F689 HydrophobicContact CB-CE1 3.45Å; F681-F689 VanDerWaalsContact CB-CE1 3.45Å; F681-F689 HydrophobicContact CB-CZ 4.45Å; F681-F689 AromaticContact CD1-CD1 3.48Å; F681-F689 HydrophobicContact CD1-CD1 3.48Å; F681-F689 VanDerWaalsContact CD1-CD1 3.48Å; F681-F689 AromaticContact CD1-CE1 3.68Å; F681-F689 HydrophobicContact CD1-CE1 3.68Å; F681-F689 HydrophobicContact CD2-CD1 4.26Å; F681-F689 AromaticContact CD2-CE1 3.8Å; F681-F689 HydrophobicContact CD2-CE1 3.8Å; F681-F689 AromaticContact CE1-CD1 3.85Å; F681-F689 HydrophobicContact CE1-CD1 3.85Å; F681-F689 HydrophobicContact CE1-CE1 4.34Å; F681-F689 HydrophobicContact CE2-CE1 4.45Å; F681-F689 AromaticContact CG-CD1 3.73Å; F681-F689 HydrophobicContact CG-CD1 3.73Å; F681-F689 AromaticContact CG-CE1 3.38Å; F681-F689 HydrophobicContact CG-CE1 3.38Å; F681-F689 HydrophobicContact CZ-CD1 4.39Å; F681-L700 HydrophobicContact CZ-CB 4.25Å; F681-L701 HydrophobicContact CD2-CD2 4.41Å; F681-L701 HydrophobicContact CE2-CD2 4.29Å
682	Y	90.7	Very high	85.6	Confident	63 Å²	63	46.9 Å²	46.9	25%	0.247	23%	0.225	C	C	.	.	H	α-helix	trans	-59.6	-39.8	175.6	171.4	-100.7	0	0	0	111.8	R554 M557 V558 E678 F679 I680 G686 Q687 D688	R554-Y682 HydrophobicContact CB-CE1 4.26Å; R554-Y682 HydrophobicContact CG-CE1 3.71Å; M557-Y682 HydrophobicContact CE-CE1 3.53Å; M557-Y682 VanDerWaalsContact CE-OH 3.29Å; M557-Y682 WeakPolarHBondContact CE-OH 3.17Å; V558-Y682 HydrophobicContact CG2-CD1 3.77Å; V558-Y682 HydrophobicContact CG2-CE1 4.38Å; E678-Y682 WeakPolarHBondContact O-CB 3.44Å; E678-Y682 PolarHBondContact O-N 3.4Å; F679-Y682 PolarHBondContact O-N 3.49Å; I680-Y682 PolarHBondContact O-N 3.09Å; Y682-G686 WeakPolarHBondContact O-CA 3.39Å; Y682-G686 PolarHBondContact O-N 3.45Å; Y682-Q687 WeakPolarHBondContact CA-O 3.34Å; Y682-D688 HydrophobicContact CD2-CB 4.39Å
683	Y	90.1	Very high	83.7	Confident	59 Å²	59	47.4 Å²	47.4	23%	0.231	24%	0.243	C	C	.	.	H	α-helix	trans	-58.8	-51.8	174.4	175.2	-114	0	0	0	111.6	R554 L555 M616 F679 I680 F681	R554-Y683 HydrophobicContact CB-CD2 4.15Å; L555-Y683 HydrophobicContact CB-CD2 4.11Å; L555-Y683 HydrophobicContact CB-CE2 3.62Å; L555-Y683 HydrophobicContact CD1-CD2 4.44Å; L555-Y683 HydrophobicContact CD1-CE2 4.13Å; L555-Y683 HydrophobicContact CG-CE2 4.36Å; M616-Y683 HydrophobicContact CB-CD1 3.94Å; M616-Y683 HydrophobicContact CB-CE1 3.83Å; M616-Y683 HydrophobicContact CE-CD1 4.46Å; M616-Y683 HydrophobicContact CG-CD1 3.74Å; M616-Y683 HydrophobicContact CG-CE1 3.54Å; M616-Y683 HydrophobicContact SD-CD1 3.41Å; M616-Y683 WeakPolarHBondContact SD-CD1 3.39Å; M616-Y683 HydrophobicContact SD-CE1 3.79Å; M616-Y683 HydrophobicContact SD-CG 4.1Å; F679-Y683 PolarHBondContact O-N 3.14Å; I680-Y683 WeakPolarHBondContact O-CB 3.42Å; I680-Y683 PolarHBondContact O-N 3.07Å; F681-Y683 VanDerWaalsContact C-N 3.28Å; F681-Y683 PolarHBondContact O-N 2.65Å
684	V	86	Confident	82.2	Confident	61 Å²	61	49.7 Å²	49.7	37%	0.37	27%	0.267	S	S	.	.	H	α-helix	trans	-74.9	-48.4	-172.5	177.5	0	0	0	0	112.2	I618 I680 F681	I618-V684 HydrophobicContact CB-CG1 4.43Å; I618-V684 HydrophobicContact CD1-CB 4.12Å; I618-V684 HydrophobicContact CD1-CG1 3.97Å; I680-V684 WeakPolarHBondContact O-CG2 3.18Å; I680-V684 PolarHBondContact O-N 3.25Å; F681-V684 PolarHBondContact O-N 3.35Å
685	K	84.9	Confident	80.8	Confident	78 Å²	78	54.5 Å²	54.5	34%	0.339	29%	0.294	S	S	.	.	H	α-helix	trans	-93.9	-18.7	-174.7	-70.3	-71.3	-171.4	172.2	0	113.6	I618 F681 Q687 D705	I618-K685 HydrophobicContact CD1-CD 4.48Å; I618-K685 HydrophobicContact CD1-CG 3.64Å; F681-K685 HydrophobicContact CD1-CB 3.96Å; F681-K685 HydrophobicContact CD1-CG 4.24Å; F681-K685 HydrophobicContact CE1-CB 3.71Å; F681-K685 HydrophobicContact CE1-CG 3.86Å; F681-K685 HydrophobicContact CE2-CG 4.35Å; F681-K685 HydrophobicContact CZ-CB 4.28Å; F681-K685 HydrophobicContact CZ-CG 3.91Å; F681-K685 WeakPolarHBondContact O-CB 3.44Å; F681-K685 PolarHBondContact O-N 2.95Å; K685-Q687 PolarHBondContact O-N 3.3Å; K685-D705 IonicContact NZ-OD1 3.43Å; K685-D705 IonicContact NZ-OD2 2.73Å; K685-D705 PolarHBondContact NZ-OD2 3.17Å
686	G	81.5	Confident	79.5	Confident	31 Å²	31	58.2 Å²	58.2	32%	0.32	31%	0.31	S	S	.	.			trans	70.4	12.4	-174.5	0	0	0	0	0	114.7	Y682	Y682-G686 WeakPolarHBondContact O-CA 3.39Å; Y682-G686 PolarHBondContact O-N 3.45Å
687	Q	78.6	Confident	78.3	Confident	104 Å²	104	59.5 Å²	59.5	49%	0.486	32%	0.316	S	S	.	.			trans	-115	138.4	-178.8	-66.1	-179.1	-0.1	0	0	109.3	F681 Y682 K685	F681-Q687 HydrophobicContact CE1-CB 4.4Å; Y682-Q687 WeakPolarHBondContact CA-O 3.34Å; K685-Q687 PolarHBondContact O-N 3.3Å
688	D	73.4	Confident	77.2	Confident	78 Å²	78	63.3 Å²	63.3	42%	0.417	34%	0.337	S	S	.	.			trans	-100.5	119.6	175.6	-173	-5.1	0	0	0	108	Y682 R690	Y682-D688 HydrophobicContact CD2-CB 4.39Å; D688-R690 VanDerWaalsContact CG-NE 3.31Å; D688-R690 VanDerWaalsContact OD1-CB 3.28Å; D688-R690 WeakPolarHBondContact OD1-CB 3.48Å; D688-R690 WeakPolarHBondContact OD1-CG 3.28Å; D688-R690 IonicContact OD1-CZ 2.92Å; D688-R690 PolarHBondContact OD1-N 2.94Å; D688-R690 VanDerWaalsContact OD1-N 3.08Å; D688-R690 IonicContact OD1-NE 2.68Å; D688-R690 PolarHBondContact OD1-NE 3.2Å; D688-R690 IonicContact OD2-CZ 3.38Å; D688-R690 IonicContact OD2-NE 3.37Å; D688-R690 PolarHBondContact OD2-NE 2.93Å; D688-R690 IonicContact OD2-NH2 2.92Å; D688-R690 PolarHBondContact OD2-NH2 3.44Å
689	F	77.6	Confident	76.1	Confident	4 Å²	4	70 Å²	70	2%	0.018	37%	0.365	C	S	.	.			trans	-105.1	12.9	-179.8	67.4	-103.5	0	0	0	113.2	Y625 E678 F681 H691 V692 L697 L700 L701	Y625-F689 HydrophobicContact CD2-CE2 4.29Å; Y625-F689 HydrophobicContact CD2-CZ 4.28Å; Y625-F689 AromaticContact CE2-CE2 3.71Å; Y625-F689 HydrophobicContact CE2-CE2 3.71Å; Y625-F689 HydrophobicContact CE2-CZ 4.13Å; Y625-F689 AromaticContact CZ-CE2 3.86Å; E678-F689 HydrophobicContact CB-CE1 4.42Å; E678-F689 HydrophobicContact CB-CE2 4.42Å; E678-F689 HydrophobicContact CB-CZ 4.04Å; E678-F689 HydrophobicContact CG-CD2 4.47Å; E678-F689 HydrophobicContact CG-CE1 4.42Å; E678-F689 HydrophobicContact CG-CE2 3.62Å; E678-F689 HydrophobicContact CG-CZ 3.59Å; F681-F689 HydrophobicContact CB-CD1 4.14Å; F681-F689 HydrophobicContact CB-CE1 3.45Å; F681-F689 VanDerWaalsContact CB-CE1 3.45Å; F681-F689 HydrophobicContact CB-CZ 4.45Å; F681-F689 AromaticContact CD1-CD1 3.48Å; F681-F689 HydrophobicContact CD1-CD1 3.48Å; F681-F689 VanDerWaalsContact CD1-CD1 3.48Å; F681-F689 AromaticContact CD1-CE1 3.68Å; F681-F689 HydrophobicContact CD1-CE1 3.68Å; F681-F689 HydrophobicContact CD2-CD1 4.26Å; F681-F689 AromaticContact CD2-CE1 3.8Å; F681-F689 HydrophobicContact CD2-CE1 3.8Å; F681-F689 AromaticContact CE1-CD1 3.85Å; F681-F689 HydrophobicContact CE1-CD1 3.85Å; F681-F689 HydrophobicContact CE1-CE1 4.34Å; F681-F689 HydrophobicContact CE2-CE1 4.45Å; F681-F689 AromaticContact CG-CD1 3.73Å; F681-F689 HydrophobicContact CG-CD1 3.73Å; F681-F689 AromaticContact CG-CE1 3.38Å; F681-F689 HydrophobicContact CG-CE1 3.38Å; F681-F689 HydrophobicContact CZ-CD1 4.39Å; F689-H691 PolarHBondContact O-N 3.45Å; F689-V692 HydrophobicContact CB-CB 4.34Å; F689-V692 HydrophobicContact CB-CG2 4Å; F689-V692 VanDerWaalsContact O-CB 3.26Å; F689-V692 WeakPolarHBondContact O-CB 3.12Å; F689-V692 VanDerWaalsContact O-CG2 3.22Å; F689-V692 WeakPolarHBondContact O-CG2 3.25Å; F689-V692 PolarHBondContact O-N 3.33Å; F689-L697 HydrophobicContact CB-CD1 4.3Å; F689-L697 HydrophobicContact CD2-CD1 3.23Å; F689-L697 HydrophobicContact CE2-CD1 3.67Å; F689-L697 HydrophobicContact CG-CD1 3.98Å; F689-L700 HydrophobicContact CB-CD1 3.84Å; F689-L701 HydrophobicContact CE1-CD2 4.44Å; F689-L701 HydrophobicContact CZ-CD2 4.25Å
690	R	68.3	Low	74.8	Confident	105 Å²	105	71.3 Å²	71.3	40%	0.396	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57	130.6	173.9	-72.1	178.3	-63	157.2	5.1	110.3	E678 D688 V692	E678-R690 WeakPolarHBondContact OE2-CD 3.46Å; E678-R690 WeakPolarHBondContact OE2-CG 3.44Å; D688-R690 VanDerWaalsContact CG-NE 3.31Å; D688-R690 VanDerWaalsContact OD1-CB 3.28Å; D688-R690 WeakPolarHBondContact OD1-CB 3.48Å; D688-R690 WeakPolarHBondContact OD1-CG 3.28Å; D688-R690 IonicContact OD1-CZ 2.92Å; D688-R690 PolarHBondContact OD1-N 2.94Å; D688-R690 VanDerWaalsContact OD1-N 3.08Å; D688-R690 IonicContact OD1-NE 2.68Å; D688-R690 PolarHBondContact OD1-NE 3.2Å; D688-R690 IonicContact OD2-CZ 3.38Å; D688-R690 IonicContact OD2-NE 3.37Å; D688-R690 PolarHBondContact OD2-NE 2.93Å; D688-R690 IonicContact OD2-NH2 2.92Å; D688-R690 PolarHBondContact OD2-NH2 3.44Å; R690-V692 PolarHBondContact O-N 2.84Å
691	H	64.2	Low	73.7	Confident	198 Å²	198	72.2 Å²	72.2	92%	0.917	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.1	13.8	-177	-47.1	-57.3	0	0	0	115.9	F689 G693	F689-H691 PolarHBondContact O-N 3.45Å; H691-G693 PolarHBondContact O-N 3.19Å
692	V	63	Low	72.6	Confident	32 Å²	32	75 Å²	75	19%	0.194	40%	0.402	C	S	.	.			trans	-75.8	123.9	172.5	-178.7	0	0	0	0	109.1	F689 R690 E696 L697 L700	F689-V692 HydrophobicContact CB-CB 4.34Å; F689-V692 HydrophobicContact CB-CG2 4Å; F689-V692 VanDerWaalsContact O-CB 3.26Å; F689-V692 WeakPolarHBondContact O-CB 3.12Å; F689-V692 VanDerWaalsContact O-CG2 3.22Å; F689-V692 WeakPolarHBondContact O-CG2 3.25Å; F689-V692 PolarHBondContact O-N 3.33Å; R690-V692 PolarHBondContact O-N 2.84Å; V692-E696 HydrophobicContact CG1-CB 3.46Å; V692-E696 VanDerWaalsContact CG1-CB 3.46Å; V692-E696 HydrophobicContact CG1-CG 3.53Å; V692-L697 HydrophobicContact CG1-CB 4.34Å; V692-L700 HydrophobicContact CB-CD1 4.5Å; V692-L700 HydrophobicContact CG1-CD1 4Å; V692-L700 HydrophobicContact CG2-CD1 4.29Å
693	G	55.3	Low	70.8	Confident	52 Å²	52	74.3 Å²	74.3	54%	0.536	41%	0.414	S	S	.	.			trans	-79.5	136.4	-174.6	0	0	0	0	0	113.2	H691 D695 E696	H691-G693 PolarHBondContact O-N 3.19Å; G693-D695 PolarHBondContact O-N 3.4Å; G693-E696 PolarHBondContact O-N 2.56Å
694	G	65	Low	68.5	Low	48 Å²	48	80.4 Å²	80.4	50%	0.495	44%	0.441	S	S	.	.	H	α-helix	trans	32.2	-97.6	162.2	0	0	0	0	0	116.6	E696 L697 D698	G694-E696 VanDerWaalsContact C-N 3.29Å; G694-E696 PolarHBondContact O-N 2.97Å; G694-L697 WeakPolarHBondContact O-CB 3.47Å; G694-L697 PolarHBondContact O-N 3.44Å; G694-D698 PolarHBondContact O-N 3.35Å
695	D	63.5	Low	66.4	Low	138 Å²	138	83.5 Å²	83.5	74%	0.738	46%	0.456	S	S	*	.	H	α-helix	trans	-61.5	-33.3	-173.4	-68	-12.4	0	0	0	113.9	G693 K699	G693-D695 PolarHBondContact O-N 3.4Å; D695-K699 WeakPolarHBondContact O-CG 3.31Å; D695-K699 PolarHBondContact O-N 3.23Å; D695-K699 VanDerWaalsContact O-N 3.11Å
696	E	66.2	Low	63.7	Low	124 Å²	124	84.9 Å²	84.9	58%	0.579	48%	0.475	S	S	*	.	H	α-helix	trans	-79.1	-33.1	-179.4	-166.7	175.2	-147.3	0	0	110.8	V692 G693 G694 K699 L700	V692-E696 HydrophobicContact CG1-CB 3.46Å; V692-E696 VanDerWaalsContact CG1-CB 3.46Å; V692-E696 HydrophobicContact CG1-CG 3.53Å; G693-E696 PolarHBondContact O-N 2.56Å; G694-E696 VanDerWaalsContact C-N 3.29Å; G694-E696 PolarHBondContact O-N 2.97Å; E696-K699 PolarHBondContact O-N 3.39Å; E696-L700 WeakPolarHBondContact O-CG 3.3Å; E696-L700 PolarHBondContact O-N 3.37Å
697	L	70.1	Confident	61.2	Low	27 Å²	27	91 Å²	91	14%	0.141	50%	0.501	C	S	.	.	H	α-helix	trans	-64.8	-47.8	171.4	-176.7	67.5	0	0	0	110.5	Y625 F689 V692 G694 K699 L700 L701	Y625-L697 HydrophobicContact CE1-CD2 4.04Å; F689-L697 HydrophobicContact CB-CD1 4.3Å; F689-L697 HydrophobicContact CD2-CD1 3.23Å; F689-L697 HydrophobicContact CE2-CD1 3.67Å; F689-L697 HydrophobicContact CG-CD1 3.98Å; V692-L697 HydrophobicContact CG1-CB 4.34Å; G694-L697 WeakPolarHBondContact O-CB 3.47Å; G694-L697 PolarHBondContact O-N 3.44Å; L697-K699 VanDerWaalsContact C-N 3.27Å; L697-K699 PolarHBondContact O-N 2.81Å; L697-L700 PolarHBondContact O-N 3.27Å; L697-L701 HydrophobicContact CD1-CD1 4.11Å; L697-L701 HydrophobicContact CD1-CG 4.34Å; L697-L701 HydrophobicContact CG-CD1 3.82Å; L697-L701 HydrophobicContact CG-CG 4.4Å; L697-L701 WeakPolarHBondContact O-CB 2.96Å; L697-L701 WeakPolarHBondContact O-CG 2.99Å; L697-L701 PolarHBondContact O-N 2.61Å
698	D	71.7	Confident	58.9	Low	83 Å²	83	99.5 Å²	99.5	44%	0.444	54%	0.536	S	S	.	.	H	α-helix	trans	-63.4	-33.4	176.9	-87.2	-35.9	0	0	0	112.3	R626 G694 A702	R626-D698 IonicContact NH2-OD1 3.9Å; G694-D698 PolarHBondContact O-N 3.35Å; D698-A702 WeakPolarHBondContact O-CB 3.46Å; D698-A702 PolarHBondContact O-N 3.24Å
699	K	70.2	Confident	58.2	Low	160 Å²	160	100.6 Å²	100.6	70%	0.696	54%	0.542	S	S	*	.	H	α-helix	trans	-65.9	-45.9	172.7	-84.7	178.7	179.4	174.6	0	112.7	D695 E696 L697 L701 A702	D695-K699 WeakPolarHBondContact O-CG 3.31Å; D695-K699 PolarHBondContact O-N 3.23Å; D695-K699 VanDerWaalsContact O-N 3.11Å; E696-K699 PolarHBondContact O-N 3.39Å; L697-K699 VanDerWaalsContact C-N 3.27Å; L697-K699 PolarHBondContact O-N 2.81Å; K699-L701 VanDerWaalsContact C-N 3.35Å; K699-A702 PolarHBondContact O-N 3.37Å
700	L	67.8	Low	57.1	Low	45 Å²	45	105.7 Å²	105.7	24%	0.236	57%	0.57	C	S	.	*	H	α-helix	trans	-62.7	-43.2	177.8	-79.5	162.6	0	0	0	111.3	F681 F689 V692 E696 L697	F681-L700 HydrophobicContact CZ-CB 4.25Å; F689-L700 HydrophobicContact CB-CD1 3.84Å; V692-L700 HydrophobicContact CB-CD1 4.5Å; V692-L700 HydrophobicContact CG1-CD1 4Å; V692-L700 HydrophobicContact CG2-CD1 4.29Å; E696-L700 WeakPolarHBondContact O-CG 3.3Å; E696-L700 PolarHBondContact O-N 3.37Å; L697-L700 PolarHBondContact O-N 3.27Å
701	L	68.7	Low	56.5	Low	19 Å²	19	105.7 Å²	105.7	10%	0.099	58%	0.58	C	S	.	*	H	α-helix	trans	-73	-26.9	178.6	-63.1	172.8	0	0	0	112.9	V622 Y625 F681 F689 L697 K699 G703	V622-L701 HydrophobicContact CB-CD2 4.43Å; V622-L701 HydrophobicContact CG1-CB 4.03Å; V622-L701 HydrophobicContact CG1-CD2 4.16Å; V622-L701 HydrophobicContact CG2-CD2 3.76Å; Y625-L701 HydrophobicContact CD1-CD1 4.29Å; Y625-L701 HydrophobicContact CE1-CD1 4.5Å; F681-L701 HydrophobicContact CD2-CD2 4.41Å; F681-L701 HydrophobicContact CE2-CD2 4.29Å; F689-L701 HydrophobicContact CE1-CD2 4.44Å; F689-L701 HydrophobicContact CZ-CD2 4.25Å; L697-L701 HydrophobicContact CD1-CD1 4.11Å; L697-L701 HydrophobicContact CD1-CG 4.34Å; L697-L701 HydrophobicContact CG-CD1 3.82Å; L697-L701 HydrophobicContact CG-CG 4.4Å; L697-L701 WeakPolarHBondContact O-CB 2.96Å; L697-L701 WeakPolarHBondContact O-CG 2.99Å; L697-L701 PolarHBondContact O-N 2.61Å; K699-L701 VanDerWaalsContact C-N 3.35Å; L701-G703 VanDerWaalsContact C-N 3.31Å; L701-G703 PolarHBondContact O-N 3.17Å
702	A	67.1	Low	56.1	Low	67 Å²	67	100.3 Å²	100.3	55%	0.554	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.6	-1.5	-179.3	0	0	0	0	0	114.7	D698 K699 K704	D698-A702 WeakPolarHBondContact O-CB 3.46Å; D698-A702 PolarHBondContact O-N 3.24Å; K699-A702 PolarHBondContact O-N 3.37Å; A702-K704 VanDerWaalsContact C-N 3.26Å; A702-K704 PolarHBondContact O-N 2.98Å; A702-K704 VanDerWaalsContact O-N 3.12Å
703	G	52.8	Low	55.6	Low	47 Å²	47	104.6 Å²	104.6	49%	0.485	58%	0.583	S	S	.	*	T	Hydrogen-bonded Turn	trans	61.8	24.5	169.3	0	0	0	0	0	115.6	L701 D705	L701-G703 VanDerWaalsContact C-N 3.31Å; L701-G703 PolarHBondContact O-N 3.17Å; G703-D705 VanDerWaalsContact C-N 3.28Å; G703-D705 PolarHBondContact O-N 2.85Å
704	K	42.3	Very low	55.7	Low	187 Å²	187	108.1 Å²	108.1	81%	0.813	59%	0.586	S	S	*	*			trans	-78.8	86.6	168.1	-84.4	-173.6	177.8	176	0	108.9	A702 S706	A702-K704 VanDerWaalsContact C-N 3.26Å; A702-K704 PolarHBondContact O-N 2.98Å; A702-K704 VanDerWaalsContact O-N 3.12Å; K704-S706 PolarHBondContact O-N 3.17Å
705	D	41.3	Very low	55	Low	126 Å²	126	112.4 Å²	112.4	67%	0.674	59%	0.592	S	S	*	*			trans	-58.4	93.4	159.7	-71.9	-31.4	0	0	0	107.7	K685 G703 D707	K685-D705 IonicContact NZ-OD1 3.43Å; K685-D705 IonicContact NZ-OD2 2.73Å; K685-D705 PolarHBondContact NZ-OD2 3.17Å; G703-D705 VanDerWaalsContact C-N 3.28Å; G703-D705 PolarHBondContact O-N 2.85Å; D705-D707 PolarHBondContact O-N 3.48Å; D705-D707 VanDerWaalsContact O-N 3.13Å
706	S	29.7	Very low	54.3	Low	107 Å²	107	110.4 Å²	110.4	75%	0.748	58%	0.581	S	S	*	*			trans	-71.3	75.3	152.3	53.6	0	0	0	0	107.4	K704	K704-S706 PolarHBondContact O-N 3.17Å
707	D	29	Very low	53.3	Low	160 Å²	160	109.3 Å²	109.3	86%	0.856	58%	0.581	S	S	*	*			trans	-147.2	109.5	155.1	-94.5	-28.1	0	0	0	109.1	D705	D705-D707 PolarHBondContact O-N 3.48Å; D705-D707 VanDerWaalsContact O-N 3.13Å
708	K	29.6	Very low	51.8	Low	283 Å²	283	116.7 Å²	116.7	100%	1.23	62%	0.621	S	S	*	*			trans	-110.5	0	168.6	-111.6	-170.4	179.4	-177.2	0	107

Retrieved 708 of 708 residues in 289.1 ms (Link to these results)

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