A0A096N7U8_PAPAN Loading...

Exocyst complex component 8

Component of the exocyst complex involved in the docking of exocytic vesicles with fusion sites on the plasma membrane.

AlphaFold DB (A0A2K6CZ17), UniProt , Accession A0A096N7U8, Species PAPAN (Papio anubis, Olive baboon), Gene EXOC8, Length 725 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	34.9	Very low	43.3	Very low	232 Å²	232	102 Å²	102	100%	1.143	63%	0.628	S	S	*	*				0	-3.1	0	-132.3	169.1	-175.4	0	0	114.1
2	A	29	Very low	45.3	Very low	91 Å²	91	108.1 Å²	108.1	75%	0.752	63%	0.631	S	S	*	*			trans	-88.1	-16.6	-178.5	0	0	0	0	0	115.6
3	M	30.1	Very low	47.2	Very low	178 Å²	178	100.8 Å²	100.8	88%	0.877	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.7	-12.2	179.3	-80.4	176.5	117.9	0	0	114.6
4	A	30.3	Very low	48.8	Very low	81 Å²	81	99.7 Å²	99.7	67%	0.669	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.3	-9.3	-179.2	0	0	0	0	0	113.7
5	M	34.8	Very low	50.4	Low	145 Å²	145	104.5 Å²	104.5	71%	0.714	57%	0.574	S	S	*	*	S	Bend	trans	-94.5	-23.1	-176.2	-61	-135.2	83.9	0	0	113.8	S8	M5-S8 PolarHBondContact O-OG 3.46Å
6	S	44.6	Very low	51.7	Low	88 Å²	88	104.7 Å²	104.7	62%	0.615	57%	0.569	S	S	*	*	S	Bend	trans	-73.7	-33.1	179.4	55.2	0	0	0	0	113.5	S8 G9	S6-S8 VanDerWaalsContact C-N 3.3Å; S6-S8 PolarHBondContact O-N 3.23Å; S6-G9 PolarHBondContact O-N 3.25Å
7	D	46.2	Very low	52.9	Low	120 Å²	120	101.7 Å²	101.7	64%	0.642	55%	0.552	S	S	*	*	H	α-helix	trans	-69.7	-28.2	-176.6	-158.3	22.9	0	0	0	112.7	G9 S11	D7-G9 VanDerWaalsContact C-N 3.29Å; D7-G9 PolarHBondContact O-N 3.01Å; D7-S11 PolarHBondContact O-N 3.45Å; D7-S11 PolarHBondContact O-OG 3.11Å
8	S	52	Low	53.9	Low	56 Å²	56	102.8 Å²	102.8	39%	0.392	55%	0.553	S	S	.	*	H	α-helix	trans	-69.3	-25.5	174.9	79.3	0	0	0	0	113.5	M5 S6 R12	M5-S8 PolarHBondContact O-OG 3.46Å; S6-S8 VanDerWaalsContact C-N 3.3Å; S6-S8 PolarHBondContact O-N 3.23Å; S8-R12 WeakPolarHBondContact O-CB 3.34Å; S8-R12 VanDerWaalsContact O-CG 3.24Å; S8-R12 WeakPolarHBondContact O-CG 3.29Å; S8-R12 PolarHBondContact O-N 3.4Å
9	G	56	Low	55.1	Low	40 Å²	40	100.4 Å²	100.4	41%	0.412	55%	0.545	S	S	.	.	H	α-helix	trans	-77.8	-46.6	179.6	0	0	0	0	0	112	S6 D7 R12 L13	S6-G9 PolarHBondContact O-N 3.25Å; D7-G9 VanDerWaalsContact C-N 3.29Å; D7-G9 PolarHBondContact O-N 3.01Å; G9-R12 PolarHBondContact O-N 3.08Å; G9-L13 WeakPolarHBondContact O-CB 3.42Å; G9-L13 PolarHBondContact O-N 3.42Å
10	A	58.7	Low	55.8	Low	43 Å²	43	100.2 Å²	100.2	36%	0.355	57%	0.567	S	S	.	*	H	α-helix	trans	-64.5	-40.9	179.4	0	0	0	0	0	112.3	R12 L13 R14	A10-R12 PolarHBondContact O-N 3.37Å; A10-L13 WeakPolarHBondContact O-CB 3.45Å; A10-L13 PolarHBondContact O-N 3.42Å; A10-R14 WeakPolarHBondContact O-CB 3.43Å; A10-R14 PolarHBondContact O-N 2.9Å
11	S	60.2	Low	56.5	Low	48 Å²	48	98.6 Å²	98.6	34%	0.336	57%	0.573	S	S	.	*	H	α-helix	trans	-76.6	-18.2	179	51.2	0	0	0	0	114.2	D7 R15	D7-S11 PolarHBondContact O-N 3.45Å; D7-S11 PolarHBondContact O-OG 3.11Å; S11-R15 PolarHBondContact O-NE 2.76Å; S11-R15 VanDerWaalsContact O-NE 3.15Å
12	R	66.3	Low	58.5	Low	175 Å²	175	91.1 Å²	91.1	66%	0.66	54%	0.535	S	S	*	.	H	α-helix	trans	-79.2	-42.1	165.9	-80.3	178.8	-179.4	-162.1	1.6	111.9	S8 G9 A10 R14 R15 Q16	S8-R12 WeakPolarHBondContact O-CB 3.34Å; S8-R12 VanDerWaalsContact O-CG 3.24Å; S8-R12 WeakPolarHBondContact O-CG 3.29Å; S8-R12 PolarHBondContact O-N 3.4Å; G9-R12 PolarHBondContact O-N 3.08Å; A10-R12 PolarHBondContact O-N 3.37Å; R12-R14 VanDerWaalsContact C-N 3.35Å; R12-R15 PolarHBondContact O-N 3.33Å; R12-Q16 PolarHBondContact O-N 3.37Å
13	L	70.3	Confident	60.8	Low	13 Å²	13	92.6 Å²	92.6	7%	0.068	53%	0.526	C	S	.	.	H	α-helix	trans	-58.2	-48	175.7	-164.2	91.6	0	0	0	110.6	G9 A10 R15 Q16 L17 Y27 I48 L51	G9-L13 WeakPolarHBondContact O-CB 3.42Å; G9-L13 PolarHBondContact O-N 3.42Å; A10-L13 WeakPolarHBondContact O-CB 3.45Å; A10-L13 PolarHBondContact O-N 3.42Å; L13-R15 PolarHBondContact O-N 3.22Å; L13-Q16 PolarHBondContact O-N 3.33Å; L13-L17 HydrophobicContact CD2-CD1 4.22Å; L13-L17 HydrophobicContact CG-CD1 4.08Å; L13-L17 VanDerWaalsContact O-CG 3.3Å; L13-L17 WeakPolarHBondContact O-CG 3.26Å; L13-L17 PolarHBondContact O-N 2.95Å; L13-Y27 WeakPolarHBondContact CD1-OH 3.08Å; L13-I48 HydrophobicContact CD2-CG1 3.93Å; L13-L51 HydrophobicContact CD2-CD2 4.46Å
14	R	70.4	Confident	62.9	Low	86 Å²	86	86.8 Å²	86.8	33%	0.325	51%	0.506	S	S	.	.	H	α-helix	trans	-57.5	-47.5	176.7	-172.3	168.2	-179.6	168.8	3.1	112.5	A10 R12 Q16 L17 E18 L51	A10-R14 WeakPolarHBondContact O-CB 3.43Å; A10-R14 PolarHBondContact O-N 2.9Å; R12-R14 VanDerWaalsContact C-N 3.35Å; R14-Q16 VanDerWaalsContact C-N 3.34Å; R14-Q16 PolarHBondContact O-N 2.66Å; R14-L17 PolarHBondContact O-N 2.91Å; R14-E18 HydrophobicContact CG-CG 4.4Å; R14-E18 WeakPolarHBondContact CG-OE1 3.34Å; R14-E18 IonicContact CZ-OE1 2.82Å; R14-E18 IonicContact NE-OE1 3.66Å; R14-E18 PolarHBondContact NE-OE1 3.05Å; R14-E18 WeakPolarHBondContact O-CB 3.4Å; R14-E18 VanDerWaalsContact O-CG 3.28Å; R14-E18 WeakPolarHBondContact O-CG 3.36Å; R14-E18 PolarHBondContact O-N 3.26Å; R14-L51 HydrophobicContact CB-CD1 4.47Å; R14-L51 HydrophobicContact CB-CD2 4Å; R14-L51 HydrophobicContact CG-CD2 4.26Å
15	R	72.1	Confident	65.1	Low	172 Å²	172	93.8 Å²	93.8	65%	0.649	52%	0.515	S	S	*	.	H	α-helix	trans	-65.1	-31.5	176.6	-89.4	-177.2	-81	176.2	-13.2	114.3	S11 R12 L13	S11-R15 PolarHBondContact O-NE 2.76Å; S11-R15 VanDerWaalsContact O-NE 3.15Å; R12-R15 PolarHBondContact O-N 3.33Å; L13-R15 PolarHBondContact O-N 3.22Å
16	Q	71.2	Confident	67	Low	107 Å²	107	91.6 Å²	91.6	50%	0.5	51%	0.506	S	S	.	.	H	α-helix	trans	-72	-40.2	174.7	-80.5	-179.6	-22.9	0	0	111.7	R12 L13 R14 S19	R12-Q16 PolarHBondContact O-N 3.37Å; L13-Q16 PolarHBondContact O-N 3.33Å; R14-Q16 VanDerWaalsContact C-N 3.34Å; R14-Q16 PolarHBondContact O-N 2.66Å; Q16-S19 PolarHBondContact O-N 3.38Å; Q16-S19 PolarHBondContact O-OG 3.47Å
17	L	72.4	Confident	68.5	Low	54 Å²	54	89 Å²	89	28%	0.283	48%	0.483	S	S	.	.	H	α-helix	trans	-71.8	-33.1	178.4	-67.4	167.9	0	0	0	112.9	L13 R14 S19 F22 L51	L13-L17 HydrophobicContact CD2-CD1 4.22Å; L13-L17 HydrophobicContact CG-CD1 4.08Å; L13-L17 VanDerWaalsContact O-CG 3.3Å; L13-L17 WeakPolarHBondContact O-CG 3.26Å; L13-L17 PolarHBondContact O-N 2.95Å; R14-L17 PolarHBondContact O-N 2.91Å; L17-S19 PolarHBondContact O-N 3.41Å; L17-F22 HydrophobicContact CD2-CD2 4.45Å; L17-F22 HydrophobicContact CD2-CE1 4.05Å; L17-F22 HydrophobicContact CD2-CE2 3.73Å; L17-F22 HydrophobicContact CD2-CZ 3.5Å; L17-F22 VanDerWaalsContact CD2-CZ 3.5Å; L17-L51 HydrophobicContact CD1-CD2 4.01Å
18	E	71.4	Confident	70	Confident	122 Å²	122	87.6 Å²	87.6	57%	0.57	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.8	-2.7	177.6	-72.2	170.1	177.9	0	0	113.4	R14	R14-E18 HydrophobicContact CG-CG 4.4Å; R14-E18 WeakPolarHBondContact CG-OE1 3.34Å; R14-E18 IonicContact CZ-OE1 2.82Å; R14-E18 IonicContact NE-OE1 3.66Å; R14-E18 PolarHBondContact NE-OE1 3.05Å; R14-E18 WeakPolarHBondContact O-CB 3.4Å; R14-E18 VanDerWaalsContact O-CG 3.28Å; R14-E18 WeakPolarHBondContact O-CG 3.36Å; R14-E18 PolarHBondContact O-N 3.26Å
19	S	76.1	Confident	71.1	Confident	57 Å²	57	90.8 Å²	90.8	40%	0.399	49%	0.485	S	S	.	.	S	Bend	trans	-74.5	128.3	-179.9	72.1	0	0	0	0	111.6	Q16 L17 G21 F22	Q16-S19 PolarHBondContact O-N 3.38Å; Q16-S19 PolarHBondContact O-OG 3.47Å; L17-S19 PolarHBondContact O-N 3.41Å; S19-G21 PolarHBondContact O-N 3.01Å; S19-F22 WeakPolarHBondContact O-CB 3.38Å; S19-F22 PolarHBondContact O-N 3.15Å; S19-F22 VanDerWaalsContact O-N 3.09Å
20	G	68.8	Low	72	Confident	95 Å²	95	94.2 Å²	94.2	98%	0.979	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	1.7	-175	0	0	0	0	0	116.6
21	G	69.8	Low	72.7	Confident	68 Å²	68	93.6 Å²	93.6	70%	0.701	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.5	22.7	175.4	0	0	0	0	0	113.4	S19 E23	S19-G21 PolarHBondContact O-N 3.01Å; G21-E23 PolarHBondContact O-N 3.12Å
22	F	78.4	Confident	73.2	Confident	75 Å²	75	94.4 Å²	94.4	33%	0.329	49%	0.487	S	S	.	.			trans	-68.8	117	-176.3	179.7	-101.2	0	0	0	112.5	L17 S19 A24 Y27	L17-F22 HydrophobicContact CD2-CD2 4.45Å; L17-F22 HydrophobicContact CD2-CE1 4.05Å; L17-F22 HydrophobicContact CD2-CE2 3.73Å; L17-F22 HydrophobicContact CD2-CZ 3.5Å; L17-F22 VanDerWaalsContact CD2-CZ 3.5Å; S19-F22 WeakPolarHBondContact O-CB 3.38Å; S19-F22 PolarHBondContact O-N 3.15Å; S19-F22 VanDerWaalsContact O-N 3.09Å; F22-A24 HydrophobicContact CE1-CB 3.98Å; F22-Y27 HydrophobicContact CE2-CD1 4.03Å; F22-Y27 AromaticContact CE2-CD2 3.75Å; F22-Y27 HydrophobicContact CE2-CD2 3.75Å; F22-Y27 HydrophobicContact CE2-CE2 4.39Å; F22-Y27 AromaticContact CE2-CG 3.54Å; F22-Y27 HydrophobicContact CE2-CG 3.54Å; F22-Y27 AromaticContact CZ-CD1 3.78Å; F22-Y27 HydrophobicContact CZ-CD1 3.78Å; F22-Y27 HydrophobicContact CZ-CD2 4.35Å; F22-Y27 HydrophobicContact CZ-CE1 4.47Å; F22-Y27 AromaticContact CZ-CG 3.71Å; F22-Y27 HydrophobicContact CZ-CG 3.71Å
23	E	75.7	Confident	73.5	Confident	121 Å²	121	92.7 Å²	92.7	57%	0.565	49%	0.487	S	S	*	.			trans	-103.8	105.8	171.4	-76	-169.1	-171.3	0	0	111.5	G21 R25 L26 Y27	G21-E23 PolarHBondContact O-N 3.12Å; E23-R25 PolarHBondContact O-N 2.88Å; E23-R25 VanDerWaalsContact O-N 3.13Å; E23-L26 HydrophobicContact CB-CB 4.22Å; E23-L26 HydrophobicContact CB-CD1 4.17Å; E23-L26 HydrophobicContact CB-CG 4.25Å; E23-L26 PolarHBondContact O-N 3.3Å; E23-L26 VanDerWaalsContact O-N 3.15Å; E23-L26 WeakPolarHBondContact OE2-CD1 3.37Å; E23-L26 WeakPolarHBondContact OE2-CG 3.35Å; E23-Y27 PolarHBondContact O-N 3.41Å
24	A	74.3	Confident	73.4	Confident	57 Å²	57	99 Å²	99	47%	0.471	52%	0.515	S	S	.	.	H	α-helix	trans	-54.6	-36	-177.9	0	0	0	0	0	113.6	F22 V28	F22-A24 HydrophobicContact CE1-CB 3.98Å; A24-V28 VanDerWaalsContact O-CG2 3.26Å; A24-V28 WeakPolarHBondContact O-CG2 3.14Å; A24-V28 PolarHBondContact O-N 3.3Å
25	R	76.6	Confident	73.3	Confident	227 Å²	227	96.1 Å²	96.1	86%	0.857	51%	0.509	S	S	*	.	H	α-helix	trans	-70.8	-39.6	-178.9	-67.2	-176.7	178.5	-177.3	0.1	112.7	E23 K29	E23-R25 PolarHBondContact O-N 2.88Å; E23-R25 VanDerWaalsContact O-N 3.13Å; R25-K29 VanDerWaalsContact O-CB 3.29Å; R25-K29 WeakPolarHBondContact O-CB 3.46Å; R25-K29 PolarHBondContact O-N 3.03Å; R25-K29 VanDerWaalsContact O-N 3.12Å
26	L	75.2	Confident	72.9	Confident	99 Å²	99	96 Å²	96	52%	0.518	52%	0.521	S	S	.	.	H	α-helix	trans	-70.9	-39.5	176.1	-71	-179.8	0	0	0	111	E23 K29 Q30	E23-L26 HydrophobicContact CB-CB 4.22Å; E23-L26 HydrophobicContact CB-CD1 4.17Å; E23-L26 HydrophobicContact CB-CG 4.25Å; E23-L26 PolarHBondContact O-N 3.3Å; E23-L26 VanDerWaalsContact O-N 3.15Å; E23-L26 WeakPolarHBondContact OE2-CD1 3.37Å; E23-L26 WeakPolarHBondContact OE2-CG 3.35Å; L26-K29 PolarHBondContact O-N 3.01Å; L26-Q30 WeakPolarHBondContact O-CB 3.39Å; L26-Q30 PolarHBondContact O-N 3.38Å
27	Y	76.5	Confident	72.9	Confident	34 Å²	34	92.4 Å²	92.4	13%	0.133	51%	0.512	C	S	.	.	H	α-helix	trans	-60.9	-49.7	176.8	-179	-102.9	0	0	0	112.2	L13 F22 E23 K29 Q30 L31 I48	L13-Y27 WeakPolarHBondContact CD1-OH 3.08Å; F22-Y27 HydrophobicContact CE2-CD1 4.03Å; F22-Y27 AromaticContact CE2-CD2 3.75Å; F22-Y27 HydrophobicContact CE2-CD2 3.75Å; F22-Y27 HydrophobicContact CE2-CE2 4.39Å; F22-Y27 AromaticContact CE2-CG 3.54Å; F22-Y27 HydrophobicContact CE2-CG 3.54Å; F22-Y27 AromaticContact CZ-CD1 3.78Å; F22-Y27 HydrophobicContact CZ-CD1 3.78Å; F22-Y27 HydrophobicContact CZ-CD2 4.35Å; F22-Y27 HydrophobicContact CZ-CE1 4.47Å; F22-Y27 AromaticContact CZ-CG 3.71Å; F22-Y27 HydrophobicContact CZ-CG 3.71Å; E23-Y27 PolarHBondContact O-N 3.41Å; Y27-K29 VanDerWaalsContact C-N 3.31Å; Y27-K29 PolarHBondContact O-N 3.43Å; Y27-Q30 PolarHBondContact O-N 2.65Å; Y27-L31 WeakPolarHBondContact O-CB 3.42Å; Y27-L31 PolarHBondContact O-N 2.89Å; Y27-I48 HydrophobicContact CE1-CD1 4.22Å
28	V	76.7	Confident	72.9	Confident	90 Å²	90	95.1 Å²	95.1	55%	0.545	53%	0.527	S	S	.	.	H	α-helix	trans	-63.6	-37.9	176.6	173.6	0	0	0	0	111.4	A24 L31 S32	A24-V28 VanDerWaalsContact O-CG2 3.26Å; A24-V28 WeakPolarHBondContact O-CG2 3.14Å; A24-V28 PolarHBondContact O-N 3.3Å; V28-L31 PolarHBondContact O-N 2.91Å; V28-S32 WeakPolarHBondContact O-CB 3.38Å; V28-S32 PolarHBondContact O-N 3.29Å; V28-S32 PolarHBondContact O-OG 3.48Å
29	K	76.3	Confident	73	Confident	123 Å²	123	98.6 Å²	98.6	54%	0.535	54%	0.535	S	S	.	.	H	α-helix	trans	-63.7	-44.3	176.6	-171	177	-178.1	-178.9	0	111.7	R25 L26 Y27 S32 Q33	R25-K29 VanDerWaalsContact O-CB 3.29Å; R25-K29 WeakPolarHBondContact O-CB 3.46Å; R25-K29 PolarHBondContact O-N 3.03Å; R25-K29 VanDerWaalsContact O-N 3.12Å; L26-K29 PolarHBondContact O-N 3.01Å; Y27-K29 VanDerWaalsContact C-N 3.31Å; Y27-K29 PolarHBondContact O-N 3.43Å; K29-S32 PolarHBondContact O-N 2.98Å; K29-S32 PolarHBondContact O-OG 3.3Å; K29-Q33 WeakPolarHBondContact O-CG 3.39Å; K29-Q33 PolarHBondContact O-N 3.02Å; K29-Q33 VanDerWaalsContact O-N 3.11Å
30	Q	74.9	Confident	72.7	Confident	112 Å²	112	99.3 Å²	99.3	52%	0.523	54%	0.535	S	S	.	.	H	α-helix	trans	-69.5	-36.6	178.6	-161.1	170.5	8.5	0	0	111.8	L26 Y27 Q33 Q34	L26-Q30 WeakPolarHBondContact O-CB 3.39Å; L26-Q30 PolarHBondContact O-N 3.38Å; Y27-Q30 PolarHBondContact O-N 2.65Å; Q30-Q33 PolarHBondContact O-N 3.13Å; Q30-Q34 WeakPolarHBondContact O-CG 3.37Å; Q30-Q34 PolarHBondContact O-N 3.33Å
31	L	73.6	Confident	73.1	Confident	30 Å²	30	97.8 Å²	97.8	16%	0.157	50%	0.504	C	S	.	.	H	α-helix	trans	-63.1	-44.6	173.2	-161	78.9	0	0	0	111.3	Y27 V28 Q33 Q34 S35 L41 H44	Y27-L31 WeakPolarHBondContact O-CB 3.42Å; Y27-L31 PolarHBondContact O-N 2.89Å; V28-L31 PolarHBondContact O-N 2.91Å; L31-Q33 VanDerWaalsContact C-N 3.28Å; L31-Q33 PolarHBondContact O-N 3.32Å; L31-Q34 PolarHBondContact O-N 2.94Å; L31-S35 WeakPolarHBondContact O-CB 3.37Å; L31-S35 PolarHBondContact O-N 3.35Å; L31-S35 PolarHBondContact O-OG 3.15Å; L31-L41 HydrophobicContact CD2-CD2 4.06Å; L31-L41 HydrophobicContact CG-CD2 4.29Å; L31-H44 WeakPolarHBondContact CD1-CD2 3.37Å; L31-H44 HydrophobicContact CD2-CB 4.18Å
32	S	70.3	Confident	73.4	Confident	65 Å²	65	99.4 Å²	99.4	46%	0.455	49%	0.493	S	S	.	.	H	α-helix	trans	-67.5	-25.6	177.7	72.4	0	0	0	0	113.8	V28 K29	V28-S32 WeakPolarHBondContact O-CB 3.38Å; V28-S32 PolarHBondContact O-N 3.29Å; V28-S32 PolarHBondContact O-OG 3.48Å; K29-S32 PolarHBondContact O-N 2.98Å; K29-S32 PolarHBondContact O-OG 3.3Å
33	Q	73.2	Confident	73.4	Confident	140 Å²	140	100 Å²	100	65%	0.654	50%	0.496	S	S	*	.	H	α-helix	trans	-82.8	-21.1	177.6	-76.7	178.3	-7.5	0	0	113.7	K29 Q30 L31	K29-Q33 WeakPolarHBondContact O-CG 3.39Å; K29-Q33 PolarHBondContact O-N 3.02Å; K29-Q33 VanDerWaalsContact O-N 3.11Å; Q30-Q33 PolarHBondContact O-N 3.13Å; L31-Q33 VanDerWaalsContact C-N 3.28Å; L31-Q33 PolarHBondContact O-N 3.32Å
34	Q	68.4	Low	73.4	Confident	144 Å²	144	96.4 Å²	96.4	67%	0.673	48%	0.48	S	S	*	.	H	α-helix	trans	-100.7	-8	-178.5	-70.8	179.8	-5.2	0	0	113.4	Q30 L31	Q30-Q34 WeakPolarHBondContact O-CG 3.37Å; Q30-Q34 PolarHBondContact O-N 3.33Å; L31-Q34 PolarHBondContact O-N 2.94Å
35	S	66.9	Low	73.6	Confident	26 Å²	26	102 Å²	102	18%	0.182	49%	0.489	C	S	.	.			trans	-101.4	116.5	-176.5	-51.3	0	0	0	0	109.9	L31 G37	L31-S35 WeakPolarHBondContact O-CB 3.37Å; L31-S35 PolarHBondContact O-N 3.35Å; L31-S35 PolarHBondContact O-OG 3.15Å; S35-G37 VanDerWaalsContact C-N 3.3Å; S35-G37 PolarHBondContact O-N 2.89Å
36	D	63.8	Low	73.9	Confident	170 Å²	170	97.8 Å²	97.8	91%	0.909	48%	0.479	S	S	*	.	S	Bend	trans	-86.2	6.7	-179.3	-80.5	-29.1	0	0	0	113.4
37	G	72.1	Confident	74.1	Confident	31 Å²	31	98.9 Å²	98.9	32%	0.32	48%	0.476	S	S	.	.	S	Bend	trans	-165.5	158.6	176.9	0	0	0	0	0	116.3	S35 R39 D40	S35-G37 VanDerWaalsContact C-N 3.3Å; S35-G37 PolarHBondContact O-N 2.89Å; G37-R39 PolarHBondContact O-N 3.37Å; G37-D40 PolarHBondContact O-N 3Å
38	D	72.9	Confident	74.3	Confident	111 Å²	111	100 Å²	100	59%	0.594	48%	0.484	S	S	*	.	H	α-helix	trans	-58.3	-31.9	179.3	-173.1	45.1	0	0	0	112.9	D40 L41 Q42	D38-D40 PolarHBondContact O-N 3.19Å; D38-L41 PolarHBondContact O-N 3.4Å; D38-Q42 PolarHBondContact O-N 2.98Å; D38-Q42 VanDerWaalsContact O-N 3.08Å; D38-Q42 PolarHBondContact OD2-NE2 2.88Å
39	R	72.6	Confident	74.6	Confident	196 Å²	196	100 Å²	100	74%	0.74	48%	0.478	S	S	*	.	H	α-helix	trans	-65.2	-37.8	180	-158	179.2	77.5	175.9	5.4	112.7	G37 Q42 E43	G37-R39 PolarHBondContact O-N 3.37Å; R39-Q42 PolarHBondContact O-N 2.96Å; R39-E43 PolarHBondContact O-N 2.79Å
40	D	70.6	Confident	74.9	Confident	72 Å²	72	96.7 Å²	96.7	39%	0.385	47%	0.473	S	S	.	.	H	α-helix	trans	-73.8	-34	-178	-67.1	-10.3	0	0	0	111.3	G37 D38 H44	G37-D40 PolarHBondContact O-N 3Å; D38-D40 PolarHBondContact O-N 3.19Å; D40-H44 PolarHBondContact O-N 3.48Å
41	L	75.5	Confident	75.3	Confident	63 Å²	63	92.4 Å²	92.4	33%	0.33	45%	0.454	S	S	.	.	H	α-helix	trans	-68.2	-40.8	173.6	-75.9	162.7	0	0	0	112	L31 D38 H44 R45	L31-L41 HydrophobicContact CD2-CD2 4.06Å; L31-L41 HydrophobicContact CG-CD2 4.29Å; D38-L41 PolarHBondContact O-N 3.4Å; L41-H44 PolarHBondContact O-N 2.97Å; L41-R45 WeakPolarHBondContact O-CB 3.38Å; L41-R45 PolarHBondContact O-N 3.07Å
42	Q	77	Confident	75.6	Confident	102 Å²	102	93.4 Å²	93.4	48%	0.477	47%	0.467	S	S	.	.	H	α-helix	trans	-65.1	-39.9	175	-81.4	161.7	4.3	0	0	112.1	D38 R39 R45 Q46	D38-Q42 PolarHBondContact O-N 2.98Å; D38-Q42 VanDerWaalsContact O-N 3.08Å; D38-Q42 PolarHBondContact OD2-NE2 2.88Å; R39-Q42 PolarHBondContact O-N 2.96Å; Q42-R45 PolarHBondContact O-N 3.23Å; Q42-Q46 PolarHBondContact O-N 3.09Å
43	E	78.9	Confident	76.1	Confident	86 Å²	86	95.6 Å²	95.6	40%	0.402	47%	0.47	S	S	.	.	H	α-helix	trans	-66.4	-40.4	175.8	-162	-178.3	175.1	0	0	111.7	R39 Q46 R47	R39-E43 PolarHBondContact O-N 2.79Å; E43-Q46 PolarHBondContact O-N 3.4Å; E43-R47 WeakPolarHBondContact O-CG 3.3Å; E43-R47 PolarHBondContact O-N 3.27Å; E43-R47 IonicContact OE1-CZ 3.63Å; E43-R47 IonicContact OE1-NE 2.65Å; E43-R47 IonicContact OE1-NH2 3.57Å; E43-R47 PolarHBondContact OE1-NH2 3.34Å; E43-R47 IonicContact OE2-NH2 3.56Å
44	H	74.7	Confident	76.6	Confident	47 Å²	47	93.4 Å²	93.4	22%	0.218	46%	0.46	C	S	.	.	H	α-helix	trans	-65.6	-39.8	174.3	-120	73.1	0	0	0	112.7	L31 D40 L41 R47 I48	L31-H44 WeakPolarHBondContact CD1-CD2 3.37Å; L31-H44 HydrophobicContact CD2-CB 4.18Å; D40-H44 PolarHBondContact O-N 3.48Å; L41-H44 PolarHBondContact O-N 2.97Å; H44-R47 PolarHBondContact O-N 2.99Å; H44-I48 WeakPolarHBondContact O-CG1 3.28Å; H44-I48 PolarHBondContact O-N 3.47Å
45	R	79.6	Confident	77.1	Confident	174 Å²	174	89.1 Å²	89.1	66%	0.657	44%	0.443	S	S	*	.	H	α-helix	trans	-60.3	-46.5	173.7	176.7	-176.4	158	164.2	-3.4	111.2	L41 Q42 R47 I48 Q49	L41-R45 WeakPolarHBondContact O-CB 3.38Å; L41-R45 PolarHBondContact O-N 3.07Å; Q42-R45 PolarHBondContact O-N 3.23Å; R45-R47 VanDerWaalsContact C-N 3.31Å; R45-R47 PolarHBondContact O-N 3.4Å; R45-I48 PolarHBondContact O-N 3.19Å; R45-Q49 WeakPolarHBondContact O-CB 3.38Å; R45-Q49 PolarHBondContact O-N 3.01Å
46	Q	81.2	Confident	77.4	Confident	138 Å²	138	90.8 Å²	90.8	65%	0.645	46%	0.458	S	S	*	.	H	α-helix	trans	-61.4	-39.5	177	-82.4	-176.1	-5	0	0	112	Q42 E43 Q49 A50	Q42-Q46 PolarHBondContact O-N 3.09Å; E43-Q46 PolarHBondContact O-N 3.4Å; Q46-Q49 PolarHBondContact O-N 3.35Å; Q46-A50 WeakPolarHBondContact O-CB 3.34Å; Q46-A50 PolarHBondContact O-N 3.15Å
47	R	79.8	Confident	78	Confident	123 Å²	123	89.5 Å²	89.5	46%	0.464	45%	0.447	S	S	.	.	H	α-helix	trans	-65.4	-41	175.8	-71.7	178.4	-164.5	153.4	2.2	113	E43 H44 R45 Q49 L51	E43-R47 WeakPolarHBondContact O-CG 3.3Å; E43-R47 PolarHBondContact O-N 3.27Å; E43-R47 IonicContact OE1-CZ 3.63Å; E43-R47 IonicContact OE1-NE 2.65Å; E43-R47 IonicContact OE1-NH2 3.57Å; E43-R47 PolarHBondContact OE1-NH2 3.34Å; E43-R47 IonicContact OE2-NH2 3.56Å; H44-R47 PolarHBondContact O-N 2.99Å; R45-R47 VanDerWaalsContact C-N 3.31Å; R45-R47 PolarHBondContact O-N 3.4Å; R47-Q49 VanDerWaalsContact C-N 3.33Å; R47-L51 WeakPolarHBondContact O-CB 3.24Å; R47-L51 PolarHBondContact O-N 3.45Å
48	I	81.6	Confident	78.3	Confident	57 Å²	57	91.4 Å²	91.4	29%	0.292	45%	0.45	S	S	.	.	H	α-helix	trans	-65.2	-41	175.5	-68.1	166.9	0	0	0	110.3	L13 Y27 H44 R45 L51 A52	L13-I48 HydrophobicContact CD2-CG1 3.93Å; Y27-I48 HydrophobicContact CE1-CD1 4.22Å; H44-I48 WeakPolarHBondContact O-CG1 3.28Å; H44-I48 PolarHBondContact O-N 3.47Å; R45-I48 PolarHBondContact O-N 3.19Å; I48-L51 PolarHBondContact O-N 2.91Å; I48-A52 WeakPolarHBondContact O-CB 3.43Å; I48-A52 PolarHBondContact O-N 2.92Å
49	Q	82.3	Confident	78.4	Confident	90 Å²	90	92 Å²	92	42%	0.421	45%	0.453	S	S	.	.	H	α-helix	trans	-66.6	-43.7	179.7	-168.1	166.5	-9.4	0	0	112	R45 Q46 R47 L51 A52 E53	R45-Q49 WeakPolarHBondContact O-CB 3.38Å; R45-Q49 PolarHBondContact O-N 3.01Å; Q46-Q49 PolarHBondContact O-N 3.35Å; R47-Q49 VanDerWaalsContact C-N 3.33Å; Q49-L51 PolarHBondContact O-N 3.37Å; Q49-A52 WeakPolarHBondContact O-CB 3.48Å; Q49-A52 PolarHBondContact O-N 2.9Å; Q49-E53 PolarHBondContact O-N 3.49Å
50	A	82.9	Confident	78.4	Confident	54 Å²	54	87 Å²	87	45%	0.446	44%	0.436	S	S	.	.	H	α-helix	trans	-62.2	-41.2	173.5	0	0	0	0	0	112.1	Q46 A52 E53 E54	Q46-A50 WeakPolarHBondContact O-CB 3.34Å; Q46-A50 PolarHBondContact O-N 3.15Å; A50-A52 VanDerWaalsContact C-N 3.33Å; A50-A52 PolarHBondContact O-N 3.49Å; A50-E53 PolarHBondContact O-N 3.41Å; A50-E54 WeakPolarHBondContact O-CB 3.4Å; A50-E54 PolarHBondContact O-N 3.46Å
51	L	83.3	Confident	78.6	Confident	21 Å²	21	91.6 Å²	91.6	11%	0.11	45%	0.448	C	S	.	.	H	α-helix	trans	-65.4	-38.1	176.3	-155.1	95.3	0	0	0	111.5	L13 R14 L17 R47 I48 Q49 E54 T55	L13-L51 HydrophobicContact CD2-CD2 4.46Å; R14-L51 HydrophobicContact CB-CD1 4.47Å; R14-L51 HydrophobicContact CB-CD2 4Å; R14-L51 HydrophobicContact CG-CD2 4.26Å; L17-L51 HydrophobicContact CD1-CD2 4.01Å; R47-L51 WeakPolarHBondContact O-CB 3.24Å; R47-L51 PolarHBondContact O-N 3.45Å; I48-L51 PolarHBondContact O-N 2.91Å; Q49-L51 PolarHBondContact O-N 3.37Å; L51-E54 PolarHBondContact O-N 2.86Å; L51-T55 PolarHBondContact O-N 2.84Å; L51-T55 PolarHBondContact O-OG1 3.5Å
52	A	79.6	Confident	78.7	Confident	52 Å²	52	92.9 Å²	92.9	43%	0.43	46%	0.455	S	S	.	.	H	α-helix	trans	-64.1	-47.6	176.8	0	0	0	0	0	111.5	I48 Q49 A50 E54 T55 A56	I48-A52 WeakPolarHBondContact O-CB 3.43Å; I48-A52 PolarHBondContact O-N 2.92Å; Q49-A52 WeakPolarHBondContact O-CB 3.48Å; Q49-A52 PolarHBondContact O-N 2.9Å; A50-A52 VanDerWaalsContact C-N 3.33Å; A50-A52 PolarHBondContact O-N 3.49Å; A52-E54 PolarHBondContact O-N 3.24Å; A52-T55 WeakPolarHBondContact CA-OG1 2.83Å; A52-T55 PolarHBondContact O-N 2.71Å; A52-T55 PolarHBondContact O-OG1 3.47Å; A52-A56 WeakPolarHBondContact O-CB 3.18Å; A52-A56 PolarHBondContact O-N 3.34Å
53	E	81.9	Confident	78.4	Confident	111 Å²	111	91.4 Å²	91.4	52%	0.519	45%	0.453	S	S	.	.	H	α-helix	trans	-60.7	-43.2	175.4	-74.9	167.9	-166	0	0	111.6	Q49 A50 A56 Q57	Q49-E53 PolarHBondContact O-N 3.49Å; A50-E53 PolarHBondContact O-N 3.41Å; E53-A56 PolarHBondContact O-N 2.95Å; E53-Q57 PolarHBondContact O-N 3.33Å
54	E	83.3	Confident	77.8	Confident	94 Å²	94	91.4 Å²	91.4	44%	0.439	45%	0.45	S	S	.	.	H	α-helix	trans	-64	-42.4	175.9	-167.8	-165.9	154.5	0	0	112	A50 L51 A52 N58	A50-E54 WeakPolarHBondContact O-CB 3.4Å; A50-E54 PolarHBondContact O-N 3.46Å; L51-E54 PolarHBondContact O-N 2.86Å; A52-E54 PolarHBondContact O-N 3.24Å; E54-N58 WeakPolarHBondContact O-CB 3.37Å; E54-N58 PolarHBondContact O-N 3.1Å; E54-N58 PolarHBondContact O-ND2 3.43Å
55	T	78.6	Confident	77.6	Confident	53 Å²	53	95.4 Å²	95.4	33%	0.325	47%	0.469	S	S	.	.	H	α-helix	trans	-66.8	-38.5	175.1	44.6	0	0	0	0	112.4	L51 A52 N58 L59	L51-T55 PolarHBondContact O-N 2.84Å; L51-T55 PolarHBondContact O-OG1 3.5Å; A52-T55 WeakPolarHBondContact CA-OG1 2.83Å; A52-T55 PolarHBondContact O-N 2.71Å; A52-T55 PolarHBondContact O-OG1 3.47Å; T55-N58 PolarHBondContact O-N 3.16Å; T55-L59 WeakPolarHBondContact O-CB 3.04Å; T55-L59 PolarHBondContact O-N 3.3Å
56	A	72.9	Confident	77.3	Confident	61 Å²	61	89.6 Å²	89.6	50%	0.504	45%	0.451	S	S	.	.	H	α-helix	trans	-63.5	-44.6	176.4	0	0	0	0	0	111.2	A52 E53 L59 K60	A52-A56 WeakPolarHBondContact O-CB 3.18Å; A52-A56 PolarHBondContact O-N 3.34Å; E53-A56 PolarHBondContact O-N 2.95Å; A56-L59 PolarHBondContact O-N 2.95Å; A56-K60 VanDerWaalsContact O-CB 3.26Å; A56-K60 WeakPolarHBondContact O-CB 3.26Å; A56-K60 PolarHBondContact O-N 2.88Å
57	Q	76.1	Confident	76.7	Confident	144 Å²	144	85.8 Å²	85.8	67%	0.673	43%	0.431	S	S	*	.	H	α-helix	trans	-64.8	-41.1	175	-76.9	-179.4	-5.4	0	0	112.6	E53 K60 R61	E53-Q57 PolarHBondContact O-N 3.33Å; Q57-K60 PolarHBondContact O-N 2.95Å; Q57-R61 WeakPolarHBondContact O-CB 3.47Å; Q57-R61 PolarHBondContact O-N 2.89Å
58	N	78.3	Confident	76.1	Confident	71 Å²	71	88.6 Å²	88.6	38%	0.38	44%	0.441	S	S	.	.	H	α-helix	trans	-66.6	-39.6	176.3	-82.1	-38	0	0	0	112.2	E54 T55 R61 N62	E54-N58 WeakPolarHBondContact O-CB 3.37Å; E54-N58 PolarHBondContact O-N 3.1Å; E54-N58 PolarHBondContact O-ND2 3.43Å; T55-N58 PolarHBondContact O-N 3.16Å; N58-R61 PolarHBondContact O-N 3.35Å; N58-N62 VanDerWaalsContact O-CB 3.23Å; N58-N62 WeakPolarHBondContact O-CB 3.32Å; N58-N62 PolarHBondContact O-N 2.99Å
59	L	75.9	Confident	75.8	Confident	124 Å²	124	91.9 Å²	91.9	65%	0.649	46%	0.455	S	S	*	.	H	α-helix	trans	-64.8	-45.9	175.7	-147.5	109	0	0	0	110.1	T55 A56 R61 N62 V63	T55-L59 WeakPolarHBondContact O-CB 3.04Å; T55-L59 PolarHBondContact O-N 3.3Å; A56-L59 PolarHBondContact O-N 2.95Å; L59-R61 PolarHBondContact O-N 2.94Å; L59-N62 PolarHBondContact O-N 3.37Å; L59-V63 WeakPolarHBondContact O-CB 3.38Å; L59-V63 VanDerWaalsContact O-CG2 3.25Å; L59-V63 WeakPolarHBondContact O-CG2 3.41Å; L59-V63 PolarHBondContact O-N 3Å
60	K	72.8	Confident	75.6	Confident	90 Å²	90	93.9 Å²	93.9	39%	0.391	46%	0.463	S	S	.	.	H	α-helix	trans	-55.6	-50.9	174.4	-172.1	166.1	-174.5	172.2	0	110.3	A56 Q57 N62 V63 Y64 E339	A56-K60 VanDerWaalsContact O-CB 3.26Å; A56-K60 WeakPolarHBondContact O-CB 3.26Å; A56-K60 PolarHBondContact O-N 2.88Å; Q57-K60 PolarHBondContact O-N 2.95Å; K60-N62 VanDerWaalsContact C-N 3.35Å; K60-N62 PolarHBondContact O-N 2.92Å; K60-V63 PolarHBondContact O-N 2.82Å; K60-Y64 HydrophobicContact CD-CE2 3.95Å; K60-Y64 VanDerWaalsContact CE-CE2 3.42Å; K60-Y64 WeakPolarHBondContact CE-OH 3.32Å; K60-Y64 HydrophobicContact CG-CD2 3.68Å; K60-Y64 HydrophobicContact CG-CE2 3.27Å; K60-Y64 WeakPolarHBondContact O-CD2 3.44Å; K60-Y64 PolarHBondContact O-N 2.49Å; K60-E339 WeakPolarHBondContact CE-OE1 3.5Å; K60-E339 IonicContact NZ-OE1 3.6Å; K60-E339 PolarHBondContact NZ-OE1 3.08Å
61	R	75.4	Confident	75.1	Confident	168 Å²	168	93.1 Å²	93.1	63%	0.634	45%	0.451	S	S	*	.	H	α-helix	trans	-61.9	-37.8	177.5	-168.2	175.4	-176.8	138.9	1.8	113.4	Q57 N58 L59 Q65	Q57-R61 WeakPolarHBondContact O-CB 3.47Å; Q57-R61 PolarHBondContact O-N 2.89Å; N58-R61 PolarHBondContact O-N 3.35Å; L59-R61 PolarHBondContact O-N 2.94Å; R61-Q65 WeakPolarHBondContact O-CB 3.24Å; R61-Q65 VanDerWaalsContact O-CG 3.29Å; R61-Q65 WeakPolarHBondContact O-CG 3.32Å; R61-Q65 PolarHBondContact O-N 3.1Å
62	N	75.8	Confident	74.4	Confident	91 Å²	91	95.7 Å²	95.7	49%	0.487	46%	0.462	S	S	.	.	H	α-helix	trans	-72.2	-40.6	179	-163.5	-54.9	0	0	0	111.5	N58 L59 K60 Q65 N66	N58-N62 VanDerWaalsContact O-CB 3.23Å; N58-N62 WeakPolarHBondContact O-CB 3.32Å; N58-N62 PolarHBondContact O-N 2.99Å; L59-N62 PolarHBondContact O-N 3.37Å; K60-N62 VanDerWaalsContact C-N 3.35Å; K60-N62 PolarHBondContact O-N 2.92Å; N62-Q65 PolarHBondContact O-N 2.89Å; N62-N66 WeakPolarHBondContact O-CB 3.24Å; N62-N66 PolarHBondContact O-N 3.4Å; N62-N66 PolarHBondContact O-ND2 3.26Å; N62-N66 PolarHBondContact OD1-ND2 2.93Å
63	V	71.5	Confident	74.2	Confident	71 Å²	71	96.7 Å²	96.7	43%	0.43	46%	0.464	S	S	.	.	H	α-helix	trans	-61	-45.8	171.5	171.6	0	0	0	0	110	L59 K60 N66 Y67	L59-V63 WeakPolarHBondContact O-CB 3.38Å; L59-V63 VanDerWaalsContact O-CG2 3.25Å; L59-V63 WeakPolarHBondContact O-CG2 3.41Å; L59-V63 PolarHBondContact O-N 3Å; K60-V63 PolarHBondContact O-N 2.82Å; V63-N66 CarbonylContact O-C 3.51Å; V63-N66 PolarHBondContact O-N 3.19Å; V63-Y67 WeakPolarHBondContact O-CA 3.42Å; V63-Y67 WeakPolarHBondContact O-CB 3.45Å; V63-Y67 PolarHBondContact O-N 2.69Å
64	Y	66.6	Low	73.8	Confident	86 Å²	86	93.6 Å²	93.6	34%	0.337	46%	0.457	S	S	.	.	H	α-helix	trans	-65.9	-38.2	176.4	-76.6	-62.8	0	0	0	114	K60 N66 Y67 E342	K60-Y64 HydrophobicContact CD-CE2 3.95Å; K60-Y64 VanDerWaalsContact CE-CE2 3.42Å; K60-Y64 WeakPolarHBondContact CE-OH 3.32Å; K60-Y64 HydrophobicContact CG-CD2 3.68Å; K60-Y64 HydrophobicContact CG-CE2 3.27Å; K60-Y64 WeakPolarHBondContact O-CD2 3.44Å; K60-Y64 PolarHBondContact O-N 2.49Å; Y64-N66 VanDerWaalsContact C-N 3.33Å; Y64-N66 PolarHBondContact O-N 3.04Å; Y64-Y67 WeakPolarHBondContact O-CB 3.25Å; Y64-Y67 PolarHBondContact O-N 2.99Å; Y64-E342 VanDerWaalsContact CE1-OE2 3.24Å; Y64-E342 WeakPolarHBondContact CE1-OE2 3.46Å
65	Q	70.4	Confident	73.1	Confident	130 Å²	130	96.3 Å²	96.3	61%	0.607	46%	0.463	S	S	*	.	H	α-helix	trans	-65.4	-37.7	176.1	-82.1	180	-12.2	0	0	112.2	R61 N62 Y67	R61-Q65 WeakPolarHBondContact O-CB 3.24Å; R61-Q65 VanDerWaalsContact O-CG 3.29Å; R61-Q65 WeakPolarHBondContact O-CG 3.32Å; R61-Q65 PolarHBondContact O-N 3.1Å; N62-Q65 PolarHBondContact O-N 2.89Å; Q65-Y67 VanDerWaalsContact C-N 3.35Å
66	N	74	Confident	73	Confident	52 Å²	52	99.6 Å²	99.6	28%	0.278	48%	0.475	S	S	.	.	H	α-helix	trans	-88.4	-4.4	176.5	-66.9	-54.3	0	0	0	113	N62 V63 Y64 R68 Q69 F70	N62-N66 WeakPolarHBondContact O-CB 3.24Å; N62-N66 PolarHBondContact O-N 3.4Å; N62-N66 PolarHBondContact O-ND2 3.26Å; N62-N66 PolarHBondContact OD1-ND2 2.93Å; V63-N66 CarbonylContact O-C 3.51Å; V63-N66 PolarHBondContact O-N 3.19Å; Y64-N66 VanDerWaalsContact C-N 3.33Å; Y64-N66 PolarHBondContact O-N 3.04Å; N66-R68 VanDerWaalsContact C-N 3.27Å; N66-R68 PolarHBondContact O-N 3.17Å; N66-Q69 WeakPolarHBondContact O-CA 3.44Å; N66-Q69 WeakPolarHBondContact O-CB 3.27Å; N66-Q69 PolarHBondContact O-N 3.27Å; N66-F70 HydrophobicContact CB-CD2 4.04Å; N66-F70 HydrophobicContact CB-CE2 4.06Å; N66-F70 WeakPolarHBondContact O-CD2 3.23Å; N66-F70 PolarHBondContact O-N 3.03Å
67	Y	68.6	Low	73.3	Confident	58 Å²	58	101.9 Å²	101.9	23%	0.227	48%	0.477	C	S	.	.	H	α-helix	trans	-59.3	-38.5	-175.2	-163.7	-110.7	0	0	0	112.5	V63 Y64 Q65 Q69 F70 I71 V346	V63-Y67 WeakPolarHBondContact O-CA 3.42Å; V63-Y67 WeakPolarHBondContact O-CB 3.45Å; V63-Y67 PolarHBondContact O-N 2.69Å; Y64-Y67 WeakPolarHBondContact O-CB 3.25Å; Y64-Y67 PolarHBondContact O-N 2.99Å; Q65-Y67 VanDerWaalsContact C-N 3.35Å; Y67-Q69 VanDerWaalsContact C-N 3.32Å; Y67-Q69 PolarHBondContact O-N 3.43Å; Y67-F70 PolarHBondContact O-N 3.27Å; Y67-I71 HydrophobicContact CD1-CD1 3.51Å; Y67-I71 HydrophobicContact CD1-CG1 4.24Å; Y67-I71 HydrophobicContact CE1-CD1 3.37Å; Y67-I71 HydrophobicContact CE1-CG1 4.32Å; Y67-I71 HydrophobicContact CG-CD1 4.38Å; Y67-I71 WeakPolarHBondContact O-CB 3.24Å; Y67-I71 WeakPolarHBondContact O-CG1 3.35Å; Y67-I71 PolarHBondContact O-N 2.88Å; Y67-V346 HydrophobicContact CE1-CG2 4.02Å; Y67-V346 HydrophobicContact CE2-CG2 4.31Å; Y67-V346 VanDerWaalsContact CZ-CG2 3.48Å; Y67-V346 WeakPolarHBondContact OH-CG2 3.28Å
68	R	66.8	Low	73	Confident	183 Å²	183	96.3 Å²	96.3	69%	0.691	45%	0.454	S	S	*	.	H	α-helix	trans	-61	-42.6	174.6	-170.6	-179	177.7	119.1	0.8	111.7	N66 I71 E72	N66-R68 VanDerWaalsContact C-N 3.27Å; N66-R68 PolarHBondContact O-N 3.17Å; R68-I71 PolarHBondContact O-N 3.44Å; R68-E72 IonicContact CZ-OE1 3.98Å; R68-E72 IonicContact NE-OE1 2.72Å; R68-E72 PolarHBondContact NE-OE1 2.98Å; R68-E72 IonicContact NH2-OE1 2.71Å; R68-E72 WeakPolarHBondContact O-CB 3.48Å; R68-E72 VanDerWaalsContact O-CG 3.28Å; R68-E72 WeakPolarHBondContact O-CG 3.3Å; R68-E72 PolarHBondContact O-N 3.2Å
69	Q	75.2	Confident	72.8	Confident	125 Å²	125	98 Å²	98	58%	0.584	46%	0.456	S	S	*	.	H	α-helix	trans	-70.3	-36	177.6	-68.5	178.9	-3.7	0	0	111.8	N66 Y67 T73	N66-Q69 WeakPolarHBondContact O-CA 3.44Å; N66-Q69 WeakPolarHBondContact O-CB 3.27Å; N66-Q69 PolarHBondContact O-N 3.27Å; Y67-Q69 VanDerWaalsContact C-N 3.32Å; Y67-Q69 PolarHBondContact O-N 3.43Å; Q69-T73 WeakPolarHBondContact O-CB 3.43Å; Q69-T73 PolarHBondContact O-N 3.12Å; Q69-T73 PolarHBondContact O-OG1 3.34Å
70	F	77.5	Confident	73.1	Confident	133 Å²	133	97 Å²	97	58%	0.583	45%	0.451	S	S	*	.	H	α-helix	trans	-66.6	-41	173.5	-85.7	-71.9	0	0	0	112.5	N66 Y67 T73 A74	N66-F70 HydrophobicContact CB-CD2 4.04Å; N66-F70 HydrophobicContact CB-CE2 4.06Å; N66-F70 WeakPolarHBondContact O-CD2 3.23Å; N66-F70 PolarHBondContact O-N 3.03Å; Y67-F70 PolarHBondContact O-N 3.27Å; F70-T73 WeakPolarHBondContact CA-OG1 3.42Å; F70-T73 PolarHBondContact O-OG1 3.11Å; F70-A74 WeakPolarHBondContact O-CB 3.46Å; F70-A74 PolarHBondContact O-N 2.93Å
71	I	72.4	Confident	73.2	Confident	38 Å²	38	97.4 Å²	97.4	20%	0.195	45%	0.454	C	S	.	.	H	α-helix	trans	-66.9	-43.6	174.8	-72	-179.2	0	0	0	110.6	Y67 R68 A74 R75 V346 A349	Y67-I71 HydrophobicContact CD1-CD1 3.51Å; Y67-I71 HydrophobicContact CD1-CG1 4.24Å; Y67-I71 HydrophobicContact CE1-CD1 3.37Å; Y67-I71 HydrophobicContact CE1-CG1 4.32Å; Y67-I71 HydrophobicContact CG-CD1 4.38Å; Y67-I71 WeakPolarHBondContact O-CB 3.24Å; Y67-I71 WeakPolarHBondContact O-CG1 3.35Å; Y67-I71 PolarHBondContact O-N 2.88Å; R68-I71 PolarHBondContact O-N 3.44Å; I71-A74 PolarHBondContact O-N 3.46Å; I71-R75 WeakPolarHBondContact O-CB 2.99Å; I71-R75 PolarHBondContact O-N 3.21Å; I71-V346 HydrophobicContact CD1-CG2 4.17Å; I71-A349 HydrophobicContact CG2-CB 3.95Å
72	E	69	Low	72.8	Confident	74 Å²	74	90.4 Å²	90.4	35%	0.346	43%	0.431	S	S	.	.	H	α-helix	trans	-61.3	-48.5	176.5	-77.3	170.1	-174.1	0	0	110.4	R68 A74 R75 E76	R68-E72 IonicContact CZ-OE1 3.98Å; R68-E72 IonicContact NE-OE1 2.72Å; R68-E72 PolarHBondContact NE-OE1 2.98Å; R68-E72 IonicContact NH2-OE1 2.71Å; R68-E72 WeakPolarHBondContact O-CB 3.48Å; R68-E72 VanDerWaalsContact O-CG 3.28Å; R68-E72 WeakPolarHBondContact O-CG 3.3Å; R68-E72 PolarHBondContact O-N 3.2Å; E72-A74 PolarHBondContact O-N 3.01Å; E72-R75 WeakPolarHBondContact O-CB 3.46Å; E72-R75 PolarHBondContact O-N 2.88Å; E72-E76 PolarHBondContact O-N 3.42Å
73	T	76.3	Confident	73.2	Confident	74 Å²	74	89.9 Å²	89.9	45%	0.454	43%	0.426	S	S	.	.	H	α-helix	trans	-64.4	-40.8	176.1	38.7	0	0	0	0	113.4	Q69 F70 R75 E76 I77	Q69-T73 WeakPolarHBondContact O-CB 3.43Å; Q69-T73 PolarHBondContact O-N 3.12Å; Q69-T73 PolarHBondContact O-OG1 3.34Å; F70-T73 WeakPolarHBondContact CA-OG1 3.42Å; F70-T73 PolarHBondContact O-OG1 3.11Å; T73-R75 VanDerWaalsContact C-N 3.32Å; T73-R75 PolarHBondContact O-N 3.37Å; T73-E76 WeakPolarHBondContact O-CB 3.46Å; T73-E76 PolarHBondContact O-N 2.96Å; T73-I77 WeakPolarHBondContact O-CB 3.45Å; T73-I77 WeakPolarHBondContact O-CD1 3.3Å; T73-I77 WeakPolarHBondContact O-CG1 3.38Å; T73-I77 PolarHBondContact O-N 3.44Å
74	A	71.8	Confident	73.7	Confident	46 Å²	46	92.2 Å²	92.2	38%	0.38	43%	0.433	S	S	.	.	H	α-helix	trans	-64.2	-38.1	175.3	0	0	0	0	0	111.9	F70 I71 E72 I77 S78	F70-A74 WeakPolarHBondContact O-CB 3.46Å; F70-A74 PolarHBondContact O-N 2.93Å; I71-A74 PolarHBondContact O-N 3.46Å; E72-A74 PolarHBondContact O-N 3.01Å; A74-I77 PolarHBondContact O-N 2.82Å; A74-S78 WeakPolarHBondContact O-CB 3.5Å; A74-S78 PolarHBondContact O-N 3.43Å
75	R	69.6	Low	74.2	Confident	150 Å²	150	95.3 Å²	95.3	57%	0.566	45%	0.446	S	S	*	.	H	α-helix	trans	-65.6	-42.3	174.3	-175.1	-178.3	-79.8	178.5	-4.6	111.1	I71 E72 T73 S78 Y79	I71-R75 WeakPolarHBondContact O-CB 2.99Å; I71-R75 PolarHBondContact O-N 3.21Å; E72-R75 WeakPolarHBondContact O-CB 3.46Å; E72-R75 PolarHBondContact O-N 2.88Å; T73-R75 VanDerWaalsContact C-N 3.32Å; T73-R75 PolarHBondContact O-N 3.37Å; R75-S78 PolarHBondContact O-N 2.86Å; R75-Y79 VanDerWaalsContact O-CB 3.32Å; R75-Y79 WeakPolarHBondContact O-CB 3.36Å; R75-Y79 PolarHBondContact O-N 2.87Å
76	E	75.8	Confident	74.3	Confident	122 Å²	122	93.2 Å²	93.2	57%	0.57	44%	0.436	S	S	*	.	H	α-helix	trans	-61.1	-44.1	173.9	-129.7	94.7	-144.8	0	0	111.4	E72 T73 Y79 L80	E72-E76 PolarHBondContact O-N 3.42Å; T73-E76 WeakPolarHBondContact O-CB 3.46Å; T73-E76 PolarHBondContact O-N 2.96Å; E76-Y79 WeakPolarHBondContact O-CB 3.47Å; E76-Y79 PolarHBondContact O-N 2.69Å; E76-L80 WeakPolarHBondContact O-CB 3.43Å; E76-L80 PolarHBondContact O-N 2.68Å
77	I	79.8	Confident	74.6	Confident	109 Å²	109	96 Å²	96	56%	0.559	45%	0.45	S	S	*	.	H	α-helix	trans	-63.7	-45.5	178.3	-69.5	163.1	0	0	0	110.6	T73 A74 Y79 L80 E81	T73-I77 WeakPolarHBondContact O-CB 3.45Å; T73-I77 WeakPolarHBondContact O-CD1 3.3Å; T73-I77 WeakPolarHBondContact O-CG1 3.38Å; T73-I77 PolarHBondContact O-N 3.44Å; A74-I77 PolarHBondContact O-N 2.82Å; I77-Y79 VanDerWaalsContact C-N 3.31Å; I77-Y79 PolarHBondContact O-N 3.46Å; I77-L80 PolarHBondContact O-N 2.88Å; I77-E81 WeakPolarHBondContact O-CB 3.4Å; I77-E81 PolarHBondContact O-N 3.08Å
78	S	69.3	Low	75.2	Confident	27 Å²	27	96.2 Å²	96.2	19%	0.189	46%	0.46	C	S	.	.	H	α-helix	trans	-63.3	-38.7	176.3	-175.5	0	0	0	0	111.7	A74 R75 S82	A74-S78 WeakPolarHBondContact O-CB 3.5Å; A74-S78 PolarHBondContact O-N 3.43Å; R75-S78 PolarHBondContact O-N 2.86Å; S78-S82 WeakPolarHBondContact O-CB 3.35Å; S78-S82 PolarHBondContact O-N 2.91Å; S78-S82 PolarHBondContact O-OG 3.44Å
79	Y	74.5	Confident	75.9	Confident	106 Å²	106	92.7 Å²	92.7	42%	0.416	45%	0.451	S	S	.	.	H	α-helix	trans	-63.4	-46.5	175	-176	-95.2	0	0	0	111.9	R75 E76 I77 S82 E83	R75-Y79 VanDerWaalsContact O-CB 3.32Å; R75-Y79 WeakPolarHBondContact O-CB 3.36Å; R75-Y79 PolarHBondContact O-N 2.87Å; E76-Y79 WeakPolarHBondContact O-CB 3.47Å; E76-Y79 PolarHBondContact O-N 2.69Å; I77-Y79 VanDerWaalsContact C-N 3.31Å; I77-Y79 PolarHBondContact O-N 3.46Å; Y79-S82 WeakPolarHBondContact CA-OG 3.32Å; Y79-S82 PolarHBondContact O-N 3.46Å; Y79-S82 PolarHBondContact O-OG 2.85Å; Y79-E83 HydrophobicContact CD1-CG 4.44Å; Y79-E83 HydrophobicContact CE1-CG 3.94Å; Y79-E83 WeakPolarHBondContact CE1-OE1 3.49Å; Y79-E83 PolarHBondContact O-N 2.86Å; Y79-E83 PolarHBondContact OH-OE1 3.14Å
80	L	81.2	Confident	76.2	Confident	105 Å²	105	91.5 Å²	91.5	55%	0.55	45%	0.448	S	S	.	.	H	α-helix	trans	-62.4	-45.3	175.5	-88.4	158.4	0	0	0	112.6	E76 I77 S82 E83 M84	E76-L80 WeakPolarHBondContact O-CB 3.43Å; E76-L80 PolarHBondContact O-N 2.68Å; I77-L80 PolarHBondContact O-N 2.88Å; L80-S82 VanDerWaalsContact C-N 3.26Å; L80-S82 PolarHBondContact O-N 2.94Å; L80-E83 PolarHBondContact O-N 3.39Å; L80-M84 WeakPolarHBondContact O-CB 2.85Å; L80-M84 PolarHBondContact O-N 3.4Å
81	E	76.8	Confident	76.3	Confident	98 Å²	98	89.9 Å²	89.9	46%	0.458	45%	0.445	S	S	.	.	H	α-helix	trans	-58.8	-43.7	177.4	-176.7	178.8	-175.8	0	0	110.4	I77 M84 Y85	I77-E81 WeakPolarHBondContact O-CB 3.4Å; I77-E81 PolarHBondContact O-N 3.08Å; E81-M84 WeakPolarHBondContact O-CB 3.46Å; E81-M84 PolarHBondContact O-N 3.04Å; E81-Y85 HydrophobicContact CG-CD2 3.99Å; E81-Y85 HydrophobicContact CG-CE2 3.87Å; E81-Y85 VanDerWaalsContact O-CD2 3.26Å; E81-Y85 WeakPolarHBondContact O-CD2 3.13Å; E81-Y85 PolarHBondContact O-N 3.19Å
82	S	66.6	Low	76.7	Confident	21 Å²	21	92.2 Å²	92.2	15%	0.147	46%	0.461	C	S	.	.	H	α-helix	trans	-74.8	-28.9	-178.7	55.1	0	0	0	0	112.9	S78 Y79 L80 Q86 R405	S78-S82 WeakPolarHBondContact O-CB 3.35Å; S78-S82 PolarHBondContact O-N 2.91Å; S78-S82 PolarHBondContact O-OG 3.44Å; Y79-S82 WeakPolarHBondContact CA-OG 3.32Å; Y79-S82 PolarHBondContact O-N 3.46Å; Y79-S82 PolarHBondContact O-OG 2.85Å; L80-S82 VanDerWaalsContact C-N 3.26Å; L80-S82 PolarHBondContact O-N 2.94Å; S82-Q86 PolarHBondContact O-N 3.4Å; S82-Q86 VanDerWaalsContact O-N 3.13Å; S82-R405 PolarHBondContact O-NH1 2.86Å; S82-R405 PolarHBondContact OG-NH1 3.36Å
83	E	84.1	Confident	77.3	Confident	79 Å²	79	93 Å²	93	37%	0.369	47%	0.465	S	S	.	.	H	α-helix	trans	-66.3	-40.1	165.5	-80.5	-171.4	157.2	0	0	112.2	Y79 L80 Y85 Q86 L87 R405	Y79-E83 HydrophobicContact CD1-CG 4.44Å; Y79-E83 HydrophobicContact CE1-CG 3.94Å; Y79-E83 WeakPolarHBondContact CE1-OE1 3.49Å; Y79-E83 PolarHBondContact O-N 2.86Å; Y79-E83 PolarHBondContact OH-OE1 3.14Å; L80-E83 PolarHBondContact O-N 3.39Å; E83-Y85 VanDerWaalsContact C-N 3.34Å; E83-Y85 PolarHBondContact O-N 3.37Å; E83-Q86 WeakPolarHBondContact O-CB 3.29Å; E83-Q86 PolarHBondContact O-N 2.92Å; E83-L87 PolarHBondContact O-N 3.13Å; E83-R405 VanDerWaalsContact CA-NH2 3.31Å
84	M	81.3	Confident	77.4	Confident	121 Å²	121	94.9 Å²	94.9	60%	0.596	47%	0.469	S	S	*	.	H	α-helix	trans	-63.9	-39.6	176	-173.1	-172.4	67.5	0	0	111.5	L80 E81 L87 S88	L80-M84 WeakPolarHBondContact O-CB 2.85Å; L80-M84 PolarHBondContact O-N 3.4Å; E81-M84 WeakPolarHBondContact O-CB 3.46Å; E81-M84 PolarHBondContact O-N 3.04Å; M84-L87 PolarHBondContact O-N 2.89Å; M84-S88 WeakPolarHBondContact O-CB 3.27Å; M84-S88 PolarHBondContact O-N 3.05Å
85	Y	77.6	Confident	77.8	Confident	151 Å²	151	98.5 Å²	98.5	59%	0.592	48%	0.476	S	S	*	.	H	α-helix	trans	-63.3	-41	172.3	-89.4	-73.7	0	0	0	112.5	E81 E83 S88 H89	E81-Y85 HydrophobicContact CG-CD2 3.99Å; E81-Y85 HydrophobicContact CG-CE2 3.87Å; E81-Y85 VanDerWaalsContact O-CD2 3.26Å; E81-Y85 WeakPolarHBondContact O-CD2 3.13Å; E81-Y85 PolarHBondContact O-N 3.19Å; E83-Y85 VanDerWaalsContact C-N 3.34Å; E83-Y85 PolarHBondContact O-N 3.37Å; Y85-S88 PolarHBondContact O-N 3.48Å; Y85-H89 WeakPolarHBondContact O-CB 3.34Å; Y85-H89 PolarHBondContact O-N 2.81Å
86	Q	72.8	Confident	78	Confident	85 Å²	85	94.5 Å²	94.5	40%	0.397	47%	0.471	S	S	.	.	H	α-helix	trans	-61.5	-45.8	173.2	-79.1	-171.1	-29	0	0	112.1	S82 E83 S88 H89 L90 R405	S82-Q86 PolarHBondContact O-N 3.4Å; S82-Q86 VanDerWaalsContact O-N 3.13Å; E83-Q86 WeakPolarHBondContact O-CB 3.29Å; E83-Q86 PolarHBondContact O-N 2.92Å; Q86-S88 VanDerWaalsContact C-N 3.3Å; Q86-S88 PolarHBondContact O-N 3.08Å; Q86-H89 PolarHBondContact O-N 3.36Å; Q86-L90 WeakPolarHBondContact O-CB 3.36Å; Q86-L90 PolarHBondContact O-N 2.9Å; Q86-R405 VanDerWaalsContact CD-CZ 3.4Å; Q86-R405 HydrophobicContact CG-CG 3.65Å
87	L	80.8	Confident	77.8	Confident	111 Å²	111	91.6 Å²	91.6	58%	0.581	46%	0.464	S	S	*	.	H	α-helix	trans	-61.2	-43.2	178.4	-162.7	85.9	0	0	0	110.6	E83 M84 L90 L91	E83-L87 PolarHBondContact O-N 3.13Å; M84-L87 PolarHBondContact O-N 2.89Å; L87-L90 PolarHBondContact O-N 3.27Å; L87-L91 HydrophobicContact CD2-CD1 4.26Å; L87-L91 HydrophobicContact CG-CD1 4.21Å; L87-L91 VanDerWaalsContact O-CB 3.3Å; L87-L91 WeakPolarHBondContact O-CB 3.44Å; L87-L91 WeakPolarHBondContact O-CG 3.28Å; L87-L91 PolarHBondContact O-N 2.83Å
88	S	80.8	Confident	77.5	Confident	63 Å²	63	92.2 Å²	92.2	44%	0.441	47%	0.468	S	S	.	.	H	α-helix	trans	-61.1	-43.7	175.5	-176.9	0	0	0	0	112.2	M84 Y85 Q86 L91 T92	M84-S88 WeakPolarHBondContact O-CB 3.27Å; M84-S88 PolarHBondContact O-N 3.05Å; Y85-S88 PolarHBondContact O-N 3.48Å; Q86-S88 VanDerWaalsContact C-N 3.3Å; Q86-S88 PolarHBondContact O-N 3.08Å; S88-L91 PolarHBondContact O-N 3.3Å; S88-T92 WeakPolarHBondContact O-CB 3.15Å; S88-T92 PolarHBondContact O-N 3.43Å; S88-T92 PolarHBondContact O-OG1 3.02Å
89	H	81.3	Confident	77.7	Confident	109 Å²	109	97.5 Å²	97.5	51%	0.505	49%	0.489	S	S	.	.	H	α-helix	trans	-63.3	-47.5	175.1	-172.1	-80	0	0	0	111.1	Y85 Q86 L91 T92 E93	Y85-H89 WeakPolarHBondContact O-CB 3.34Å; Y85-H89 PolarHBondContact O-N 2.81Å; Q86-H89 PolarHBondContact O-N 3.36Å; H89-L91 VanDerWaalsContact C-N 3.29Å; H89-L91 PolarHBondContact O-N 3.03Å; H89-T92 WeakPolarHBondContact O-CB 3.5Å; H89-T92 PolarHBondContact O-N 3.32Å; H89-T92 VanDerWaalsContact O-N 3.1Å; H89-E93 IonicContact CE1-OE2 3.39Å; H89-E93 IonicContact ND1-OE2 3.17Å; H89-E93 WeakPolarHBondContact O-CB 3.37Å; H89-E93 PolarHBondContact O-N 3.4Å
90	L	80.1	Confident	77	Confident	99 Å²	99	96.4 Å²	96.4	52%	0.518	50%	0.497	S	S	.	.	H	α-helix	trans	-60.5	-40	177.8	-136.9	78	0	0	0	111.4	Q86 L87 E93 Q94	Q86-L90 WeakPolarHBondContact O-CB 3.36Å; Q86-L90 PolarHBondContact O-N 2.9Å; L87-L90 PolarHBondContact O-N 3.27Å; L90-E93 PolarHBondContact O-N 2.8Å; L90-Q94 WeakPolarHBondContact O-CB 3.4Å; L90-Q94 VanDerWaalsContact O-CG 3.31Å; L90-Q94 WeakPolarHBondContact O-CG 3.46Å; L90-Q94 PolarHBondContact O-N 3.07Å
91	L	80.7	Confident	76	Confident	100 Å²	100	95.5 Å²	95.5	52%	0.524	49%	0.492	S	S	.	.	H	α-helix	trans	-67.5	-37	174.9	-75.6	169.3	0	0	0	112	L87 S88 H89 K95	L87-L91 HydrophobicContact CD2-CD1 4.26Å; L87-L91 HydrophobicContact CG-CD1 4.21Å; L87-L91 VanDerWaalsContact O-CB 3.3Å; L87-L91 WeakPolarHBondContact O-CB 3.44Å; L87-L91 WeakPolarHBondContact O-CG 3.28Å; L87-L91 PolarHBondContact O-N 2.83Å; S88-L91 PolarHBondContact O-N 3.3Å; H89-L91 VanDerWaalsContact C-N 3.29Å; H89-L91 PolarHBondContact O-N 3.03Å; L91-K95 WeakPolarHBondContact O-CB 3.33Å; L91-K95 PolarHBondContact O-N 3.44Å
92	T	81.4	Confident	74.7	Confident	87 Å²	87	94.9 Å²	94.9	53%	0.534	50%	0.497	S	S	.	.	H	α-helix	trans	-68.6	-40.3	175.6	-56.1	0	0	0	0	110.8	S88 H89 K95 S96	S88-T92 WeakPolarHBondContact O-CB 3.15Å; S88-T92 PolarHBondContact O-N 3.43Å; S88-T92 PolarHBondContact O-OG1 3.02Å; H89-T92 WeakPolarHBondContact O-CB 3.5Å; H89-T92 PolarHBondContact O-N 3.32Å; H89-T92 VanDerWaalsContact O-N 3.1Å; T92-K95 PolarHBondContact O-N 3.2Å; T92-S96 WeakPolarHBondContact O-CB 3.45Å; T92-S96 PolarHBondContact O-N 3.26Å
93	E	80.8	Confident	73.8	Confident	90 Å²	90	101.5 Å²	101.5	42%	0.421	53%	0.53	S	S	.	.	H	α-helix	trans	-68.6	-40.3	176.5	-162.1	176.1	-171	0	0	111.3	H89 L90 S96 S97	H89-E93 IonicContact CE1-OE2 3.39Å; H89-E93 IonicContact ND1-OE2 3.17Å; H89-E93 WeakPolarHBondContact O-CB 3.37Å; H89-E93 PolarHBondContact O-N 3.4Å; L90-E93 PolarHBondContact O-N 2.8Å; E93-S96 PolarHBondContact O-N 2.88Å; E93-S97 WeakPolarHBondContact O-CB 3.18Å; E93-S97 PolarHBondContact O-N 3.17Å; E93-S97 PolarHBondContact O-OG 2.77Å
94	Q	78.9	Confident	71.9	Confident	113 Å²	113	103 Å²	103	53%	0.528	55%	0.545	S	S	.	.	H	α-helix	trans	-66.2	-39.6	170.8	-78.3	-164.2	0.9	0	0	112.3	L90 S97 L98	L90-Q94 WeakPolarHBondContact O-CB 3.4Å; L90-Q94 VanDerWaalsContact O-CG 3.31Å; L90-Q94 WeakPolarHBondContact O-CG 3.46Å; L90-Q94 PolarHBondContact O-N 3.07Å; Q94-S97 CarbonylContact O-C 3.44Å; Q94-S97 WeakPolarHBondContact O-CB 3.21Å; Q94-S97 PolarHBondContact O-N 3.27Å; Q94-L98 WeakPolarHBondContact O-CB 3.39Å; Q94-L98 WeakPolarHBondContact O-CG 3.18Å; Q94-L98 PolarHBondContact O-N 3.11Å
95	K	78.9	Confident	70	Confident	122 Å²	122	103.9 Å²	103.9	53%	0.53	55%	0.551	S	S	.	*	H	α-helix	trans	-62.7	-45.9	174.2	179.3	178.8	172	-179.1	0	111.1	L91 T92 S97 L98 E99	L91-K95 WeakPolarHBondContact O-CB 3.33Å; L91-K95 PolarHBondContact O-N 3.44Å; T92-K95 PolarHBondContact O-N 3.2Å; K95-S97 VanDerWaalsContact C-N 3.31Å; K95-S97 PolarHBondContact O-N 3.37Å; K95-L98 CarbonylContact O-C 3.32Å; K95-L98 PolarHBondContact O-N 3.3Å; K95-L98 VanDerWaalsContact O-N 3.16Å; K95-E99 WeakPolarHBondContact CE-OE1 3.43Å; K95-E99 HydrophobicContact CG-CG 4.4Å; K95-E99 IonicContact NZ-OE1 3.86Å; K95-E99 WeakPolarHBondContact O-CB 3.33Å; K95-E99 WeakPolarHBondContact O-CG 3.36Å; K95-E99 PolarHBondContact O-N 2.91Å
96	S	74.2	Confident	68.1	Low	67 Å²	67	103.6 Å²	103.6	47%	0.469	56%	0.559	S	S	.	*	H	α-helix	trans	-58.8	-42.1	171.6	151.1	0	0	0	0	111.7	T92 E93 L98 E99 S100	T92-S96 WeakPolarHBondContact O-CB 3.45Å; T92-S96 PolarHBondContact O-N 3.26Å; E93-S96 PolarHBondContact O-N 2.88Å; S96-L98 VanDerWaalsContact C-N 3.32Å; S96-L98 PolarHBondContact O-N 3.38Å; S96-E99 PolarHBondContact O-N 3.15Å; S96-S100 VanDerWaalsContact O-CB 3.23Å; S96-S100 WeakPolarHBondContact O-CB 3.47Å; S96-S100 PolarHBondContact O-N 3.15Å; S96-S100 PolarHBondContact O-OG 3.22Å
97	S	72	Confident	66.5	Low	61 Å²	61	104.4 Å²	104.4	43%	0.427	57%	0.571	S	S	.	*	H	α-helix	trans	-64.3	-37.1	175.4	-59	0	0	0	0	111.9	E93 Q94 K95 S100 I101	E93-S97 WeakPolarHBondContact O-CB 3.18Å; E93-S97 PolarHBondContact O-N 3.17Å; E93-S97 PolarHBondContact O-OG 2.77Å; Q94-S97 CarbonylContact O-C 3.44Å; Q94-S97 WeakPolarHBondContact O-CB 3.21Å; Q94-S97 PolarHBondContact O-N 3.27Å; K95-S97 VanDerWaalsContact C-N 3.31Å; K95-S97 PolarHBondContact O-N 3.37Å; S97-S100 WeakPolarHBondContact CA-OG 3.34Å; S97-S100 PolarHBondContact O-OG 3.45Å; S97-S100 VanDerWaalsContact O-OG 3.06Å; S97-I101 WeakPolarHBondContact O-CG1 3.46Å; S97-I101 PolarHBondContact O-N 2.92Å
98	L	74.1	Confident	64.2	Low	121 Å²	121	103.8 Å²	103.8	63%	0.634	58%	0.582	S	S	*	*	H	α-helix	trans	-73.6	-37.7	176	-77.3	164.9	0	0	0	112.5	Q94 K95 S96 S100 I101	Q94-L98 WeakPolarHBondContact O-CB 3.39Å; Q94-L98 WeakPolarHBondContact O-CG 3.18Å; Q94-L98 PolarHBondContact O-N 3.11Å; K95-L98 CarbonylContact O-C 3.32Å; K95-L98 PolarHBondContact O-N 3.3Å; K95-L98 VanDerWaalsContact O-N 3.16Å; S96-L98 VanDerWaalsContact C-N 3.32Å; S96-L98 PolarHBondContact O-N 3.38Å; L98-S100 VanDerWaalsContact C-N 3.35Å; L98-I101 PolarHBondContact O-N 3.24Å
99	E	72.1	Confident	61.8	Low	138 Å²	138	105.7 Å²	105.7	65%	0.645	60%	0.602	S	S	*	*	H	α-helix	trans	-73.6	-26.8	176.7	-73.9	175.7	172.8	0	0	112.3	K95 S96	K95-E99 WeakPolarHBondContact CE-OE1 3.43Å; K95-E99 HydrophobicContact CG-CG 4.4Å; K95-E99 IonicContact NZ-OE1 3.86Å; K95-E99 WeakPolarHBondContact O-CB 3.33Å; K95-E99 WeakPolarHBondContact O-CG 3.36Å; K95-E99 PolarHBondContact O-N 2.91Å; S96-E99 PolarHBondContact O-N 3.15Å
100	S	60.8	Low	59.5	Low	83 Å²	83	105.4 Å²	105.4	58%	0.58	62%	0.619	S	S	*	*	S	Bend	trans	-84.9	-9.9	175.7	60.3	0	0	0	0	114.1	S96 S97 L98 P102	S96-S100 VanDerWaalsContact O-CB 3.23Å; S96-S100 WeakPolarHBondContact O-CB 3.47Å; S96-S100 PolarHBondContact O-N 3.15Å; S96-S100 PolarHBondContact O-OG 3.22Å; S97-S100 WeakPolarHBondContact CA-OG 3.34Å; S97-S100 PolarHBondContact O-OG 3.45Å; S97-S100 VanDerWaalsContact O-OG 3.06Å; L98-S100 VanDerWaalsContact C-N 3.35Å; S100-P102 WeakPolarHBondContact O-CD 3.3Å
101	I	60.9	Low	57.2	Low	86 Å²	86	105.2 Å²	105.2	44%	0.441	63%	0.631	S	S	.	*	S	Bend	trans	-73.6	111.9	162.9	-67	163	0	0	0	106.4	S97 L98 L105	S97-I101 WeakPolarHBondContact O-CG1 3.46Å; S97-I101 PolarHBondContact O-N 2.92Å; L98-I101 PolarHBondContact O-N 3.24Å; I101-L105 HydrophobicContact CG2-CD1 4.21Å
102	P	48.7	Very low	54.9	Low	86 Å²	86	105.2 Å²	105.2	56%	0.558	65%	0.646	S	S	*	*			trans	-60.1	157.6	176.8	-16.6	30.8	0	0	0	110	S100 T104	S100-P102 WeakPolarHBondContact O-CD 3.3Å; P102-T104 HydrophobicContact CB-CG2 4.5Å; P102-T104 PolarHBondContact O-N 2.98Å; P102-T104 PolarHBondContact O-OG1 3.41Å
103	L	48.4	Very low	52.4	Low	159 Å²	159	105.1 Å²	105.1	83%	0.832	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.6	47.1	164.1	-82.2	152.7	0	0	0	114	L106	L103-L106 HydrophobicContact CD2-CD1 4.09Å
104	T	43.5	Very low	50.1	Low	112 Å²	112	105.5 Å²	105.5	69%	0.687	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.6	-3.1	176.6	43.2	0	0	0	0	112.3	P102	P102-T104 HydrophobicContact CB-CG2 4.5Å; P102-T104 PolarHBondContact O-N 2.98Å; P102-T104 PolarHBondContact O-OG1 3.41Å
105	L	41.3	Very low	47.7	Very low	138 Å²	138	104.8 Å²	104.8	72%	0.723	69%	0.694	S	S	*	*			trans	-110.8	40.4	169.2	-66.2	176.6	0	0	0	112.5	I101 P107	I101-L105 HydrophobicContact CG2-CD1 4.21Å; L105-P107 WeakPolarHBondContact O-CD 3.35Å
106	L	38.1	Very low	45.3	Very low	145 Å²	145	103.8 Å²	103.8	76%	0.759	71%	0.708	S	S	*	*			trans	-90.6	85.4	149.5	-84.6	168.1	0	0	0	108.3	L103 A108	L103-L106 HydrophobicContact CD2-CD1 4.09Å; L106-A108 PolarHBondContact O-N 3.39Å
107	P	37.7	Very low	43	Very low	102 Å²	102	105.6 Å²	105.6	66%	0.662	73%	0.727	S	S	*	*			trans	-71.9	113	163.5	30	-30.2	0	0	0	107.8	L105 A109	L105-P107 WeakPolarHBondContact O-CD 3.35Å; P107-A109 PolarHBondContact O-N 3.07Å
108	A	33	Very low	40.9	Very low	98 Å²	98	108.2 Å²	108.2	81%	0.81	75%	0.746	S	S	*	*			trans	25.3	45.2	130.8	0	0	0	0	0	119.1	L106	L106-A108 PolarHBondContact O-N 3.39Å
109	A	30.8	Very low	38.7	Very low	103 Å²	103	106.6 Å²	106.6	85%	0.851	76%	0.758	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.5	26.9	176.2	0	0	0	0	0	112.7	P107	P107-A109 PolarHBondContact O-N 3.07Å
110	A	32.4	Very low	36.5	Very low	104 Å²	104	103.8 Å²	103.8	86%	0.86	77%	0.766	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.2	8.9	175.5	0	0	0	0	0	113.8
111	A	33.1	Very low	34.9	Very low	95 Å²	95	108.5 Å²	108.5	79%	0.785	78%	0.779	S	S	*	*	S	Bend	trans	-131.4	20.9	-173.5	0	0	0	0	0	116
112	A	31.2	Very low	33.2	Very low	100 Å²	100	113.7 Å²	113.7	83%	0.826	80%	0.801	S	S	*	*			trans	-134.1	30.9	176.2	0	0	0	0	0	113.8
113	G	29.8	Very low	32.1	Very low	84 Å²	84	112.8 Å²	112.8	87%	0.866	81%	0.808	S	S	*	*			trans	-98.3	65.5	171.6	0	0	0	0	0	112
114	A	33.1	Very low	31.1	Very low	98 Å²	98	112.6 Å²	112.6	81%	0.81	81%	0.812	S	S	*	*	S	Bend	trans	-178.2	76.5	162	0	0	0	0	0	112
115	A	28.2	Very low	30.1	Very low	99 Å²	99	110.9 Å²	110.9	82%	0.818	82%	0.818	S	S	*	*	S	Bend	trans	-172.7	138.7	149.3	0	0	0	0	0	111
116	A	27.6	Very low	29.3	Very low	101 Å²	101	107.9 Å²	107.9	84%	0.835	82%	0.819	S	S	*	*			trans	79.5	68.2	166.8	0	0	0	0	0	117.4
117	A	26	Very low	28.7	Very low	104 Å²	104	106.3 Å²	106.3	86%	0.86	83%	0.828	S	S	*	*			trans	-82.8	121	138.6	0	0	0	0	0	108.6
118	S	28.3	Very low	28	Very low	117 Å²	117	105.5 Å²	105.5	82%	0.818	84%	0.838	S	S	*	*			trans	178.3	121.5	149.1	55.3	0	0	0	0	113.2
119	G	27	Very low	27.6	Very low	86 Å²	86	104.2 Å²	104.2	89%	0.887	83%	0.834	S	S	*	*			trans	78.8	138.1	151.9	0	0	0	0	0	116.1
120	G	27.5	Very low	27.4	Very low	79 Å²	79	110.6 Å²	110.6	81%	0.814	84%	0.836	S	S	*	*			cis	166.5	157.8	12.1	0	0	0	0	0	107.4
121	E	26	Very low	27.1	Very low	183 Å²	183	111.2 Å²	111.2	86%	0.855	83%	0.825	S	S	*	*			trans	-76	176.3	-166.6	-58.4	168.4	121	0	0	116.5
122	E	26.6	Very low	26.7	Very low	195 Å²	195	114 Å²	114	91%	0.911	82%	0.821	S	S	*	*			trans	73.4	147.4	159.4	-58	-171	159	0	0	117.5
123	G	24.8	Very low	26.4	Very low	67 Å²	67	116.7 Å²	116.7	69%	0.691	82%	0.821	S	S	*	*			cis	164	146.3	5.4	0	0	0	0	0	109.1
124	V	26.6	Very low	26.1	Very low	154 Å²	154	123.9 Å²	123.9	93%	0.933	82%	0.822	S	S	*	*			trans	53.4	121.7	146.2	-170.6	0	0	0	0	122
125	G	24.2	Very low	25.7	Very low	77 Å²	77	122.7 Å²	122.7	79%	0.794	82%	0.819	S	S	*	*				106.4	134	118.6	0	0	0	0	0	121.9
126	G	23.6	Very low	25.6	Very low	74 Å²	74	127.5 Å²	127.5	76%	0.763	82%	0.824	S	S	*	*			trans	97.5	103.7	148.1	0	0	0	0	0	116.4
127	A	24.7	Very low	25.4	Very low	113 Å²	113	127.6 Å²	127.6	93%	0.934	83%	0.826	S	S	*	*				72.8	123.1	73.5	0	0	0	0	0	115.5
128	G	23.6	Very low	25.3	Very low	85 Å²	85	126.1 Å²	126.1	88%	0.876	82%	0.82	S	S	*	*			trans	148.2	108.8	148.9	0	0	0	0	0	118.9
129	G	24.1	Very low	25	Very low	70 Å²	70	130.4 Å²	130.4	72%	0.722	82%	0.824	S	S	*	*			trans	98.7	108	138	0	0	0	0	0	117.6
130	R	26.7	Very low	25	Very low	238 Å²	238	134.9 Å²	134.9	90%	0.898	82%	0.82	S	S	*	*				80.3	140.8	84.2	-88	-170	161.3	160.1	-1.3	112.7
131	D	25.8	Very low	24.7	Very low	116 Å²	116	136.9 Å²	136.9	62%	0.62	82%	0.821	S	S	*	*			cis	-174.9	159.5	-6.4	-132.4	-37.3	0	0	0	107.7
132	H	24.9	Very low	24.9	Very low	154 Å²	154	134.1 Å²	134.1	71%	0.713	82%	0.817	S	S	*	*			trans	75.2	118.9	145.4	-90.8	52.5	0	0	0	125.2
133	L	26.2	Very low	25	Very low	156 Å²	156	131 Å²	131	82%	0.817	81%	0.813	S	S	*	*				170.6	106.8	113.5	-88	151.5	0	0	0	108.4
134	R	23.6	Very low	24.9	Very low	235 Å²	235	131.6 Å²	131.6	89%	0.887	82%	0.82	S	S	*	*				84.1	123.2	71	-176	177.5	161.3	-170.3	-6	115
135	G	23	Very low	24.9	Very low	73 Å²	73	128.1 Å²	128.1	75%	0.753	82%	0.815	S	S	*	*			trans	107.3	132.6	154.4	0	0	0	0	0	114
136	Q	26.1	Very low	24.9	Very low	200 Å²	200	129.1 Å²	129.1	94%	0.935	82%	0.816	S	S	*	*			cis	-167.6	151.1	14.8	-162.9	168.5	35.7	0	0	108.9
137	A	24.3	Very low	24.9	Very low	104 Å²	104	131.2 Å²	131.2	86%	0.86	82%	0.819	S	S	*	*			trans	-96.5	167.2	-177.1	0	0	0	0	0	113.4
138	G	23	Very low	25.2	Very low	72 Å²	72	137.2 Å²	137.2	74%	0.742	82%	0.818	S	S	*	*			trans	126.6	141.3	158.1	0	0	0	0	0	112.9
139	F	23.9	Very low	25.2	Very low	207 Å²	207	141.2 Å²	141.2	91%	0.908	82%	0.819	S	S	*	*			cis	-167.7	152.3	-0	-160.2	-100.6	0	0	0	107.1
140	F	25	Very low	25.5	Very low	181 Å²	181	141 Å²	141	79%	0.794	82%	0.817	S	S	*	*			trans	-67	152.9	177.6	-90.6	-104.2	0	0	0	113.4
141	S	22.8	Very low	26	Very low	120 Å²	120	135.5 Å²	135.5	84%	0.839	82%	0.815	S	S	*	*			trans	-144.2	110.5	147	-71.5	0	0	0	0	110.8
142	T	29.3	Very low	26.1	Very low	125 Å²	125	133.7 Å²	133.7	77%	0.767	82%	0.824	S	S	*	*			trans	-70.1	155.8	153.6	42.9	0	0	0	0	110.3
143	P	30.1	Very low	26.7	Very low	129 Å²	129	132.2 Å²	132.2	84%	0.838	83%	0.827	S	S	*	*				-140.1	146.2	123.2	25.6	-7	0	0	0	113.5
144	G	22.4	Very low	27.7	Very low	81 Å²	81	126.8 Å²	126.8	84%	0.835	81%	0.81	S	S	*	*			trans	-105.7	158.2	165.5	0	0	0	0	0	111.8
145	G	25.8	Very low	29	Very low	80 Å²	80	122 Å²	122	83%	0.825	80%	0.797	S	S	*	*			trans	124.2	101.8	149.7	0	0	0	0	0	118.3
146	A	24.3	Very low	30.5	Very low	99 Å²	99	124.8 Å²	124.8	82%	0.818	79%	0.79	S	S	*	*			trans	97.7	123.9	140.3	0	0	0	0	0	121.6
147	S	22.6	Very low	32	Very low	118 Å²	118	117.2 Å²	117.2	83%	0.825	77%	0.766	S	S	*	*			trans	109.1	111.1	141	-57.7	0	0	0	0	118.6
148	R	31.9	Very low	33.8	Very low	239 Å²	239	117.3 Å²	117.3	90%	0.902	75%	0.747	S	S	*	*			trans	-11.4	120.3	150.3	-76.1	168.2	148.4	172.6	-8.9	115.5
149	D	23.7	Very low	35.8	Very low	169 Å²	169	117.5 Å²	117.5	90%	0.904	73%	0.729	S	S	*	*				-173	159.8	114.4	-101.9	-19.9	0	0	0	110.9
150	G	29.7	Very low	37.6	Very low	65 Å²	65	116 Å²	116	67%	0.67	72%	0.717	S	S	*	*			trans	-73.3	175.1	-158.2	0	0	0	0	0	118.7
151	S	37.8	Very low	39.6	Very low	123 Å²	123	111 Å²	111	86%	0.86	70%	0.702	S	S	*	*			trans	73.6	100.8	179.4	69.1	0	0	0	0	115.6
152	G	28.8	Very low	42	Very low	78 Å²	78	105.7 Å²	105.7	80%	0.804	66%	0.664	S	S	*	*			trans	-89.3	122.5	-170.3	0	0	0	0	0	114.7	G154	G152-G154 VanDerWaalsContact C-N 3.26Å; G152-G154 PolarHBondContact O-N 3.01Å
153	P	37.7	Very low	43.9	Very low	122 Å²	122	102.5 Å²	102.5	79%	0.792	64%	0.644	S	S	*	*			trans	-85.5	41.5	176.3	35.4	-34.6	0	0	0	113.3
154	G	45.4	Very low	45.7	Very low	43 Å²	43	100.1 Å²	100.1	44%	0.443	63%	0.627	S	S	.	*	H	α-helix	trans	-87.9	-25.7	-168.4	0	0	0	0	0	116.4	G152 K158	G152-G154 VanDerWaalsContact C-N 3.26Å; G152-G154 PolarHBondContact O-N 3.01Å; G154-K158 WeakPolarHBondContact O-CG 3.45Å
155	E	51.9	Low	47.9	Very low	134 Å²	134	98 Å²	98	63%	0.626	60%	0.597	S	S	*	*	H	α-helix	trans	-80.6	-40.3	-172.1	-67.9	-176.6	155.5	0	0	112.5	G157 K158 Q159	E155-G157 VanDerWaalsContact C-N 3.32Å; E155-G157 PolarHBondContact O-N 3.39Å; E155-K158 PolarHBondContact O-N 3.34Å; E155-Q159 PolarHBondContact O-N 3.05Å
156	E	53.8	Low	50	Low	131 Å²	131	94.5 Å²	94.5	61%	0.612	56%	0.559	S	S	*	*	H	α-helix	trans	-63	-35.5	178.8	-67.1	-171	166.3	0	0	112.9	Q159 R160	E156-Q159 PolarHBondContact O-N 3.29Å; E156-R160 WeakPolarHBondContact O-CG 3.48Å; E156-R160 PolarHBondContact O-N 3.31Å; E156-R160 VanDerWaalsContact O-N 3.11Å
157	G	57.7	Low	52	Low	41 Å²	41	96.7 Å²	96.7	42%	0.423	55%	0.552	S	S	.	*	H	α-helix	trans	-68.5	-37.1	176.8	0	0	0	0	0	113.3	E155 T161	E155-G157 VanDerWaalsContact C-N 3.32Å; E155-G157 PolarHBondContact O-N 3.39Å; G157-T161 PolarHBondContact O-N 3.41Å; G157-T161 PolarHBondContact O-OG1 3.38Å
158	K	62.6	Low	54.1	Low	107 Å²	107	95.8 Å²	95.8	47%	0.465	53%	0.533	S	S	.	.	H	α-helix	trans	-70.6	-34.5	176.1	-68.7	179.6	-178.5	-176.1	0	111.7	G154 E155 T161 L162 Y182	G154-K158 WeakPolarHBondContact O-CG 3.45Å; E155-K158 PolarHBondContact O-N 3.34Å; K158-T161 PolarHBondContact O-N 3.18Å; K158-L162 PolarHBondContact O-N 2.76Å; K158-Y182 HydrophobicContact CD-CD2 4.19Å
159	Q	64	Low	55.9	Low	75 Å²	75	84.8 Å²	84.8	35%	0.35	49%	0.493	S	S	.	.	H	α-helix	trans	-70.7	-41	177.2	-161.1	158.8	14.5	0	0	112.4	E155 E156 T161 L162 T163 Q181	E155-Q159 PolarHBondContact O-N 3.05Å; E156-Q159 PolarHBondContact O-N 3.29Å; Q159-T161 VanDerWaalsContact C-N 3.3Å; Q159-T161 PolarHBondContact O-N 2.98Å; Q159-L162 WeakPolarHBondContact O-CB 3.27Å; Q159-L162 PolarHBondContact O-N 3.01Å; Q159-T163 PolarHBondContact O-N 3.47Å; Q159-T163 PolarHBondContact O-OG1 3.38Å; Q159-Q181 WeakPolarHBondContact CG-O 3.38Å; Q159-Q181 PolarHBondContact NE2-O 3.49Å
160	R	62.4	Low	57.8	Low	177 Å²	177	80.7 Å²	80.7	67%	0.668	47%	0.468	S	S	*	.	H	α-helix	trans	-62.7	-34.9	173.1	-70.5	177.5	-172.8	-180	6.2	113.3	E156 T164	E156-R160 WeakPolarHBondContact O-CG 3.48Å; E156-R160 PolarHBondContact O-N 3.31Å; E156-R160 VanDerWaalsContact O-N 3.11Å; R160-T164 PolarHBondContact O-N 3.4Å; R160-T164 PolarHBondContact O-OG1 2.89Å
161	T	67.7	Low	59.2	Low	76 Å²	76	80.6 Å²	80.6	47%	0.466	47%	0.467	S	S	.	.	H	α-helix	trans	-70.2	-39	176.8	-52.8	0	0	0	0	110.9	G157 K158 Q159 T164 L165	G157-T161 PolarHBondContact O-N 3.41Å; G157-T161 PolarHBondContact O-OG1 3.38Å; K158-T161 PolarHBondContact O-N 3.18Å; Q159-T161 VanDerWaalsContact C-N 3.3Å; Q159-T161 PolarHBondContact O-N 2.98Å; T161-T164 PolarHBondContact O-N 2.77Å; T161-L165 HydrophobicContact CG2-CD1 4.15Å; T161-L165 WeakPolarHBondContact O-CG 3.49Å; T161-L165 PolarHBondContact O-N 3.36Å
162	L	71.6	Confident	60	Low	8 Å²	8	75 Å²	75	4%	0.042	43%	0.428	C	S	.	.	H	α-helix	trans	-60.4	-46.8	173.7	-179.5	64.7	0	0	0	111.7	K158 Q159 T164 L165 L166 Q181 L183 M208	K158-L162 PolarHBondContact O-N 2.76Å; Q159-L162 WeakPolarHBondContact O-CB 3.27Å; Q159-L162 PolarHBondContact O-N 3.01Å; L162-T164 PolarHBondContact O-N 3.28Å; L162-L165 PolarHBondContact O-N 3.49Å; L162-L165 VanDerWaalsContact O-N 3.15Å; L162-L166 HydrophobicContact CD1-CD1 3.84Å; L162-L166 HydrophobicContact CD1-CG 3.99Å; L162-L166 HydrophobicContact CD2-CD1 4.4Å; L162-L166 HydrophobicContact CG-CD1 3.79Å; L162-L166 HydrophobicContact CG-CG 4.29Å; L162-L166 WeakPolarHBondContact O-CG 3.33Å; L162-L166 PolarHBondContact O-N 3.36Å; L162-Q181 HydrophobicContact CD2-CB 4.21Å; L162-L183 HydrophobicContact CB-CB 4.15Å; L162-L183 HydrophobicContact CD1-CB 4.09Å; L162-L183 HydrophobicContact CD1-CD1 4.05Å; L162-M208 HydrophobicContact CD1-CE 4.04Å; L162-M208 HydrophobicContact CD1-CG 4.36Å; L162-M208 HydrophobicContact CD1-SD 4.15Å; L162-M208 HydrophobicContact CD2-SD 4.12Å
163	T	69.4	Low	61.2	Low	58 Å²	58	81.6 Å²	81.6	36%	0.356	43%	0.429	S	S	.	.	H	α-helix	trans	-58.3	-48.1	178.9	-43.8	0	0	0	0	111.6	Q159 L165 L166 E167 L176	Q159-T163 PolarHBondContact O-N 3.47Å; Q159-T163 PolarHBondContact O-OG1 3.38Å; T163-L165 PolarHBondContact O-N 3Å; T163-L166 PolarHBondContact O-N 3.19Å; T163-E167 WeakPolarHBondContact O-CG 3.47Å; T163-E167 PolarHBondContact O-N 3.22Å; T163-E167 VanDerWaalsContact O-N 3.1Å; T163-L176 HydrophobicContact CG2-CD2 4Å
164	T	67.6	Low	61.8	Low	78 Å²	78	83.5 Å²	83.5	48%	0.479	43%	0.427	S	S	.	.	H	α-helix	trans	-62.3	-29.4	178.5	-48.2	0	0	0	0	113.1	R160 T161 L162	R160-T164 PolarHBondContact O-N 3.4Å; R160-T164 PolarHBondContact O-OG1 2.89Å; T161-T164 PolarHBondContact O-N 2.77Å; L162-T164 PolarHBondContact O-N 3.28Å
165	L	69	Low	62.3	Low	38 Å²	38	83 Å²	83	20%	0.199	41%	0.414	C	S	.	.	H	α-helix	trans	-84	-38.3	179.3	-73	171.3	0	0	0	112.3	T161 L162 T163 E167 K168 L183 F206	T161-L165 HydrophobicContact CG2-CD1 4.15Å; T161-L165 WeakPolarHBondContact O-CG 3.49Å; T161-L165 PolarHBondContact O-N 3.36Å; L162-L165 PolarHBondContact O-N 3.49Å; L162-L165 VanDerWaalsContact O-N 3.15Å; T163-L165 PolarHBondContact O-N 3Å; L165-E167 VanDerWaalsContact C-N 3.32Å; L165-E167 PolarHBondContact O-N 2.99Å; L165-K168 WeakPolarHBondContact O-CB 3.34Å; L165-K168 PolarHBondContact O-N 3.27Å; L165-L183 HydrophobicContact CD1-CD2 3.72Å; L165-F206 HydrophobicContact CB-CE1 4.06Å; L165-F206 HydrophobicContact CD1-CE1 4.48Å
166	L	69.4	Low	62.4	Low	5 Å²	5	80.3 Å²	80.3	3%	0.026	40%	0.403	C	S	.	.	H	α-helix	trans	-69.5	-27.6	176.8	-71.8	176.4	0	0	0	112.8	L162 T163 K168 V169 L176 M208 L213	L162-L166 HydrophobicContact CD1-CD1 3.84Å; L162-L166 HydrophobicContact CD1-CG 3.99Å; L162-L166 HydrophobicContact CD2-CD1 4.4Å; L162-L166 HydrophobicContact CG-CD1 3.79Å; L162-L166 HydrophobicContact CG-CG 4.29Å; L162-L166 WeakPolarHBondContact O-CG 3.33Å; L162-L166 PolarHBondContact O-N 3.36Å; T163-L166 PolarHBondContact O-N 3.19Å; L166-K168 PolarHBondContact O-N 3.47Å; L166-V169 PolarHBondContact O-N 2.82Å; L166-L176 HydrophobicContact CB-CD2 4.12Å; L166-L176 HydrophobicContact CD1-CD2 4.12Å; L166-M208 HydrophobicContact CD1-CE 4.27Å; L166-M208 HydrophobicContact CD2-CE 4.06Å; L166-L213 HydrophobicContact CD2-CD2 3.57Å
167	E	67.2	Low	62.2	Low	146 Å²	146	81.6 Å²	81.6	68%	0.682	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-24	170.5	-77.7	178.5	175.4	0	0	113.4	T163 L165 V169	T163-E167 WeakPolarHBondContact O-CG 3.47Å; T163-E167 PolarHBondContact O-N 3.22Å; T163-E167 VanDerWaalsContact O-N 3.1Å; L165-E167 VanDerWaalsContact C-N 3.32Å; L165-E167 PolarHBondContact O-N 2.99Å; E167-V169 VanDerWaalsContact C-N 3.32Å
168	K	65.9	Low	61.9	Low	99 Å²	99	82.8 Å²	82.8	43%	0.43	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-4.3	177.4	-60.5	178.3	-177.6	175.3	0	113.2	L165 L166 M224 Y225	L165-K168 WeakPolarHBondContact O-CB 3.34Å; L165-K168 PolarHBondContact O-N 3.27Å; L166-K168 PolarHBondContact O-N 3.47Å; K168-M224 WeakPolarHBondContact O-CA 3.47Å; K168-Y225 PolarHBondContact O-N 3.39Å
169	V	70.3	Confident	61.4	Low	8 Å²	8	83.6 Å²	83.6	5%	0.048	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	109.8	179.1	-168.8	0	0	0	0	109.5	L166 E167 G171 C172 F206 A215 Y225	L166-V169 PolarHBondContact O-N 2.82Å; E167-V169 VanDerWaalsContact C-N 3.32Å; V169-G171 PolarHBondContact O-N 3.15Å; V169-C172 HydrophobicContact CB-CB 4.43Å; V169-C172 WeakPolarHBondContact CG1-SG 3.18Å; V169-F206 HydrophobicContact CG2-CE2 3.85Å; V169-F206 HydrophobicContact CG2-CZ 4.05Å; V169-A215 HydrophobicContact CG1-CB 4.01Å; V169-Y225 CarbonylContact C-O 3.53Å; V169-Y225 WeakPolarHBondContact CA-O 3.46Å; V169-Y225 HydrophobicContact CG2-CD2 4.5Å
170	E	64.1	Low	61.2	Low	82 Å²	82	82 Å²	82	38%	0.383	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	125.2	173.8	-72.4	-176.8	164.9	0	0	109.7	R221 M224 Y225 Y227	E170-R221 IonicContact OE1-NH1 3.81Å; E170-R221 PolarHBondContact OE1-NH1 2.83Å; E170-M224 VanDerWaalsContact CD-CE 3.43Å; E170-M224 HydrophobicContact CG-CE 3.62Å; E170-M224 WeakPolarHBondContact OE1-CE 3.43Å; E170-Y225 PolarHBondContact N-O 2.95Å; E170-Y227 PolarHBondContact O-N 3.07Å
171	G	58.9	Low	61.5	Low	64 Å²	64	74.4 Å²	74.4	66%	0.66	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	108	-3.6	177.7	0	0	0	0	0	116.1	V169	V169-G171 PolarHBondContact O-N 3.15Å
172	C	54.8	Low	61.8	Low	6 Å²	6	74.1 Å²	74.1	4%	0.041	39%	0.392	C	S	.	.			trans	-97.7	24	-171.9	-68.8	0	0	0	0	116.3	V169 H174 L175 Y227	V169-C172 HydrophobicContact CB-CB 4.43Å; V169-C172 WeakPolarHBondContact CG1-SG 3.18Å; C172-H174 VanDerWaalsContact C-N 3.31Å; C172-H174 PolarHBondContact O-N 3.27Å; C172-L175 PolarHBondContact O-N 2.91Å; C172-Y227 VanDerWaalsContact SG-CD2 3.58Å
173	R	53.1	Low	62.1	Low	216 Å²	216	74.6 Å²	74.6	82%	0.815	39%	0.394	S	S	*	.	G	3₁₀ helix	trans	-64	-31.5	-177.5	-82.7	-173.6	173.6	178	-2.1	114.1	L175	R173-L175 PolarHBondContact O-N 2.97Å
174	H	51.7	Low	62.7	Low	161 Å²	161	74.3 Å²	74.3	75%	0.745	39%	0.392	S	S	*	.	G	3₁₀ helix	trans	-78	-15.2	-176.7	-63	-66	0	0	0	114.7	C172	C172-H174 VanDerWaalsContact C-N 3.31Å; C172-H174 PolarHBondContact O-N 3.27Å
175	L	55.1	Low	63.4	Low	34 Å²	34	73 Å²	73	18%	0.178	38%	0.379	C	S	.	.	G	3₁₀ helix	trans	-94.2	-11.7	-178.8	-64.2	172.6	0	0	0	113.2	C172 R173 E177 Y227 L230	C172-L175 PolarHBondContact O-N 2.91Å; R173-L175 PolarHBondContact O-N 2.97Å; L175-E177 PolarHBondContact O-N 3.44Å; L175-Y227 HydrophobicContact CD1-CE2 4.25Å; L175-L230 HydrophobicContact CD1-CD1 4.15Å; L175-L230 HydrophobicContact CD1-CD2 4.05Å; L175-L230 HydrophobicContact CD2-CD2 3.68Å
176	L	53.1	Low	64.1	Low	77 Å²	77	74.2 Å²	74.2	40%	0.403	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-12.8	177.1	-75.4	162.3	0	0	0	113.1	T163 L166	T163-L176 HydrophobicContact CG2-CD2 4Å; L166-L176 HydrophobicContact CB-CD2 4.12Å; L166-L176 HydrophobicContact CD1-CD2 4.12Å
177	E	51	Low	64.8	Low	158 Å²	158	74.6 Å²	74.6	74%	0.738	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.3	-2.6	-173.9	-67.1	-178.7	167.7	0	0	113.8	L175 P179	L175-E177 PolarHBondContact O-N 3.44Å; E177-P179 VanDerWaalsContact O-CD 3.22Å; E177-P179 WeakPolarHBondContact O-CD 3.43Å
178	T	50.7	Low	65.7	Low	66 Å²	66	71 Å²	71	41%	0.405	38%	0.376	S	S	.	.			trans	-85.7	110.7	-179.9	-42.6	0	0	0	0	111.1	G180	T178-G180 PolarHBondContact O-N 3.27Å
179	P	51.5	Low	66.8	Low	123 Å²	123	66.9 Å²	66.9	80%	0.799	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.8	125.2	-178.4	27.4	-32.3	0	0	0	111	E177	E177-P179 VanDerWaalsContact O-CD 3.22Å; E177-P179 WeakPolarHBondContact O-CD 3.43Å
180	G	61.5	Low	67.6	Low	43 Å²	43	67.8 Å²	67.8	44%	0.443	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	110.9	4.9	172.2	0	0	0	0	0	116.5	T178 N209	T178-G180 PolarHBondContact O-N 3.27Å; G180-N209 PolarHBondContact O-ND2 3.41Å
181	Q	68.1	Low	68.6	Low	16 Å²	16	64.5 Å²	64.5	8%	0.075	35%	0.349	C	S	.	.			trans	-83.9	131.6	174.3	-72.5	-179.4	-9.8	0	0	112.2	Q159 L162 M208 N209 D210	Q159-Q181 WeakPolarHBondContact CG-O 3.38Å; Q159-Q181 PolarHBondContact NE2-O 3.49Å; L162-Q181 HydrophobicContact CD2-CB 4.21Å; Q181-M208 HydrophobicContact CB-SD 4.46Å; Q181-N209 WeakPolarHBondContact CA-OD1 3.46Å; Q181-D210 PolarHBondContact NE2-OD1 2.9Å; Q181-D210 PolarHBondContact NE2-OD2 3.39Å
182	Y	74.1	Confident	69.9	Low	71 Å²	71	63.4 Å²	63.4	28%	0.278	33%	0.325	S	S	.	.			trans	-132.3	149.1	173.2	66	-94.6	0	0	0	111.1	K158 V184 M208 N209	K158-Y182 HydrophobicContact CD-CD2 4.19Å; Y182-V184 HydrophobicContact CD2-CG2 4.28Å; Y182-V184 HydrophobicContact CE2-CG2 3.85Å; Y182-V184 PolarHBondContact O-N 3.43Å; Y182-M208 WeakPolarHBondContact O-CA 3.48Å; Y182-N209 HydrophobicContact CD1-CB 4.17Å; Y182-N209 HydrophobicContact CE1-CB 3.72Å; Y182-N209 HydrophobicContact CE2-CB 4.36Å; Y182-N209 PolarHBondContact O-N 3.1Å
183	L	77.6	Confident	71	Confident	18 Å²	18	65 Å²	65	9%	0.094	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	126.9	178.8	-171.8	71.2	0	0	0	110.6	L162 L165 N186 F206	L162-L183 HydrophobicContact CB-CB 4.15Å; L162-L183 HydrophobicContact CD1-CB 4.09Å; L162-L183 HydrophobicContact CD1-CD1 4.05Å; L165-L183 HydrophobicContact CD1-CD2 3.72Å; L183-N186 HydrophobicContact CD1-CB 4.37Å; L183-N186 HydrophobicContact CD2-CB 4.33Å; L183-F206 HydrophobicContact CD1-CB 4.26Å; L183-F206 HydrophobicContact CD1-CD1 4.34Å
184	V	81.4	Confident	71.9	Confident	51 Å²	51	56.3 Å²	56.3	31%	0.309	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	-49.1	173.9	-175.7	0	0	0	0	110.2	Y182 L207 V276 T280	Y182-V184 HydrophobicContact CD2-CG2 4.28Å; Y182-V184 HydrophobicContact CE2-CG2 3.85Å; Y182-V184 PolarHBondContact O-N 3.43Å; V184-L207 HydrophobicContact CB-CG 4.27Å; V184-L207 PolarHBondContact N-O 3.48Å; V184-V276 HydrophobicContact CG1-CG1 3.64Å; V184-T280 HydrophobicContact CG2-CG2 4.31Å
185	Y	82.3	Confident	72.9	Confident	50 Å²	50	55.4 Å²	55.4	20%	0.196	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.6	152.2	-178.3	-169.1	-104.8	0	0	0	112	L207 E272 W273 V276	Y185-L207 PolarHBondContact N-O 3.07Å; Y185-L207 WeakPolarHBondContact O-CB 3.44Å; Y185-L207 PolarHBondContact O-N 3.31Å; Y185-E272 PolarHBondContact OH-OE2 3.1Å; Y185-W273 AromaticContact CD1-CD2 3.89Å; Y185-W273 HydrophobicContact CD1-CD2 3.89Å; Y185-W273 AromaticContact CD1-CE2 3.79Å; Y185-W273 HydrophobicContact CD1-CE3 4.01Å; Y185-W273 AromaticContact CD1-CH2 3.95Å; Y185-W273 HydrophobicContact CD1-CH2 3.95Å; Y185-W273 AromaticContact CD1-CZ2 3.83Å; Y185-W273 HydrophobicContact CD1-CZ2 3.83Å; Y185-W273 HydrophobicContact CD1-CZ3 4.04Å; Y185-W273 AromaticContact CE1-CD1 3.94Å; Y185-W273 AromaticContact CE1-CD2 3.78Å; Y185-W273 HydrophobicContact CE1-CD2 3.78Å; Y185-W273 AromaticContact CE1-CE2 3.54Å; Y185-W273 HydrophobicContact CE1-CE3 4.36Å; Y185-W273 HydrophobicContact CE1-CG 4.05Å; Y185-W273 AromaticContact CE1-CZ2 3.95Å; Y185-W273 HydrophobicContact CE1-CZ2 3.95Å; Y185-W273 AromaticContact CE1-NE1 3.65Å; Y185-V276 HydrophobicContact CG-CG1 4.48Å
186	N	84.3	Confident	73.5	Confident	64 Å²	64	61 Å²	61	34%	0.342	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	148.1	174.6	72.7	-58	0	0	0	111.4	L183 H204 G205 F206	L183-N186 HydrophobicContact CD1-CB 4.37Å; L183-N186 HydrophobicContact CD2-CB 4.33Å; N186-H204 PolarHBondContact ND2-NE2 2.88Å; N186-G205 VanDerWaalsContact CA-O 3.25Å; N186-G205 WeakPolarHBondContact CA-O 3.46Å; N186-F206 HydrophobicContact CB-CD1 4.02Å
187	G	84	Confident	74.3	Confident	13 Å²	13	60.6 Å²	60.6	13%	0.134	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-174	157.9	-177.7	0	0	0	0	0	114	G205	G187-G205 PolarHBondContact N-O 3.1Å; G187-G205 VanDerWaalsContact N-O 3.11Å; G187-G205 PolarHBondContact O-N 3.44Å
188	D	86.3	Confident	75.5	Confident	71 Å²	71	55.4 Å²	55.4	38%	0.38	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	137.3	176.3	-67.7	-40.6	0	0	0	111.1	H204	D188-H204 IonicContact OD1-CE1 2.65Å; D188-H204 IonicContact OD1-CG 3.7Å; D188-H204 IonicContact OD1-ND1 3.78Å; D188-H204 PolarHBondContact OD1-ND1 3.07Å
189	L	88.5	Confident	77	Confident	12 Å²	12	58.1 Å²	58.1	6%	0.063	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	160.1	179.2	-64.2	169	0	0	0	110	V203 F251 F262 A264 W273	L189-V203 HydrophobicContact CB-CG2 3.78Å; L189-V203 PolarHBondContact N-O 3.34Å; L189-V203 PolarHBondContact O-N 3.5Å; L189-F251 HydrophobicContact CD1-CZ 3.88Å; L189-F251 HydrophobicContact CD2-CE1 3.86Å; L189-F251 HydrophobicContact CD2-CZ 4.05Å; L189-F262 HydrophobicContact CB-CB 4.49Å; L189-F262 HydrophobicContact CB-CD1 4.4Å; L189-F262 HydrophobicContact CD1-CB 4.41Å; L189-F262 HydrophobicContact CD1-CG 4.5Å; L189-A264 HydrophobicContact CD2-CB 4.23Å; L189-W273 HydrophobicContact CD1-CZ2 4.11Å
190	V	86.8	Confident	78.5	Confident	27 Å²	27	56.6 Å²	56.6	16%	0.164	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	124.7	172.8	-177.5	0	0	0	0	109	Y192 Q199 R202 F262 Q263	V190-Y192 HydrophobicContact CB-CE2 4.34Å; V190-Y192 HydrophobicContact CG1-CD2 4.27Å; V190-Y192 HydrophobicContact CG1-CE2 3.8Å; V190-Q199 HydrophobicContact CG1-CG 3.63Å; V190-R202 HydrophobicContact CG2-CG 4.4Å; V190-F262 CarbonylContact O-C 3.55Å; V190-F262 WeakPolarHBondContact O-CA 3.19Å; V190-Q263 HydrophobicContact CB-CB 4.39Å; V190-Q263 PolarHBondContact N-O 3.21Å; V190-Q263 PolarHBondContact O-N 2.97Å
191	E	86.9	Confident	79.6	Confident	13 Å²	13	57.5 Å²	57.5	6%	0.061	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	139	178.2	-176.2	179.3	-161.1	0	0	111.5	L200 Q201 V203 R260 F262	E191-L200 HydrophobicContact CG-CB 4.4Å; E191-L200 HydrophobicContact CG-CD1 4.14Å; E191-L200 PolarHBondContact O-N 3.44Å; E191-Q201 HydrophobicContact CB-CG 4.16Å; E191-Q201 PolarHBondContact N-O 2.95Å; E191-Q201 WeakPolarHBondContact OE2-CG 3.35Å; E191-Q201 PolarHBondContact OE2-NE2 3.13Å; E191-V203 HydrophobicContact CB-CG1 4.21Å; E191-R260 IonicContact OE1-CZ 2.83Å; E191-R260 IonicContact OE1-NE 3.27Å; E191-R260 PolarHBondContact OE1-NE 3.03Å; E191-R260 IonicContact OE1-NH2 2.74Å; E191-R260 PolarHBondContact OE1-NH2 3.29Å; E191-R260 IonicContact OE2-CZ 3.19Å; E191-R260 IonicContact OE2-NH2 3.78Å; E191-R260 PolarHBondContact OE2-NH2 3.48Å; E191-F262 HydrophobicContact CB-CD1 4.19Å; E191-F262 HydrophobicContact CB-CE1 4.07Å; E191-F262 HydrophobicContact CG-CD1 4.5Å; E191-F262 HydrophobicContact CG-CE1 4.11Å
192	Y	84.8	Confident	80.4	Confident	41 Å²	41	63.2 Å²	63.2	16%	0.161	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	146.5	174.7	-81.9	-103.3	0	0	0	111.3	V190 M197 A198 Q199 M250 I261 Q263	V190-Y192 HydrophobicContact CB-CE2 4.34Å; V190-Y192 HydrophobicContact CG1-CD2 4.27Å; V190-Y192 HydrophobicContact CG1-CE2 3.8Å; Y192-M197 WeakPolarHBondContact CD1-O 3.35Å; Y192-A198 WeakPolarHBondContact CA-O 3.46Å; Y192-Q199 HydrophobicContact CD1-CB 4.48Å; Y192-Q199 HydrophobicContact CE1-CB 3.95Å; Y192-Q199 HydrophobicContact CE2-CG 4.43Å; Y192-M250 HydrophobicContact CD1-CE 3.65Å; Y192-M250 HydrophobicContact CD2-CE 3.3Å; Y192-M250 HydrophobicContact CE1-CE 4.02Å; Y192-M250 HydrophobicContact CE2-CE 3.71Å; Y192-M250 HydrophobicContact CG-CE 3.27Å; Y192-I261 PolarHBondContact N-O 3.49Å; Y192-Q263 HydrophobicContact CD2-CB 4.08Å; Y192-Q263 HydrophobicContact CE2-CB 3.77Å; Y192-Q263 PolarHBondContact OH-OE1 3.31Å
193	D	79.1	Confident	81.1	Confident	41 Å²	41	59.9 Å²	59.9	22%	0.219	31%	0.307	C	S	.	.			trans	-63.4	131.3	172.4	-169.1	-92.9	0	0	0	110.4	D195 H196 M197 A198 L200	D193-D195 VanDerWaalsContact C-N 3.27Å; D193-D195 PolarHBondContact O-N 3.44Å; D193-D195 PolarHBondContact OD1-N 3.41Å; D193-H196 HydrophobicContact CB-CB 4.44Å; D193-H196 WeakPolarHBondContact OD1-CB 3.31Å; D193-H196 IonicContact OD1-CG 3.46Å; D193-H196 PolarHBondContact OD1-N 2.82Å; D193-H196 IonicContact OD1-ND1 3.43Å; D193-H196 PolarHBondContact OD1-ND1 2.96Å; D193-M197 WeakPolarHBondContact O-CA 3.3Å; D193-M197 PolarHBondContact O-N 3.37Å; D193-M197 VanDerWaalsContact O-N 3.14Å; D193-A198 HydrophobicContact CB-CB 4.46Å; D193-A198 PolarHBondContact N-O 3.07Å; D193-L200 HydrophobicContact CB-CD1 4.08Å; D193-L200 HydrophobicContact CB-CD2 4.2Å; D193-L200 HydrophobicContact CB-CG 4.07Å
194	A	72.3	Confident	81.5	Confident	33 Å²	33	59.6 Å²	59.6	27%	0.273	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-24.3	-174.5	0	0	0	0	0	113.4	S259	A194-S259 WeakPolarHBondContact CB-O 3.38Å
195	D	72.1	Confident	81.7	Confident	142 Å²	142	57.2 Å²	57.2	76%	0.759	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105	-41.5	-173.1	-61.9	-35.2	0	0	0	112	D193	D193-D195 VanDerWaalsContact C-N 3.27Å; D193-D195 PolarHBondContact O-N 3.44Å; D193-D195 PolarHBondContact OD1-N 3.41Å
196	H	67.2	Low	81.8	Confident	151 Å²	151	54.9 Å²	54.9	70%	0.699	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101	-7	-174.5	-57.2	87.6	0	0	0	113.7	D193 A198	D193-H196 HydrophobicContact CB-CB 4.44Å; D193-H196 WeakPolarHBondContact OD1-CB 3.31Å; D193-H196 IonicContact OD1-CG 3.46Å; D193-H196 PolarHBondContact OD1-N 2.82Å; D193-H196 IonicContact OD1-ND1 3.43Å; D193-H196 PolarHBondContact OD1-ND1 2.96Å; H196-A198 PolarHBondContact O-N 3.07Å
197	M	69.9	Low	81.8	Confident	69 Å²	69	51.9 Å²	51.9	34%	0.34	27%	0.266	S	S	.	.			trans	52	28.9	-177	-69.2	-70.4	-155.7	0	0	113.5	Y192 D193 M247 I261	Y192-M197 WeakPolarHBondContact CD1-O 3.35Å; D193-M197 WeakPolarHBondContact O-CA 3.3Å; D193-M197 PolarHBondContact O-N 3.37Å; D193-M197 VanDerWaalsContact O-N 3.14Å; M197-M247 HydrophobicContact CE-CE 3.85Å; M197-M247 HydrophobicContact CE-CG 3.9Å; M197-M247 HydrophobicContact CE-SD 3.55Å; M197-M247 VanDerWaalsContact CE-SD 3.55Å; M197-I261 HydrophobicContact CE-CD1 3.94Å; M197-I261 HydrophobicContact SD-CD1 3.91Å
198	A	76.6	Confident	81.9	Confident	49 Å²	49	51.2 Å²	51.2	41%	0.405	26%	0.26	S	S	.	.			trans	-86	141.7	174.8	0	0	0	0	0	110.1	Y192 D193 H196 L200	Y192-A198 WeakPolarHBondContact CA-O 3.46Å; D193-A198 HydrophobicContact CB-CB 4.46Å; D193-A198 PolarHBondContact N-O 3.07Å; H196-A198 PolarHBondContact O-N 3.07Å; A198-L200 PolarHBondContact O-N 3.3Å
199	Q	82.5	Confident	81.6	Confident	123 Å²	123	49.2 Å²	49.2	58%	0.575	25%	0.249	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-67.7	119.2	174.8	-176.4	179.4	2.6	0	0	109.5	V190 Y192	V190-Q199 HydrophobicContact CG1-CG 3.63Å; Y192-Q199 HydrophobicContact CD1-CB 4.48Å; Y192-Q199 HydrophobicContact CE1-CB 3.95Å; Y192-Q199 HydrophobicContact CE2-CG 4.43Å
200	L	82.8	Confident	81.2	Confident	90 Å²	90	51.3 Å²	51.3	47%	0.471	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	-66.1	-177.9	-70.2	176	0	0	0	111.4	E191 D193 A198	E191-L200 HydrophobicContact CG-CB 4.4Å; E191-L200 HydrophobicContact CG-CD1 4.14Å; E191-L200 PolarHBondContact O-N 3.44Å; D193-L200 HydrophobicContact CB-CD1 4.08Å; D193-L200 HydrophobicContact CB-CD2 4.2Å; D193-L200 HydrophobicContact CB-CG 4.07Å; A198-L200 PolarHBondContact O-N 3.3Å
201	Q	85.3	Confident	81	Confident	63 Å²	63	50.3 Å²	50.3	29%	0.294	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.1	157.7	-170.8	57.8	-171.9	-24.3	0	0	112.5	E191 V203 T216 N228	E191-Q201 HydrophobicContact CB-CG 4.16Å; E191-Q201 PolarHBondContact N-O 2.95Å; E191-Q201 WeakPolarHBondContact OE2-CG 3.35Å; E191-Q201 PolarHBondContact OE2-NE2 3.13Å; Q201-V203 HydrophobicContact CG-CG1 3.88Å; Q201-T216 HydrophobicContact CB-CG2 4.39Å; Q201-T216 HydrophobicContact CG-CG2 4.47Å; Q201-T216 PolarHBondContact OE1-OG1 2.79Å; Q201-N228 PolarHBondContact NE2-ND2 3.39Å
202	R	84.4	Confident	80.9	Confident	135 Å²	135	50 Å²	50	51%	0.509	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	129.7	169.7	-64.3	-177.5	67.1	-175.3	-0.6	109	V190 W217	V190-R202 HydrophobicContact CG2-CG 4.4Å; R202-W217 HydrophobicContact CB-CB 4.07Å; R202-W217 WeakPolarHBondContact O-CB 3.21Å; R202-W217 PolarHBondContact O-N 3.46Å
203	V	88.3	Confident	80.8	Confident	1 Å²	1	48 Å²	48	1%	0.006	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	156.2	-178.6	-55.6	0	0	0	0	110.6	L189 E191 Q201 V214 A215 F262	L189-V203 HydrophobicContact CB-CG2 3.78Å; L189-V203 PolarHBondContact N-O 3.34Å; L189-V203 PolarHBondContact O-N 3.5Å; E191-V203 HydrophobicContact CB-CG1 4.21Å; Q201-V203 HydrophobicContact CG-CG1 3.88Å; V203-V214 HydrophobicContact CB-CG1 3.82Å; V203-V214 HydrophobicContact CG1-CG1 4.16Å; V203-V214 HydrophobicContact CG2-CG1 4Å; V203-A215 CarbonylContact C-O 3.46Å; V203-A215 WeakPolarHBondContact CA-O 3.29Å; V203-A215 WeakPolarHBondContact CB-O 3.4Å; V203-F262 HydrophobicContact CG2-CD1 3.95Å; V203-F262 HydrophobicContact CG2-CE1 3.9Å
204	H	85.4	Confident	81.1	Confident	12 Å²	12	46.3 Å²	46.3	6%	0.056	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	124	171.1	-161.8	88.5	0	0	0	108.4	N186 D188 F206 A215 Y225	N186-H204 PolarHBondContact ND2-NE2 2.88Å; D188-H204 IonicContact OD1-CE1 2.65Å; D188-H204 IonicContact OD1-CG 3.7Å; D188-H204 IonicContact OD1-ND1 3.78Å; D188-H204 PolarHBondContact OD1-ND1 3.07Å; H204-F206 HydrophobicContact CB-CE2 4.36Å; H204-F206 AromaticContact CD2-CD1 3.93Å; H204-F206 AromaticContact CD2-CD2 3.92Å; H204-F206 AromaticContact CD2-CE1 3.48Å; H204-F206 VanDerWaalsContact CD2-CE1 3.48Å; H204-F206 WeakPolarHBondContact CD2-CE1 3.2Å; H204-F206 AromaticContact CD2-CE2 3.48Å; H204-F206 VanDerWaalsContact CD2-CE2 3.48Å; H204-F206 WeakPolarHBondContact CD2-CE2 3.49Å; H204-F206 AromaticContact CD2-CZ 3.24Å; H204-F206 WeakPolarHBondContact CD2-CZ 3.44Å; H204-F206 AromaticContact NE2-CE1 3.69Å; H204-F206 AromaticContact NE2-CZ 3.87Å; H204-A215 PolarHBondContact N-O 3.43Å; H204-A215 PolarHBondContact O-N 3.1Å; H204-Y225 HydrophobicContact CB-CD1 3.8Å; H204-Y225 HydrophobicContact CB-CE1 3.58Å; H204-Y225 AromaticContact CG-CE1 4Å
205	G	85.6	Confident	81.8	Confident	1 Å²	1	44.7 Å²	44.7	1%	0.01	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	131.5	175.5	0	0	0	0	0	110.6	N186 G187 L213	N186-G205 VanDerWaalsContact CA-O 3.25Å; N186-G205 WeakPolarHBondContact CA-O 3.46Å; G187-G205 PolarHBondContact N-O 3.1Å; G187-G205 VanDerWaalsContact N-O 3.11Å; G187-G205 PolarHBondContact O-N 3.44Å; G205-L213 CarbonylContact C-O 3.55Å; G205-L213 WeakPolarHBondContact CA-O 3.37Å
206	F	85.1	Confident	82.4	Confident	2 Å²	2	38.7 Å²	38.7	1%	0.009	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	110.1	169.2	-58.4	-88	0	0	0	108.5	L165 V169 L183 N186 H204 L213 A215	L165-F206 HydrophobicContact CB-CE1 4.06Å; L165-F206 HydrophobicContact CD1-CE1 4.48Å; V169-F206 HydrophobicContact CG2-CE2 3.85Å; V169-F206 HydrophobicContact CG2-CZ 4.05Å; L183-F206 HydrophobicContact CD1-CB 4.26Å; L183-F206 HydrophobicContact CD1-CD1 4.34Å; N186-F206 HydrophobicContact CB-CD1 4.02Å; H204-F206 HydrophobicContact CB-CE2 4.36Å; H204-F206 AromaticContact CD2-CD1 3.93Å; H204-F206 AromaticContact CD2-CD2 3.92Å; H204-F206 AromaticContact CD2-CE1 3.48Å; H204-F206 VanDerWaalsContact CD2-CE1 3.48Å; H204-F206 WeakPolarHBondContact CD2-CE1 3.2Å; H204-F206 AromaticContact CD2-CE2 3.48Å; H204-F206 VanDerWaalsContact CD2-CE2 3.48Å; H204-F206 WeakPolarHBondContact CD2-CE2 3.49Å; H204-F206 AromaticContact CD2-CZ 3.24Å; H204-F206 WeakPolarHBondContact CD2-CZ 3.44Å; H204-F206 AromaticContact NE2-CE1 3.69Å; H204-F206 AromaticContact NE2-CZ 3.87Å; F206-L213 HydrophobicContact CB-CB 4.15Å; F206-L213 HydrophobicContact CB-CD2 4.36Å; F206-L213 HydrophobicContact CD2-CD2 3.85Å; F206-L213 HydrophobicContact CD2-CG 4.16Å; F206-L213 HydrophobicContact CG-CD2 4.39Å; F206-L213 PolarHBondContact N-O 2.96Å; F206-L213 PolarHBondContact O-N 2.99Å; F206-A215 HydrophobicContact CE2-CB 4.18Å
207	L	84.7	Confident	83	Confident	0 Å²	0	35 Å²	35	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	118.1	176.1	-179.5	60.5	0	0	0	109.8	V184 Y185 L212 L233 W273 V276 L277	V184-L207 HydrophobicContact CB-CG 4.27Å; V184-L207 PolarHBondContact N-O 3.48Å; Y185-L207 PolarHBondContact N-O 3.07Å; Y185-L207 WeakPolarHBondContact O-CB 3.44Å; Y185-L207 PolarHBondContact O-N 3.31Å; L207-L212 HydrophobicContact CB-CD1 4.03Å; L207-L212 HydrophobicContact CD1-CB 4.21Å; L207-L212 HydrophobicContact CD1-CD1 4.15Å; L207-L233 HydrophobicContact CD1-CD1 4.35Å; L207-L233 HydrophobicContact CD1-CD2 3.99Å; L207-W273 HydrophobicContact CB-CZ3 4.09Å; L207-V276 HydrophobicContact CD2-CB 4.49Å; L207-V276 HydrophobicContact CD2-CG1 3.72Å; L207-L277 HydrophobicContact CD1-CD2 3.63Å; L207-L277 HydrophobicContact CD2-CD2 3.8Å; L207-L277 HydrophobicContact CD2-CG 4.14Å; L207-L277 HydrophobicContact CG-CD2 4.32Å
208	M	85.1	Confident	83.3	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	178.1	173.5	-48.8	-172.2	-157.7	0	0	109.8	L162 L166 Q181 Y182 D210 C211 L213	L162-M208 HydrophobicContact CD1-CE 4.04Å; L162-M208 HydrophobicContact CD1-CG 4.36Å; L162-M208 HydrophobicContact CD1-SD 4.15Å; L162-M208 HydrophobicContact CD2-SD 4.12Å; L166-M208 HydrophobicContact CD1-CE 4.27Å; L166-M208 HydrophobicContact CD2-CE 4.06Å; Q181-M208 HydrophobicContact CB-SD 4.46Å; Y182-M208 WeakPolarHBondContact O-CA 3.48Å; M208-D210 VanDerWaalsContact C-N 3.28Å; M208-D210 PolarHBondContact O-N 3.32Å; M208-C211 WeakPolarHBondContact CA-O 3.5Å; M208-C211 WeakPolarHBondContact CB-O 3.33Å; M208-C211 PolarHBondContact N-O 2.93Å; M208-L213 HydrophobicContact CE-CB 4.1Å; M208-L213 HydrophobicContact CE-CD2 4.13Å
209	N	81.1	Confident	82.6	Confident	29 Å²	29	35.9 Å²	35.9	16%	0.155	18%	0.178	C	C	.	.	S	Bend	trans	-66.3	-24.2	-178.5	57.4	-31	0	0	0	114.6	G180 Q181 Y182	G180-N209 PolarHBondContact O-ND2 3.41Å; Q181-N209 WeakPolarHBondContact CA-OD1 3.46Å; Y182-N209 HydrophobicContact CD1-CB 4.17Å; Y182-N209 HydrophobicContact CE1-CB 3.72Å; Y182-N209 HydrophobicContact CE2-CB 4.36Å; Y182-N209 PolarHBondContact O-N 3.1Å
210	D	80.4	Confident	81.3	Confident	55 Å²	55	38.7 Å²	38.7	29%	0.294	19%	0.191	S	C	.	.	S	Bend	trans	-126	-17.6	-176.5	61	-9.9	0	0	0	113.9	Q181 M208 L233	Q181-D210 PolarHBondContact NE2-OD1 2.9Å; Q181-D210 PolarHBondContact NE2-OD2 3.39Å; M208-D210 VanDerWaalsContact C-N 3.28Å; M208-D210 PolarHBondContact O-N 3.32Å; D210-L233 WeakPolarHBondContact O-CG 3.41Å; D210-L233 PolarHBondContact O-N 2.88Å; D210-L233 VanDerWaalsContact O-N 3.12Å
211	C	82.7	Confident	80.4	Confident	7 Å²	7	41 Å²	41	5%	0.047	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	155.6	-174.6	61.7	0	0	0	0	114	M208 L230 Y231	M208-C211 WeakPolarHBondContact CA-O 3.5Å; M208-C211 WeakPolarHBondContact CB-O 3.33Å; M208-C211 PolarHBondContact N-O 2.93Å; C211-L230 HydrophobicContact CB-CD1 3.93Å; C211-L230 HydrophobicContact CB-CG 4.28Å; C211-Y231 CarbonylContact C-O 3.58Å; C211-Y231 WeakPolarHBondContact CA-O 3.46Å; C211-Y231 WeakPolarHBondContact CB-O 3.3Å
212	L	83.5	Confident	79.1	Confident	5 Å²	5	50 Å²	50	3%	0.026	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	113.1	171.3	175.2	68.6	0	0	0	108.8	L207 V214 Y231 L233 L236 L253 W273 L277	L207-L212 HydrophobicContact CB-CD1 4.03Å; L207-L212 HydrophobicContact CD1-CB 4.21Å; L207-L212 HydrophobicContact CD1-CD1 4.15Å; L212-V214 HydrophobicContact CG-CG2 4.49Å; L212-Y231 PolarHBondContact N-O 3.26Å; L212-Y231 PolarHBondContact O-N 2.73Å; L212-L233 HydrophobicContact CB-CD2 4.44Å; L212-L236 HydrophobicContact CD2-CD2 4.11Å; L212-L253 HydrophobicContact CD2-CD1 3.65Å; L212-W273 HydrophobicContact CD1-CH2 4.27Å; L212-W273 HydrophobicContact CD1-CZ3 3.89Å; L212-L277 HydrophobicContact CD2-CD2 4.31Å
213	L	82.9	Confident	77.9	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	130.1	174.4	169.7	71.1	0	0	0	109.7	L166 G205 F206 M208 Y227 L230	L166-L213 HydrophobicContact CD2-CD2 3.57Å; G205-L213 CarbonylContact C-O 3.55Å; G205-L213 WeakPolarHBondContact CA-O 3.37Å; F206-L213 HydrophobicContact CB-CB 4.15Å; F206-L213 HydrophobicContact CB-CD2 4.36Å; F206-L213 HydrophobicContact CD2-CD2 3.85Å; F206-L213 HydrophobicContact CD2-CG 4.16Å; F206-L213 HydrophobicContact CG-CD2 4.39Å; F206-L213 PolarHBondContact N-O 2.96Å; F206-L213 PolarHBondContact O-N 2.99Å; M208-L213 HydrophobicContact CE-CB 4.1Å; M208-L213 HydrophobicContact CE-CD2 4.13Å; L213-Y227 HydrophobicContact CD1-CD2 3.44Å; L213-Y227 VanDerWaalsContact CD1-CD2 3.44Å; L213-Y227 HydrophobicContact CD1-CE2 3.43Å; L213-Y227 VanDerWaalsContact CD1-CE2 3.43Å; L213-L230 HydrophobicContact CB-CD1 3.83Å; L213-L230 HydrophobicContact CD1-CD1 4.21Å
214	V	85.8	Confident	77	Confident	5 Å²	5	46.9 Å²	46.9	3%	0.03	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	127.2	172.5	-178	0	0	0	0	108.3	V203 L212 N228 A229 Y231 F262	V203-V214 HydrophobicContact CB-CG1 3.82Å; V203-V214 HydrophobicContact CG1-CG1 4.16Å; V203-V214 HydrophobicContact CG2-CG1 4Å; L212-V214 HydrophobicContact CG-CG2 4.49Å; V214-N228 VanDerWaalsContact O-CB 3.32Å; V214-N228 WeakPolarHBondContact O-CB 3.24Å; V214-N228 PolarHBondContact O-N 2.72Å; V214-N228 VanDerWaalsContact O-N 3.14Å; V214-A229 PolarHBondContact N-O 3.01Å; V214-A229 PolarHBondContact O-N 3.35Å; V214-Y231 HydrophobicContact CB-CE2 4.5Å; V214-Y231 HydrophobicContact CG2-CD2 4.13Å; V214-Y231 HydrophobicContact CG2-CE2 3.83Å; V214-F262 HydrophobicContact CG1-CE1 4.47Å
215	A	85.9	Confident	76.7	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	137	179.3	0	0	0	0	0	111	V169 V203 H204 F206 R226	V169-A215 HydrophobicContact CG1-CB 4.01Å; V203-A215 CarbonylContact C-O 3.46Å; V203-A215 WeakPolarHBondContact CA-O 3.29Å; V203-A215 WeakPolarHBondContact CB-O 3.4Å; H204-A215 PolarHBondContact N-O 3.43Å; H204-A215 PolarHBondContact O-N 3.1Å; F206-A215 HydrophobicContact CE2-CB 4.18Å; A215-R226 CarbonylContact C-O 3.55Å; A215-R226 VanDerWaalsContact CA-O 3.25Å; A215-R226 WeakPolarHBondContact CA-O 3.29Å; A215-R226 WeakPolarHBondContact CB-O 3.45Å
216	T	85.1	Confident	76.4	Confident	16 Å²	16	53.8 Å²	53.8	10%	0.098	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	141.6	179.3	-63.6	0	0	0	0	111.1	Q201 Y225 R226 N228	Q201-T216 HydrophobicContact CB-CG2 4.39Å; Q201-T216 HydrophobicContact CG-CG2 4.47Å; Q201-T216 PolarHBondContact OE1-OG1 2.79Å; T216-Y225 CarbonylContact O-C 3.52Å; T216-Y225 WeakPolarHBondContact O-CA 3.28Å; T216-R226 PolarHBondContact N-O 3.3Å; T216-R226 PolarHBondContact O-N 3.28Å; T216-N228 PolarHBondContact OG1-ND2 3.37Å
217	W	80.9	Confident	76.2	Confident	73 Å²	73	57.9 Å²	57.9	28%	0.277	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	129.6	173.8	-168.9	-78.1	0	0	0	112.4	R202 Y225	R202-W217 HydrophobicContact CB-CB 4.07Å; R202-W217 WeakPolarHBondContact O-CB 3.21Å; R202-W217 PolarHBondContact O-N 3.46Å; W217-Y225 HydrophobicContact CD2-CE1 4.26Å; W217-Y225 HydrophobicContact CE3-CD1 4.19Å; W217-Y225 AromaticContact CE3-CE1 3.38Å; W217-Y225 HydrophobicContact CE3-CE1 3.38Å; W217-Y225 AromaticContact CZ3-CE1 3.57Å; W217-Y225 HydrophobicContact CZ3-CE1 3.57Å; W217-Y225 AromaticContact CZ3-CZ 3.82Å; W217-Y225 WeakPolarHBondContact CZ3-OH 3.37Å
218	L	76.1	Confident	76.1	Confident	10 Å²	10	60.5 Å²	60.5	5%	0.052	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-87.8	125	170.9	-78	96.6	0	0	0	112	Q220 M224 R226	L218-Q220 VanDerWaalsContact C-N 3.32Å; L218-Q220 PolarHBondContact O-N 2.77Å; L218-M224 WeakPolarHBondContact CD1-O 3.5Å; L218-M224 PolarHBondContact N-O 3.29Å; L218-R226 HydrophobicContact CD1-CB 3.73Å
219	P	61.5	Low	75.8	Confident	126 Å²	126	61.3 Å²	61.3	82%	0.818	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-28.9	176.4	-20.5	32.2	0	0	0	114.1
220	Q	55.9	Low	75.9	Confident	183 Å²	183	62.8 Å²	62.8	86%	0.855	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.8	-15.3	-171.5	-86.4	163	-21.2	0	0	114.9	L218	L218-Q220 VanDerWaalsContact C-N 3.32Å; L218-Q220 PolarHBondContact O-N 2.77Å
221	R	63.1	Low	75.8	Confident	138 Å²	138	61.1 Å²	61.1	52%	0.521	28%	0.284	S	S	.	.	S	Bend	trans	-138.2	105.6	-179.6	-61.2	-174.8	79.5	-176.3	1.6	110.3	E170 G223 M224	E170-R221 IonicContact OE1-NH1 3.81Å; E170-R221 PolarHBondContact OE1-NH1 2.83Å; R221-G223 PolarHBondContact O-N 3.19Å; R221-M224 HydrophobicContact CB-CB 4.23Å; R221-M224 HydrophobicContact CB-SD 4.11Å; R221-M224 PolarHBondContact NE-SD 2.84Å; R221-M224 VanDerWaalsContact NE-SD 3.42Å; R221-M224 PolarHBondContact O-N 3.22Å
222	R	57.1	Low	75.7	Confident	253 Å²	253	63.7 Å²	63.7	96%	0.955	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	122.8	179.3	-91.2	-176.1	172	-178.8	-2.1	110.7
223	G	59.8	Low	75.5	Confident	32 Å²	32	63.6 Å²	63.6	33%	0.33	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.3	11.6	174.2	0	0	0	0	0	115.6	R221	R221-G223 PolarHBondContact O-N 3.19Å
224	M	69.4	Low	75.1	Confident	38 Å²	38	68.4 Å²	68.4	19%	0.187	33%	0.328	C	S	.	.			trans	-113.8	140.8	171.5	-77.1	172.8	60.2	0	0	111.1	K168 E170 L218 R221	K168-M224 WeakPolarHBondContact O-CA 3.47Å; E170-M224 VanDerWaalsContact CD-CE 3.43Å; E170-M224 HydrophobicContact CG-CE 3.62Å; E170-M224 WeakPolarHBondContact OE1-CE 3.43Å; L218-M224 WeakPolarHBondContact CD1-O 3.5Å; L218-M224 PolarHBondContact N-O 3.29Å; R221-M224 HydrophobicContact CB-CB 4.23Å; R221-M224 HydrophobicContact CB-SD 4.11Å; R221-M224 PolarHBondContact NE-SD 2.84Å; R221-M224 VanDerWaalsContact NE-SD 3.42Å; R221-M224 PolarHBondContact O-N 3.22Å
225	Y	79.3	Confident	74.3	Confident	30 Å²	30	70.5 Å²	70.5	12%	0.118	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	153	-178.6	-52.9	-86.4	0	0	0	110.4	K168 V169 E170 H204 T216 W217	K168-Y225 PolarHBondContact O-N 3.39Å; V169-Y225 CarbonylContact C-O 3.53Å; V169-Y225 WeakPolarHBondContact CA-O 3.46Å; V169-Y225 HydrophobicContact CG2-CD2 4.5Å; E170-Y225 PolarHBondContact N-O 2.95Å; H204-Y225 HydrophobicContact CB-CD1 3.8Å; H204-Y225 HydrophobicContact CB-CE1 3.58Å; H204-Y225 AromaticContact CG-CE1 4Å; T216-Y225 CarbonylContact O-C 3.52Å; T216-Y225 WeakPolarHBondContact O-CA 3.28Å; W217-Y225 HydrophobicContact CD2-CE1 4.26Å; W217-Y225 HydrophobicContact CE3-CD1 4.19Å; W217-Y225 AromaticContact CE3-CE1 3.38Å; W217-Y225 HydrophobicContact CE3-CE1 3.38Å; W217-Y225 AromaticContact CZ3-CE1 3.57Å; W217-Y225 HydrophobicContact CZ3-CE1 3.57Å; W217-Y225 AromaticContact CZ3-CZ 3.82Å; W217-Y225 WeakPolarHBondContact CZ3-OH 3.37Å
226	R	79.2	Confident	74	Confident	127 Å²	127	70.7 Å²	70.7	48%	0.479	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	131	172.8	-171.1	178.5	-66.1	124.5	-1.5	108.4	A215 T216 L218 N228	A215-R226 CarbonylContact C-O 3.55Å; A215-R226 VanDerWaalsContact CA-O 3.25Å; A215-R226 WeakPolarHBondContact CA-O 3.29Å; A215-R226 WeakPolarHBondContact CB-O 3.45Å; T216-R226 PolarHBondContact N-O 3.3Å; T216-R226 PolarHBondContact O-N 3.28Å; L218-R226 HydrophobicContact CD1-CB 3.73Å; R226-N228 PolarHBondContact O-N 2.88Å
227	Y	81.7	Confident	73.7	Confident	89 Å²	89	72 Å²	72	35%	0.349	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-51.6	126.9	169.4	176.2	-92.6	0	0	0	110.6	E170 C172 L175 L213 L230	E170-Y227 PolarHBondContact O-N 3.07Å; C172-Y227 VanDerWaalsContact SG-CD2 3.58Å; L175-Y227 HydrophobicContact CD1-CE2 4.25Å; L213-Y227 HydrophobicContact CD1-CD2 3.44Å; L213-Y227 VanDerWaalsContact CD1-CD2 3.44Å; L213-Y227 HydrophobicContact CD1-CE2 3.43Å; L213-Y227 VanDerWaalsContact CD1-CE2 3.43Å; Y227-L230 HydrophobicContact CE2-CB 4.16Å; Y227-L230 WeakPolarHBondContact OH-CB 3.32Å; Y227-L230 PolarHBondContact OH-N 3.03Å
228	N	81.2	Confident	73.8	Confident	55 Å²	55	71 Å²	71	29%	0.294	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	-58.1	178	178.8	-50.6	0	0	0	110.5	Q201 V214 T216 R226 R260	Q201-N228 PolarHBondContact NE2-ND2 3.39Å; V214-N228 VanDerWaalsContact O-CB 3.32Å; V214-N228 WeakPolarHBondContact O-CB 3.24Å; V214-N228 PolarHBondContact O-N 2.72Å; V214-N228 VanDerWaalsContact O-N 3.14Å; T216-N228 PolarHBondContact OG1-ND2 3.37Å; R226-N228 PolarHBondContact O-N 2.88Å; N228-R260 PolarHBondContact OD1-NH1 3.37Å; N228-R260 VanDerWaalsContact OD1-NH1 3.15Å; N228-R260 PolarHBondContact OD1-NH2 2.92Å
229	A	78.9	Confident	74.2	Confident	16 Å²	16	73.5 Å²	73.5	13%	0.132	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.8	150.5	-178.9	0	0	0	0	0	112.6	V214 Y231	V214-A229 PolarHBondContact N-O 3.01Å; V214-A229 PolarHBondContact O-N 3.35Å; A229-Y231 HydrophobicContact CB-CE1 4.26Å; A229-Y231 HydrophobicContact CB-CE2 3.87Å
230	L	82.8	Confident	75.1	Confident	61 Å²	61	72 Å²	72	32%	0.319	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	125.4	172.3	-174.9	75.8	0	0	0	109.2	L175 C211 L213 Y227	L175-L230 HydrophobicContact CD1-CD1 4.15Å; L175-L230 HydrophobicContact CD1-CD2 4.05Å; L175-L230 HydrophobicContact CD2-CD2 3.68Å; C211-L230 HydrophobicContact CB-CD1 3.93Å; C211-L230 HydrophobicContact CB-CG 4.28Å; L213-L230 HydrophobicContact CB-CD1 3.83Å; L213-L230 HydrophobicContact CD1-CD1 4.21Å; Y227-L230 HydrophobicContact CE2-CB 4.16Å; Y227-L230 WeakPolarHBondContact OH-CB 3.32Å; Y227-L230 PolarHBondContact OH-N 3.03Å
231	Y	80.2	Confident	76.3	Confident	19 Å²	19	64.8 Å²	64.8	8%	0.075	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	124.3	-179	-59.4	-63.8	0	0	0	110.7	C211 L212 V214 A229 M255 R260	C211-Y231 CarbonylContact C-O 3.58Å; C211-Y231 WeakPolarHBondContact CA-O 3.46Å; C211-Y231 WeakPolarHBondContact CB-O 3.3Å; L212-Y231 PolarHBondContact N-O 3.26Å; L212-Y231 PolarHBondContact O-N 2.73Å; V214-Y231 HydrophobicContact CB-CE2 4.5Å; V214-Y231 HydrophobicContact CG2-CD2 4.13Å; V214-Y231 HydrophobicContact CG2-CE2 3.83Å; A229-Y231 HydrophobicContact CB-CE1 4.26Å; A229-Y231 HydrophobicContact CB-CE2 3.87Å; Y231-M255 HydrophobicContact CD1-CB 4.4Å; Y231-M255 HydrophobicContact CD1-CE 4.05Å; Y231-M255 HydrophobicContact CD1-CG 3.72Å; Y231-M255 HydrophobicContact CD1-SD 4.34Å; Y231-M255 HydrophobicContact CE1-CB 4.41Å; Y231-M255 HydrophobicContact CE1-CG 4.04Å; Y231-M255 HydrophobicContact CG-CG 4.29Å; Y231-R260 WeakPolarHBondContact OH-CD 3.39Å; Y231-R260 PolarHBondContact OH-NH1 2.89Å
232	S	80.4	Confident	76.8	Confident	62 Å²	62	67 Å²	67	43%	0.434	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	135.1	166.9	174.1	0	0	0	0	109.7	D234 G235	S232-D234 PolarHBondContact O-N 3.39Å; S232-G235 PolarHBondContact O-N 2.92Å
233	L	79.4	Confident	77.5	Confident	3 Å²	3	59.7 Å²	59.7	2%	0.016	33%	0.327	C	S	.	.	G	3₁₀ helix	trans	-66.5	-18	-178.4	-66.8	177	0	0	0	113.4	L207 D210 L212 G235 L236 L277 T280 L284	L207-L233 HydrophobicContact CD1-CD1 4.35Å; L207-L233 HydrophobicContact CD1-CD2 3.99Å; D210-L233 WeakPolarHBondContact O-CG 3.41Å; D210-L233 PolarHBondContact O-N 2.88Å; D210-L233 VanDerWaalsContact O-N 3.12Å; L212-L233 HydrophobicContact CB-CD2 4.44Å; L233-G235 VanDerWaalsContact C-N 3.34Å; L233-G235 PolarHBondContact O-N 3.43Å; L233-L236 HydrophobicContact CD2-CD2 3.78Å; L233-L236 PolarHBondContact O-N 3.48Å; L233-L277 HydrophobicContact CD2-CD2 4.44Å; L233-T280 HydrophobicContact CD1-CG2 3.61Å; L233-L284 HydrophobicContact CB-CD2 3.93Å
234	D	72.8	Confident	77.9	Confident	101 Å²	101	63 Å²	63	54%	0.54	34%	0.337	S	S	.	.	G	3₁₀ helix	trans	-66.1	-34.5	179.9	-76.2	-29.1	0	0	0	112.8	S232	S232-D234 PolarHBondContact O-N 3.39Å
235	G	69.8	Low	77.5	Confident	48 Å²	48	66.8 Å²	66.8	50%	0.495	37%	0.365	S	S	.	.	G	3₁₀ helix	trans	-95.4	-3	179.3	0	0	0	0	0	114.7	S232 L233 M255	S232-G235 PolarHBondContact O-N 2.92Å; L233-G235 VanDerWaalsContact C-N 3.34Å; L233-G235 PolarHBondContact O-N 3.43Å; G235-M255 VanDerWaalsContact C-SD 3.51Å; G235-M255 VanDerWaalsContact O-SD 3.37Å
236	L	79.5	Confident	76.6	Confident	5 Å²	5	70.8 Å²	70.8	3%	0.026	39%	0.394	C	S	.	.			trans	-87.4	116	-168.4	-171	70.2	0	0	0	113.1	L212 L233 V238 L253 M255 L277 K281	L212-L236 HydrophobicContact CD2-CD2 4.11Å; L233-L236 HydrophobicContact CD2-CD2 3.78Å; L233-L236 PolarHBondContact O-N 3.48Å; L236-V238 HydrophobicContact CD2-CG2 4.23Å; L236-V238 HydrophobicContact CG-CG2 4.15Å; L236-L253 HydrophobicContact CD1-CB 4.07Å; L236-L253 HydrophobicContact CD1-CD1 4.29Å; L236-L253 HydrophobicContact CD1-CD2 4.11Å; L236-L253 HydrophobicContact CD1-CG 4.39Å; L236-M255 WeakPolarHBondContact CA-SD 2.95Å; L236-M255 HydrophobicContact CB-SD 3.56Å; L236-M255 VanDerWaalsContact CB-SD 3.56Å; L236-M255 HydrophobicContact CD1-CG 3.56Å; L236-M255 HydrophobicContact CD1-SD 3.24Å; L236-M255 WeakPolarHBondContact CD1-SD 3.37Å; L236-M255 HydrophobicContact CG-SD 3.98Å; L236-L277 HydrophobicContact CD2-CD2 4.28Å; L236-K281 PolarHBondContact O-NZ 3.14Å
237	A	79.9	Confident	76	Confident	43 Å²	43	67.3 Å²	67.3	36%	0.355	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	117.8	169.6	0	0	0	0	0	110.2	L254	A237-L254 HydrophobicContact CB-CB 3.95Å; A237-L254 PolarHBondContact N-O 2.82Å; A237-L254 PolarHBondContact O-N 2.91Å
238	V	82.1	Confident	75.7	Confident	53 Å²	53	69.4 Å²	69.4	32%	0.321	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	122.2	-179.4	-170.8	0	0	0	0	108.8	L236 F251 L253 L274 L277	L236-V238 HydrophobicContact CD2-CG2 4.23Å; L236-V238 HydrophobicContact CG-CG2 4.15Å; V238-F251 HydrophobicContact CG1-CD2 4.29Å; V238-L253 HydrophobicContact CB-CD2 4.18Å; V238-L253 HydrophobicContact CG1-CD2 3.87Å; V238-L253 HydrophobicContact CG2-CD2 3.73Å; V238-L274 HydrophobicContact CG1-CD2 3.29Å; V238-L277 HydrophobicContact CG1-CD1 4.37Å; V238-L277 HydrophobicContact CG2-CB 4.41Å; V238-L277 HydrophobicContact CG2-CD1 4.18Å
239	V	83.6	Confident	75.7	Confident	62 Å²	62	67.5 Å²	67.5	38%	0.376	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	120.5	-179.4	179.4	0	0	0	0	109.6	V241 K252 L254	V239-V241 PolarHBondContact O-N 3.24Å; V239-K252 HydrophobicContact CB-CB 4.26Å; V239-K252 PolarHBondContact N-O 2.76Å; V239-K252 PolarHBondContact O-N 2.74Å; V239-L254 HydrophobicContact CG2-CD1 3.48Å; V239-L254 VanDerWaalsContact CG2-CD1 3.48Å; V239-L254 HydrophobicContact CG2-CG 4.13Å
240	N	82.3	Confident	76	Confident	95 Å²	95	67 Å²	67	51%	0.508	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	118.6	172.9	-175.6	7.7	0	0	0	110.1	K270 L274	N240-K270 WeakPolarHBondContact OD1-CE 3.26Å; N240-K270 PolarHBondContact OD1-NZ 3.07Å; N240-L274 HydrophobicContact CB-CD1 3.85Å
241	V	80.1	Confident	76.1	Confident	30 Å²	30	64.2 Å²	64.2	18%	0.182	37%	0.365	C	S	.	.	P	Polyproline II helix	trans	-83	127.5	175.6	-176.5	0	0	0	0	108.4	V239 M247 M250 K252 K270	V239-V241 PolarHBondContact O-N 3.24Å; V241-M247 HydrophobicContact CG1-CB 4.46Å; V241-M247 HydrophobicContact CG1-SD 4.11Å; V241-M250 HydrophobicContact CB-CB 4.27Å; V241-M250 WeakPolarHBondContact CB-O 3.45Å; V241-M250 PolarHBondContact N-O 2.85Å; V241-K252 HydrophobicContact CG2-CB 3.96Å; V241-K270 PolarHBondContact O-NZ 2.9Å
242	K	73.4	Confident	76.4	Confident	185 Å²	185	66 Å²	66	80%	0.804	37%	0.374	S	S	*	.	P	Polyproline II helix	trans	-67.1	139.4	177.5	-70.6	-177.6	179.8	178	0	110.1	N244	K242-N244 PolarHBondContact O-N 3.43Å; K242-N244 VanDerWaalsContact O-N 3.16Å
243	D	72.7	Confident	76.6	Confident	99 Å²	99	63.4 Å²	63.4	53%	0.529	36%	0.355	S	S	.	.			trans	-69.1	113.2	-179.3	-57.8	-39.1	0	0	0	109.9	M247 D249 K270	D243-M247 CarbonylContact C-O 3.42Å; D243-M247 WeakPolarHBondContact CA-O 3.34Å; D243-D249 PolarHBondContact OD1-N 3.48Å; D243-D249 VanDerWaalsContact OD1-N 3.08Å; D243-K270 IonicContact OD1-NZ 2.84Å; D243-K270 PolarHBondContact OD1-NZ 3.45Å
244	N	66.5	Low	76.5	Confident	102 Å²	102	66.2 Å²	66.2	55%	0.545	37%	0.369	S	S	.	.	B	Isolated β-bridge	trans	-146	114.8	175	-173.8	28.1	0	0	0	108.2	K242 M247	K242-N244 PolarHBondContact O-N 3.43Å; K242-N244 VanDerWaalsContact O-N 3.16Å; N244-M247 CarbonylContact C-O 3.33Å; N244-M247 PolarHBondContact N-O 2.86Å; N244-M247 CarbonylContact O-C 3.6Å; N244-M247 VanDerWaalsContact O-CA 3.31Å; N244-M247 WeakPolarHBondContact O-CA 3.42Å; N244-M247 VanDerWaalsContact O-CB 3.27Å; N244-M247 WeakPolarHBondContact O-CB 3.48Å; N244-M247 PolarHBondContact O-N 3.3Å
245	P	60.9	Low	76.5	Confident	117 Å²	117	63.1 Å²	63.1	76%	0.76	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.3	125.8	-176.4	-24.2	32.8	0	0	0	111.2
246	P	60.9	Low	75.8	Confident	114 Å²	114	70.1 Å²	70.1	74%	0.74	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	cis	-89.1	0.1	15.7	35.3	-36.2	0	0	0	116.6	K248	P246-K248 PolarHBondContact O-N 2.63Å
247	M	67.1	Low	74.8	Confident	54 Å²	54	75.2 Å²	75.2	27%	0.266	40%	0.403	S	S	.	.	B	Isolated β-bridge	trans	-82.9	97.4	-179.1	-52.9	170.3	-135.5	0	0	110.9	M197 V241 D243 N244 M250	M197-M247 HydrophobicContact CE-CE 3.85Å; M197-M247 HydrophobicContact CE-CG 3.9Å; M197-M247 HydrophobicContact CE-SD 3.55Å; M197-M247 VanDerWaalsContact CE-SD 3.55Å; V241-M247 HydrophobicContact CG1-CB 4.46Å; V241-M247 HydrophobicContact CG1-SD 4.11Å; D243-M247 CarbonylContact C-O 3.42Å; D243-M247 WeakPolarHBondContact CA-O 3.34Å; N244-M247 CarbonylContact C-O 3.33Å; N244-M247 PolarHBondContact N-O 2.86Å; N244-M247 CarbonylContact O-C 3.6Å; N244-M247 VanDerWaalsContact O-CA 3.31Å; N244-M247 WeakPolarHBondContact O-CA 3.42Å; N244-M247 VanDerWaalsContact O-CB 3.27Å; N244-M247 WeakPolarHBondContact O-CB 3.48Å; N244-M247 PolarHBondContact O-N 3.3Å; M247-M250 HydrophobicContact CB-SD 3.86Å; M247-M250 HydrophobicContact CG-SD 4.14Å
248	K	75.8	Confident	74.4	Confident	133 Å²	133	78.9 Å²	78.9	58%	0.578	41%	0.412	S	S	*	.			trans	-122.7	131.9	175.4	-172.8	-175.3	174.7	-173.4	0	109.8	P246 M250 Q263	P246-K248 PolarHBondContact O-N 2.63Å; K248-M250 VanDerWaalsContact C-N 3.26Å; K248-M250 PolarHBondContact O-N 2.83Å; K248-Q263 PolarHBondContact O-NE2 2.88Å
249	D	81.4	Confident	74.4	Confident	16 Å²	16	78.1 Å²	78.1	9%	0.086	41%	0.41	C	S	.	.	S	Bend	trans	60	34.3	174.9	-58.3	-41.1	0	0	0	113.6	D243 A264 A267 K270	D243-D249 PolarHBondContact OD1-N 3.48Å; D243-D249 VanDerWaalsContact OD1-N 3.08Å; D249-A264 PolarHBondContact O-N 3.02Å; D249-A267 VanDerWaalsContact CG-N 3.29Å; D249-A267 WeakPolarHBondContact OD1-CA 3.48Å; D249-A267 WeakPolarHBondContact OD1-CB 3.49Å; D249-A267 PolarHBondContact OD1-N 2.87Å; D249-A267 PolarHBondContact OD2-N 2.89Å; D249-K270 VanDerWaalsContact C-CD 3.46Å; D249-K270 HydrophobicContact CB-CD 4.43Å
250	M	83.8	Confident	74.4	Confident	5 Å²	5	76.3 Å²	76.3	3%	0.025	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	148.4	179.8	-58.5	177.9	115.6	0	0	113.3	Y192 V241 M247 K248 I261 F262 Q263 K270	Y192-M250 HydrophobicContact CD1-CE 3.65Å; Y192-M250 HydrophobicContact CD2-CE 3.3Å; Y192-M250 HydrophobicContact CE1-CE 4.02Å; Y192-M250 HydrophobicContact CE2-CE 3.71Å; Y192-M250 HydrophobicContact CG-CE 3.27Å; V241-M250 HydrophobicContact CB-CB 4.27Å; V241-M250 WeakPolarHBondContact CB-O 3.45Å; V241-M250 PolarHBondContact N-O 2.85Å; M247-M250 HydrophobicContact CB-SD 3.86Å; M247-M250 HydrophobicContact CG-SD 4.14Å; K248-M250 VanDerWaalsContact C-N 3.26Å; K248-M250 PolarHBondContact O-N 2.83Å; M250-I261 HydrophobicContact CB-CG2 4.24Å; M250-I261 HydrophobicContact CE-CG2 3.88Å; M250-I261 HydrophobicContact SD-CG2 4.27Å; M250-F262 CarbonylContact C-O 3.46Å; M250-F262 VanDerWaalsContact CA-O 3.22Å; M250-F262 WeakPolarHBondContact CA-O 3.25Å; M250-Q263 HydrophobicContact CE-CB 4.22Å; M250-Q263 HydrophobicContact CG-CB 3.98Å; M250-Q263 HydrophobicContact CG-CG 4.11Å; M250-K270 WeakPolarHBondContact O-CE 3.43Å; M250-K270 PolarHBondContact O-NZ 2.86Å
251	F	86.7	Confident	74.6	Confident	2 Å²	2	72.1 Å²	72.1	1%	0.009	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	156	166.6	64.8	-87.4	0	0	0	109.8	L189 V238 L253 F262 K270 W273 L274	L189-F251 HydrophobicContact CD1-CZ 3.88Å; L189-F251 HydrophobicContact CD2-CE1 3.86Å; L189-F251 HydrophobicContact CD2-CZ 4.05Å; V238-F251 HydrophobicContact CG1-CD2 4.29Å; F251-L253 HydrophobicContact CD2-CD2 4.05Å; F251-L253 HydrophobicContact CD2-CG 4.36Å; F251-L253 HydrophobicContact CE2-CD1 4.48Å; F251-L253 HydrophobicContact CE2-CD2 3.96Å; F251-L253 HydrophobicContact CE2-CG 4.11Å; F251-F262 HydrophobicContact CE1-CB 4.04Å; F251-F262 HydrophobicContact CE2-CB 4.06Å; F251-F262 HydrophobicContact CE2-CD2 4.1Å; F251-F262 HydrophobicContact CE2-CG 4.45Å; F251-F262 HydrophobicContact CZ-CB 3.78Å; F251-F262 HydrophobicContact CZ-CG 4.44Å; F251-F262 PolarHBondContact N-O 3.43Å; F251-F262 PolarHBondContact O-N 3.32Å; F251-K270 HydrophobicContact CD1-CG 4.43Å; F251-W273 HydrophobicContact CE1-CB 4.36Å; F251-W273 HydrophobicContact CZ-CB 4.44Å; F251-W273 HydrophobicContact CZ-CG 4.46Å; F251-L274 HydrophobicContact CB-CD2 4.02Å; F251-L274 HydrophobicContact CG-CD2 4.33Å
252	K	84.7	Confident	75	Confident	58 Å²	58	70.8 Å²	70.8	25%	0.252	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	129.4	-174.3	-176.5	174.4	-169.7	175.8	0	109.7	V239 V241 L254 S259 R260 I261	V239-K252 HydrophobicContact CB-CB 4.26Å; V239-K252 PolarHBondContact N-O 2.76Å; V239-K252 PolarHBondContact O-N 2.74Å; V241-K252 HydrophobicContact CG2-CB 3.96Å; K252-L254 HydrophobicContact CD-CD2 3.98Å; K252-L254 HydrophobicContact CG-CD2 4.13Å; K252-L254 HydrophobicContact CG-CG 4.43Å; K252-S259 WeakPolarHBondContact CE-OG 3.5Å; K252-S259 PolarHBondContact NZ-OG 3.06Å; K252-R260 CarbonylContact C-O 3.57Å; K252-R260 WeakPolarHBondContact CA-O 3.45Å; K252-I261 HydrophobicContact CB-CG1 4.46Å; K252-I261 HydrophobicContact CD-CG1 4.35Å; K252-I261 HydrophobicContact CG-CG1 4.15Å
253	L	85.4	Confident	75.6	Confident	6 Å²	6	64.1 Å²	64.1	3%	0.031	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	118.8	170.5	-60.7	-173.1	0	0	0	108.4	L212 L236 V238 F251 R260 F262	L212-L253 HydrophobicContact CD2-CD1 3.65Å; L236-L253 HydrophobicContact CD1-CB 4.07Å; L236-L253 HydrophobicContact CD1-CD1 4.29Å; L236-L253 HydrophobicContact CD1-CD2 4.11Å; L236-L253 HydrophobicContact CD1-CG 4.39Å; V238-L253 HydrophobicContact CB-CD2 4.18Å; V238-L253 HydrophobicContact CG1-CD2 3.87Å; V238-L253 HydrophobicContact CG2-CD2 3.73Å; F251-L253 HydrophobicContact CD2-CD2 4.05Å; F251-L253 HydrophobicContact CD2-CG 4.36Å; F251-L253 HydrophobicContact CE2-CD1 4.48Å; F251-L253 HydrophobicContact CE2-CD2 3.96Å; F251-L253 HydrophobicContact CE2-CG 4.11Å; L253-R260 PolarHBondContact N-O 3.02Å; L253-R260 PolarHBondContact O-N 3.42Å; L253-F262 HydrophobicContact CB-CE2 4.1Å; L253-F262 HydrophobicContact CD1-CD2 3.89Å; L253-F262 HydrophobicContact CD1-CE2 3.48Å; L253-F262 VanDerWaalsContact CD1-CE2 3.48Å; L253-F262 HydrophobicContact CD1-CZ 4.43Å; L253-F262 HydrophobicContact CG-CD2 3.86Å; L253-F262 HydrophobicContact CG-CE2 3.75Å
254	L	78.1	Confident	76.3	Confident	63 Å²	63	59.6 Å²	59.6	33%	0.33	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	116.4	175.3	-63.6	175.8	0	0	0	108.1	A237 V239 K252	A237-L254 HydrophobicContact CB-CB 3.95Å; A237-L254 PolarHBondContact N-O 2.82Å; A237-L254 PolarHBondContact O-N 2.91Å; V239-L254 HydrophobicContact CG2-CD1 3.48Å; V239-L254 VanDerWaalsContact CG2-CD1 3.48Å; V239-L254 HydrophobicContact CG2-CG 4.13Å; K252-L254 HydrophobicContact CD-CD2 3.98Å; K252-L254 HydrophobicContact CG-CD2 4.13Å; K252-L254 HydrophobicContact CG-CG 4.43Å
255	M	72.3	Confident	77	Confident	35 Å²	35	62.4 Å²	62.4	17%	0.172	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	100	178.7	-72.5	-61.8	-61.1	0	0	107.7	Y231 G235 L236 P257 E258	Y231-M255 HydrophobicContact CD1-CB 4.4Å; Y231-M255 HydrophobicContact CD1-CE 4.05Å; Y231-M255 HydrophobicContact CD1-CG 3.72Å; Y231-M255 HydrophobicContact CD1-SD 4.34Å; Y231-M255 HydrophobicContact CE1-CB 4.41Å; Y231-M255 HydrophobicContact CE1-CG 4.04Å; Y231-M255 HydrophobicContact CG-CG 4.29Å; G235-M255 VanDerWaalsContact C-SD 3.51Å; G235-M255 VanDerWaalsContact O-SD 3.37Å; L236-M255 WeakPolarHBondContact CA-SD 2.95Å; L236-M255 HydrophobicContact CB-SD 3.56Å; L236-M255 VanDerWaalsContact CB-SD 3.56Å; L236-M255 HydrophobicContact CD1-CG 3.56Å; L236-M255 HydrophobicContact CD1-SD 3.24Å; L236-M255 WeakPolarHBondContact CD1-SD 3.37Å; L236-M255 HydrophobicContact CG-SD 3.98Å; M255-P257 CarbonylContact O-C 3.44Å; M255-P257 VanDerWaalsContact O-N 3.16Å; M255-E258 CarbonylContact C-O 3.59Å; M255-E258 PolarHBondContact N-O 3.2Å; M255-E258 CarbonylContact O-C 3.55Å; M255-E258 WeakPolarHBondContact O-CA 3.32Å; M255-E258 PolarHBondContact O-N 2.82Å
256	F	55.1	Low	78.1	Confident	195 Å²	195	59.8 Å²	59.8	86%	0.855	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.6	125	-177.1	-179.1	-92	0	0	0	111.8
257	P	57.8	Low	79	Confident	113 Å²	113	56.5 Å²	56.5	73%	0.734	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	cis	-95.1	-0.9	6.5	37	-34.3	0	0	0	115.8	M255	M255-P257 CarbonylContact O-C 3.44Å; M255-P257 VanDerWaalsContact O-N 3.16Å
258	E	71.3	Confident	79.7	Confident	119 Å²	119	60 Å²	60	56%	0.556	30%	0.299	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.2	148.6	-174.1	-63.2	-176.5	175.8	0	0	114.5	M255	M255-E258 CarbonylContact C-O 3.59Å; M255-E258 PolarHBondContact N-O 3.2Å; M255-E258 CarbonylContact O-C 3.55Å; M255-E258 WeakPolarHBondContact O-CA 3.32Å; M255-E258 PolarHBondContact O-N 2.82Å
259	S	81.8	Confident	80.2	Confident	38 Å²	38	55.3 Å²	55.3	27%	0.266	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	114.8	178.6	134.2	0	0	0	0	107.8	A194 K252	A194-S259 WeakPolarHBondContact CB-O 3.38Å; K252-S259 WeakPolarHBondContact CE-OG 3.5Å; K252-S259 PolarHBondContact NZ-OG 3.06Å
260	R	84.1	Confident	80.3	Confident	23 Å²	23	55.1 Å²	55.1	9%	0.087	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	139.5	-178.2	-65.6	179.5	76.3	171.7	7.8	111.2	E191 N228 Y231 K252 L253 F262	E191-R260 IonicContact OE1-CZ 2.83Å; E191-R260 IonicContact OE1-NE 3.27Å; E191-R260 PolarHBondContact OE1-NE 3.03Å; E191-R260 IonicContact OE1-NH2 2.74Å; E191-R260 PolarHBondContact OE1-NH2 3.29Å; E191-R260 IonicContact OE2-CZ 3.19Å; E191-R260 IonicContact OE2-NH2 3.78Å; E191-R260 PolarHBondContact OE2-NH2 3.48Å; N228-R260 PolarHBondContact OD1-NH1 3.37Å; N228-R260 VanDerWaalsContact OD1-NH1 3.15Å; N228-R260 PolarHBondContact OD1-NH2 2.92Å; Y231-R260 WeakPolarHBondContact OH-CD 3.39Å; Y231-R260 PolarHBondContact OH-NH1 2.89Å; K252-R260 CarbonylContact C-O 3.57Å; K252-R260 WeakPolarHBondContact CA-O 3.45Å; L253-R260 PolarHBondContact N-O 3.02Å; L253-R260 PolarHBondContact O-N 3.42Å; R260-F262 HydrophobicContact CB-CE2 3.57Å; R260-F262 HydrophobicContact CB-CZ 3.73Å
261	I	86.5	Confident	80.3	Confident	7 Å²	7	62.6 Å²	62.6	4%	0.036	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	128.7	178.5	-56.5	178.6	0	0	0	108.7	Y192 M197 M250 K252	Y192-I261 PolarHBondContact N-O 3.49Å; M197-I261 HydrophobicContact CE-CD1 3.94Å; M197-I261 HydrophobicContact SD-CD1 3.91Å; M250-I261 HydrophobicContact CB-CG2 4.24Å; M250-I261 HydrophobicContact CE-CG2 3.88Å; M250-I261 HydrophobicContact SD-CG2 4.27Å; K252-I261 HydrophobicContact CB-CG1 4.46Å; K252-I261 HydrophobicContact CD-CG1 4.35Å; K252-I261 HydrophobicContact CG-CG1 4.15Å
262	F	87.9	Confident	80.2	Confident	2 Å²	2	65.2 Å²	65.2	1%	0.009	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	134.9	177.9	-59.9	-78.7	0	0	0	110.6	L189 V190 E191 V203 V214 M250 F251 L253 R260	L189-F262 HydrophobicContact CB-CB 4.49Å; L189-F262 HydrophobicContact CB-CD1 4.4Å; L189-F262 HydrophobicContact CD1-CB 4.41Å; L189-F262 HydrophobicContact CD1-CG 4.5Å; V190-F262 CarbonylContact O-C 3.55Å; V190-F262 WeakPolarHBondContact O-CA 3.19Å; E191-F262 HydrophobicContact CB-CD1 4.19Å; E191-F262 HydrophobicContact CB-CE1 4.07Å; E191-F262 HydrophobicContact CG-CD1 4.5Å; E191-F262 HydrophobicContact CG-CE1 4.11Å; V203-F262 HydrophobicContact CG2-CD1 3.95Å; V203-F262 HydrophobicContact CG2-CE1 3.9Å; V214-F262 HydrophobicContact CG1-CE1 4.47Å; M250-F262 CarbonylContact C-O 3.46Å; M250-F262 VanDerWaalsContact CA-O 3.22Å; M250-F262 WeakPolarHBondContact CA-O 3.25Å; F251-F262 HydrophobicContact CE1-CB 4.04Å; F251-F262 HydrophobicContact CE2-CB 4.06Å; F251-F262 HydrophobicContact CE2-CD2 4.1Å; F251-F262 HydrophobicContact CE2-CG 4.45Å; F251-F262 HydrophobicContact CZ-CB 3.78Å; F251-F262 HydrophobicContact CZ-CG 4.44Å; F251-F262 PolarHBondContact N-O 3.43Å; F251-F262 PolarHBondContact O-N 3.32Å; L253-F262 HydrophobicContact CB-CE2 4.1Å; L253-F262 HydrophobicContact CD1-CD2 3.89Å; L253-F262 HydrophobicContact CD1-CE2 3.48Å; L253-F262 VanDerWaalsContact CD1-CE2 3.48Å; L253-F262 HydrophobicContact CD1-CZ 4.43Å; L253-F262 HydrophobicContact CG-CD2 3.86Å; L253-F262 HydrophobicContact CG-CE2 3.75Å; R260-F262 HydrophobicContact CB-CE2 3.57Å; R260-F262 HydrophobicContact CB-CZ 3.73Å
263	Q	86.8	Confident	80.4	Confident	45 Å²	45	62.6 Å²	62.6	21%	0.21	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	127.8	169.8	-174.1	175.3	45.4	0	0	109.6	V190 Y192 K248 M250	V190-Q263 HydrophobicContact CB-CB 4.39Å; V190-Q263 PolarHBondContact N-O 3.21Å; V190-Q263 PolarHBondContact O-N 2.97Å; Y192-Q263 HydrophobicContact CD2-CB 4.08Å; Y192-Q263 HydrophobicContact CE2-CB 3.77Å; Y192-Q263 PolarHBondContact OH-OE1 3.31Å; K248-Q263 PolarHBondContact O-NE2 2.88Å; M250-Q263 HydrophobicContact CE-CB 4.22Å; M250-Q263 HydrophobicContact CG-CB 3.98Å; M250-Q263 HydrophobicContact CG-CG 4.11Å
264	A	86.7	Confident	80.4	Confident	5 Å²	5	63.8 Å²	63.8	4%	0.041	31%	0.313	C	S	.	.			trans	-85.9	156.1	170.2	0	0	0	0	0	110.7	L189 D249 N266 I269 K270	L189-A264 HydrophobicContact CD2-CB 4.23Å; D249-A264 PolarHBondContact O-N 3.02Å; A264-N266 PolarHBondContact O-N 3.34Å; A264-I269 HydrophobicContact CB-CB 4.41Å; A264-I269 HydrophobicContact CB-CG2 4.1Å; A264-K270 HydrophobicContact CB-CB 3.83Å
265	E	82.4	Confident	80.8	Confident	161 Å²	161	67 Å²	67	75%	0.752	33%	0.327	S	S	*	.	S	Bend	trans	-62.3	-29.7	179.2	-177.4	178.5	-170.1	0	0	112.9	I269	E265-I269 HydrophobicContact CB-CD1 4.05Å
266	N	83.4	Confident	81.5	Confident	62 Å²	62	66.5 Å²	66.5	33%	0.332	33%	0.326	S	S	.	.	S	Bend	trans	-155.6	162.5	176.5	56	46.7	0	0	0	112.4	A264 K268 I269 K270	A264-N266 PolarHBondContact O-N 3.34Å; N266-K268 PolarHBondContact O-N 3.48Å; N266-K268 WeakPolarHBondContact OD1-CB 3.46Å; N266-K268 PolarHBondContact OD1-N 3.2Å; N266-I269 WeakPolarHBondContact ND2-CD1 3.41Å; N266-I269 PolarHBondContact O-N 2.98Å; N266-I269 VanDerWaalsContact OD1-CB 3.31Å; N266-I269 WeakPolarHBondContact OD1-CB 3.27Å; N266-I269 WeakPolarHBondContact OD1-CD1 3.44Å; N266-I269 WeakPolarHBondContact OD1-CG1 3.48Å; N266-I269 PolarHBondContact OD1-N 3.46Å; N266-K270 PolarHBondContact O-N 2.91Å
267	A	80.8	Confident	82.9	Confident	44 Å²	44	57.4 Å²	57.4	36%	0.364	29%	0.286	S	S	.	.	H	α-helix	trans	-56.7	-20	176.3	0	0	0	0	0	114.4	D249 R271	D249-A267 VanDerWaalsContact CG-N 3.29Å; D249-A267 WeakPolarHBondContact OD1-CA 3.48Å; D249-A267 WeakPolarHBondContact OD1-CB 3.49Å; D249-A267 PolarHBondContact OD1-N 2.87Å; D249-A267 PolarHBondContact OD2-N 2.89Å; A267-R271 WeakPolarHBondContact O-CG 3.48Å; A267-R271 PolarHBondContact O-N 3.24Å; A267-R271 PolarHBondContact O-NE 2.93Å; A267-R271 VanDerWaalsContact O-NE 3.13Å
268	K	82.1	Confident	84.2	Confident	129 Å²	129	57.1 Å²	57.1	56%	0.561	28%	0.275	S	S	*	.	H	α-helix	trans	-77.5	-51.8	177.2	-169.5	-172.2	175.2	-160.3	0	110.2	N266 K270 R271 E272	N266-K268 PolarHBondContact O-N 3.48Å; N266-K268 WeakPolarHBondContact OD1-CB 3.46Å; N266-K268 PolarHBondContact OD1-N 3.2Å; K268-K270 VanDerWaalsContact C-N 3.32Å; K268-K270 PolarHBondContact O-N 3.3Å; K268-R271 PolarHBondContact O-N 3.43Å; K268-R271 VanDerWaalsContact O-N 3.11Å; K268-E272 VanDerWaalsContact CE-OE1 3.22Å; K268-E272 WeakPolarHBondContact CE-OE1 3.41Å; K268-E272 IonicContact NZ-OE1 3.8Å; K268-E272 WeakPolarHBondContact O-CG 3.4Å; K268-E272 PolarHBondContact O-N 3.5Å
269	I	84.5	Confident	84.8	Confident	34 Å²	34	57.5 Å²	57.5	17%	0.174	28%	0.277	C	S	.	.	H	α-helix	trans	-62.9	-38	177.3	-69.1	164.9	0	0	0	110.7	A264 E265 N266 R271 E272 W273	A264-I269 HydrophobicContact CB-CB 4.41Å; A264-I269 HydrophobicContact CB-CG2 4.1Å; E265-I269 HydrophobicContact CB-CD1 4.05Å; N266-I269 WeakPolarHBondContact ND2-CD1 3.41Å; N266-I269 PolarHBondContact O-N 2.98Å; N266-I269 VanDerWaalsContact OD1-CB 3.31Å; N266-I269 WeakPolarHBondContact OD1-CB 3.27Å; N266-I269 WeakPolarHBondContact OD1-CD1 3.44Å; N266-I269 WeakPolarHBondContact OD1-CG1 3.48Å; N266-I269 PolarHBondContact OD1-N 3.46Å; I269-R271 VanDerWaalsContact C-N 3.35Å; I269-R271 PolarHBondContact O-N 3.37Å; I269-E272 PolarHBondContact O-N 3.29Å; I269-W273 WeakPolarHBondContact O-CB 3.35Å; I269-W273 PolarHBondContact O-N 2.83Å
270	K	83.9	Confident	84.9	Confident	11 Å²	11	56.3 Å²	56.3	5%	0.048	27%	0.268	C	S	.	.	H	α-helix	trans	-57.6	-46.4	171.9	172.6	172.6	165.6	178.1	0	112.1	N240 V241 D243 D249 M250 F251 A264 N266 K268 W273 L274	N240-K270 WeakPolarHBondContact OD1-CE 3.26Å; N240-K270 PolarHBondContact OD1-NZ 3.07Å; V241-K270 PolarHBondContact O-NZ 2.9Å; D243-K270 IonicContact OD1-NZ 2.84Å; D243-K270 PolarHBondContact OD1-NZ 3.45Å; D249-K270 VanDerWaalsContact C-CD 3.46Å; D249-K270 HydrophobicContact CB-CD 4.43Å; M250-K270 WeakPolarHBondContact O-CE 3.43Å; M250-K270 PolarHBondContact O-NZ 2.86Å; F251-K270 HydrophobicContact CD1-CG 4.43Å; A264-K270 HydrophobicContact CB-CB 3.83Å; N266-K270 PolarHBondContact O-N 2.91Å; K268-K270 VanDerWaalsContact C-N 3.32Å; K268-K270 PolarHBondContact O-N 3.3Å; K270-W273 PolarHBondContact O-N 3.21Å; K270-L274 HydrophobicContact CG-CD1 4.19Å; K270-L274 VanDerWaalsContact O-CG 3.28Å; K270-L274 WeakPolarHBondContact O-CG 3.5Å; K270-L274 PolarHBondContact O-N 3.42Å; K270-L274 VanDerWaalsContact O-N 3.07Å
271	R	83.9	Confident	84.9	Confident	162 Å²	162	59.5 Å²	59.5	61%	0.611	28%	0.282	S	S	*	.	H	α-helix	trans	-65.8	-42.7	178.2	-77.2	-176.8	-67	153.1	-0.8	111.5	A267 K268 I269 L274 E275	A267-R271 WeakPolarHBondContact O-CG 3.48Å; A267-R271 PolarHBondContact O-N 3.24Å; A267-R271 PolarHBondContact O-NE 2.93Å; A267-R271 VanDerWaalsContact O-NE 3.13Å; K268-R271 PolarHBondContact O-N 3.43Å; K268-R271 VanDerWaalsContact O-N 3.11Å; I269-R271 VanDerWaalsContact C-N 3.35Å; I269-R271 PolarHBondContact O-N 3.37Å; R271-L274 PolarHBondContact O-N 3.35Å; R271-E275 VanDerWaalsContact O-CB 3.26Å; R271-E275 WeakPolarHBondContact O-CB 3.39Å; R271-E275 PolarHBondContact O-N 2.86Å
272	E	85.4	Confident	84.7	Confident	58 Å²	58	66.1 Å²	66.1	27%	0.271	31%	0.307	S	S	.	.	H	α-helix	trans	-58.9	-47.3	175.1	-70.8	173.8	-166.2	0	0	111.4	Y185 K268 I269 L274 E275 V276	Y185-E272 PolarHBondContact OH-OE2 3.1Å; K268-E272 VanDerWaalsContact CE-OE1 3.22Å; K268-E272 WeakPolarHBondContact CE-OE1 3.41Å; K268-E272 IonicContact NZ-OE1 3.8Å; K268-E272 WeakPolarHBondContact O-CG 3.4Å; K268-E272 PolarHBondContact O-N 3.5Å; I269-E272 PolarHBondContact O-N 3.29Å; E272-L274 PolarHBondContact O-N 2.91Å; E272-E275 PolarHBondContact O-N 3.2Å; E272-V276 WeakPolarHBondContact O-CB 3.32Å; E272-V276 WeakPolarHBondContact O-CG2 3.23Å; E272-V276 PolarHBondContact O-N 3.11Å
273	W	87.7	Confident	84.4	Confident	2 Å²	2	68.7 Å²	68.7	1%	0.008	33%	0.328	C	S	.	.	H	α-helix	trans	-58.8	-47	175.9	-92.2	109	0	0	0	112.7	Y185 L189 L207 L212 F251 I269 K270 L277	Y185-W273 AromaticContact CD1-CD2 3.89Å; Y185-W273 HydrophobicContact CD1-CD2 3.89Å; Y185-W273 AromaticContact CD1-CE2 3.79Å; Y185-W273 HydrophobicContact CD1-CE3 4.01Å; Y185-W273 AromaticContact CD1-CH2 3.95Å; Y185-W273 HydrophobicContact CD1-CH2 3.95Å; Y185-W273 AromaticContact CD1-CZ2 3.83Å; Y185-W273 HydrophobicContact CD1-CZ2 3.83Å; Y185-W273 HydrophobicContact CD1-CZ3 4.04Å; Y185-W273 AromaticContact CE1-CD1 3.94Å; Y185-W273 AromaticContact CE1-CD2 3.78Å; Y185-W273 HydrophobicContact CE1-CD2 3.78Å; Y185-W273 AromaticContact CE1-CE2 3.54Å; Y185-W273 HydrophobicContact CE1-CE3 4.36Å; Y185-W273 HydrophobicContact CE1-CG 4.05Å; Y185-W273 AromaticContact CE1-CZ2 3.95Å; Y185-W273 HydrophobicContact CE1-CZ2 3.95Å; Y185-W273 AromaticContact CE1-NE1 3.65Å; L189-W273 HydrophobicContact CD1-CZ2 4.11Å; L207-W273 HydrophobicContact CB-CZ3 4.09Å; L212-W273 HydrophobicContact CD1-CH2 4.27Å; L212-W273 HydrophobicContact CD1-CZ3 3.89Å; F251-W273 HydrophobicContact CE1-CB 4.36Å; F251-W273 HydrophobicContact CZ-CB 4.44Å; F251-W273 HydrophobicContact CZ-CG 4.46Å; I269-W273 WeakPolarHBondContact O-CB 3.35Å; I269-W273 PolarHBondContact O-N 2.83Å; K270-W273 PolarHBondContact O-N 3.21Å; W273-L277 HydrophobicContact CE3-CD1 4.03Å; W273-L277 HydrophobicContact CE3-CG 4.21Å; W273-L277 WeakPolarHBondContact O-CB 3.46Å; W273-L277 WeakPolarHBondContact O-CD1 3.33Å; W273-L277 WeakPolarHBondContact O-CG 3.43Å; W273-L277 PolarHBondContact O-N 3.35Å
274	L	85.8	Confident	84.1	Confident	31 Å²	31	68.2 Å²	68.2	16%	0.162	33%	0.327	C	S	.	.	H	α-helix	trans	-64.3	-44.2	179.7	-69.2	176.1	0	0	0	111.9	V238 N240 F251 K270 R271 E272 E278	V238-L274 HydrophobicContact CG1-CD2 3.29Å; N240-L274 HydrophobicContact CB-CD1 3.85Å; F251-L274 HydrophobicContact CB-CD2 4.02Å; F251-L274 HydrophobicContact CG-CD2 4.33Å; K270-L274 HydrophobicContact CG-CD1 4.19Å; K270-L274 VanDerWaalsContact O-CG 3.28Å; K270-L274 WeakPolarHBondContact O-CG 3.5Å; K270-L274 PolarHBondContact O-N 3.42Å; K270-L274 VanDerWaalsContact O-N 3.07Å; R271-L274 PolarHBondContact O-N 3.35Å; E272-L274 PolarHBondContact O-N 2.91Å; L274-E278 WeakPolarHBondContact O-CB 3.36Å; L274-E278 PolarHBondContact O-N 2.98Å
275	E	86.8	Confident	83.7	Confident	130 Å²	130	71.3 Å²	71.3	61%	0.607	35%	0.348	S	S	*	.	H	α-helix	trans	-64.5	-49.1	-179.8	-175	171.6	-167.7	0	0	111.1	R271 E272 L277 E278 E279	R271-E275 VanDerWaalsContact O-CB 3.26Å; R271-E275 WeakPolarHBondContact O-CB 3.39Å; R271-E275 PolarHBondContact O-N 2.86Å; E272-E275 PolarHBondContact O-N 3.2Å; E275-L277 PolarHBondContact O-N 3.4Å; E275-E278 PolarHBondContact O-N 3.08Å; E275-E279 WeakPolarHBondContact O-CB 3.49Å; E275-E279 PolarHBondContact O-N 2.86Å
276	V	86.4	Confident	83.7	Confident	26 Å²	26	68.4 Å²	68.4	16%	0.158	34%	0.335	C	S	.	.	H	α-helix	trans	-68.5	-37	-179.3	-178.4	0	0	0	0	111.6	V184 Y185 L207 E272 T280	V184-V276 HydrophobicContact CG1-CG1 3.64Å; Y185-V276 HydrophobicContact CG-CG1 4.48Å; L207-V276 HydrophobicContact CD2-CB 4.49Å; L207-V276 HydrophobicContact CD2-CG1 3.72Å; E272-V276 WeakPolarHBondContact O-CB 3.32Å; E272-V276 WeakPolarHBondContact O-CG2 3.23Å; E272-V276 PolarHBondContact O-N 3.11Å; V276-T280 WeakPolarHBondContact O-CB 3.25Å; V276-T280 PolarHBondContact O-N 3.37Å; V276-T280 PolarHBondContact O-OG1 3.1Å
277	L	84.9	Confident	83.5	Confident	4 Å²	4	71.1 Å²	71.1	2%	0.021	34%	0.343	C	S	.	.	H	α-helix	trans	-64.1	-42.6	174.5	-79	166.5	0	0	0	111.8	L207 L212 L233 L236 V238 W273 E275 K281	L207-L277 HydrophobicContact CD1-CD2 3.63Å; L207-L277 HydrophobicContact CD2-CD2 3.8Å; L207-L277 HydrophobicContact CD2-CG 4.14Å; L207-L277 HydrophobicContact CG-CD2 4.32Å; L212-L277 HydrophobicContact CD2-CD2 4.31Å; L233-L277 HydrophobicContact CD2-CD2 4.44Å; L236-L277 HydrophobicContact CD2-CD2 4.28Å; V238-L277 HydrophobicContact CG1-CD1 4.37Å; V238-L277 HydrophobicContact CG2-CB 4.41Å; V238-L277 HydrophobicContact CG2-CD1 4.18Å; W273-L277 HydrophobicContact CE3-CD1 4.03Å; W273-L277 HydrophobicContact CE3-CG 4.21Å; W273-L277 WeakPolarHBondContact O-CB 3.46Å; W273-L277 WeakPolarHBondContact O-CD1 3.33Å; W273-L277 WeakPolarHBondContact O-CG 3.43Å; W273-L277 PolarHBondContact O-N 3.35Å; E275-L277 PolarHBondContact O-N 3.4Å; L277-K281 WeakPolarHBondContact O-CB 3.29Å; L277-K281 PolarHBondContact O-N 3.01Å
278	E	84.3	Confident	83.3	Confident	106 Å²	106	75.8 Å²	75.8	50%	0.495	35%	0.352	S	S	.	.	H	α-helix	trans	-69	-41.5	178.5	-168.9	173.6	-179.7	0	0	111.8	L274 E275 K281 R282	L274-E278 WeakPolarHBondContact O-CB 3.36Å; L274-E278 PolarHBondContact O-N 2.98Å; E275-E278 PolarHBondContact O-N 3.08Å; E278-K281 PolarHBondContact O-N 3.43Å; E278-R282 WeakPolarHBondContact O-CB 3.41Å; E278-R282 WeakPolarHBondContact O-CG 3.33Å; E278-R282 PolarHBondContact O-N 2.92Å; E278-R282 IonicContact OE1-CZ 3.36Å; E278-R282 IonicContact OE1-NE 3.89Å; E278-R282 IonicContact OE1-NH2 3.53Å; E278-R282 PolarHBondContact OE1-NH2 3.37Å
279	E	84.9	Confident	83.1	Confident	128 Å²	128	75.7 Å²	75.7	60%	0.598	35%	0.348	S	S	*	.	H	α-helix	trans	-62.6	-45	175.9	-171.4	176.2	-163.3	0	0	111.6	E275 K281 R282 A283	E275-E279 WeakPolarHBondContact O-CB 3.49Å; E275-E279 PolarHBondContact O-N 2.86Å; E279-K281 PolarHBondContact O-N 2.69Å; E279-R282 PolarHBondContact O-N 3.47Å; E279-A283 WeakPolarHBondContact O-CB 3.36Å; E279-A283 PolarHBondContact O-N 3.3Å
280	T	83.9	Confident	82.8	Confident	12 Å²	12	81.3 Å²	81.3	7%	0.074	37%	0.367	C	S	.	.	H	α-helix	trans	-64.4	-40.9	178.1	-50.8	0	0	0	0	111.2	V184 L233 V276 A283 L284	V184-T280 HydrophobicContact CG2-CG2 4.31Å; L233-T280 HydrophobicContact CD1-CG2 3.61Å; V276-T280 WeakPolarHBondContact O-CB 3.25Å; V276-T280 PolarHBondContact O-N 3.37Å; V276-T280 PolarHBondContact O-OG1 3.1Å; T280-A283 PolarHBondContact O-N 2.94Å; T280-L284 PolarHBondContact O-N 3.03Å
281	K	83.4	Confident	82.2	Confident	90 Å²	90	85.6 Å²	85.6	39%	0.391	39%	0.387	S	S	.	.	H	α-helix	trans	-65.5	-40.5	176.4	-171.2	175.5	-176.9	175.5	0	112.3	L236 L277 E278 E279 L284 S285	L236-K281 PolarHBondContact O-NZ 3.14Å; L277-K281 WeakPolarHBondContact O-CB 3.29Å; L277-K281 PolarHBondContact O-N 3.01Å; E278-K281 PolarHBondContact O-N 3.43Å; E279-K281 PolarHBondContact O-N 2.69Å; K281-L284 PolarHBondContact O-N 2.93Å; K281-S285 PolarHBondContact O-N 2.64Å
282	R	82.3	Confident	81.4	Confident	147 Å²	147	84.2 Å²	84.2	56%	0.555	39%	0.388	S	S	*	.	H	α-helix	trans	-63.2	-47.2	174.3	-74.8	178.9	-171.6	-171.4	5.5	111	E278 E279 L284 S285 E286	E278-R282 WeakPolarHBondContact O-CB 3.41Å; E278-R282 WeakPolarHBondContact O-CG 3.33Å; E278-R282 PolarHBondContact O-N 2.92Å; E278-R282 IonicContact OE1-CZ 3.36Å; E278-R282 IonicContact OE1-NE 3.89Å; E278-R282 IonicContact OE1-NH2 3.53Å; E278-R282 PolarHBondContact OE1-NH2 3.37Å; E279-R282 PolarHBondContact O-N 3.47Å; R282-L284 VanDerWaalsContact C-N 3.31Å; R282-L284 PolarHBondContact O-N 3.24Å; R282-S285 PolarHBondContact O-N 3.32Å; R282-S285 VanDerWaalsContact O-N 3.14Å; R282-S285 PolarHBondContact O-OG 3.45Å; R282-E286 WeakPolarHBondContact O-CG 3.38Å; R282-E286 PolarHBondContact O-N 2.99Å
283	A	82.6	Confident	80.7	Confident	55 Å²	55	86.1 Å²	86.1	46%	0.455	40%	0.396	S	S	.	.	H	α-helix	trans	-58.8	-40.7	177.4	0	0	0	0	0	112.5	E279 T280 E286 K287	E279-A283 WeakPolarHBondContact O-CB 3.36Å; E279-A283 PolarHBondContact O-N 3.3Å; T280-A283 PolarHBondContact O-N 2.94Å; A283-E286 PolarHBondContact O-N 3.34Å; A283-K287 WeakPolarHBondContact O-CB 3.27Å; A283-K287 PolarHBondContact O-N 3.05Å
284	L	81	Confident	79.5	Confident	36 Å²	36	93.2 Å²	93.2	19%	0.188	43%	0.429	C	S	.	.	H	α-helix	trans	-63	-44.9	174.9	-170.1	73.4	0	0	0	111.7	L233 T280 K281 R282 E286 K287 R288	L233-L284 HydrophobicContact CB-CD2 3.93Å; T280-L284 PolarHBondContact O-N 3.03Å; K281-L284 PolarHBondContact O-N 2.93Å; R282-L284 VanDerWaalsContact C-N 3.31Å; R282-L284 PolarHBondContact O-N 3.24Å; L284-E286 PolarHBondContact O-N 2.83Å; L284-K287 PolarHBondContact O-N 2.86Å; L284-R288 WeakPolarHBondContact O-CB 3.35Å; L284-R288 PolarHBondContact O-N 3.27Å
285	S	77.9	Confident	78.2	Confident	70 Å²	70	95.9 Å²	95.9	49%	0.49	46%	0.456	S	S	.	.	H	α-helix	trans	-65.4	-37.1	178.3	72.4	0	0	0	0	113	K281 R282 R289	K281-S285 PolarHBondContact O-N 2.64Å; R282-S285 PolarHBondContact O-N 3.32Å; R282-S285 VanDerWaalsContact O-N 3.14Å; R282-S285 PolarHBondContact O-OG 3.45Å; S285-R289 WeakPolarHBondContact O-CB 3.31Å; S285-R289 PolarHBondContact O-N 2.86Å
286	E	81.4	Confident	76.8	Confident	100 Å²	100	93.6 Å²	93.6	47%	0.467	46%	0.46	S	S	.	.	H	α-helix	trans	-70.8	-40.6	176.4	-74.7	-177.9	179.6	0	0	112.1	R282 A283 L284 R288 R289 R290	R282-E286 WeakPolarHBondContact O-CG 3.38Å; R282-E286 PolarHBondContact O-N 2.99Å; A283-E286 PolarHBondContact O-N 3.34Å; L284-E286 PolarHBondContact O-N 2.83Å; E286-R288 VanDerWaalsContact C-N 3.34Å; E286-R289 PolarHBondContact O-N 2.65Å; E286-R290 WeakPolarHBondContact O-CG 3.41Å; E286-R290 PolarHBondContact O-N 2.91Å
287	K	79.9	Confident	74.9	Confident	118 Å²	118	95 Å²	95	51%	0.513	47%	0.474	S	S	.	.	H	α-helix	trans	-59.8	-45.5	173.7	-173	-177.9	177.1	-170.4	0	110.8	A283 L284 R289 R290 E291	A283-K287 WeakPolarHBondContact O-CB 3.27Å; A283-K287 PolarHBondContact O-N 3.05Å; L284-K287 PolarHBondContact O-N 2.86Å; K287-R289 PolarHBondContact O-N 2.65Å; K287-R290 PolarHBondContact O-N 3.33Å; K287-E291 VanDerWaalsContact CE-OE1 3.22Å; K287-E291 WeakPolarHBondContact CE-OE1 3.38Å; K287-E291 WeakPolarHBondContact O-CG 3.45Å; K287-E291 PolarHBondContact O-N 2.87Å
288	R	76.6	Confident	73	Confident	142 Å²	142	101 Å²	101	54%	0.536	51%	0.513	S	S	.	.	H	α-helix	trans	-66.2	-38.2	178.6	-161.6	179.9	-167.3	-166.5	4.2	112.9	L284 E286 R290 E291 Q292	L284-R288 WeakPolarHBondContact O-CB 3.35Å; L284-R288 PolarHBondContact O-N 3.27Å; E286-R288 VanDerWaalsContact C-N 3.34Å; R288-R290 VanDerWaalsContact C-N 3.34Å; R288-E291 PolarHBondContact O-N 3.28Å; R288-Q292 WeakPolarHBondContact O-CB 3.2Å; R288-Q292 PolarHBondContact O-N 3.45Å
289	R	78.3	Confident	71	Confident	128 Å²	128	107.5 Å²	107.5	48%	0.483	53%	0.533	S	S	.	.	H	α-helix	trans	-62.8	-41.7	173.7	-171.8	178.2	66.8	88.3	0.1	111.1	S285 E286 K287 Q292 E293	S285-R289 WeakPolarHBondContact O-CB 3.31Å; S285-R289 PolarHBondContact O-N 2.86Å; E286-R289 PolarHBondContact O-N 2.65Å; K287-R289 PolarHBondContact O-N 2.65Å; R289-Q292 PolarHBondContact O-N 2.87Å; R289-E293 WeakPolarHBondContact CG-OE1 3.42Å; R289-E293 IonicContact CZ-OE1 3.11Å; R289-E293 IonicContact CZ-OE2 3.2Å; R289-E293 VanDerWaalsContact NH1-CD 3.31Å; R289-E293 IonicContact NH1-OE1 2.65Å; R289-E293 PolarHBondContact NH1-OE1 3.21Å; R289-E293 IonicContact NH1-OE2 3.79Å; R289-E293 PolarHBondContact NH1-OE2 3.33Å; R289-E293 WeakPolarHBondContact O-CB 3.45Å; R289-E293 VanDerWaalsContact O-CG 3.27Å; R289-E293 WeakPolarHBondContact O-CG 3.28Å; R289-E293 PolarHBondContact O-N 3.29Å
290	R	76.6	Confident	68.7	Low	152 Å²	152	104.3 Å²	104.3	57%	0.574	54%	0.535	S	S	*	.	H	α-helix	trans	-64.8	-42.6	174.1	-74.7	-179.3	-178.7	162.6	4.8	112.4	E286 K287 R288 Q292 E293 E294	E286-R290 WeakPolarHBondContact O-CG 3.41Å; E286-R290 PolarHBondContact O-N 2.91Å; K287-R290 PolarHBondContact O-N 3.33Å; R288-R290 VanDerWaalsContact C-N 3.34Å; R290-Q292 VanDerWaalsContact C-N 3.33Å; R290-Q292 PolarHBondContact O-N 2.82Å; R290-E293 PolarHBondContact O-N 3.08Å; R290-E294 WeakPolarHBondContact O-CB 3.45Å; R290-E294 WeakPolarHBondContact O-CG 3.22Å; R290-E294 PolarHBondContact O-N 3.26Å
291	E	72.8	Confident	66.6	Low	101 Å²	101	109.9 Å²	109.9	47%	0.472	57%	0.571	S	S	.	*	H	α-helix	trans	-64	-36.9	175.7	-72.5	170.8	179.3	0	0	112.1	K287 R288 A295	K287-E291 VanDerWaalsContact CE-OE1 3.22Å; K287-E291 WeakPolarHBondContact CE-OE1 3.38Å; K287-E291 WeakPolarHBondContact O-CG 3.45Å; K287-E291 PolarHBondContact O-N 2.87Å; R288-E291 PolarHBondContact O-N 3.28Å; E291-A295 VanDerWaalsContact O-CB 3.23Å; E291-A295 WeakPolarHBondContact O-CB 3.38Å; E291-A295 PolarHBondContact O-N 3.1Å
292	Q	66	Low	64.5	Low	133 Å²	133	111.4 Å²	111.4	62%	0.621	59%	0.59	S	S	*	*	H	α-helix	trans	-69.3	-38.2	171.9	-92.4	179.9	-14.7	0	0	112.9	R288 R289 R290 A295 A296	R288-Q292 WeakPolarHBondContact O-CB 3.2Å; R288-Q292 PolarHBondContact O-N 3.45Å; R289-Q292 PolarHBondContact O-N 2.87Å; R290-Q292 VanDerWaalsContact C-N 3.33Å; R290-Q292 PolarHBondContact O-N 2.82Å; Q292-A295 PolarHBondContact O-N 3.47Å; Q292-A296 WeakPolarHBondContact O-CB 3.49Å; Q292-A296 PolarHBondContact O-N 3.35Å
293	E	70.6	Confident	62.1	Low	98 Å²	98	113.4 Å²	113.4	46%	0.458	61%	0.606	S	S	.	*	H	α-helix	trans	-70.5	-36.6	176.7	-76.5	170.4	-178.3	0	0	112	R289 R290 A296 A297	R289-E293 WeakPolarHBondContact CG-OE1 3.42Å; R289-E293 IonicContact CZ-OE1 3.11Å; R289-E293 IonicContact CZ-OE2 3.2Å; R289-E293 VanDerWaalsContact NH1-CD 3.31Å; R289-E293 IonicContact NH1-OE1 2.65Å; R289-E293 PolarHBondContact NH1-OE1 3.21Å; R289-E293 IonicContact NH1-OE2 3.79Å; R289-E293 PolarHBondContact NH1-OE2 3.33Å; R289-E293 WeakPolarHBondContact O-CB 3.45Å; R289-E293 VanDerWaalsContact O-CG 3.27Å; R289-E293 WeakPolarHBondContact O-CG 3.28Å; R289-E293 PolarHBondContact O-N 3.29Å; R290-E293 PolarHBondContact O-N 3.08Å; E293-A296 CarbonylContact O-C 3.5Å; E293-A296 PolarHBondContact O-N 2.9Å; E293-A297 PolarHBondContact O-N 2.65Å
294	E	63.6	Low	59.9	Low	150 Å²	150	116.7 Å²	116.7	70%	0.701	62%	0.619	S	S	*	*	H	α-helix	trans	-71.4	-34.2	173.2	-75.8	178.7	171.9	0	0	112.2	R290 A296	R290-E294 WeakPolarHBondContact O-CB 3.45Å; R290-E294 WeakPolarHBondContact O-CG 3.22Å; R290-E294 PolarHBondContact O-N 3.26Å; E294-A296 VanDerWaalsContact C-N 3.31Å
295	A	58	Low	57.5	Low	88 Å²	88	121.8 Å²	121.8	73%	0.727	65%	0.653	S	S	*	*	H	α-helix	trans	-72	-24.3	171.2	0	0	0	0	0	113.1	E291 Q292	E291-A295 VanDerWaalsContact O-CB 3.23Å; E291-A295 WeakPolarHBondContact O-CB 3.38Å; E291-A295 PolarHBondContact O-N 3.1Å; Q292-A295 PolarHBondContact O-N 3.47Å
296	A	56.5	Low	55.3	Low	82 Å²	82	122.9 Å²	122.9	68%	0.678	66%	0.66	S	S	*	*	S	Bend	trans	-94.2	-3.6	178.4	0	0	0	0	0	114.1	Q292 E293 E294	Q292-A296 WeakPolarHBondContact O-CB 3.49Å; Q292-A296 PolarHBondContact O-N 3.35Å; E293-A296 CarbonylContact O-C 3.5Å; E293-A296 PolarHBondContact O-N 2.9Å; E294-A296 VanDerWaalsContact C-N 3.31Å
297	A	46.4	Very low	53.1	Low	56 Å²	56	127.1 Å²	127.1	46%	0.463	68%	0.677	S	S	.	*	S	Bend	trans	-68.4	135.4	174.4	0	0	0	0	0	110.8	E293 R299	E293-A297 PolarHBondContact O-N 2.65Å; A297-R299 PolarHBondContact O-N 3.35Å
298	P	46.5	Very low	50.9	Low	128 Å²	128	126.4 Å²	126.4	83%	0.831	69%	0.693	S	S	*	*			trans	-68.5	110.3	-171.8	26.1	-31.4	0	0	0	110.5
299	R	41.2	Very low	48.7	Very low	244 Å²	244	125.3 Å²	125.3	92%	0.921	70%	0.702	S	S	*	*			trans	-59.4	136.4	155	-74.6	-176.2	172.1	170.3	-1	107.5	A297	A297-R299 PolarHBondContact O-N 3.35Å
300	G	37	Very low	46.9	Very low	61 Å²	61	126.1 Å²	126.1	63%	0.629	72%	0.716	S	S	*	*			trans	-54.3	176	-168.5	0	0	0	0	0	116.4
301	P	39.8	Very low	45.1	Very low	128 Å²	128	124.2 Å²	124.2	83%	0.831	72%	0.724	S	S	*	*	P	Polyproline II helix	trans	-62	143.7	-159.2	24.9	-33	0	0	0	112.7	Q303	P301-Q303 PolarHBondContact O-N 3.44Å
302	P	39.2	Very low	43.3	Very low	122 Å²	122	128.3 Å²	128.3	79%	0.792	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-65.4	123.1	176.9	25.7	-30.7	0	0	0	109.7	V304	P302-V304 PolarHBondContact O-N 2.89Å
303	Q	31.2	Very low	41.7	Very low	190 Å²	190	131.5 Å²	131.5	89%	0.888	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-62.2	118.4	167.4	-117.8	178.9	-20.2	0	0	108.6	P301 T305	P301-Q303 PolarHBondContact O-N 3.44Å; Q303-T305 PolarHBondContact O-N 2.71Å
304	V	37.5	Very low	40	Very low	123 Å²	123	134.1 Å²	134.1	75%	0.745	77%	0.772	S	S	*	*			trans	-58.6	111.1	170.1	-168.8	0	0	0	0	108	P302 S306	P302-V304 PolarHBondContact O-N 2.89Å; V304-S306 PolarHBondContact O-N 2.93Å
305	T	30	Very low	38.5	Very low	144 Å²	144	133.5 Å²	133.5	88%	0.883	77%	0.774	S	S	*	*			trans	-77.2	81.6	160.2	53.3	0	0	0	0	107.3	Q303	Q303-T305 PolarHBondContact O-N 2.71Å
306	S	31.4	Very low	37.3	Very low	93 Å²	93	137.2 Å²	137.2	65%	0.65	78%	0.776	S	S	*	*			trans	-65	134	166.9	49.8	0	0	0	0	109.5	V304 A308	V304-S306 PolarHBondContact O-N 2.93Å; S306-A308 PolarHBondContact O-N 2.9Å
307	K	36.4	Very low	36.1	Very low	189 Å²	189	142.1 Å²	142.1	82%	0.822	79%	0.785	S	S	*	*			trans	-33.5	123	158.9	-65.1	173.9	174.5	-178.5	0	111.1	T309	K307-T309 PolarHBondContact O-N 3.46Å
308	A	32.9	Very low	35.4	Very low	102 Å²	102	147.9 Å²	147.9	84%	0.843	80%	0.802	S	S	*	*			trans	-88	89.5	156.3	0	0	0	0	0	107	S306	S306-A308 PolarHBondContact O-N 2.9Å
309	T	31.1	Very low	34.6	Very low	119 Å²	119	150.3 Å²	150.3	73%	0.73	80%	0.803	S	S	*	*			trans	-85.7	116	161.7	-52.2	0	0	0	0	106.5	K307	K307-T309 PolarHBondContact O-N 3.46Å
310	N	39.3	Very low	34.6	Very low	145 Å²	145	143.9 Å²	143.9	78%	0.775	79%	0.792	S	S	*	*			trans	-62.5	136.5	174.9	-91.1	-22.4	0	0	0	110.7
311	P	39.4	Very low	34.8	Very low	113 Å²	113	145.8 Å²	145.8	73%	0.734	80%	0.802	S	S	*	*	S	Bend	trans	-100	35.5	-172.7	39.6	-35.6	0	0	0	114.3
312	F	34.6	Very low	34.4	Very low	186 Å²	186	146.4 Å²	146.4	82%	0.816	80%	0.803	S	S	*	*			trans	-149.1	97	170.8	-82.9	-84.9	0	0	0	108.8
313	E	33	Very low	34.5	Very low	200 Å²	200	146 Å²	146	94%	0.935	80%	0.801	S	S	*	*			trans	-177.2	110.9	144	-102.5	164.6	-170	0	0	107.9
314	D	34.2	Very low	34.6	Very low	153 Å²	153	146.5 Å²	146.5	82%	0.818	80%	0.803	S	S	*	*			trans	-73.7	161.8	163.9	-83.1	-47.9	0	0	0	109.7
315	D	32.6	Very low	34.5	Very low	137 Å²	137	147 Å²	147	73%	0.733	81%	0.806	S	S	*	*			trans	95.1	106.8	159	-60.5	-31.6	0	0	0	119.7
316	E	34.1	Very low	34.9	Very low	167 Å²	167	149 Å²	149	78%	0.78	81%	0.806	S	S	*	*				93.3	133.2	126.3	-69.5	-179.5	173	0	0	121.7
317	E	31.4	Very low	35.1	Very low	184 Å²	184	153.4 Å²	153.4	86%	0.86	82%	0.816	S	S	*	*			trans	102.7	142.6	149.9	-73.9	176.3	-177	0	0	122.3
318	E	30.7	Very low	35.3	Very low	178 Å²	178	153.1 Å²	153.1	83%	0.832	82%	0.817	S	S	*	*			trans	-96.4	152.3	-152.3	-69.4	168	139.3	0	0	114.8
319	E	29.9	Very low	35.6	Very low	179 Å²	179	155.9 Å²	155.9	84%	0.836	82%	0.818	S	S	*	*			trans	60.7	165.8	143.5	-77.5	-165.3	-178.7	0	0	122.1
320	P	40.6	Very low	36.4	Very low	108 Å²	108	151.3 Å²	151.3	70%	0.701	79%	0.79	S	S	*	*			cis	-131.2	177.5	-25.5	28.1	-6.2	0	0	0	114.3
321	A	41.7	Very low	36.9	Very low	102 Å²	102	149.3 Å²	149.3	84%	0.843	78%	0.779	S	S	*	*			trans	-69.8	151.3	179.5	0	0	0	0	0	115.4
322	V	32	Very low	37.6	Very low	141 Å²	141	146 Å²	146	86%	0.855	76%	0.755	S	S	*	*			trans	-125.3	143.1	167	-116.6	0	0	0	0	109.7
323	P	40.1	Very low	38.4	Very low	114 Å²	114	140.8 Å²	140.8	74%	0.74	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-87	153.2	-157.1	35	-33.5	0	0	0	113.9	V325	P323-V325 PolarHBondContact O-N 3.15Å
324	E	34.4	Very low	39.5	Very low	199 Å²	199	135.5 Å²	135.5	93%	0.93	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-59.9	125	174	-66.3	173.2	157.1	0	0	111.2
325	V	34.6	Very low	40.7	Very low	135 Å²	135	134.7 Å²	134.7	82%	0.818	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-93.6	124.3	168.6	-171.3	0	0	0	0	107.3	P323 E327	P323-V325 PolarHBondContact O-N 3.15Å; V325-E327 PolarHBondContact O-N 3.46Å
326	E	37.8	Very low	42.5	Very low	186 Å²	186	132 Å²	132	87%	0.869	69%	0.689	S	S	*	*	P	Polyproline II helix	trans	-53.1	116.7	177.2	-64.2	174	155.9	0	0	110.6	E328	E326-E328 PolarHBondContact O-N 3.3Å; E326-E328 VanDerWaalsContact O-N 3.15Å
327	E	36.6	Very low	44.2	Very low	185 Å²	185	124.3 Å²	124.3	86%	0.864	65%	0.654	S	S	*	*			trans	-65.8	109.6	172	-71.3	-175.1	157.9	0	0	109.2	V325 N329	V325-E327 PolarHBondContact O-N 3.46Å; E327-N329 PolarHBondContact O-N 3.42Å
328	E	40.3	Very low	46	Very low	182 Å²	182	121.8 Å²	121.8	85%	0.85	64%	0.642	S	S	*	*			trans	-58.4	104.9	165.2	-78.3	-174.8	156.8	0	0	109	E326 V330	E326-E328 PolarHBondContact O-N 3.3Å; E326-E328 VanDerWaalsContact O-N 3.15Å; E328-V330 PolarHBondContact O-N 2.97Å; E328-V330 VanDerWaalsContact O-N 3.07Å
329	N	40.5	Very low	48.1	Very low	161 Å²	161	115.7 Å²	115.7	86%	0.861	61%	0.613	S	S	*	*			trans	-57	112.4	172	-109	-53.9	0	0	0	109.4	E327 D331	E327-N329 PolarHBondContact O-N 3.42Å; N329-D331 PolarHBondContact O-N 3.45Å; N329-D331 VanDerWaalsContact O-N 3.08Å
330	V	47	Very low	50.4	Low	23 Å²	23	107.2 Å²	107.2	14%	0.139	57%	0.574	C	S	.	*			trans	-65.6	109	169.7	177.3	0	0	0	0	107.9	E328 L332 K370 P373	E328-V330 PolarHBondContact O-N 2.97Å; E328-V330 VanDerWaalsContact O-N 3.07Å; V330-L332 PolarHBondContact O-N 3.29Å; V330-K370 HydrophobicContact CG1-CD 3.81Å; V330-K370 HydrophobicContact CG2-CB 4.22Å; V330-K370 HydrophobicContact CG2-CD 4.24Å; V330-P373 HydrophobicContact CB-CG 4.36Å; V330-P373 HydrophobicContact CG2-CG 4.46Å
331	D	50.5	Low	52	Low	102 Å²	102	103 Å²	103	55%	0.545	55%	0.546	S	S	.	.			trans	-67.4	98	177.3	-169.4	8.4	0	0	0	111	N329 S333	N329-D331 PolarHBondContact O-N 3.45Å; N329-D331 VanDerWaalsContact O-N 3.08Å; D331-S333 WeakPolarHBondContact OD1-CB 3.49Å; D331-S333 PolarHBondContact OD1-N 3.45Å; D331-S333 PolarHBondContact OD1-OG 2.99Å
332	L	53.1	Low	53.8	Low	43 Å²	43	102.2 Å²	102.2	23%	0.225	53%	0.525	C	S	.	.			trans	-83.5	7.1	173.7	-74.4	157.8	0	0	0	112.9	V330 M334 P375 V376	V330-L332 PolarHBondContact O-N 3.29Å; L332-M334 PolarHBondContact O-N 3.43Å; L332-P375 HydrophobicContact CD1-CB 3.55Å; L332-P375 HydrophobicContact CD1-CG 3.34Å; L332-V376 HydrophobicContact CD1-CG2 4.14Å; L332-V376 HydrophobicContact CD2-CG2 3.84Å; L332-V376 HydrophobicContact CG-CG2 4.34Å
333	S	50.7	Low	56.1	Low	78 Å²	78	98.3 Å²	98.3	55%	0.545	50%	0.499	S	S	.	.			trans	-78.6	-0.3	179.7	-38.5	0	0	0	0	113.5	D331 E335	D331-S333 WeakPolarHBondContact OD1-CB 3.49Å; D331-S333 PolarHBondContact OD1-N 3.45Å; D331-S333 PolarHBondContact OD1-OG 2.99Å; S333-E335 PolarHBondContact O-N 2.88Å; S333-E335 VanDerWaalsContact O-N 3.1Å
334	M	57.5	Low	58	Low	88 Å²	88	93 Å²	93	43%	0.433	47%	0.465	S	S	.	.			trans	-66.5	112.5	178.9	-133.1	171.6	150.8	0	0	108.7	L332 W336 I337	L332-M334 PolarHBondContact O-N 3.43Å; M334-W336 PolarHBondContact O-N 2.7Å; M334-W336 VanDerWaalsContact O-N 3.1Å; M334-W336 PolarHBondContact SD-NE1 3.02Å; M334-I337 HydrophobicContact CB-CD1 4.01Å; M334-I337 HydrophobicContact CB-CG1 4.2Å; M334-I337 WeakPolarHBondContact O-CB 3.17Å; M334-I337 PolarHBondContact O-N 3.36Å
335	E	57.8	Low	60.2	Low	137 Å²	137	85.8 Å²	85.8	64%	0.64	43%	0.433	S	S	*	.	H	α-helix	trans	-53.6	-36.5	-169.4	-63.1	-174.9	149.1	0	0	113.1	S333 I337 Q338 E339	S333-E335 PolarHBondContact O-N 2.88Å; S333-E335 VanDerWaalsContact O-N 3.1Å; E335-I337 VanDerWaalsContact C-N 3.27Å; E335-I337 PolarHBondContact O-N 3.38Å; E335-Q338 PolarHBondContact O-N 2.92Å; E335-E339 WeakPolarHBondContact O-CG 3.27Å; E335-E339 PolarHBondContact O-N 2.77Å
336	W	71.5	Confident	62.4	Low	79 Å²	79	80.6 Å²	80.6	30%	0.299	40%	0.401	S	S	.	.	H	α-helix	trans	-64.9	-25.5	178.6	76.9	-87.7	0	0	0	114	M334 L340 Y366	M334-W336 PolarHBondContact O-N 2.7Å; M334-W336 VanDerWaalsContact O-N 3.1Å; M334-W336 PolarHBondContact SD-NE1 3.02Å; W336-L340 HydrophobicContact CE3-CD1 4.38Å; W336-L340 HydrophobicContact CZ3-CD1 4.27Å; W336-L340 WeakPolarHBondContact O-CB 3.23Å; W336-L340 PolarHBondContact O-N 2.97Å; W336-Y366 HydrophobicContact CH2-CG 4.46Å; W336-Y366 HydrophobicContact CZ2-CD1 4.16Å; W336-Y366 HydrophobicContact CZ2-CD2 4.46Å; W336-Y366 HydrophobicContact CZ2-CE1 4.5Å; W336-Y366 HydrophobicContact CZ2-CG 4.13Å
337	I	70.4	Confident	64.4	Low	7 Å²	7	72.5 Å²	72.5	4%	0.036	37%	0.365	C	S	.	.	H	α-helix	trans	-77.6	-33.1	177.8	-61.5	-179.5	0	0	0	110.5	M334 E335 Y366 L379	M334-I337 HydrophobicContact CB-CD1 4.01Å; M334-I337 HydrophobicContact CB-CG1 4.2Å; M334-I337 WeakPolarHBondContact O-CB 3.17Å; M334-I337 PolarHBondContact O-N 3.36Å; E335-I337 VanDerWaalsContact C-N 3.27Å; E335-I337 PolarHBondContact O-N 3.38Å; I337-Y366 HydrophobicContact CD1-CD1 4.02Å; I337-Y366 HydrophobicContact CD1-CE1 3.6Å; I337-L379 HydrophobicContact CG2-CD1 4.37Å; I337-L379 HydrophobicContact CG2-CD2 3.21Å; I337-L379 HydrophobicContact CG2-CG 4.4Å
338	Q	69.4	Low	66.3	Low	131 Å²	131	64.6 Å²	64.6	61%	0.612	33%	0.329	S	S	*	.	H	α-helix	trans	-74.1	-34.3	175.3	-62.8	-171.1	0.2	0	0	111.7	E335 P341	E335-Q338 PolarHBondContact O-N 2.92Å; Q338-P341 WeakPolarHBondContact O-CD 3.4Å
339	E	73.9	Confident	68	Low	50 Å²	50	56.7 Å²	56.7	23%	0.234	29%	0.294	C	S	.	.	H	α-helix	trans	-81.1	-19.9	177.5	-66.7	176.5	174.4	0	0	112.5	K60 E335 P341 E342 D343	K60-E339 WeakPolarHBondContact CE-OE1 3.5Å; K60-E339 IonicContact NZ-OE1 3.6Å; K60-E339 PolarHBondContact NZ-OE1 3.08Å; E335-E339 WeakPolarHBondContact O-CG 3.27Å; E335-E339 PolarHBondContact O-N 2.77Å; E339-P341 VanDerWaalsContact C-CD 3.5Å; E339-E342 WeakPolarHBondContact O-CA 3.47Å; E339-E342 WeakPolarHBondContact O-CB 3.39Å; E339-E342 PolarHBondContact O-N 3.32Å; E339-D343 PolarHBondContact O-N 2.82Å
340	L	78.2	Confident	69.6	Low	1 Å²	1	54.8 Å²	54.8	1%	0.005	28%	0.28	C	S	.	.	H	α-helix	trans	-51.1	-45.4	-177.3	-169.6	76.5	0	0	0	115.3	W336 E342 D343 L344 L359 L363 V383	W336-L340 HydrophobicContact CE3-CD1 4.38Å; W336-L340 HydrophobicContact CZ3-CD1 4.27Å; W336-L340 WeakPolarHBondContact O-CB 3.23Å; W336-L340 PolarHBondContact O-N 2.97Å; L340-E342 VanDerWaalsContact C-N 3.26Å; L340-E342 PolarHBondContact O-N 3.26Å; L340-D343 PolarHBondContact O-N 2.92Å; L340-L344 HydrophobicContact CG-CD1 4.31Å; L340-L344 WeakPolarHBondContact O-CB 3.35Å; L340-L344 VanDerWaalsContact O-CG 3.28Å; L340-L344 WeakPolarHBondContact O-CG 3.49Å; L340-L344 PolarHBondContact O-N 3.44Å; L340-L359 HydrophobicContact CD1-CB 3.98Å; L340-L359 HydrophobicContact CD1-CD2 4.22Å; L340-L363 HydrophobicContact CD2-CB 3.87Å; L340-L363 HydrophobicContact CD2-CD1 3.78Å; L340-L363 HydrophobicContact CD2-CD2 3.59Å; L340-L363 HydrophobicContact CD2-CG 3.9Å; L340-V383 HydrophobicContact CD2-CG2 4.31Å
341	P	75.1	Confident	70.9	Confident	20 Å²	20	58 Å²	58	13%	0.13	29%	0.29	C	S	.	.	H	α-helix	trans	-65.1	-32.1	178.2	-19.4	34	0	0	0	112.6	Q338 E339 D345 L379	Q338-P341 WeakPolarHBondContact O-CD 3.4Å; E339-P341 VanDerWaalsContact C-CD 3.5Å; P341-D345 PolarHBondContact O-N 2.64Å; P341-L379 HydrophobicContact CG-CD1 4.16Å
342	E	78	Confident	72.3	Confident	84 Å²	84	56.1 Å²	56.1	39%	0.393	28%	0.28	S	S	.	.	H	α-helix	trans	-76.2	-41	177.7	-59.6	-177.2	177.3	0	0	110.7	Y64 E339 L340 L344 D345 V346	Y64-E342 VanDerWaalsContact CE1-OE2 3.24Å; Y64-E342 WeakPolarHBondContact CE1-OE2 3.46Å; E339-E342 WeakPolarHBondContact O-CA 3.47Å; E339-E342 WeakPolarHBondContact O-CB 3.39Å; E339-E342 PolarHBondContact O-N 3.32Å; L340-E342 VanDerWaalsContact C-N 3.26Å; L340-E342 PolarHBondContact O-N 3.26Å; E342-L344 VanDerWaalsContact C-N 3.32Å; E342-L344 PolarHBondContact O-N 3.06Å; E342-D345 WeakPolarHBondContact O-CB 3.43Å; E342-D345 PolarHBondContact O-N 3.33Å; E342-D345 VanDerWaalsContact O-N 3.15Å; E342-V346 PolarHBondContact O-N 3.47Å
343	D	80.6	Confident	73.6	Confident	59 Å²	59	55.4 Å²	55.4	32%	0.316	28%	0.275	S	S	.	.	H	α-helix	trans	-62.9	-38.2	174.4	-72	-21.1	0	0	0	111.8	E339 L340 V346 C347 L359	E339-D343 PolarHBondContact O-N 2.82Å; L340-D343 PolarHBondContact O-N 2.92Å; D343-V346 WeakPolarHBondContact O-CB 3.07Å; D343-V346 PolarHBondContact O-N 3.35Å; D343-C347 PolarHBondContact O-N 3.07Å; D343-C347 PolarHBondContact O-SG 3.04Å; D343-C347 VanDerWaalsContact O-SG 3.37Å; D343-L359 HydrophobicContact CB-CD1 4.2Å
344	L	80	Confident	75.1	Confident	3 Å²	3	54.9 Å²	54.9	2%	0.016	26%	0.264	C	S	.	.	H	α-helix	trans	-63.1	-42.6	172.2	-75.3	169.7	0	0	0	111.7	L340 E342 V346 C347 I348 A356 L359 L360 V383	L340-L344 HydrophobicContact CG-CD1 4.31Å; L340-L344 WeakPolarHBondContact O-CB 3.35Å; L340-L344 VanDerWaalsContact O-CG 3.28Å; L340-L344 WeakPolarHBondContact O-CG 3.49Å; L340-L344 PolarHBondContact O-N 3.44Å; E342-L344 VanDerWaalsContact C-N 3.32Å; E342-L344 PolarHBondContact O-N 3.06Å; L344-V346 VanDerWaalsContact C-N 3.26Å; L344-V346 PolarHBondContact O-N 3.49Å; L344-C347 PolarHBondContact O-N 3.23Å; L344-I348 WeakPolarHBondContact O-CB 3.07Å; L344-I348 WeakPolarHBondContact O-CD1 3.23Å; L344-I348 WeakPolarHBondContact O-CG1 3.32Å; L344-I348 PolarHBondContact O-N 2.74Å; L344-A356 HydrophobicContact CD2-CB 4.11Å; L344-A356 WeakPolarHBondContact CD2-O 3.32Å; L344-L359 HydrophobicContact CD2-CB 4.29Å; L344-L360 HydrophobicContact CD1-CD2 3.83Å; L344-L360 HydrophobicContact CD2-CD1 4.44Å; L344-L360 HydrophobicContact CD2-CD2 4.2Å; L344-L360 HydrophobicContact CD2-CG 3.97Å; L344-V383 HydrophobicContact CD1-CG1 4.39Å
345	D	80.1	Confident	76.3	Confident	47 Å²	47	51.6 Å²	51.6	25%	0.251	25%	0.252	S	S	.	.	H	α-helix	trans	-62	-35	175.5	-80.2	-21.5	0	0	0	111.2	P341 E342 A349 R386	P341-D345 PolarHBondContact O-N 2.64Å; E342-D345 WeakPolarHBondContact O-CB 3.43Å; E342-D345 PolarHBondContact O-N 3.33Å; E342-D345 VanDerWaalsContact O-N 3.15Å; D345-A349 VanDerWaalsContact O-CB 3.3Å; D345-A349 WeakPolarHBondContact O-CB 3.28Å; D345-A349 PolarHBondContact O-N 2.85Å; D345-R386 IonicContact OD1-CZ 3.97Å; D345-R386 IonicContact OD1-NH1 2.83Å; D345-R386 PolarHBondContact OD1-NH1 2.96Å; D345-R386 IonicContact OD1-NH2 3.2Å; D345-R386 IonicContact OD2-CZ 2.69Å; D345-R386 IonicContact OD2-NH1 2.88Å; D345-R386 PolarHBondContact OD2-NH1 2.98Å; D345-R386 IonicContact OD2-NH2 2.68Å; D345-R386 PolarHBondContact OD2-NH2 2.88Å
346	V	80.5	Confident	77.5	Confident	26 Å²	26	45 Å²	45	16%	0.158	22%	0.221	C	C	.	.	H	α-helix	trans	-67.2	-49.6	172.4	172.6	0	0	0	0	112.1	Y67 I71 E342 D343 L344 I348 A349 Q350	Y67-V346 HydrophobicContact CE1-CG2 4.02Å; Y67-V346 HydrophobicContact CE2-CG2 4.31Å; Y67-V346 VanDerWaalsContact CZ-CG2 3.48Å; Y67-V346 WeakPolarHBondContact OH-CG2 3.28Å; I71-V346 HydrophobicContact CD1-CG2 4.17Å; E342-V346 PolarHBondContact O-N 3.47Å; D343-V346 WeakPolarHBondContact O-CB 3.07Å; D343-V346 PolarHBondContact O-N 3.35Å; L344-V346 VanDerWaalsContact C-N 3.26Å; L344-V346 PolarHBondContact O-N 3.49Å; V346-I348 VanDerWaalsContact C-N 3.27Å; V346-I348 PolarHBondContact O-N 2.97Å; V346-A349 CarbonylContact O-C 3.54Å; V346-A349 PolarHBondContact O-N 3.4Å; V346-A349 VanDerWaalsContact O-N 3.07Å; V346-Q350 HydrophobicContact CG1-CG 4.13Å; V346-Q350 VanDerWaalsContact CG1-NE2 3.26Å; V346-Q350 WeakPolarHBondContact O-CB 3.44Å; V346-Q350 WeakPolarHBondContact O-CG 3.39Å; V346-Q350 PolarHBondContact O-N 2.87Å
347	C	79.9	Confident	78	Confident	16 Å²	16	41.3 Å²	41.3	11%	0.108	21%	0.207	C	C	.	.	H	α-helix	trans	-60.1	-40.5	179.3	-69.4	0	0	0	0	111.1	D343 L344 Q350 R351 D352 A356	D343-C347 PolarHBondContact O-N 3.07Å; D343-C347 PolarHBondContact O-SG 3.04Å; D343-C347 VanDerWaalsContact O-SG 3.37Å; L344-C347 PolarHBondContact O-N 3.23Å; C347-Q350 PolarHBondContact O-N 3.44Å; C347-R351 PolarHBondContact O-N 3.35Å; C347-R351 VanDerWaalsContact O-N 3.13Å; C347-D352 PolarHBondContact O-N 2.83Å; C347-A356 HydrophobicContact CB-CB 3.72Å
348	I	78.3	Confident	78.7	Confident	20 Å²	20	44.1 Å²	44.1	10%	0.103	22%	0.222	C	C	.	.	H	α-helix	trans	-62.9	-42.8	173.7	-66.5	164	0	0	0	110.8	L344 V346 R351 L390 V393	L344-I348 WeakPolarHBondContact O-CB 3.07Å; L344-I348 WeakPolarHBondContact O-CD1 3.23Å; L344-I348 WeakPolarHBondContact O-CG1 3.32Å; L344-I348 PolarHBondContact O-N 2.74Å; V346-I348 VanDerWaalsContact C-N 3.27Å; V346-I348 PolarHBondContact O-N 2.97Å; I348-R351 PolarHBondContact O-N 3.24Å; I348-L390 HydrophobicContact CD1-CB 4.02Å; I348-L390 HydrophobicContact CG1-CB 4.17Å; I348-L390 HydrophobicContact CG1-CD1 4.02Å; I348-V393 HydrophobicContact CG2-CG2 4.25Å
349	A	75.2	Confident	79.4	Confident	15 Å²	15	39.7 Å²	39.7	12%	0.124	20%	0.203	C	C	.	.	H	α-helix	trans	-67.3	-36.7	178.6	0	0	0	0	0	113.3	I71 D345 V346 R351	I71-A349 HydrophobicContact CG2-CB 3.95Å; D345-A349 VanDerWaalsContact O-CB 3.3Å; D345-A349 WeakPolarHBondContact O-CB 3.28Å; D345-A349 PolarHBondContact O-N 2.85Å; V346-A349 CarbonylContact O-C 3.54Å; V346-A349 PolarHBondContact O-N 3.4Å; V346-A349 VanDerWaalsContact O-N 3.07Å; A349-R351 PolarHBondContact O-N 2.89Å
350	Q	74.6	Confident	79.7	Confident	121 Å²	121	37.6 Å²	37.6	57%	0.565	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.4	-4.3	177.5	-67.9	-177.8	7.8	0	0	113.3	V346 C347 D352	V346-Q350 HydrophobicContact CG1-CG 4.13Å; V346-Q350 VanDerWaalsContact CG1-NE2 3.26Å; V346-Q350 WeakPolarHBondContact O-CB 3.44Å; V346-Q350 WeakPolarHBondContact O-CG 3.39Å; V346-Q350 PolarHBondContact O-N 2.87Å; C347-Q350 PolarHBondContact O-N 3.44Å; Q350-D352 PolarHBondContact O-N 3.37Å
351	R	74.2	Confident	79.9	Confident	92 Å²	92	40.4 Å²	40.4	35%	0.347	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.3	24.1	-171.7	-57.6	176.3	163.8	-128.1	-14.5	113.2	C347 I348 A349 F353 E397	C347-R351 PolarHBondContact O-N 3.35Å; C347-R351 VanDerWaalsContact O-N 3.13Å; I348-R351 PolarHBondContact O-N 3.24Å; A349-R351 PolarHBondContact O-N 2.89Å; R351-F353 HydrophobicContact CB-CE2 4.28Å; R351-F353 HydrophobicContact CB-CZ 4.14Å; R351-F353 HydrophobicContact CG-CZ 4.43Å; R351-F353 PolarHBondContact O-N 3.13Å; R351-E397 IonicContact CZ-OE1 2.77Å; R351-E397 IonicContact CZ-OE2 3.8Å; R351-E397 IonicContact NH1-OE1 2.75Å; R351-E397 PolarHBondContact NH1-OE1 3.16Å; R351-E397 VanDerWaalsContact NH1-OE1 3.08Å; R351-E397 IonicContact NH1-OE2 3.38Å; R351-E397 PolarHBondContact NH1-OE2 2.81Å; R351-E397 IonicContact NH2-OE1 2.68Å; R351-E397 PolarHBondContact NH2-OE1 3.29Å; R351-E397 IonicContact NH2-OE2 3.09Å
352	D	79.8	Confident	80.3	Confident	62 Å²	62	45.7 Å²	45.7	33%	0.332	23%	0.229	S	C	.	.			trans	-87.7	80.1	171.4	-175.7	13.2	0	0	0	109.7	C347 Q350 E354 G355 A356	C347-D352 PolarHBondContact O-N 2.83Å; Q350-D352 PolarHBondContact O-N 3.37Å; D352-E354 VanDerWaalsContact C-N 3.3Å; D352-E354 PolarHBondContact OD1-N 3.2Å; D352-G355 PolarHBondContact OD1-N 2.7Å; D352-A356 PolarHBondContact O-N 2.88Å
353	F	80.7	Confident	80.3	Confident	28 Å²	28	41.9 Å²	41.9	12%	0.123	21%	0.211	C	C	.	.	H	α-helix	trans	-71.9	-25.9	-179.1	-51.9	-57.1	0	0	0	112.7	R351 V357 L390 V393 L394 E397 Q417	R351-F353 HydrophobicContact CB-CE2 4.28Å; R351-F353 HydrophobicContact CB-CZ 4.14Å; R351-F353 HydrophobicContact CG-CZ 4.43Å; R351-F353 PolarHBondContact O-N 3.13Å; F353-V357 VanDerWaalsContact O-CG2 3.27Å; F353-V357 WeakPolarHBondContact O-CG2 3.39Å; F353-V357 PolarHBondContact O-N 3.39Å; F353-V357 VanDerWaalsContact O-N 3.11Å; F353-L390 HydrophobicContact CD1-CD1 3.45Å; F353-L390 VanDerWaalsContact CD1-CD1 3.45Å; F353-L390 HydrophobicContact CE1-CD1 4.06Å; F353-L390 HydrophobicContact CG-CD1 4.41Å; F353-V393 HydrophobicContact CE1-CG1 3.84Å; F353-V393 HydrophobicContact CZ-CG1 3.93Å; F353-L394 HydrophobicContact CB-CD2 4.02Å; F353-L394 HydrophobicContact CD1-CD2 3.86Å; F353-L394 HydrophobicContact CD1-CG 4.2Å; F353-L394 HydrophobicContact CD2-CD2 3.6Å; F353-L394 HydrophobicContact CE1-CD2 4.16Å; F353-L394 HydrophobicContact CE1-CG 4.4Å; F353-L394 HydrophobicContact CE2-CD2 3.94Å; F353-L394 HydrophobicContact CG-CD2 3.55Å; F353-L394 HydrophobicContact CG-CG 4.35Å; F353-L394 HydrophobicContact CZ-CD2 4.2Å; F353-E397 HydrophobicContact CE2-CG 4.47Å; F353-E397 HydrophobicContact CZ-CG 4.24Å; F353-Q417 HydrophobicContact CB-CG 3.96Å
354	E	82.4	Confident	80.3	Confident	67 Å²	67	43 Å²	43	31%	0.313	22%	0.218	S	C	.	.	H	α-helix	trans	-68.8	-49.1	176.3	-83	164.1	-162.3	0	0	110.4	D352 A356 V357 D358 R413 Q417	D352-E354 VanDerWaalsContact C-N 3.3Å; D352-E354 PolarHBondContact OD1-N 3.2Å; E354-A356 VanDerWaalsContact C-N 3.3Å; E354-A356 PolarHBondContact O-N 3.3Å; E354-V357 PolarHBondContact O-N 3.46Å; E354-D358 WeakPolarHBondContact O-CB 3.38Å; E354-D358 VanDerWaalsContact O-CG 3.24Å; E354-D358 PolarHBondContact O-N 3.29Å; E354-R413 IonicContact OE1-CZ 3.86Å; E354-R413 IonicContact OE1-NE 3.71Å; E354-R413 PolarHBondContact OE1-NE 3.33Å; E354-R413 IonicContact OE1-NH2 3.83Å; E354-R413 PolarHBondContact OE1-NH2 2.92Å; E354-R413 IonicContact OE2-CZ 2.65Å; E354-R413 IonicContact OE2-NE 2.64Å; E354-R413 IonicContact OE2-NH2 3.66Å; E354-R413 PolarHBondContact OE2-NH2 3.13Å; E354-Q417 HydrophobicContact CG-CG 4.36Å
355	G	81.6	Confident	80.2	Confident	18 Å²	18	49.5 Å²	49.5	19%	0.186	25%	0.247	C	C	.	.	H	α-helix	trans	-58.7	-40.7	174.5	0	0	0	0	0	112.8	D352 D358 L359	D352-G355 PolarHBondContact OD1-N 2.7Å; G355-D358 PolarHBondContact O-N 3.35Å; G355-L359 VanDerWaalsContact O-CG 3.3Å; G355-L359 WeakPolarHBondContact O-CG 3.46Å; G355-L359 PolarHBondContact O-N 3.38Å; G355-L359 VanDerWaalsContact O-N 3.08Å
356	A	83.6	Confident	79.9	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-61.9	-46.1	176.9	0	0	0	0	0	112.5	L344 C347 D352 E354 L359 L360 L390	L344-A356 HydrophobicContact CD2-CB 4.11Å; L344-A356 WeakPolarHBondContact CD2-O 3.32Å; C347-A356 HydrophobicContact CB-CB 3.72Å; D352-A356 PolarHBondContact O-N 2.88Å; E354-A356 VanDerWaalsContact C-N 3.3Å; E354-A356 PolarHBondContact O-N 3.3Å; A356-L359 PolarHBondContact O-N 2.97Å; A356-L360 WeakPolarHBondContact O-CG 3.47Å; A356-L360 PolarHBondContact O-N 2.87Å; A356-L360 VanDerWaalsContact O-N 3.15Å; A356-L390 HydrophobicContact CB-CD1 4.47Å; A356-L390 HydrophobicContact CB-CD2 4.06Å
357	V	82.5	Confident	79.5	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-71.1	-36.1	-179.8	177.6	0	0	0	0	111.4	F353 E354 L359 L360 D361 L390 Q417 R420 L421	F353-V357 VanDerWaalsContact O-CG2 3.27Å; F353-V357 WeakPolarHBondContact O-CG2 3.39Å; F353-V357 PolarHBondContact O-N 3.39Å; F353-V357 VanDerWaalsContact O-N 3.11Å; E354-V357 PolarHBondContact O-N 3.46Å; V357-L359 VanDerWaalsContact C-N 3.29Å; V357-L359 PolarHBondContact O-N 3.48Å; V357-L360 WeakPolarHBondContact O-CB 3.35Å; V357-L360 PolarHBondContact O-N 3.14Å; V357-L360 VanDerWaalsContact O-N 3.14Å; V357-D361 PolarHBondContact O-N 3.31Å; V357-L390 HydrophobicContact CG2-CD2 4.27Å; V357-Q417 HydrophobicContact CG2-CB 4.06Å; V357-Q417 HydrophobicContact CG2-CG 4.34Å; V357-R420 HydrophobicContact CG1-CB 3.66Å; V357-L421 HydrophobicContact CG2-CD1 4.26Å; V357-L421 HydrophobicContact CG2-CD2 3.99Å; V357-L421 HydrophobicContact CG2-CG 3.96Å
358	D	85.3	Confident	78.9	Confident	67 Å²	67	55.9 Å²	55.9	36%	0.358	27%	0.27	S	S	.	.	H	α-helix	trans	-62.5	-36.6	174.6	-72.2	-2.4	0	0	0	112.3	E354 G355 K362 R420	E354-D358 WeakPolarHBondContact O-CB 3.38Å; E354-D358 VanDerWaalsContact O-CG 3.24Å; E354-D358 PolarHBondContact O-N 3.29Å; G355-D358 PolarHBondContact O-N 3.35Å; D358-K362 WeakPolarHBondContact O-CB 3.45Å; D358-K362 VanDerWaalsContact O-CG 3.24Å; D358-K362 WeakPolarHBondContact O-CG 3.41Å; D358-K362 PolarHBondContact O-N 2.82Å; D358-R420 IonicContact OD1-CZ 2.99Å; D358-R420 VanDerWaalsContact OD1-CZ 3.25Å; D358-R420 IonicContact OD1-NH1 3.08Å; D358-R420 PolarHBondContact OD1-NH1 2.9Å; D358-R420 IonicContact OD1-NH2 3.84Å; D358-R420 PolarHBondContact OD1-NH2 3.4Å
359	L	82.3	Confident	78	Confident	37 Å²	37	62.4 Å²	62.4	19%	0.194	31%	0.305	C	S	.	.	H	α-helix	trans	-66.8	-38.6	173.6	-73.4	172.6	0	0	0	111.9	L340 D343 L344 G355 A356 V357 L363	L340-L359 HydrophobicContact CD1-CB 3.98Å; L340-L359 HydrophobicContact CD1-CD2 4.22Å; D343-L359 HydrophobicContact CB-CD1 4.2Å; L344-L359 HydrophobicContact CD2-CB 4.29Å; G355-L359 VanDerWaalsContact O-CG 3.3Å; G355-L359 WeakPolarHBondContact O-CG 3.46Å; G355-L359 PolarHBondContact O-N 3.38Å; G355-L359 VanDerWaalsContact O-N 3.08Å; A356-L359 PolarHBondContact O-N 2.97Å; V357-L359 VanDerWaalsContact C-N 3.29Å; V357-L359 PolarHBondContact O-N 3.48Å; L359-L363 PolarHBondContact O-N 3.39Å
360	L	81.5	Confident	77.4	Confident	7 Å²	7	65.3 Å²	65.3	4%	0.037	32%	0.315	C	S	.	.	H	α-helix	trans	-67.3	-41.5	175.2	-68.3	168.2	0	0	0	112.1	L344 A356 V357 L363 N364 V383 V387 L390 L421	L344-L360 HydrophobicContact CD1-CD2 3.83Å; L344-L360 HydrophobicContact CD2-CD1 4.44Å; L344-L360 HydrophobicContact CD2-CD2 4.2Å; L344-L360 HydrophobicContact CD2-CG 3.97Å; A356-L360 WeakPolarHBondContact O-CG 3.47Å; A356-L360 PolarHBondContact O-N 2.87Å; A356-L360 VanDerWaalsContact O-N 3.15Å; V357-L360 WeakPolarHBondContact O-CB 3.35Å; V357-L360 PolarHBondContact O-N 3.14Å; V357-L360 VanDerWaalsContact O-N 3.14Å; L360-L363 PolarHBondContact O-N 3.3Å; L360-N364 WeakPolarHBondContact O-CB 3.29Å; L360-N364 PolarHBondContact O-N 2.9Å; L360-N364 PolarHBondContact O-ND2 2.85Å; L360-V383 HydrophobicContact CD2-CG1 3.34Å; L360-V387 HydrophobicContact CD1-CG2 3.7Å; L360-V387 HydrophobicContact CD2-CG2 3.69Å; L360-V387 HydrophobicContact CG-CG2 4.37Å; L360-L390 HydrophobicContact CD1-CD2 4.12Å; L360-L421 HydrophobicContact CD1-CD2 3.54Å
361	D	82.3	Confident	76.6	Confident	60 Å²	60	64.1 Å²	64.1	32%	0.321	32%	0.318	S	S	.	.	H	α-helix	trans	-64.3	-43.1	176.6	-75.7	-15	0	0	0	111	V357 L363 N364 H365 R420	V357-D361 PolarHBondContact O-N 3.31Å; D361-L363 VanDerWaalsContact C-N 3.32Å; D361-L363 PolarHBondContact O-N 2.99Å; D361-N364 PolarHBondContact O-N 3.22Å; D361-H365 WeakPolarHBondContact O-CB 3.48Å; D361-H365 PolarHBondContact O-N 3.41Å; D361-R420 IonicContact OD2-CZ 2.69Å; D361-R420 IonicContact OD2-NE 3.12Å; D361-R420 PolarHBondContact OD2-NE 3.06Å; D361-R420 IonicContact OD2-NH2 2.88Å; D361-R420 PolarHBondContact OD2-NH2 3.46Å
362	K	82.4	Confident	75.7	Confident	131 Å²	131	62.1 Å²	62.1	57%	0.57	32%	0.318	S	S	*	.	H	α-helix	trans	-59.7	-41.7	173.6	-74.8	169.6	-173	170.3	0	112.3	D358 Y366	D358-K362 WeakPolarHBondContact O-CB 3.45Å; D358-K362 VanDerWaalsContact O-CG 3.24Å; D358-K362 WeakPolarHBondContact O-CG 3.41Å; D358-K362 PolarHBondContact O-N 2.82Å; K362-Y366 WeakPolarHBondContact O-CB 3.42Å; K362-Y366 PolarHBondContact O-N 3.47Å; K362-Y366 VanDerWaalsContact O-N 3.11Å
363	L	79.4	Confident	75.2	Confident	3 Å²	3	61.1 Å²	61.1	2%	0.016	32%	0.315	C	S	.	.	H	α-helix	trans	-63.8	-48.8	175.3	177.6	70.6	0	0	0	110.9	L340 L359 L360 D361 H365 Y366 L367 L379 V383	L340-L363 HydrophobicContact CD2-CB 3.87Å; L340-L363 HydrophobicContact CD2-CD1 3.78Å; L340-L363 HydrophobicContact CD2-CD2 3.59Å; L340-L363 HydrophobicContact CD2-CG 3.9Å; L359-L363 PolarHBondContact O-N 3.39Å; L360-L363 PolarHBondContact O-N 3.3Å; D361-L363 VanDerWaalsContact C-N 3.32Å; D361-L363 PolarHBondContact O-N 2.99Å; L363-H365 VanDerWaalsContact C-N 3.33Å; L363-H365 PolarHBondContact O-N 3.26Å; L363-Y366 PolarHBondContact O-N 3.45Å; L363-L367 HydrophobicContact CD1-CD1 3.7Å; L363-L367 HydrophobicContact CD1-CG 3.98Å; L363-L367 HydrophobicContact CD2-CD1 4.08Å; L363-L367 HydrophobicContact CG-CD1 3.63Å; L363-L367 HydrophobicContact CG-CG 4.21Å; L363-L367 VanDerWaalsContact O-CB 3.32Å; L363-L367 WeakPolarHBondContact O-CB 3.47Å; L363-L367 VanDerWaalsContact O-CG 3.24Å; L363-L367 WeakPolarHBondContact O-CG 3.45Å; L363-L367 PolarHBondContact O-N 3.16Å; L363-L379 HydrophobicContact CD1-CD2 4.39Å; L363-V383 HydrophobicContact CD2-CB 4.29Å; L363-V383 HydrophobicContact CD2-CG1 3.91Å; L363-V383 HydrophobicContact CD2-CG2 3.8Å
364	N	79.1	Confident	74.4	Confident	84 Å²	84	64.4 Å²	64.4	45%	0.449	34%	0.339	S	S	.	.	H	α-helix	trans	-60	-43.9	-178.6	-77.2	-28.3	0	0	0	111.4	L360 D361 Y366 L367 E368	L360-N364 WeakPolarHBondContact O-CB 3.29Å; L360-N364 PolarHBondContact O-N 2.9Å; L360-N364 PolarHBondContact O-ND2 2.85Å; D361-N364 PolarHBondContact O-N 3.22Å; N364-Y366 VanDerWaalsContact C-N 3.34Å; N364-Y366 PolarHBondContact O-N 3.12Å; N364-L367 CarbonylContact O-C 3.51Å; N364-L367 PolarHBondContact O-N 2.93Å; N364-L367 VanDerWaalsContact O-N 3.12Å; N364-E368 WeakPolarHBondContact O-CG 3.48Å; N364-E368 PolarHBondContact O-N 2.88Å
365	H	79.3	Confident	73.6	Confident	139 Å²	139	64.1 Å²	64.1	64%	0.644	34%	0.343	S	S	*	.	H	α-helix	trans	-64.2	-37.9	177.1	-138.4	48.2	0	0	0	112.6	D361 L363 L367 E368	D361-H365 WeakPolarHBondContact O-CB 3.48Å; D361-H365 PolarHBondContact O-N 3.41Å; L363-H365 VanDerWaalsContact C-N 3.33Å; L363-H365 PolarHBondContact O-N 3.26Å; H365-L367 VanDerWaalsContact C-N 3.27Å; H365-L367 PolarHBondContact O-N 2.93Å; H365-E368 IonicContact CE1-OE2 3.9Å; H365-E368 IonicContact CG-OE2 3.96Å; H365-E368 IonicContact ND1-OE2 3.87Å; H365-E368 PolarHBondContact ND1-OE2 3.41Å
366	Y	74	Confident	72.9	Confident	72 Å²	72	63.3 Å²	63.3	28%	0.282	34%	0.335	S	S	.	.	H	α-helix	trans	-70.3	-25.4	175.6	-170.1	-102.7	0	0	0	113.1	W336 I337 K362 L363 N364 K370	W336-Y366 HydrophobicContact CH2-CG 4.46Å; W336-Y366 HydrophobicContact CZ2-CD1 4.16Å; W336-Y366 HydrophobicContact CZ2-CD2 4.46Å; W336-Y366 HydrophobicContact CZ2-CE1 4.5Å; W336-Y366 HydrophobicContact CZ2-CG 4.13Å; I337-Y366 HydrophobicContact CD1-CD1 4.02Å; I337-Y366 HydrophobicContact CD1-CE1 3.6Å; K362-Y366 WeakPolarHBondContact O-CB 3.42Å; K362-Y366 PolarHBondContact O-N 3.47Å; K362-Y366 VanDerWaalsContact O-N 3.11Å; L363-Y366 PolarHBondContact O-N 3.45Å; N364-Y366 VanDerWaalsContact C-N 3.34Å; N364-Y366 PolarHBondContact O-N 3.12Å; Y366-K370 PolarHBondContact OH-NZ 2.93Å
367	L	70.7	Confident	72.3	Confident	13 Å²	13	69.7 Å²	69.7	7%	0.068	36%	0.362	C	S	.	.	H	α-helix	trans	-95	-5.9	-178.9	-72.3	-178.2	0	0	0	114.1	L363 N364 H365 V376 R380	L363-L367 HydrophobicContact CD1-CD1 3.7Å; L363-L367 HydrophobicContact CD1-CG 3.98Å; L363-L367 HydrophobicContact CD2-CD1 4.08Å; L363-L367 HydrophobicContact CG-CD1 3.63Å; L363-L367 HydrophobicContact CG-CG 4.21Å; L363-L367 VanDerWaalsContact O-CB 3.32Å; L363-L367 WeakPolarHBondContact O-CB 3.47Å; L363-L367 VanDerWaalsContact O-CG 3.24Å; L363-L367 WeakPolarHBondContact O-CG 3.45Å; L363-L367 PolarHBondContact O-N 3.16Å; N364-L367 CarbonylContact O-C 3.51Å; N364-L367 PolarHBondContact O-N 2.93Å; N364-L367 VanDerWaalsContact O-N 3.12Å; H365-L367 VanDerWaalsContact C-N 3.27Å; H365-L367 PolarHBondContact O-N 2.93Å; L367-V376 HydrophobicContact CD2-CG1 3.91Å; L367-R380 HydrophobicContact CD1-CG 4.14Å; L367-R380 PolarHBondContact O-NH2 2.95Å
368	E	68.9	Low	72	Confident	138 Å²	138	75.9 Å²	75.9	65%	0.645	39%	0.391	S	S	*	.	H	α-helix	trans	-69.5	-35.9	178.2	-90.8	174.9	153.9	0	0	112.3	N364 H365	N364-E368 WeakPolarHBondContact O-CG 3.48Å; N364-E368 PolarHBondContact O-N 2.88Å; H365-E368 IonicContact CE1-OE2 3.9Å; H365-E368 IonicContact CG-OE2 3.96Å; H365-E368 IonicContact ND1-OE2 3.87Å; H365-E368 PolarHBondContact ND1-OE2 3.41Å
369	D	58.2	Low	71.4	Confident	157 Å²	157	73.7 Å²	73.7	84%	0.84	38%	0.379	S	S	*	.	S	Bend	trans	-95.4	-1.1	-172.5	-80.3	-26	0	0	0	115.1
370	K	62.3	Low	71	Confident	75 Å²	75	76.3 Å²	76.3	33%	0.326	39%	0.386	S	S	.	.	S	Bend	trans	-118.3	139.1	-171.9	-66.5	-174.2	-178.8	178.8	0	113.8	V330 Y366	V330-K370 HydrophobicContact CG1-CD 3.81Å; V330-K370 HydrophobicContact CG2-CB 4.22Å; V330-K370 HydrophobicContact CG2-CD 4.24Å; Y366-K370 PolarHBondContact OH-NZ 2.93Å
371	P	58.7	Low	70.9	Confident	97 Å²	97	78.6 Å²	78.6	63%	0.63	41%	0.406	S	S	*	.			trans	-59.9	151.2	171.6	24.9	-30.9	0	0	0	110.1	P373	P371-P373 VanDerWaalsContact C-CD 3.44Å; P371-P373 WeakPolarHBondContact O-CD 3.36Å
372	S	55.8	Low	70.8	Confident	49 Å²	49	81.7 Å²	81.7	34%	0.343	42%	0.417	S	S	.	.			trans	-99.2	84.9	-171.5	174	0	0	0	0	112.2	K377	S372-K377 VanDerWaalsContact OG-CG 3.27Å; S372-K377 WeakPolarHBondContact OG-CG 3.39Å
373	P	67.6	Low	70.7	Confident	41 Å²	41	76 Å²	76	27%	0.266	39%	0.393	S	S	.	.			trans	-66.5	162.3	170.9	31.3	-37.7	0	0	0	111.3	V330 P371 P375 V376 K377	V330-P373 HydrophobicContact CB-CG 4.36Å; V330-P373 HydrophobicContact CG2-CG 4.46Å; P371-P373 VanDerWaalsContact C-CD 3.44Å; P371-P373 WeakPolarHBondContact O-CD 3.36Å; P373-P375 VanDerWaalsContact C-CD 3.47Å; P373-P375 HydrophobicContact CB-CG 4.46Å; P373-P375 HydrophobicContact CG-CG 4.48Å; P373-V376 HydrophobicContact CG-CB 4.23Å; P373-V376 HydrophobicContact CG-CG2 3.75Å; P373-V376 WeakPolarHBondContact O-CB 3.37Å; P373-V376 PolarHBondContact O-N 3.43Å; P373-K377 PolarHBondContact O-N 3.31Å
374	P	65.2	Low	70.8	Confident	98 Å²	98	82.4 Å²	82.4	64%	0.636	42%	0.423	S	S	*	.	H	α-helix	trans	-47.7	-41.9	-179.4	10.9	-23.3	0	0	0	116.1	V376 K377 E378	P374-V376 PolarHBondContact O-N 3.31Å; P374-K377 WeakPolarHBondContact O-CB 2.87Å; P374-K377 PolarHBondContact O-N 3.1Å; P374-K377 VanDerWaalsContact O-N 3.13Å; P374-E378 PolarHBondContact O-N 3.02Å; P374-E378 VanDerWaalsContact O-N 3.08Å
375	P	65.2	Low	71	Confident	60 Å²	60	83 Å²	83	39%	0.39	42%	0.423	S	S	.	.	H	α-helix	trans	-71.3	-25.4	177.8	27.5	-37.7	0	0	0	114.4	L332 P373 K377 E378 L379	L332-P375 HydrophobicContact CD1-CB 3.55Å; L332-P375 HydrophobicContact CD1-CG 3.34Å; P373-P375 VanDerWaalsContact C-CD 3.47Å; P373-P375 HydrophobicContact CB-CG 4.46Å; P373-P375 HydrophobicContact CG-CG 4.48Å; P375-K377 VanDerWaalsContact C-N 3.31Å; P375-E378 PolarHBondContact O-N 2.81Å; P375-L379 PolarHBondContact O-N 3.43Å
376	V	66.6	Low	71	Confident	2 Å²	2	79.4 Å²	79.4	1%	0.012	40%	0.404	C	S	.	.	H	α-helix	trans	-67.6	-34.8	169.1	169.7	0	0	0	0	110.4	L332 L367 P373 P374 R380	L332-V376 HydrophobicContact CD1-CG2 4.14Å; L332-V376 HydrophobicContact CD2-CG2 3.84Å; L332-V376 HydrophobicContact CG-CG2 4.34Å; L367-V376 HydrophobicContact CD2-CG1 3.91Å; P373-V376 HydrophobicContact CG-CB 4.23Å; P373-V376 HydrophobicContact CG-CG2 3.75Å; P373-V376 WeakPolarHBondContact O-CB 3.37Å; P373-V376 PolarHBondContact O-N 3.43Å; P374-V376 PolarHBondContact O-N 3.31Å; V376-R380 WeakPolarHBondContact O-CB 3.19Å; V376-R380 WeakPolarHBondContact O-CG 3.36Å; V376-R380 PolarHBondContact O-N 3.39Å
377	K	70.9	Confident	71.4	Confident	133 Å²	133	77.6 Å²	77.6	58%	0.578	40%	0.4	S	S	*	.	H	α-helix	trans	-68.8	-40.2	175.4	-65.1	-175.4	177.4	178.1	0	112.1	S372 P373 P374 P375 R380 A381	S372-K377 VanDerWaalsContact OG-CG 3.27Å; S372-K377 WeakPolarHBondContact OG-CG 3.39Å; P373-K377 PolarHBondContact O-N 3.31Å; P374-K377 WeakPolarHBondContact O-CB 2.87Å; P374-K377 PolarHBondContact O-N 3.1Å; P374-K377 VanDerWaalsContact O-N 3.13Å; P375-K377 VanDerWaalsContact C-N 3.31Å; K377-R380 PolarHBondContact O-N 3.37Å; K377-A381 WeakPolarHBondContact O-CB 3.34Å; K377-A381 PolarHBondContact O-N 3Å
378	E	75.6	Confident	72	Confident	130 Å²	130	82.6 Å²	82.6	61%	0.607	42%	0.418	S	S	*	.	H	α-helix	trans	-63.8	-41.3	174.2	-73.1	-174.2	-179.9	0	0	112.3	P374 P375 A381 K382	P374-E378 PolarHBondContact O-N 3.02Å; P374-E378 VanDerWaalsContact O-N 3.08Å; P375-E378 PolarHBondContact O-N 2.81Å; E378-A381 PolarHBondContact O-N 3.12Å; E378-K382 WeakPolarHBondContact O-CG 3.34Å; E378-K382 PolarHBondContact O-N 3.32Å
379	L	72.6	Confident	72.7	Confident	21 Å²	21	78.7 Å²	78.7	11%	0.11	40%	0.4	C	S	.	.	H	α-helix	trans	-64.2	-46.3	174.5	-178.3	72	0	0	0	111.4	I337 P341 L363 P375 A381 K382 V383	I337-L379 HydrophobicContact CG2-CD1 4.37Å; I337-L379 HydrophobicContact CG2-CD2 3.21Å; I337-L379 HydrophobicContact CG2-CG 4.4Å; P341-L379 HydrophobicContact CG-CD1 4.16Å; L363-L379 HydrophobicContact CD1-CD2 4.39Å; P375-L379 PolarHBondContact O-N 3.43Å; L379-A381 VanDerWaalsContact C-N 3.28Å; L379-A381 PolarHBondContact O-N 2.91Å; L379-K382 PolarHBondContact O-N 3.26Å; L379-V383 HydrophobicContact CD1-CG2 4.49Å; L379-V383 HydrophobicContact CG-CG2 4.42Å; L379-V383 WeakPolarHBondContact O-CB 3.39Å; L379-V383 VanDerWaalsContact O-CG2 3.3Å; L379-V383 WeakPolarHBondContact O-CG2 3.21Å; L379-V383 PolarHBondContact O-N 3.02Å
380	R	75.6	Confident	73.9	Confident	92 Å²	92	71.3 Å²	71.3	35%	0.347	36%	0.361	S	S	.	.	H	α-helix	trans	-57.3	-42.4	174.5	-76.8	-175.3	-155.7	-119.7	6.9	111.3	L367 V376 K377 K382 V383 E384	L367-R380 HydrophobicContact CD1-CG 4.14Å; L367-R380 PolarHBondContact O-NH2 2.95Å; V376-R380 WeakPolarHBondContact O-CB 3.19Å; V376-R380 WeakPolarHBondContact O-CG 3.36Å; V376-R380 PolarHBondContact O-N 3.39Å; K377-R380 PolarHBondContact O-N 3.37Å; R380-K382 PolarHBondContact O-N 3.46Å; R380-V383 PolarHBondContact O-N 2.79Å; R380-E384 WeakPolarHBondContact O-CB 3.3Å; R380-E384 PolarHBondContact O-N 3.4Å
381	A	79.1	Confident	74.7	Confident	55 Å²	55	68.2 Å²	68.2	46%	0.455	35%	0.348	S	S	.	.	H	α-helix	trans	-63	-42	177.1	0	0	0	0	0	112.6	K377 E378 L379 E384 E385	K377-A381 WeakPolarHBondContact O-CB 3.34Å; K377-A381 PolarHBondContact O-N 3Å; E378-A381 PolarHBondContact O-N 3.12Å; L379-A381 VanDerWaalsContact C-N 3.28Å; L379-A381 PolarHBondContact O-N 2.91Å; A381-E384 PolarHBondContact O-N 2.9Å; A381-E385 PolarHBondContact O-N 3.37Å
382	K	79.1	Confident	75.9	Confident	125 Å²	125	68.3 Å²	68.3	54%	0.543	34%	0.34	S	S	.	.	H	α-helix	trans	-64.4	-40.5	174.7	-73.8	176.5	-178.8	173.7	0	112.1	E378 L379 R380 R386	E378-K382 WeakPolarHBondContact O-CG 3.34Å; E378-K382 PolarHBondContact O-N 3.32Å; L379-K382 PolarHBondContact O-N 3.26Å; R380-K382 PolarHBondContact O-N 3.46Å; K382-R386 WeakPolarHBondContact O-CD 3.32Å; K382-R386 PolarHBondContact O-N 3.46Å
383	V	80.9	Confident	77.1	Confident	11 Å²	11	68.2 Å²	68.2	7%	0.067	34%	0.337	C	S	.	.	H	α-helix	trans	-67.7	-41.8	176.4	172.2	0	0	0	0	110.5	L340 L344 L360 L363 L379 R380 E385 R386 V387	L340-V383 HydrophobicContact CD2-CG2 4.31Å; L344-V383 HydrophobicContact CD1-CG1 4.39Å; L360-V383 HydrophobicContact CD2-CG1 3.34Å; L363-V383 HydrophobicContact CD2-CB 4.29Å; L363-V383 HydrophobicContact CD2-CG1 3.91Å; L363-V383 HydrophobicContact CD2-CG2 3.8Å; L379-V383 HydrophobicContact CD1-CG2 4.49Å; L379-V383 HydrophobicContact CG-CG2 4.42Å; L379-V383 WeakPolarHBondContact O-CB 3.39Å; L379-V383 VanDerWaalsContact O-CG2 3.3Å; L379-V383 WeakPolarHBondContact O-CG2 3.21Å; L379-V383 PolarHBondContact O-N 3.02Å; R380-V383 PolarHBondContact O-N 2.79Å; V383-E385 PolarHBondContact O-N 3Å; V383-R386 CarbonylContact O-C 3.59Å; V383-R386 WeakPolarHBondContact O-CA 3.33Å; V383-R386 PolarHBondContact O-N 3.08Å; V383-V387 HydrophobicContact CG1-CG2 4.19Å; V383-V387 WeakPolarHBondContact O-CG2 3.48Å; V383-V387 PolarHBondContact O-N 2.98Å
384	E	81.6	Confident	77.6	Confident	139 Å²	139	66.3 Å²	66.3	65%	0.65	33%	0.325	S	S	*	.	H	α-helix	trans	-64.7	-38.7	179.7	-169.3	170.3	-164.6	0	0	112.3	R380 A381 R386 V387 R388	R380-E384 WeakPolarHBondContact O-CB 3.3Å; R380-E384 PolarHBondContact O-N 3.4Å; A381-E384 PolarHBondContact O-N 2.9Å; E384-R386 PolarHBondContact O-N 3.47Å; E384-V387 PolarHBondContact O-N 3.5Å; E384-R388 PolarHBondContact O-N 3.38Å
385	E	83.3	Confident	78.3	Confident	96 Å²	96	63 Å²	63	45%	0.449	30%	0.303	S	S	.	.	H	α-helix	trans	-59.5	-36.6	170.1	178.6	118.8	-129	0	0	111.7	A381 V383 R388 Q389	A381-E385 PolarHBondContact O-N 3.37Å; V383-E385 PolarHBondContact O-N 3Å; E385-R388 WeakPolarHBondContact O-CB 3.31Å; E385-R388 PolarHBondContact O-N 3.2Å; E385-R388 IonicContact OE1-CZ 3.44Å; E385-R388 IonicContact OE1-NH2 3.75Å; E385-R388 PolarHBondContact OE1-NH2 2.8Å; E385-Q389 WeakPolarHBondContact O-CG 2.71Å; E385-Q389 PolarHBondContact O-N 2.91Å
386	R	79.3	Confident	78.8	Confident	64 Å²	64	65.1 Å²	65.1	24%	0.242	31%	0.306	C	S	.	.	H	α-helix	trans	-82	-31.2	-178.6	-81.2	36.8	168.8	62.4	21.2	111.8	D345 K382 V383 E384 R388 Q389 L390	D345-R386 IonicContact OD1-CZ 3.97Å; D345-R386 IonicContact OD1-NH1 2.83Å; D345-R386 PolarHBondContact OD1-NH1 2.96Å; D345-R386 IonicContact OD1-NH2 3.2Å; D345-R386 IonicContact OD2-CZ 2.69Å; D345-R386 IonicContact OD2-NH1 2.88Å; D345-R386 PolarHBondContact OD2-NH1 2.98Å; D345-R386 IonicContact OD2-NH2 2.68Å; D345-R386 PolarHBondContact OD2-NH2 2.88Å; K382-R386 WeakPolarHBondContact O-CD 3.32Å; K382-R386 PolarHBondContact O-N 3.46Å; V383-R386 CarbonylContact O-C 3.59Å; V383-R386 WeakPolarHBondContact O-CA 3.33Å; V383-R386 PolarHBondContact O-N 3.08Å; E384-R386 PolarHBondContact O-N 3.47Å; R386-R388 VanDerWaalsContact C-N 3.3Å; R386-Q389 PolarHBondContact O-N 3.23Å; R386-L390 VanDerWaalsContact O-CB 3.3Å; R386-L390 WeakPolarHBondContact O-CB 3.4Å; R386-L390 PolarHBondContact O-N 2.79Å
387	V	82.1	Confident	79.1	Confident	34 Å²	34	67.2 Å²	67.2	21%	0.206	32%	0.316	C	S	.	.	H	α-helix	trans	-61.5	-40.6	165.4	171.9	0	0	0	0	110.3	L360 V383 E384 L390 T391 L421	L360-V387 HydrophobicContact CD1-CG2 3.7Å; L360-V387 HydrophobicContact CD2-CG2 3.69Å; L360-V387 HydrophobicContact CG-CG2 4.37Å; V383-V387 HydrophobicContact CG1-CG2 4.19Å; V383-V387 WeakPolarHBondContact O-CG2 3.48Å; V383-V387 PolarHBondContact O-N 2.98Å; E384-V387 PolarHBondContact O-N 3.5Å; V387-L390 PolarHBondContact O-N 3.16Å; V387-T391 VanDerWaalsContact O-CB 3.29Å; V387-T391 WeakPolarHBondContact O-CB 3.4Å; V387-T391 PolarHBondContact O-N 3.46Å; V387-T391 PolarHBondContact O-OG1 2.8Å; V387-L421 HydrophobicContact CG1-CD2 4.28Å
388	R	83.8	Confident	79.2	Confident	117 Å²	117	61 Å²	61	44%	0.442	29%	0.289	S	S	.	.	H	α-helix	trans	-62.1	-46.1	173.6	-174.9	-176.6	66.6	85.9	-4.6	111.3	E384 E385 R386 T391 E392	E384-R388 PolarHBondContact O-N 3.38Å; E385-R388 WeakPolarHBondContact O-CB 3.31Å; E385-R388 PolarHBondContact O-N 3.2Å; E385-R388 IonicContact OE1-CZ 3.44Å; E385-R388 IonicContact OE1-NH2 3.75Å; E385-R388 PolarHBondContact OE1-NH2 2.8Å; R386-R388 VanDerWaalsContact C-N 3.3Å; R388-T391 WeakPolarHBondContact O-CB 3.47Å; R388-T391 PolarHBondContact O-N 2.84Å; R388-E392 IonicContact CZ-OE1 3.22Å; R388-E392 IonicContact NH1-OE1 3.99Å; R388-E392 PolarHBondContact NH1-OE1 2.8Å; R388-E392 IonicContact NH1-OE2 2.8Å; R388-E392 WeakPolarHBondContact O-CG 3.45Å; R388-E392 PolarHBondContact O-N 2.74Å
389	Q	83.5	Confident	78.9	Confident	57 Å²	57	56.2 Å²	56.2	27%	0.266	27%	0.269	S	S	.	.	H	α-helix	trans	-63	-45.5	176.3	-71.1	173	3.2	0	0	112.4	E385 R386 T391 E392 V393	E385-Q389 WeakPolarHBondContact O-CG 2.71Å; E385-Q389 PolarHBondContact O-N 2.91Å; R386-Q389 PolarHBondContact O-N 3.23Å; Q389-T391 VanDerWaalsContact C-N 3.3Å; Q389-T391 PolarHBondContact O-N 3.36Å; Q389-E392 PolarHBondContact O-N 2.82Å; Q389-V393 WeakPolarHBondContact O-CG2 3.31Å; Q389-V393 PolarHBondContact O-N 3.45Å
390	L	82.1	Confident	78.3	Confident	2 Å²	2	57.1 Å²	57.1	1%	0.01	28%	0.277	C	S	.	.	H	α-helix	trans	-57.5	-44.5	173.8	173.8	61.5	0	0	0	110.9	I348 F353 A356 V357 L360 R386 V387 V393 L394 L421	I348-L390 HydrophobicContact CD1-CB 4.02Å; I348-L390 HydrophobicContact CG1-CB 4.17Å; I348-L390 HydrophobicContact CG1-CD1 4.02Å; F353-L390 HydrophobicContact CD1-CD1 3.45Å; F353-L390 VanDerWaalsContact CD1-CD1 3.45Å; F353-L390 HydrophobicContact CE1-CD1 4.06Å; F353-L390 HydrophobicContact CG-CD1 4.41Å; A356-L390 HydrophobicContact CB-CD1 4.47Å; A356-L390 HydrophobicContact CB-CD2 4.06Å; V357-L390 HydrophobicContact CG2-CD2 4.27Å; L360-L390 HydrophobicContact CD1-CD2 4.12Å; R386-L390 VanDerWaalsContact O-CB 3.3Å; R386-L390 WeakPolarHBondContact O-CB 3.4Å; R386-L390 PolarHBondContact O-N 2.79Å; V387-L390 PolarHBondContact O-N 3.16Å; L390-V393 PolarHBondContact O-N 3.45Å; L390-L394 HydrophobicContact CD1-CD1 3.96Å; L390-L394 HydrophobicContact CD1-CG 4.16Å; L390-L394 HydrophobicContact CG-CD1 3.92Å; L390-L394 WeakPolarHBondContact O-CB 3.46Å; L390-L394 VanDerWaalsContact O-CG 3.3Å; L390-L394 WeakPolarHBondContact O-CG 3.38Å; L390-L394 PolarHBondContact O-N 3.34Å; L390-L421 HydrophobicContact CD2-CD1 3.9Å; L390-L421 HydrophobicContact CD2-CD2 4.32Å; L390-L421 HydrophobicContact CG-CD1 4.21Å
391	T	81.1	Confident	77.4	Confident	10 Å²	10	59.8 Å²	59.8	6%	0.061	30%	0.298	C	S	.	.	H	α-helix	trans	-62.4	-44.6	176.4	-58.2	0	0	0	0	111	V387 R388 Q389 V393 L394 V395 L418	V387-T391 VanDerWaalsContact O-CB 3.29Å; V387-T391 WeakPolarHBondContact O-CB 3.4Å; V387-T391 PolarHBondContact O-N 3.46Å; V387-T391 PolarHBondContact O-OG1 2.8Å; R388-T391 WeakPolarHBondContact O-CB 3.47Å; R388-T391 PolarHBondContact O-N 2.84Å; Q389-T391 VanDerWaalsContact C-N 3.3Å; Q389-T391 PolarHBondContact O-N 3.36Å; T391-V393 PolarHBondContact O-N 2.79Å; T391-L394 PolarHBondContact O-N 3.15Å; T391-V395 HydrophobicContact CG2-CG2 4.14Å; T391-V395 WeakPolarHBondContact O-CB 3.36Å; T391-V395 WeakPolarHBondContact O-CG2 3.37Å; T391-V395 PolarHBondContact O-N 3.33Å; T391-L418 HydrophobicContact CG2-CD2 4.11Å
392	E	82.5	Confident	76.3	Confident	98 Å²	98	62.9 Å²	62.9	46%	0.458	30%	0.298	S	S	.	.	H	α-helix	trans	-61.7	-42.5	176.5	-77.6	172.9	-168.4	0	0	112.3	R388 Q389 V395 F396	R388-E392 IonicContact CZ-OE1 3.22Å; R388-E392 IonicContact NH1-OE1 3.99Å; R388-E392 PolarHBondContact NH1-OE1 2.8Å; R388-E392 IonicContact NH1-OE2 2.8Å; R388-E392 WeakPolarHBondContact O-CG 3.45Å; R388-E392 PolarHBondContact O-N 2.74Å; Q389-E392 PolarHBondContact O-N 2.82Å; E392-V395 PolarHBondContact O-N 2.91Å; E392-F396 WeakPolarHBondContact O-CB 3.05Å; E392-F396 PolarHBondContact O-N 2.82Å
393	V	81.3	Confident	74.8	Confident	48 Å²	48	58.2 Å²	58.2	29%	0.291	28%	0.281	S	S	.	.	H	α-helix	trans	-65.4	-45	176.1	174.4	0	0	0	0	111	I348 F353 Q389 L390 T391 V395 F396 E397	I348-V393 HydrophobicContact CG2-CG2 4.25Å; F353-V393 HydrophobicContact CE1-CG1 3.84Å; F353-V393 HydrophobicContact CZ-CG1 3.93Å; Q389-V393 WeakPolarHBondContact O-CG2 3.31Å; Q389-V393 PolarHBondContact O-N 3.45Å; L390-V393 PolarHBondContact O-N 3.45Å; T391-V393 PolarHBondContact O-N 2.79Å; V393-V395 VanDerWaalsContact C-N 3.35Å; V393-V395 PolarHBondContact O-N 3.1Å; V393-F396 WeakPolarHBondContact O-CB 3.46Å; V393-F396 PolarHBondContact O-N 2.81Å; V393-E397 WeakPolarHBondContact O-CG 3.36Å; V393-E397 PolarHBondContact O-N 3.37Å
394	L	77.9	Confident	73.3	Confident	0 Å²	0	65.4 Å²	65.4	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-61.7	-41.8	176	-76.8	169.3	0	0	0	112	F353 L390 T391 F396 E397 L398 A414 Q417 L418 L421	F353-L394 HydrophobicContact CB-CD2 4.02Å; F353-L394 HydrophobicContact CD1-CD2 3.86Å; F353-L394 HydrophobicContact CD1-CG 4.2Å; F353-L394 HydrophobicContact CD2-CD2 3.6Å; F353-L394 HydrophobicContact CE1-CD2 4.16Å; F353-L394 HydrophobicContact CE1-CG 4.4Å; F353-L394 HydrophobicContact CE2-CD2 3.94Å; F353-L394 HydrophobicContact CG-CD2 3.55Å; F353-L394 HydrophobicContact CG-CG 4.35Å; F353-L394 HydrophobicContact CZ-CD2 4.2Å; L390-L394 HydrophobicContact CD1-CD1 3.96Å; L390-L394 HydrophobicContact CD1-CG 4.16Å; L390-L394 HydrophobicContact CG-CD1 3.92Å; L390-L394 WeakPolarHBondContact O-CB 3.46Å; L390-L394 VanDerWaalsContact O-CG 3.3Å; L390-L394 WeakPolarHBondContact O-CG 3.38Å; L390-L394 PolarHBondContact O-N 3.34Å; T391-L394 PolarHBondContact O-N 3.15Å; L394-F396 VanDerWaalsContact C-N 3.31Å; L394-F396 PolarHBondContact O-N 3.16Å; L394-E397 PolarHBondContact O-N 3.46Å; L394-L398 WeakPolarHBondContact O-CB 3.33Å; L394-L398 WeakPolarHBondContact O-CD1 3.43Å; L394-L398 WeakPolarHBondContact O-CG 3.4Å; L394-L398 PolarHBondContact O-N 2.96Å; L394-A414 HydrophobicContact CD2-CB 4.03Å; L394-Q417 HydrophobicContact CD1-CB 4.36Å; L394-L418 HydrophobicContact CB-CD1 4.43Å; L394-L418 HydrophobicContact CB-CD2 3.83Å; L394-L418 HydrophobicContact CB-CG 4.12Å; L394-L418 HydrophobicContact CD1-CD2 3.71Å; L394-L418 HydrophobicContact CD1-CG 4.06Å; L394-L418 HydrophobicContact CG-CD2 4.42Å; L394-L421 HydrophobicContact CD1-CD1 3.91Å
395	V	79.6	Confident	71.6	Confident	28 Å²	28	61.9 Å²	61.9	17%	0.17	30%	0.299	C	S	.	.	H	α-helix	trans	-62.2	-41	175.3	170.2	0	0	0	0	110.8	T391 E392 V393 L398 S399 K426 L430	T391-V395 HydrophobicContact CG2-CG2 4.14Å; T391-V395 WeakPolarHBondContact O-CB 3.36Å; T391-V395 WeakPolarHBondContact O-CG2 3.37Å; T391-V395 PolarHBondContact O-N 3.33Å; E392-V395 PolarHBondContact O-N 2.91Å; V393-V395 VanDerWaalsContact C-N 3.35Å; V393-V395 PolarHBondContact O-N 3.1Å; V395-L398 PolarHBondContact O-N 2.93Å; V395-S399 PolarHBondContact O-N 3.46Å; V395-S399 VanDerWaalsContact O-N 3.15Å; V395-S399 PolarHBondContact O-OG 3.39Å; V395-K426 HydrophobicContact CG2-CD 4.32Å; V395-L430 HydrophobicContact CB-CD1 3.92Å; V395-L430 HydrophobicContact CG1-CD1 3.71Å; V395-L430 HydrophobicContact CG1-CD2 4.18Å; V395-L430 HydrophobicContact CG2-CD1 3.56Å
396	F	76.5	Confident	70.3	Confident	106 Å²	106	58.4 Å²	58.4	47%	0.465	29%	0.288	S	S	.	.	H	α-helix	trans	-67	-39.8	177.4	-174.9	-101.4	0	0	0	112.2	E392 V393 L394 S399	E392-F396 WeakPolarHBondContact O-CB 3.05Å; E392-F396 PolarHBondContact O-N 2.82Å; V393-F396 WeakPolarHBondContact O-CB 3.46Å; V393-F396 PolarHBondContact O-N 2.81Å; L394-F396 VanDerWaalsContact C-N 3.31Å; L394-F396 PolarHBondContact O-N 3.16Å; F396-S399 WeakPolarHBondContact O-CB 3.46Å; F396-S399 PolarHBondContact O-N 3.48Å
397	E	72.9	Confident	69.4	Low	46 Å²	46	57.7 Å²	57.7	22%	0.215	30%	0.301	C	S	.	.	H	α-helix	trans	-68	-34.8	175.4	-70.5	-63.8	131.5	0	0	112.9	R351 F353 V393 L394 S399	R351-E397 IonicContact CZ-OE1 2.77Å; R351-E397 IonicContact CZ-OE2 3.8Å; R351-E397 IonicContact NH1-OE1 2.75Å; R351-E397 PolarHBondContact NH1-OE1 3.16Å; R351-E397 VanDerWaalsContact NH1-OE1 3.08Å; R351-E397 IonicContact NH1-OE2 3.38Å; R351-E397 PolarHBondContact NH1-OE2 2.81Å; R351-E397 IonicContact NH2-OE1 2.68Å; R351-E397 PolarHBondContact NH2-OE1 3.29Å; R351-E397 IonicContact NH2-OE2 3.09Å; F353-E397 HydrophobicContact CE2-CG 4.47Å; F353-E397 HydrophobicContact CZ-CG 4.24Å; V393-E397 WeakPolarHBondContact O-CG 3.36Å; V393-E397 PolarHBondContact O-N 3.37Å; L394-E397 PolarHBondContact O-N 3.46Å; E397-S399 VanDerWaalsContact C-N 3.26Å; E397-S399 PolarHBondContact O-N 2.87Å
398	L	72.2	Confident	68.5	Low	2 Å²	2	60.1 Å²	60.1	1%	0.01	32%	0.317	C	S	.	.	H	α-helix	trans	-77	-11.5	176.5	-79	159	0	0	0	113.5	L394 V395 T411 A414 V415 L418 L430 N434	L394-L398 WeakPolarHBondContact O-CB 3.33Å; L394-L398 WeakPolarHBondContact O-CD1 3.43Å; L394-L398 WeakPolarHBondContact O-CG 3.4Å; L394-L398 PolarHBondContact O-N 2.96Å; V395-L398 PolarHBondContact O-N 2.93Å; L398-T411 HydrophobicContact CD2-CG2 3.62Å; L398-A414 HydrophobicContact CD1-CB 3.88Å; L398-A414 HydrophobicContact CD2-CB 4.03Å; L398-A414 HydrophobicContact CG-CB 3.84Å; L398-V415 HydrophobicContact CD1-CG2 4.27Å; L398-V415 HydrophobicContact CD2-CG2 3.79Å; L398-L418 HydrophobicContact CD1-CD1 3.36Å; L398-L418 HydrophobicContact CD1-CG 4.44Å; L398-L430 HydrophobicContact CB-CB 4.43Å; L398-N434 PolarHBondContact O-ND2 2.86Å
399	S	70.6	Confident	67.7	Low	29 Å²	29	62.7 Å²	62.7	20%	0.203	33%	0.332	C	S	.	.	S	Bend	trans	-69.4	138.1	-177.8	-69.1	0	0	0	0	111.6	V395 F396 E397 D401 R402 S403	V395-S399 PolarHBondContact O-N 3.46Å; V395-S399 VanDerWaalsContact O-N 3.15Å; V395-S399 PolarHBondContact O-OG 3.39Å; F396-S399 WeakPolarHBondContact O-CB 3.46Å; F396-S399 PolarHBondContact O-N 3.48Å; E397-S399 VanDerWaalsContact C-N 3.26Å; E397-S399 PolarHBondContact O-N 2.87Å; S399-D401 PolarHBondContact O-N 3.26Å; S399-D401 VanDerWaalsContact O-N 3.1Å; S399-R402 PolarHBondContact O-N 2.76Å; S399-S403 PolarHBondContact O-N 3.17Å
400	P	60	Low	67	Low	40 Å²	40	62.2 Å²	62.2	26%	0.26	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-23.1	-171.1	22.9	-32.7	0	0	0	113.9	R402 A437	P400-R402 VanDerWaalsContact C-N 3.28Å; P400-R402 PolarHBondContact O-N 2.91Å; P400-A437 HydrophobicContact CB-CB 3.69Å
401	D	55	Low	66.6	Low	149 Å²	149	62.6 Å²	62.6	80%	0.797	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-15.2	-176.7	-60.5	-50.1	0	0	0	114.4	S399	S399-D401 PolarHBondContact O-N 3.26Å; S399-D401 VanDerWaalsContact O-N 3.1Å
402	R	56.5	Low	66.3	Low	120 Å²	120	66.1 Å²	66.1	45%	0.453	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-127.6	-7.3	174.7	-77.9	-169.8	172.6	-155.3	-1.2	114.8	S399 P400 L404 R405	S399-R402 PolarHBondContact O-N 2.76Å; P400-R402 VanDerWaalsContact C-N 3.28Å; P400-R402 PolarHBondContact O-N 2.91Å; R402-L404 PolarHBondContact O-N 3.45Å; R402-R405 PolarHBondContact O-N 2.92Å; R402-R405 VanDerWaalsContact O-N 3.13Å
403	S	47.8	Very low	66.1	Low	26 Å²	26	67.9 Å²	67.9	18%	0.182	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	7.4	-175.6	-170.4	0	0	0	0	115.8	S399 R405 N434	S399-S403 PolarHBondContact O-N 3.17Å; S403-R405 VanDerWaalsContact C-N 3.25Å; S403-N434 VanDerWaalsContact CB-ND2 3.28Å; S403-N434 WeakPolarHBondContact CB-ND2 3.42Å; S403-N434 PolarHBondContact OG-ND2 3.24Å
404	L	49.1	Very low	66	Low	162 Å²	162	66 Å²	66	85%	0.848	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-12.4	165.5	-71.9	164.6	0	0	0	112.7	R402	R402-L404 PolarHBondContact O-N 3.45Å
405	R	47	Very low	66.2	Low	66 Å²	66	66 Å²	66	25%	0.249	34%	0.344	C	S	.	.	S	Bend	trans	-81.1	-20.7	179.5	-83.3	-167.1	-179.2	-149.2	-10.5	115	S82 E83 Q86 R402 S403	S82-R405 PolarHBondContact O-NH1 2.86Å; S82-R405 PolarHBondContact OG-NH1 3.36Å; E83-R405 VanDerWaalsContact CA-NH2 3.31Å; Q86-R405 VanDerWaalsContact CD-CZ 3.4Å; Q86-R405 HydrophobicContact CG-CG 3.65Å; R402-R405 PolarHBondContact O-N 2.92Å; R402-R405 VanDerWaalsContact O-N 3.13Å; S403-R405 VanDerWaalsContact C-N 3.25Å
406	G	55.3	Low	66.4	Low	22 Å²	22	66.4 Å²	66.4	23%	0.227	35%	0.349	C	S	.	.	S	Bend	trans	-128.6	110	-178.6	0	0	0	0	0	109.3	A410	G406-A410 VanDerWaalsContact CA-CB 3.49Å
407	G	60.3	Low	66.7	Low	49 Å²	49	61.8 Å²	61.8	51%	0.505	33%	0.328	S	S	.	.			trans	-56.5	-178.9	174.3	0	0	0	0	0	112.6	K409 A410	G407-K409 PolarHBondContact O-N 2.79Å; G407-A410 WeakPolarHBondContact O-CB 3.38Å; G407-A410 PolarHBondContact O-N 2.83Å
408	P	63.3	Low	67.2	Low	85 Å²	85	59.6 Å²	59.6	55%	0.552	32%	0.318	S	S	*	.	H	α-helix	trans	-50	-28.7	-170.9	-28.4	33.5	0	0	0	115.5	R412	P408-R412 PolarHBondContact O-N 2.66Å
409	K	66.9	Low	67.8	Low	171 Å²	171	60.8 Å²	60.8	74%	0.743	32%	0.324	S	S	*	.	H	α-helix	trans	-67.8	-36	176.3	-64.4	-176.5	178.4	-178.8	0	114	G407 R413	G407-K409 PolarHBondContact O-N 2.79Å; K409-R413 WeakPolarHBondContact O-CG 3.24Å; K409-R413 PolarHBondContact O-N 3.01Å; K409-R413 VanDerWaalsContact O-N 3.1Å
410	A	68.6	Low	68.3	Low	47 Å²	47	64.1 Å²	64.1	39%	0.388	33%	0.332	S	S	.	.	H	α-helix	trans	-71.5	-43.9	-179.4	0	0	0	0	0	111.1	G406 G407 R412 R413 A414	G406-A410 VanDerWaalsContact CA-CB 3.49Å; G407-A410 WeakPolarHBondContact O-CB 3.38Å; G407-A410 PolarHBondContact O-N 2.83Å; A410-R412 VanDerWaalsContact C-N 3.3Å; A410-R412 PolarHBondContact O-N 2.98Å; A410-R413 PolarHBondContact O-N 3.05Å; A410-A414 PolarHBondContact O-N 3.37Å
411	T	73.5	Confident	69.3	Low	11 Å²	11	63.6 Å²	63.6	7%	0.067	33%	0.327	C	S	.	.	H	α-helix	trans	-56.7	-45.5	173.1	-46.6	0	0	0	0	110.8	L398 A414 V415 F431	L398-T411 HydrophobicContact CD2-CG2 3.62Å; T411-A414 PolarHBondContact O-N 3.39Å; T411-V415 WeakPolarHBondContact O-CG2 3.34Å; T411-V415 PolarHBondContact O-N 2.93Å; T411-F431 HydrophobicContact CG2-CD2 4.39Å
412	R	75.8	Confident	70.4	Confident	83 Å²	83	59.2 Å²	59.2	31%	0.313	32%	0.317	S	S	.	.	H	α-helix	trans	-59.6	-51.9	177.7	-167.4	180	-52.7	-173.5	2.1	112.4	P408 A410 A414 V415 S416 E473 D477	P408-R412 PolarHBondContact O-N 2.66Å; A410-R412 VanDerWaalsContact C-N 3.3Å; A410-R412 PolarHBondContact O-N 2.98Å; R412-A414 VanDerWaalsContact C-N 3.29Å; R412-A414 PolarHBondContact O-N 3.19Å; R412-V415 PolarHBondContact O-N 3.48Å; R412-V415 VanDerWaalsContact O-N 3.1Å; R412-S416 PolarHBondContact O-N 3.28Å; R412-S416 PolarHBondContact O-OG 2.88Å; R412-S416 VanDerWaalsContact O-OG 3.07Å; R412-E473 IonicContact CZ-OE2 3.25Å; R412-E473 IonicContact NE-OE2 3.43Å; R412-E473 PolarHBondContact NE-OE2 3.36Å; R412-E473 IonicContact NH2-OE2 2.7Å; R412-E473 PolarHBondContact NH2-OE2 2.93Å; R412-D477 WeakPolarHBondContact CG-OD1 3.46Å; R412-D477 WeakPolarHBondContact CG-OD2 3.31Å
413	R	78.4	Confident	71.5	Confident	135 Å²	135	57.4 Å²	57.4	51%	0.509	31%	0.314	S	S	.	.	H	α-helix	trans	-56.5	-44.6	179.7	-71.9	175.4	78.5	-164.6	5.7	111.6	E354 K409 A410 S416 Q417	E354-R413 IonicContact OE1-CZ 3.86Å; E354-R413 IonicContact OE1-NE 3.71Å; E354-R413 PolarHBondContact OE1-NE 3.33Å; E354-R413 IonicContact OE1-NH2 3.83Å; E354-R413 PolarHBondContact OE1-NH2 2.92Å; E354-R413 IonicContact OE2-CZ 2.65Å; E354-R413 IonicContact OE2-NE 2.64Å; E354-R413 IonicContact OE2-NH2 3.66Å; E354-R413 PolarHBondContact OE2-NH2 3.13Å; K409-R413 WeakPolarHBondContact O-CG 3.24Å; K409-R413 PolarHBondContact O-N 3.01Å; K409-R413 VanDerWaalsContact O-N 3.1Å; A410-R413 PolarHBondContact O-N 3.05Å; R413-S416 PolarHBondContact O-N 3.42Å; R413-Q417 WeakPolarHBondContact O-CG 3.48Å; R413-Q417 PolarHBondContact O-N 3.49Å
414	A	78.6	Confident	73.2	Confident	9 Å²	9	57 Å²	57	7%	0.074	31%	0.311	C	S	.	.	H	α-helix	trans	-64.1	-39.7	177.9	0	0	0	0	0	112.6	L394 L398 A410 T411 R412 Q417 L418	L394-A414 HydrophobicContact CD2-CB 4.03Å; L398-A414 HydrophobicContact CD1-CB 3.88Å; L398-A414 HydrophobicContact CD2-CB 4.03Å; L398-A414 HydrophobicContact CG-CB 3.84Å; A410-A414 PolarHBondContact O-N 3.37Å; T411-A414 PolarHBondContact O-N 3.39Å; R412-A414 VanDerWaalsContact C-N 3.29Å; R412-A414 PolarHBondContact O-N 3.19Å; A414-Q417 PolarHBondContact O-N 3.39Å; A414-L418 WeakPolarHBondContact O-CG 3.24Å; A414-L418 PolarHBondContact O-N 3.4Å; A414-L418 VanDerWaalsContact O-N 3.1Å
415	V	82.9	Confident	74.8	Confident	0 Å²	0	54 Å²	54	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-66.6	-46.3	175.7	171.3	0	0	0	0	111.5	L398 T411 R412 Q417 L418 I419 A427 F431 D477 F478	L398-V415 HydrophobicContact CD1-CG2 4.27Å; L398-V415 HydrophobicContact CD2-CG2 3.79Å; T411-V415 WeakPolarHBondContact O-CG2 3.34Å; T411-V415 PolarHBondContact O-N 2.93Å; R412-V415 PolarHBondContact O-N 3.48Å; R412-V415 VanDerWaalsContact O-N 3.1Å; V415-Q417 VanDerWaalsContact C-N 3.27Å; V415-Q417 PolarHBondContact O-N 2.91Å; V415-L418 PolarHBondContact O-N 2.97Å; V415-L418 VanDerWaalsContact O-N 3.1Å; V415-I419 HydrophobicContact CG1-CD1 3.85Å; V415-I419 HydrophobicContact CG1-CG1 4.38Å; V415-I419 WeakPolarHBondContact O-CG1 3.38Å; V415-I419 PolarHBondContact O-N 3.01Å; V415-A427 HydrophobicContact CG1-CB 4.46Å; V415-F431 HydrophobicContact CG2-CB 3.93Å; V415-F431 HydrophobicContact CG2-CD2 3.91Å; V415-F431 HydrophobicContact CG2-CG 4.33Å; V415-D477 HydrophobicContact CG1-CB 4.47Å; V415-F478 HydrophobicContact CG1-CE2 3.97Å; V415-F478 HydrophobicContact CG1-CZ 3.88Å
416	S	83.8	Confident	76.5	Confident	37 Å²	37	54.8 Å²	54.8	26%	0.259	31%	0.305	S	S	.	.	H	α-helix	trans	-58.2	-39.9	176.9	-51.2	0	0	0	0	111.7	R412 R413 I419 R420	R412-S416 PolarHBondContact O-N 3.28Å; R412-S416 PolarHBondContact O-OG 2.88Å; R412-S416 VanDerWaalsContact O-OG 3.07Å; R413-S416 PolarHBondContact O-N 3.42Å; S416-I419 PolarHBondContact O-N 3.02Å; S416-R420 WeakPolarHBondContact O-CG 3.37Å; S416-R420 PolarHBondContact O-N 3.16Å
417	Q	83.2	Confident	77.9	Confident	9 Å²	9	53.8 Å²	53.8	4%	0.042	29%	0.294	C	S	.	.	H	α-helix	trans	-65.8	-40.7	175.2	-65.9	-29.6	-57.7	0	0	112.6	F353 E354 V357 L394 R413 A414 V415 I419 R420 L421	F353-Q417 HydrophobicContact CB-CG 3.96Å; E354-Q417 HydrophobicContact CG-CG 4.36Å; V357-Q417 HydrophobicContact CG2-CB 4.06Å; V357-Q417 HydrophobicContact CG2-CG 4.34Å; L394-Q417 HydrophobicContact CD1-CB 4.36Å; R413-Q417 WeakPolarHBondContact O-CG 3.48Å; R413-Q417 PolarHBondContact O-N 3.49Å; A414-Q417 PolarHBondContact O-N 3.39Å; V415-Q417 VanDerWaalsContact C-N 3.27Å; V415-Q417 PolarHBondContact O-N 2.91Å; Q417-I419 VanDerWaalsContact C-N 3.31Å; Q417-I419 PolarHBondContact O-N 3.2Å; Q417-R420 PolarHBondContact O-N 3.42Å; Q417-L421 VanDerWaalsContact O-CG 3.31Å; Q417-L421 WeakPolarHBondContact O-CG 3.24Å; Q417-L421 PolarHBondContact O-N 3.43Å
418	L	83	Confident	79.1	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-65.2	-34.1	175.8	-73.3	175.1	0	0	0	113.1	T391 L394 L398 A414 V415 L421 Q423 A427	T391-L418 HydrophobicContact CG2-CD2 4.11Å; L394-L418 HydrophobicContact CB-CD1 4.43Å; L394-L418 HydrophobicContact CB-CD2 3.83Å; L394-L418 HydrophobicContact CB-CG 4.12Å; L394-L418 HydrophobicContact CD1-CD2 3.71Å; L394-L418 HydrophobicContact CD1-CG 4.06Å; L394-L418 HydrophobicContact CG-CD2 4.42Å; L398-L418 HydrophobicContact CD1-CD1 3.36Å; L398-L418 HydrophobicContact CD1-CG 4.44Å; A414-L418 WeakPolarHBondContact O-CG 3.24Å; A414-L418 PolarHBondContact O-N 3.4Å; A414-L418 VanDerWaalsContact O-N 3.1Å; V415-L418 PolarHBondContact O-N 2.97Å; V415-L418 VanDerWaalsContact O-N 3.1Å; L418-L421 HydrophobicContact CD2-CD1 4.46Å; L418-L421 PolarHBondContact O-N 3.22Å; L418-Q423 PolarHBondContact O-N 3.4Å; L418-Q423 VanDerWaalsContact O-N 3.07Å; L418-A427 HydrophobicContact CB-CB 3.6Å; L418-A427 HydrophobicContact CD1-CB 4.05Å
419	I	83.4	Confident	80.1	Confident	27 Å²	27	53.8 Å²	53.8	14%	0.138	27%	0.274	C	S	.	.	H	α-helix	trans	-65.8	-45.1	174.8	-67.5	170.9	0	0	0	109.9	V415 S416 Q417 L421 G422 A427 D477 F478	V415-I419 HydrophobicContact CG1-CD1 3.85Å; V415-I419 HydrophobicContact CG1-CG1 4.38Å; V415-I419 WeakPolarHBondContact O-CG1 3.38Å; V415-I419 PolarHBondContact O-N 3.01Å; S416-I419 PolarHBondContact O-N 3.02Å; Q417-I419 VanDerWaalsContact C-N 3.31Å; Q417-I419 PolarHBondContact O-N 3.2Å; I419-L421 VanDerWaalsContact C-N 3.26Å; I419-L421 PolarHBondContact O-N 2.75Å; I419-G422 PolarHBondContact O-N 3.47Å; I419-A427 HydrophobicContact CG1-CB 4.2Å; I419-D477 HydrophobicContact CD1-CB 4.3Å; I419-D477 WeakPolarHBondContact CD1-O 3.44Å; I419-F478 HydrophobicContact CD1-CD1 3.77Å; I419-F478 HydrophobicContact CD1-CD2 4.31Å; I419-F478 HydrophobicContact CD1-CE1 3.56Å; I419-F478 HydrophobicContact CD1-CE2 4.12Å; I419-F478 HydrophobicContact CD1-CG 4.15Å; I419-F478 HydrophobicContact CD1-CZ 3.75Å; I419-F478 HydrophobicContact CG1-CD1 4.37Å; I419-F478 HydrophobicContact CG1-CE1 3.91Å; I419-F478 HydrophobicContact CG1-CZ 4.31Å
420	R	82.1	Confident	81	Confident	98 Å²	98	46.7 Å²	46.7	37%	0.37	24%	0.244	S	C	.	.	H	α-helix	trans	-60.9	-33.8	175	-70.9	176.5	68.8	-171.9	12.2	113	V357 D358 D361 S416 Q417 G422	V357-R420 HydrophobicContact CG1-CB 3.66Å; D358-R420 IonicContact OD1-CZ 2.99Å; D358-R420 VanDerWaalsContact OD1-CZ 3.25Å; D358-R420 IonicContact OD1-NH1 3.08Å; D358-R420 PolarHBondContact OD1-NH1 2.9Å; D358-R420 IonicContact OD1-NH2 3.84Å; D358-R420 PolarHBondContact OD1-NH2 3.4Å; D361-R420 IonicContact OD2-CZ 2.69Å; D361-R420 IonicContact OD2-NE 3.12Å; D361-R420 PolarHBondContact OD2-NE 3.06Å; D361-R420 IonicContact OD2-NH2 2.88Å; D361-R420 PolarHBondContact OD2-NH2 3.46Å; S416-R420 WeakPolarHBondContact O-CG 3.37Å; S416-R420 PolarHBondContact O-N 3.16Å; Q417-R420 PolarHBondContact O-N 3.42Å; R420-G422 PolarHBondContact O-N 2.96Å
421	L	80.6	Confident	81.8	Confident	30 Å²	30	44.5 Å²	44.5	16%	0.157	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.2	2	173.8	-69	171.7	0	0	0	114.1	V357 L360 V387 L390 L394 Q417 L418 I419 Q423	V357-L421 HydrophobicContact CG2-CD1 4.26Å; V357-L421 HydrophobicContact CG2-CD2 3.99Å; V357-L421 HydrophobicContact CG2-CG 3.96Å; L360-L421 HydrophobicContact CD1-CD2 3.54Å; V387-L421 HydrophobicContact CG1-CD2 4.28Å; L390-L421 HydrophobicContact CD2-CD1 3.9Å; L390-L421 HydrophobicContact CD2-CD2 4.32Å; L390-L421 HydrophobicContact CG-CD1 4.21Å; L394-L421 HydrophobicContact CD1-CD1 3.91Å; Q417-L421 VanDerWaalsContact O-CG 3.31Å; Q417-L421 WeakPolarHBondContact O-CG 3.24Å; Q417-L421 PolarHBondContact O-N 3.43Å; L418-L421 HydrophobicContact CD2-CD1 4.46Å; L418-L421 PolarHBondContact O-N 3.22Å; I419-L421 VanDerWaalsContact C-N 3.26Å; I419-L421 PolarHBondContact O-N 2.75Å; L421-Q423 VanDerWaalsContact C-N 3.26Å; L421-Q423 PolarHBondContact O-N 2.7Å
422	G	77.9	Confident	82.5	Confident	57 Å²	57	44.4 Å²	44.4	59%	0.588	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	76	9.1	-178.9	0	0	0	0	0	114.4	I419 R420 C424	I419-G422 PolarHBondContact O-N 3.47Å; R420-G422 PolarHBondContact O-N 2.96Å; G422-C424 VanDerWaalsContact C-N 3.35Å; G422-C424 PolarHBondContact O-N 3.08Å
423	Q	80.9	Confident	83	Confident	82 Å²	82	47.5 Å²	47.5	38%	0.383	24%	0.237	S	C	.	.			trans	-97	43.6	-178.5	-64.7	-68.7	-41.1	0	0	111.9	L418 L421 T425 K426 A427	L418-Q423 PolarHBondContact O-N 3.4Å; L418-Q423 VanDerWaalsContact O-N 3.07Å; L421-Q423 VanDerWaalsContact C-N 3.26Å; L421-Q423 PolarHBondContact O-N 2.7Å; Q423-T425 PolarHBondContact O-N 3.49Å; Q423-K426 PolarHBondContact O-N 2.93Å; Q423-A427 WeakPolarHBondContact O-CB 3.38Å; Q423-A427 PolarHBondContact O-N 3.27Å
424	C	82.5	Confident	83.3	Confident	18 Å²	18	41.7 Å²	41.7	12%	0.122	22%	0.215	C	C	.	.	H	α-helix	trans	-60.8	-37.9	-170.4	-54.3	0	0	0	0	113.9	G422 C428 T481	G422-C424 VanDerWaalsContact C-N 3.35Å; G422-C424 PolarHBondContact O-N 3.08Å; C424-C428 VanDerWaalsContact O-CB 3.27Å; C424-C428 WeakPolarHBondContact O-CB 3.29Å; C424-C428 PolarHBondContact O-N 2.81Å; C424-T481 HydrophobicContact CB-CG2 4.02Å
425	T	83.3	Confident	83.7	Confident	99 Å²	99	42.2 Å²	42.2	61%	0.607	22%	0.216	S	C	*	.	H	α-helix	trans	-65.2	-46.1	178.7	42.7	0	0	0	0	112.1	Q423 C428 E429	Q423-T425 PolarHBondContact O-N 3.49Å; T425-C428 WeakPolarHBondContact O-CB 3.3Å; T425-C428 PolarHBondContact O-N 2.92Å; T425-E429 PolarHBondContact O-N 3.16Å
426	K	81.9	Confident	83.9	Confident	82 Å²	82	43.4 Å²	43.4	36%	0.357	23%	0.225	S	C	.	.	H	α-helix	trans	-67.9	-39.4	177.9	-165.8	173.9	-173.9	-177.9	0	111.7	V395 Q423 C428 E429 L430	V395-K426 HydrophobicContact CG2-CD 4.32Å; Q423-K426 PolarHBondContact O-N 2.93Å; K426-C428 VanDerWaalsContact C-N 3.35Å; K426-E429 PolarHBondContact O-N 3.45Å; K426-L430 HydrophobicContact CG-CD1 4.14Å; K426-L430 WeakPolarHBondContact O-CG 3.33Å; K426-L430 PolarHBondContact O-N 3.05Å; K426-L430 VanDerWaalsContact O-N 3.1Å
427	A	84.3	Confident	84	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-59.2	-46.4	173.5	0	0	0	0	0	111.5	V415 L418 I419 Q423 L430 F431 F478	V415-A427 HydrophobicContact CG1-CB 4.46Å; L418-A427 HydrophobicContact CB-CB 3.6Å; L418-A427 HydrophobicContact CD1-CB 4.05Å; I419-A427 HydrophobicContact CG1-CB 4.2Å; Q423-A427 WeakPolarHBondContact O-CB 3.38Å; Q423-A427 PolarHBondContact O-N 3.27Å; A427-L430 PolarHBondContact O-N 2.71Å; A427-F431 VanDerWaalsContact O-CB 3.25Å; A427-F431 WeakPolarHBondContact O-CB 3.46Å; A427-F431 PolarHBondContact O-N 3.35Å; A427-F478 HydrophobicContact CB-CZ 4.49Å
428	C	85.9	Confident	84	Confident	2 Å²	2	44.9 Å²	44.9	1%	0.014	24%	0.241	C	C	.	.	H	α-helix	trans	-60.3	-48.5	177.3	179.8	0	0	0	0	111.8	C424 T425 K426 L430 F431 L432 F478 C485	C424-C428 VanDerWaalsContact O-CB 3.27Å; C424-C428 WeakPolarHBondContact O-CB 3.29Å; C424-C428 PolarHBondContact O-N 2.81Å; T425-C428 WeakPolarHBondContact O-CB 3.3Å; T425-C428 PolarHBondContact O-N 2.92Å; K426-C428 VanDerWaalsContact C-N 3.35Å; C428-L430 PolarHBondContact O-N 3.14Å; C428-F431 PolarHBondContact O-N 3.48Å; C428-L432 WeakPolarHBondContact O-CB 3.47Å; C428-L432 VanDerWaalsContact O-CG 3.22Å; C428-L432 WeakPolarHBondContact O-CG 3.34Å; C428-L432 PolarHBondContact O-N 2.91Å; C428-F478 HydrophobicContact CB-CE1 3.89Å; C428-F478 HydrophobicContact CB-CZ 3.89Å; C428-C485 HydrophobicContact CB-CB 4.14Å
429	E	85.6	Confident	84.1	Confident	133 Å²	133	45 Å²	45	62%	0.621	24%	0.242	S	C	*	.	H	α-helix	trans	-59.5	-46.2	179.6	-172.8	-175.8	168.2	0	0	111.8	T425 K426 L432 R433	T425-E429 PolarHBondContact O-N 3.16Å; K426-E429 PolarHBondContact O-N 3.45Å; E429-L432 PolarHBondContact O-N 3.36Å; E429-R433 VanDerWaalsContact O-CB 3.29Å; E429-R433 WeakPolarHBondContact O-CB 3.5Å; E429-R433 PolarHBondContact O-N 3.5Å
430	L	83.9	Confident	84.2	Confident	22 Å²	22	47 Å²	47	12%	0.115	25%	0.25	C	S	.	.	H	α-helix	trans	-69.4	-40.2	-179	-69.9	167.3	0	0	0	112.5	V395 L398 K426 A427 C428 R433 N434	V395-L430 HydrophobicContact CB-CD1 3.92Å; V395-L430 HydrophobicContact CG1-CD1 3.71Å; V395-L430 HydrophobicContact CG1-CD2 4.18Å; V395-L430 HydrophobicContact CG2-CD1 3.56Å; L398-L430 HydrophobicContact CB-CB 4.43Å; K426-L430 HydrophobicContact CG-CD1 4.14Å; K426-L430 WeakPolarHBondContact O-CG 3.33Å; K426-L430 PolarHBondContact O-N 3.05Å; K426-L430 VanDerWaalsContact O-N 3.1Å; A427-L430 PolarHBondContact O-N 2.71Å; C428-L430 PolarHBondContact O-N 3.14Å; L430-R433 PolarHBondContact O-N 3Å; L430-N434 VanDerWaalsContact O-CB 3.31Å; L430-N434 WeakPolarHBondContact O-CB 3.25Å; L430-N434 PolarHBondContact O-N 3.41Å
431	F	86.2	Confident	84.3	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-57.7	-50.9	173.4	174.8	-101.7	0	0	0	111.1	T411 V415 A427 C428 R433 N434 R435 T470 E473 F474	T411-F431 HydrophobicContact CG2-CD2 4.39Å; V415-F431 HydrophobicContact CG2-CB 3.93Å; V415-F431 HydrophobicContact CG2-CD2 3.91Å; V415-F431 HydrophobicContact CG2-CG 4.33Å; A427-F431 VanDerWaalsContact O-CB 3.25Å; A427-F431 WeakPolarHBondContact O-CB 3.46Å; A427-F431 PolarHBondContact O-N 3.35Å; C428-F431 PolarHBondContact O-N 3.48Å; F431-R433 VanDerWaalsContact C-N 3.35Å; F431-R433 PolarHBondContact O-N 2.94Å; F431-N434 PolarHBondContact O-N 3.45Å; F431-R435 HydrophobicContact CD1-CG 4.41Å; F431-R435 HydrophobicContact CD2-CG 4.43Å; F431-R435 HydrophobicContact CE1-CG 4.09Å; F431-R435 HydrophobicContact CE2-CG 4.15Å; F431-R435 HydrophobicContact CZ-CG 3.97Å; F431-R435 VanDerWaalsContact O-CG 3.27Å; F431-R435 WeakPolarHBondContact O-CG 3.23Å; F431-R435 PolarHBondContact O-N 3.39Å; F431-T470 HydrophobicContact CE1-CG2 3.86Å; F431-T470 HydrophobicContact CZ-CG2 4.1Å; F431-E473 HydrophobicContact CZ-CB 4.26Å; F431-F474 HydrophobicContact CD1-CD2 4.08Å; F431-F474 HydrophobicContact CE1-CB 4.31Å; F431-F474 AromaticContact CE1-CD2 3.95Å; F431-F474 HydrophobicContact CE1-CD2 3.95Å
432	L	88.2	Confident	84.4	Confident	10 Å²	10	45.6 Å²	45.6	5%	0.052	26%	0.258	C	S	.	.	H	α-helix	trans	-65.4	-37.7	-179.8	-65.3	174.4	0	0	0	111.9	C428 E429 R435 A436 F474 A488 F489 W492	C428-L432 WeakPolarHBondContact O-CB 3.47Å; C428-L432 VanDerWaalsContact O-CG 3.22Å; C428-L432 WeakPolarHBondContact O-CG 3.34Å; C428-L432 PolarHBondContact O-N 2.91Å; E429-L432 PolarHBondContact O-N 3.36Å; L432-R435 PolarHBondContact O-N 3.06Å; L432-A436 WeakPolarHBondContact O-CB 3.37Å; L432-A436 PolarHBondContact O-N 2.8Å; L432-F474 HydrophobicContact CD2-CD2 4.47Å; L432-A488 HydrophobicContact CD1-CB 4.18Å; L432-F489 HydrophobicContact CD2-CD2 3.9Å; L432-W492 HydrophobicContact CB-CB 4.28Å; L432-W492 HydrophobicContact CB-CG 3.96Å; L432-W492 HydrophobicContact CD1-CB 3.94Å; L432-W492 HydrophobicContact CD1-CG 4.42Å; L432-W492 HydrophobicContact CD2-CB 4.1Å; L432-W492 HydrophobicContact CD2-CD2 3.8Å; L432-W492 HydrophobicContact CD2-CE3 3.95Å; L432-W492 HydrophobicContact CD2-CG 3.85Å; L432-W492 HydrophobicContact CG-CB 4.33Å; L432-W492 HydrophobicContact CG-CG 4.28Å; L432-W492 PolarHBondContact O-NE1 3.47Å
433	R	86.7	Confident	84.8	Confident	148 Å²	148	43.8 Å²	43.8	56%	0.558	23%	0.234	S	C	*	.	H	α-helix	trans	-64.4	-42.7	175	-178.5	176.8	167.1	132.4	-2.5	112	E429 L430 F431 A436 A437	E429-R433 VanDerWaalsContact O-CB 3.29Å; E429-R433 WeakPolarHBondContact O-CB 3.5Å; E429-R433 PolarHBondContact O-N 3.5Å; L430-R433 PolarHBondContact O-N 3Å; F431-R433 VanDerWaalsContact C-N 3.35Å; F431-R433 PolarHBondContact O-N 2.94Å; R433-A436 PolarHBondContact O-N 3.46Å; R433-A437 PolarHBondContact O-N 2.78Å; R433-A437 VanDerWaalsContact O-N 3.12Å
434	N	85.4	Confident	84.9	Confident	12 Å²	12	48.6 Å²	48.6	6%	0.064	25%	0.249	C	C	.	.	H	α-helix	trans	-62	-47.6	175.2	-173.2	-61.9	0	0	0	110.7	L398 S403 L430 F431 A436 A437 A438	L398-N434 PolarHBondContact O-ND2 2.86Å; S403-N434 VanDerWaalsContact CB-ND2 3.28Å; S403-N434 WeakPolarHBondContact CB-ND2 3.42Å; S403-N434 PolarHBondContact OG-ND2 3.24Å; L430-N434 VanDerWaalsContact O-CB 3.31Å; L430-N434 WeakPolarHBondContact O-CB 3.25Å; L430-N434 PolarHBondContact O-N 3.41Å; F431-N434 PolarHBondContact O-N 3.45Å; N434-A436 PolarHBondContact O-N 3.33Å; N434-A437 WeakPolarHBondContact O-CB 3.36Å; N434-A437 PolarHBondContact O-N 3.23Å; N434-A437 VanDerWaalsContact O-N 3.16Å; N434-A438 PolarHBondContact O-N 2.78Å
435	R	86	Confident	84.9	Confident	21 Å²	21	54.1 Å²	54.1	8%	0.079	27%	0.273	C	S	.	.	H	α-helix	trans	-63	-38.7	177	-67.1	-71.8	174.7	147.1	-5.1	112.8	F431 L432 A437 A438 V439 T470 E473 W492	F431-R435 HydrophobicContact CD1-CG 4.41Å; F431-R435 HydrophobicContact CD2-CG 4.43Å; F431-R435 HydrophobicContact CE1-CG 4.09Å; F431-R435 HydrophobicContact CE2-CG 4.15Å; F431-R435 HydrophobicContact CZ-CG 3.97Å; F431-R435 VanDerWaalsContact O-CG 3.27Å; F431-R435 WeakPolarHBondContact O-CG 3.23Å; F431-R435 PolarHBondContact O-N 3.39Å; L432-R435 PolarHBondContact O-N 3.06Å; R435-A437 VanDerWaalsContact C-N 3.33Å; R435-A437 PolarHBondContact O-N 3.02Å; R435-A438 PolarHBondContact O-N 3.06Å; R435-V439 WeakPolarHBondContact O-CG2 3.47Å; R435-V439 PolarHBondContact O-N 3.29Å; R435-T470 HydrophobicContact CB-CG2 4.04Å; R435-T470 HydrophobicContact CG-CG2 3.74Å; R435-E473 IonicContact CZ-OE1 3.02Å; R435-E473 VanDerWaalsContact CZ-OE1 3.27Å; R435-E473 IonicContact CZ-OE2 3.49Å; R435-E473 IonicContact NH1-OE1 3.62Å; R435-E473 PolarHBondContact NH1-OE1 3.31Å; R435-E473 IonicContact NH2-OE1 2.82Å; R435-E473 PolarHBondContact NH2-OE1 2.93Å; R435-E473 IonicContact NH2-OE2 3.57Å; R435-E473 PolarHBondContact NH2-OE2 2.91Å; R435-W492 HydrophobicContact CB-CZ2 3.87Å
436	A	87.1	Confident	84.8	Confident	24 Å²	24	50.7 Å²	50.7	20%	0.198	25%	0.251	C	S	.	.	H	α-helix	trans	-58.7	-45.3	173.3	0	0	0	0	0	111.5	L432 R433 N434 H440	L432-A436 WeakPolarHBondContact O-CB 3.37Å; L432-A436 PolarHBondContact O-N 2.8Å; R433-A436 PolarHBondContact O-N 3.46Å; N434-A436 PolarHBondContact O-N 3.33Å; A436-H440 VanDerWaalsContact O-CB 3.24Å; A436-H440 WeakPolarHBondContact O-CB 3.22Å; A436-H440 PolarHBondContact O-N 3.14Å
437	A	85.4	Confident	84.4	Confident	31 Å²	31	55.5 Å²	55.5	26%	0.256	27%	0.267	S	S	.	.	H	α-helix	trans	-65.4	-39.5	177.1	0	0	0	0	0	112.1	P400 R433 N434 R435 T441	P400-A437 HydrophobicContact CB-CB 3.69Å; R433-A437 PolarHBondContact O-N 2.78Å; R433-A437 VanDerWaalsContact O-N 3.12Å; N434-A437 WeakPolarHBondContact O-CB 3.36Å; N434-A437 PolarHBondContact O-N 3.23Å; N434-A437 VanDerWaalsContact O-N 3.16Å; R435-A437 VanDerWaalsContact C-N 3.33Å; R435-A437 PolarHBondContact O-N 3.02Å; A437-T441 WeakPolarHBondContact O-CB 3.43Å; A437-T441 PolarHBondContact O-N 3.08Å; A437-T441 PolarHBondContact O-OG1 3.41Å
438	A	83.7	Confident	83.9	Confident	46 Å²	46	60.7 Å²	60.7	38%	0.38	29%	0.293	S	S	.	.	H	α-helix	trans	-63.2	-49.7	176.1	0	0	0	0	0	112	N434 R435 H440 T441 A442	N434-A438 PolarHBondContact O-N 2.78Å; R435-A438 PolarHBondContact O-N 3.06Å; A438-H440 VanDerWaalsContact C-N 3.35Å; A438-H440 PolarHBondContact O-N 3.37Å; A438-T441 PolarHBondContact O-N 2.98Å; A438-A442 WeakPolarHBondContact O-CB 3.47Å; A438-A442 PolarHBondContact O-N 3.36Å
439	V	85.6	Confident	83	Confident	3 Å²	3	65.3 Å²	65.3	2%	0.018	31%	0.314	C	S	.	.	H	α-helix	trans	-58.8	-47	176.4	170.5	0	0	0	0	110.7	R435 T441 A442 I443 F463 S466	R435-V439 WeakPolarHBondContact O-CG2 3.47Å; R435-V439 PolarHBondContact O-N 3.29Å; V439-T441 VanDerWaalsContact C-N 3.32Å; V439-T441 PolarHBondContact O-N 3.26Å; V439-A442 PolarHBondContact O-N 3.36Å; V439-I443 HydrophobicContact CG1-CD1 3.86Å; V439-I443 HydrophobicContact CG1-CG1 4.48Å; V439-I443 WeakPolarHBondContact O-CG1 3.32Å; V439-I443 PolarHBondContact O-N 2.95Å; V439-F463 HydrophobicContact CG1-CD2 3.75Å; V439-F463 HydrophobicContact CG1-CE2 3.99Å; V439-S466 WeakPolarHBondContact CG2-OG 3.17Å
440	H	84.8	Confident	82.3	Confident	69 Å²	69	62.4 Å²	62.4	32%	0.319	32%	0.32	S	S	.	.	H	α-helix	trans	-63.3	-37.7	179.6	175.4	-104	0	0	0	112.4	A436 A438 R444	A436-H440 VanDerWaalsContact O-CB 3.24Å; A436-H440 WeakPolarHBondContact O-CB 3.22Å; A436-H440 PolarHBondContact O-N 3.14Å; A438-H440 VanDerWaalsContact C-N 3.35Å; A438-H440 PolarHBondContact O-N 3.37Å; H440-R444 PolarHBondContact CE1-NE 2.85Å; H440-R444 PolarHBondContact CE1-NH2 2.81Å; H440-R444 PolarHBondContact NE2-NE 3.1Å; H440-R444 PolarHBondContact NE2-NH2 2.92Å; H440-R444 WeakPolarHBondContact O-CG 3.38Å; H440-R444 PolarHBondContact O-N 3.47Å; H440-R444 VanDerWaalsContact O-N 3.1Å
441	T	84.4	Confident	82	Confident	67 Å²	67	64.3 Å²	64.3	41%	0.411	34%	0.339	S	S	.	.	H	α-helix	trans	-68.9	-42	175.2	-55	0	0	0	0	111.3	A437 A438 V439 I443 R444 Q445	A437-T441 WeakPolarHBondContact O-CB 3.43Å; A437-T441 PolarHBondContact O-N 3.08Å; A437-T441 PolarHBondContact O-OG1 3.41Å; A438-T441 PolarHBondContact O-N 2.98Å; V439-T441 VanDerWaalsContact C-N 3.32Å; V439-T441 PolarHBondContact O-N 3.26Å; T441-I443 PolarHBondContact O-N 3.38Å; T441-R444 PolarHBondContact O-N 3.32Å; T441-R444 VanDerWaalsContact O-N 3.17Å; T441-Q445 HydrophobicContact CG2-CG 4.35Å; T441-Q445 WeakPolarHBondContact O-CG 3.23Å; T441-Q445 PolarHBondContact O-N 3.42Å
442	A	83.8	Confident	81.8	Confident	32 Å²	32	65.3 Å²	65.3	26%	0.264	35%	0.345	S	S	.	.	H	α-helix	trans	-61.5	-42	176.6	0	0	0	0	0	112.2	A438 V439 Q445 L446 V462	A438-A442 WeakPolarHBondContact O-CB 3.47Å; A438-A442 PolarHBondContact O-N 3.36Å; V439-A442 PolarHBondContact O-N 3.36Å; A442-Q445 PolarHBondContact O-N 3.12Å; A442-L446 PolarHBondContact O-N 2.78Å; A442-V462 HydrophobicContact CB-CG1 3.93Å
443	I	84.4	Confident	81.6	Confident	19 Å²	19	67.4 Å²	67.4	10%	0.097	36%	0.356	C	S	.	.	H	α-helix	trans	-63	-42.3	174.3	-67.8	169.1	0	0	0	110.7	V439 T441 L446 L459 F463 A503	V439-I443 HydrophobicContact CG1-CD1 3.86Å; V439-I443 HydrophobicContact CG1-CG1 4.48Å; V439-I443 WeakPolarHBondContact O-CG1 3.32Å; V439-I443 PolarHBondContact O-N 2.95Å; T441-I443 PolarHBondContact O-N 3.38Å; I443-L446 VanDerWaalsContact O-CB 3.29Å; I443-L446 WeakPolarHBondContact O-CB 3.37Å; I443-L446 PolarHBondContact O-N 2.79Å; I443-L459 HydrophobicContact CB-CD1 4.48Å; I443-L459 HydrophobicContact CG1-CD1 4.13Å; I443-L459 HydrophobicContact CG2-CD1 3.92Å; I443-F463 HydrophobicContact CD1-CD2 4.17Å; I443-A503 HydrophobicContact CG2-CB 4.04Å
444	R	83.9	Confident	81.5	Confident	182 Å²	182	65.3 Å²	65.3	69%	0.687	36%	0.356	S	S	*	.	H	α-helix	trans	-69.4	-33	179.7	-77.7	-175.6	-177.7	-147.8	3.1	114.2	H440 T441 L446	H440-R444 PolarHBondContact CE1-NE 2.85Å; H440-R444 PolarHBondContact CE1-NH2 2.81Å; H440-R444 PolarHBondContact NE2-NE 3.1Å; H440-R444 PolarHBondContact NE2-NH2 2.92Å; H440-R444 WeakPolarHBondContact O-CG 3.38Å; H440-R444 PolarHBondContact O-N 3.47Å; H440-R444 VanDerWaalsContact O-N 3.1Å; T441-R444 PolarHBondContact O-N 3.32Å; T441-R444 VanDerWaalsContact O-N 3.17Å; R444-L446 PolarHBondContact O-N 2.82Å
445	Q	82.6	Confident	81.6	Confident	134 Å²	134	65.5 Å²	65.5	63%	0.626	36%	0.355	S	S	*	.	H	α-helix	trans	-72.4	-15.5	177.6	-75	177	-15.3	0	0	112.4	T441 A442 R447	T441-Q445 HydrophobicContact CG2-CG 4.35Å; T441-Q445 WeakPolarHBondContact O-CG 3.23Å; T441-Q445 PolarHBondContact O-N 3.42Å; A442-Q445 PolarHBondContact O-N 3.12Å; Q445-R447 PolarHBondContact O-N 2.72Å; Q445-R447 VanDerWaalsContact O-N 3.08Å
446	L	81.2	Confident	81.7	Confident	27 Å²	27	64.5 Å²	64.5	14%	0.141	35%	0.352	C	S	.	.			trans	-69.9	107.2	179.9	-141.9	146.3	0	0	0	109.5	A442 I443 R444 Y455 K458 L459 V462	A442-L446 PolarHBondContact O-N 2.78Å; I443-L446 VanDerWaalsContact O-CB 3.29Å; I443-L446 WeakPolarHBondContact O-CB 3.37Å; I443-L446 PolarHBondContact O-N 2.79Å; R444-L446 PolarHBondContact O-N 2.82Å; L446-Y455 HydrophobicContact CB-CE2 4.42Å; L446-Y455 HydrophobicContact CD2-CD2 3.45Å; L446-Y455 VanDerWaalsContact CD2-CD2 3.45Å; L446-Y455 HydrophobicContact CD2-CE2 3.28Å; L446-Y455 HydrophobicContact CD2-CG 4.47Å; L446-Y455 HydrophobicContact CG-CE2 4.43Å; L446-K458 HydrophobicContact CD1-CB 4.42Å; L446-K458 HydrophobicContact CD2-CB 4.01Å; L446-L459 HydrophobicContact CD1-CD1 4.47Å; L446-V462 HydrophobicContact CD1-CB 4.03Å; L446-V462 HydrophobicContact CD1-CG1 4.41Å; L446-V462 HydrophobicContact CD1-CG2 3.79Å
447	R	73.8	Confident	81.8	Confident	184 Å²	184	67 Å²	67	69%	0.694	36%	0.359	S	S	*	.			trans	-70.4	135.4	176.4	-73.3	-173.2	160.8	-176.5	-3.9	110.7	Q445 E449	Q445-R447 PolarHBondContact O-N 2.72Å; Q445-R447 VanDerWaalsContact O-N 3.08Å; R447-E449 VanDerWaalsContact C-N 3.31Å; R447-E449 HydrophobicContact CB-CG 3.92Å; R447-E449 WeakPolarHBondContact CD-OE1 3.43Å; R447-E449 IonicContact NE-OE1 3.72Å; R447-E449 IonicContact NH1-OE1 2.69Å; R447-E449 PolarHBondContact NH1-OE1 3.03Å; R447-E449 PolarHBondContact O-N 3.21Å
448	I	74.6	Confident	82	Confident	109 Å²	109	70.6 Å²	70.6	56%	0.559	37%	0.369	S	S	*	.			trans	-74.8	89.3	169.8	-52.9	169.1	0	0	0	107.1	Y455	I448-Y455 HydrophobicContact CB-CD2 4.38Å; I448-Y455 HydrophobicContact CB-CE2 4.39Å; I448-Y455 HydrophobicContact CG1-CD2 4.2Å; I448-Y455 HydrophobicContact CG1-CE2 3.74Å
449	E	66	Low	82.3	Confident	98 Å²	98	68.4 Å²	68.4	46%	0.458	35%	0.351	S	S	.	.			trans	-123.1	120.1	178.8	-73.4	177.2	-175.1	0	0	110.1	R447	R447-E449 VanDerWaalsContact C-N 3.31Å; R447-E449 HydrophobicContact CB-CG 3.92Å; R447-E449 WeakPolarHBondContact CD-OE1 3.43Å; R447-E449 IonicContact NE-OE1 3.72Å; R447-E449 IonicContact NH1-OE1 2.69Å; R447-E449 PolarHBondContact NH1-OE1 3.03Å; R447-E449 PolarHBondContact O-N 3.21Å
450	G	69.9	Low	82.5	Confident	72 Å²	72	68.3 Å²	68.3	74%	0.742	35%	0.35	S	S	*	.	S	Bend	trans	94.3	-157.3	174.1	0	0	0	0	0	114.7
451	A	78.6	Confident	82.8	Confident	62 Å²	62	70.1 Å²	70.1	51%	0.512	36%	0.359	S	S	.	.			trans	-68.8	145.3	178	0	0	0	0	0	111.2	L453 L454 Y455	A451-L453 VanDerWaalsContact C-N 3.28Å; A451-L453 PolarHBondContact O-N 3.28Å; A451-L454 HydrophobicContact CB-CD1 4.35Å; A451-L454 WeakPolarHBondContact O-CB 3.34Å; A451-L454 PolarHBondContact O-N 3.43Å; A451-Y455 PolarHBondContact O-N 2.94Å
452	T	81.7	Confident	83.1	Confident	22 Å²	22	69.1 Å²	69.1	14%	0.135	35%	0.353	C	S	.	.	H	α-helix	trans	-56.5	-39.7	-175	-59.6	0	0	0	0	113.5	L454 Y455 I456 Q507 E513	T452-L454 VanDerWaalsContact C-N 3.28Å; T452-L454 PolarHBondContact O-N 3.04Å; T452-Y455 WeakPolarHBondContact O-CB 3.4Å; T452-Y455 PolarHBondContact O-N 3.19Å; T452-Y455 VanDerWaalsContact O-N 3.14Å; T452-I456 HydrophobicContact CG2-CG1 4.03Å; T452-I456 WeakPolarHBondContact O-CG1 3.42Å; T452-I456 PolarHBondContact O-N 2.83Å; T452-Q507 HydrophobicContact CG2-CG 3.94Å; T452-E513 VanDerWaalsContact CB-CD 3.47Å; T452-E513 WeakPolarHBondContact CB-OE1 3.41Å; T452-E513 WeakPolarHBondContact CB-OE2 3.44Å; T452-E513 WeakPolarHBondContact CG2-OE1 3.35Å; T452-E513 VanDerWaalsContact CG2-OE2 3.26Å; T452-E513 WeakPolarHBondContact CG2-OE2 3.42Å; T452-E513 VanDerWaalsContact OG1-CD 3.25Å; T452-E513 PolarHBondContact OG1-OE1 2.96Å; T452-E513 PolarHBondContact OG1-OE2 3.48Å
453	L	84.4	Confident	83.4	Confident	53 Å²	53	67.7 Å²	67.7	28%	0.277	34%	0.34	S	S	.	.	H	α-helix	trans	-58	-39.6	176.8	-172.2	67	0	0	0	112.6	A451 I456 H457 E520 V524	A451-L453 VanDerWaalsContact C-N 3.28Å; A451-L453 PolarHBondContact O-N 3.28Å; L453-I456 PolarHBondContact O-N 3.45Å; L453-H457 PolarHBondContact O-CD2 2.93Å; L453-H457 PolarHBondContact O-N 3.48Å; L453-E520 HydrophobicContact CD1-CB 4.04Å; L453-V524 HydrophobicContact CD1-CG2 4.44Å
454	L	85.2	Confident	83.7	Confident	104 Å²	104	67.1 Å²	67.1	55%	0.545	34%	0.337	S	S	.	.	H	α-helix	trans	-68.3	-40.1	178.1	-67.6	170.6	0	0	0	111.6	A451 T452 K458	A451-L454 HydrophobicContact CB-CD1 4.35Å; A451-L454 WeakPolarHBondContact O-CB 3.34Å; A451-L454 PolarHBondContact O-N 3.43Å; T452-L454 VanDerWaalsContact C-N 3.28Å; T452-L454 PolarHBondContact O-N 3.04Å; L454-K458 WeakPolarHBondContact O-CG 3.06Å; L454-K458 PolarHBondContact O-N 3.33Å; L454-K458 VanDerWaalsContact O-N 3.15Å
455	Y	87.3	Confident	84	Confident	16 Å²	16	60.7 Å²	60.7	6%	0.063	32%	0.318	C	S	.	.	H	α-helix	trans	-63.5	-44.7	173.9	171.6	-93.1	0	0	0	111.1	L446 I448 A451 T452 H457 K458 L459 Q507	L446-Y455 HydrophobicContact CB-CE2 4.42Å; L446-Y455 HydrophobicContact CD2-CD2 3.45Å; L446-Y455 VanDerWaalsContact CD2-CD2 3.45Å; L446-Y455 HydrophobicContact CD2-CE2 3.28Å; L446-Y455 HydrophobicContact CD2-CG 4.47Å; L446-Y455 HydrophobicContact CG-CE2 4.43Å; I448-Y455 HydrophobicContact CB-CD2 4.38Å; I448-Y455 HydrophobicContact CB-CE2 4.39Å; I448-Y455 HydrophobicContact CG1-CD2 4.2Å; I448-Y455 HydrophobicContact CG1-CE2 3.74Å; A451-Y455 PolarHBondContact O-N 2.94Å; T452-Y455 WeakPolarHBondContact O-CB 3.4Å; T452-Y455 PolarHBondContact O-N 3.19Å; T452-Y455 VanDerWaalsContact O-N 3.14Å; Y455-H457 PolarHBondContact O-N 3.07Å; Y455-K458 WeakPolarHBondContact O-CB 3.29Å; Y455-K458 PolarHBondContact O-N 3.47Å; Y455-K458 VanDerWaalsContact O-N 3.16Å; Y455-L459 HydrophobicContact CE1-CB 4.43Å; Y455-L459 HydrophobicContact CE1-CD2 4.12Å; Y455-L459 WeakPolarHBondContact O-CB 3.34Å; Y455-L459 PolarHBondContact O-N 3.31Å; Y455-Q507 HydrophobicContact CD1-CB 4.47Å; Y455-Q507 HydrophobicContact CD1-CG 3.67Å; Y455-Q507 HydrophobicContact CE1-CB 4.09Å; Y455-Q507 HydrophobicContact CE1-CG 3.71Å
456	I	88.5	Confident	84.3	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-63.9	-40.2	178.8	-67.1	-58.2	0	0	0	111.8	T452 L453 K458 L459 C460 F504 Q507 V508 C521	T452-I456 HydrophobicContact CG2-CG1 4.03Å; T452-I456 WeakPolarHBondContact O-CG1 3.42Å; T452-I456 PolarHBondContact O-N 2.83Å; L453-I456 PolarHBondContact O-N 3.45Å; I456-K458 VanDerWaalsContact C-N 3.34Å; I456-K458 PolarHBondContact O-N 3.22Å; I456-L459 HydrophobicContact CD1-CD2 4.21Å; I456-L459 PolarHBondContact O-N 3.06Å; I456-C460 WeakPolarHBondContact O-CB 3.46Å; I456-C460 PolarHBondContact O-N 3.26Å; I456-C460 PolarHBondContact O-SG 3.07Å; I456-F504 HydrophobicContact CD1-CD2 3.78Å; I456-F504 HydrophobicContact CD1-CE2 4.1Å; I456-F504 HydrophobicContact CG1-CE2 4.49Å; I456-F504 HydrophobicContact CG2-CD2 4.1Å; I456-F504 HydrophobicContact CG2-CE2 3.66Å; I456-Q507 HydrophobicContact CD1-CB 4.39Å; I456-Q507 HydrophobicContact CD1-CG 4.4Å; I456-V508 HydrophobicContact CD1-CG2 3.64Å; I456-V508 HydrophobicContact CG1-CG2 3.85Å; I456-C521 HydrophobicContact CG1-CB 4.33Å; I456-C521 HydrophobicContact CG2-CB 4.03Å
457	H	89.3	Confident	84.7	Confident	78 Å²	78	54.1 Å²	54.1	36%	0.361	29%	0.289	S	S	.	.	H	α-helix	trans	-58.6	-45.3	172.1	-92.6	-73.9	0	0	0	112.1	L453 Y455 H461 V524	L453-H457 PolarHBondContact O-CD2 2.93Å; L453-H457 PolarHBondContact O-N 3.48Å; Y455-H457 PolarHBondContact O-N 3.07Å; H457-H461 VanDerWaalsContact O-CB 3.28Å; H457-H461 WeakPolarHBondContact O-CB 3.44Å; H457-H461 PolarHBondContact O-N 3.16Å; H457-V524 VanDerWaalsContact CE1-CG1 3.45Å; H457-V524 WeakPolarHBondContact CE1-CG1 3.34Å; H457-V524 VanDerWaalsContact CE1-CG2 3.47Å; H457-V524 WeakPolarHBondContact CE1-CG2 3.45Å; H457-V524 WeakPolarHBondContact ND1-CG1 3.07Å; H457-V524 WeakPolarHBondContact NE2-CG2 3.15Å
458	K	88.1	Confident	85.3	Confident	106 Å²	106	47.1 Å²	47.1	46%	0.461	27%	0.265	S	S	.	.	H	α-helix	trans	-63.7	-43.5	176.4	-70.6	174.8	-179.6	179	0	111.5	L446 L454 Y455 I456 H461 V462	L446-K458 HydrophobicContact CD1-CB 4.42Å; L446-K458 HydrophobicContact CD2-CB 4.01Å; L454-K458 WeakPolarHBondContact O-CG 3.06Å; L454-K458 PolarHBondContact O-N 3.33Å; L454-K458 VanDerWaalsContact O-N 3.15Å; Y455-K458 WeakPolarHBondContact O-CB 3.29Å; Y455-K458 PolarHBondContact O-N 3.47Å; Y455-K458 VanDerWaalsContact O-N 3.16Å; I456-K458 VanDerWaalsContact C-N 3.34Å; I456-K458 PolarHBondContact O-N 3.22Å; K458-H461 PolarHBondContact O-N 3.45Å; K458-V462 WeakPolarHBondContact O-CB 3.3Å; K458-V462 VanDerWaalsContact O-CG2 3.31Å; K458-V462 WeakPolarHBondContact O-CG2 3.41Å; K458-V462 PolarHBondContact O-N 2.88Å
459	L	90.1	Very high	85.9	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-61.9	-49.1	178.4	-179.5	66.8	0	0	0	111.6	I443 L446 Y455 I456 V462 F463 F500 F504	I443-L459 HydrophobicContact CB-CD1 4.48Å; I443-L459 HydrophobicContact CG1-CD1 4.13Å; I443-L459 HydrophobicContact CG2-CD1 3.92Å; L446-L459 HydrophobicContact CD1-CD1 4.47Å; Y455-L459 HydrophobicContact CE1-CB 4.43Å; Y455-L459 HydrophobicContact CE1-CD2 4.12Å; Y455-L459 WeakPolarHBondContact O-CB 3.34Å; Y455-L459 PolarHBondContact O-N 3.31Å; I456-L459 HydrophobicContact CD1-CD2 4.21Å; I456-L459 PolarHBondContact O-N 3.06Å; L459-V462 PolarHBondContact O-N 3.12Å; L459-F463 WeakPolarHBondContact O-CB 3.37Å; L459-F463 PolarHBondContact O-N 2.76Å; L459-F500 HydrophobicContact CD2-CD2 4.44Å; L459-F500 HydrophobicContact CD2-CE2 4.15Å; L459-F500 HydrophobicContact CG-CD2 4.21Å; L459-F500 HydrophobicContact CG-CE2 3.95Å; L459-F504 HydrophobicContact CD2-CB 4.48Å
460	C	91.2	Very high	86.9	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-58.4	-50.5	175.6	-67.1	0	0	0	0	110	I456 V462 F463 F464 H528	I456-C460 WeakPolarHBondContact O-CB 3.46Å; I456-C460 PolarHBondContact O-N 3.26Å; I456-C460 PolarHBondContact O-SG 3.07Å; C460-V462 PolarHBondContact O-N 3.14Å; C460-F463 PolarHBondContact O-N 3.32Å; C460-F464 HydrophobicContact CB-CD2 3.91Å; C460-F464 HydrophobicContact CB-CE2 4.03Å; C460-F464 WeakPolarHBondContact O-CB 3.47Å; C460-F464 WeakPolarHBondContact O-CD2 3.33Å; C460-F464 PolarHBondContact O-N 3.2Å; C460-H528 HydrophobicContact CB-CB 4.45Å
461	H	90	Very high	87.8	Confident	107 Å²	107	39 Å²	39	50%	0.495	21%	0.207	S	C	.	.	H	α-helix	trans	-56.1	-55.2	179.3	-175.5	-78	0	0	0	111.3	H457 K458 F463 T465	H457-H461 VanDerWaalsContact O-CB 3.28Å; H457-H461 WeakPolarHBondContact O-CB 3.44Å; H457-H461 PolarHBondContact O-N 3.16Å; K458-H461 PolarHBondContact O-N 3.45Å; H461-F463 PolarHBondContact O-N 3.27Å; H461-T465 WeakPolarHBondContact O-CB 3.49Å; H461-T465 VanDerWaalsContact O-CG2 3.23Å; H461-T465 WeakPolarHBondContact O-CG2 3.4Å; H461-T465 PolarHBondContact O-N 2.79Å; H461-T465 PolarHBondContact O-OG1 3.01Å
462	V	89.8	Confident	88.1	Confident	47 Å²	47	42.5 Å²	42.5	29%	0.285	21%	0.207	S	C	.	.	H	α-helix	trans	-58.4	-45.7	-178.6	170.1	0	0	0	0	112.2	A442 L446 K458 L459 C460 T465 S466	A442-V462 HydrophobicContact CB-CG1 3.93Å; L446-V462 HydrophobicContact CD1-CB 4.03Å; L446-V462 HydrophobicContact CD1-CG1 4.41Å; L446-V462 HydrophobicContact CD1-CG2 3.79Å; K458-V462 WeakPolarHBondContact O-CB 3.3Å; K458-V462 VanDerWaalsContact O-CG2 3.31Å; K458-V462 WeakPolarHBondContact O-CG2 3.41Å; K458-V462 PolarHBondContact O-N 2.88Å; L459-V462 PolarHBondContact O-N 3.12Å; C460-V462 PolarHBondContact O-N 3.14Å; V462-T465 PolarHBondContact O-OG1 2.71Å; V462-S466 VanDerWaalsContact O-CB 3.23Å; V462-S466 WeakPolarHBondContact O-CB 3.38Å; V462-S466 PolarHBondContact O-N 3.34Å; V462-S466 VanDerWaalsContact O-N 3.14Å
463	F	91.9	Very high	88.2	Confident	2 Å²	2	42.3 Å²	42.3	1%	0.009	20%	0.204	C	C	.	.	H	α-helix	trans	-67.8	-52.7	-178.9	174.9	-103.5	0	0	0	112.1	V439 I443 L459 C460 H461 S466 L467 A496 M497 F500	V439-F463 HydrophobicContact CG1-CD2 3.75Å; V439-F463 HydrophobicContact CG1-CE2 3.99Å; I443-F463 HydrophobicContact CD1-CD2 4.17Å; L459-F463 WeakPolarHBondContact O-CB 3.37Å; L459-F463 PolarHBondContact O-N 2.76Å; C460-F463 PolarHBondContact O-N 3.32Å; H461-F463 PolarHBondContact O-N 3.27Å; F463-S466 PolarHBondContact O-N 2.85Å; F463-L467 HydrophobicContact CE1-CD2 4.05Å; F463-L467 HydrophobicContact CZ-CD2 4.1Å; F463-L467 WeakPolarHBondContact O-CB 3.36Å; F463-L467 PolarHBondContact O-N 3.29Å; F463-A496 HydrophobicContact CE2-CB 4.08Å; F463-A496 WeakPolarHBondContact CE2-O 3.3Å; F463-A496 HydrophobicContact CZ-CB 4.25Å; F463-M497 HydrophobicContact CE1-CE 3.96Å; F463-M497 HydrophobicContact CE1-SD 3.88Å; F463-M497 HydrophobicContact CZ-CE 4.45Å; F463-M497 HydrophobicContact CZ-SD 4.31Å; F463-F500 HydrophobicContact CB-CD2 3.79Å; F463-F500 HydrophobicContact CB-CE2 4.33Å; F463-F500 HydrophobicContact CD1-CB 3.87Å; F463-F500 HydrophobicContact CD1-CD1 4.32Å; F463-F500 AromaticContact CD1-CD2 3.65Å; F463-F500 HydrophobicContact CD1-CD2 3.65Å; F463-F500 HydrophobicContact CD1-CE2 4.28Å; F463-F500 AromaticContact CD1-CG 3.67Å; F463-F500 HydrophobicContact CD1-CG 3.67Å; F463-F500 HydrophobicContact CD2-CB 3.84Å; F463-F500 HydrophobicContact CD2-CD2 4.35Å; F463-F500 HydrophobicContact CD2-CG 4.4Å; F463-F500 HydrophobicContact CE1-CB 3.77Å; F463-F500 HydrophobicContact CE1-CD1 4.31Å; F463-F500 HydrophobicContact CE1-CD2 4.34Å; F463-F500 AromaticContact CE1-CG 3.88Å; F463-F500 HydrophobicContact CE1-CG 3.88Å; F463-F500 HydrophobicContact CE2-CB 3.73Å; F463-F500 HydrophobicContact CG-CB 3.91Å; F463-F500 AromaticContact CG-CD2 3.66Å; F463-F500 HydrophobicContact CG-CD2 3.66Å; F463-F500 HydrophobicContact CG-CE2 4.48Å; F463-F500 AromaticContact CG-CG 3.95Å; F463-F500 HydrophobicContact CG-CG 3.95Å; F463-F500 HydrophobicContact CZ-CB 3.7Å; F463-F500 HydrophobicContact CZ-CG 4.34Å
464	F	90.6	Very high	88.3	Confident	7 Å²	7	39.9 Å²	39.9	3%	0.031	19%	0.192	C	C	.	.	H	α-helix	trans	-70.5	-34.1	-175.3	-69.6	-65.3	0	0	0	112.2	C460 L467 L468 M497 F500 H528 C529 L532 I543	C460-F464 HydrophobicContact CB-CD2 3.91Å; C460-F464 HydrophobicContact CB-CE2 4.03Å; C460-F464 WeakPolarHBondContact O-CB 3.47Å; C460-F464 WeakPolarHBondContact O-CD2 3.33Å; C460-F464 PolarHBondContact O-N 3.2Å; F464-L467 PolarHBondContact O-N 3Å; F464-L468 VanDerWaalsContact O-CB 3.25Å; F464-L468 WeakPolarHBondContact O-CB 3.09Å; F464-L468 PolarHBondContact O-N 3.23Å; F464-M497 HydrophobicContact CE1-CE 3.96Å; F464-F500 HydrophobicContact CE2-CE1 4.42Å; F464-F500 HydrophobicContact CE2-CE2 4.47Å; F464-F500 HydrophobicContact CE2-CZ 4.04Å; F464-F500 HydrophobicContact CZ-CE1 4.29Å; F464-F500 HydrophobicContact CZ-CZ 4.37Å; F464-H528 HydrophobicContact CB-CB 4.47Å; F464-H528 HydrophobicContact CD2-CB 3.27Å; F464-H528 HydrophobicContact CE2-CB 3.52Å; F464-H528 HydrophobicContact CG-CB 3.96Å; F464-H528 HydrophobicContact CZ-CB 4.32Å; F464-C529 HydrophobicContact CE1-CB 3.98Å; F464-C529 HydrophobicContact CZ-CB 3.95Å; F464-L532 HydrophobicContact CB-CD1 4.24Å; F464-L532 HydrophobicContact CD1-CD1 3.22Å; F464-L532 HydrophobicContact CD1-CG 4.48Å; F464-L532 HydrophobicContact CE1-CD1 3.76Å; F464-L532 HydrophobicContact CG-CD1 4.04Å; F464-I543 HydrophobicContact CE1-CD1 4.28Å; F464-I543 HydrophobicContact CZ-CD1 3.85Å
465	T	89	Confident	88.3	Confident	47 Å²	47	40.4 Å²	40.4	29%	0.288	19%	0.191	S	C	.	.	H	α-helix	trans	-66.7	-41.7	172.1	59.8	0	0	0	0	111.5	H461 V462 L467 L468 E469	H461-T465 WeakPolarHBondContact O-CB 3.49Å; H461-T465 VanDerWaalsContact O-CG2 3.23Å; H461-T465 WeakPolarHBondContact O-CG2 3.4Å; H461-T465 PolarHBondContact O-N 2.79Å; H461-T465 PolarHBondContact O-OG1 3.01Å; V462-T465 PolarHBondContact O-OG1 2.71Å; T465-L467 VanDerWaalsContact C-N 3.32Å; T465-L467 PolarHBondContact O-N 2.82Å; T465-L468 WeakPolarHBondContact O-CB 3.19Å; T465-L468 PolarHBondContact O-N 3.04Å; T465-E469 WeakPolarHBondContact O-CB 3.35Å; T465-E469 VanDerWaalsContact O-CG 3.29Å; T465-E469 WeakPolarHBondContact O-CG 3.35Å; T465-E469 PolarHBondContact O-N 3.32Å
466	S	88.4	Confident	88.1	Confident	21 Å²	21	44.9 Å²	44.9	15%	0.147	22%	0.215	C	C	.	.	H	α-helix	trans	-64.3	-38.2	176.7	-173.6	0	0	0	0	112	V439 V462 F463 T470	V439-S466 WeakPolarHBondContact CG2-OG 3.17Å; V462-S466 VanDerWaalsContact O-CB 3.23Å; V462-S466 WeakPolarHBondContact O-CB 3.38Å; V462-S466 PolarHBondContact O-N 3.34Å; V462-S466 VanDerWaalsContact O-N 3.14Å; F463-S466 PolarHBondContact O-N 2.85Å; S466-T470 WeakPolarHBondContact O-CB 3.26Å; S466-T470 PolarHBondContact O-N 2.92Å; S466-T470 PolarHBondContact O-OG1 3.28Å
467	L	89.4	Confident	87.7	Confident	2 Å²	2	45.8 Å²	45.8	1%	0.01	22%	0.22	C	C	.	.	H	α-helix	trans	-66	-42.9	175.1	-173.9	56.5	0	0	0	111.5	F463 F464 T465 T470 A471 W492 A493 L532 L539	F463-L467 HydrophobicContact CE1-CD2 4.05Å; F463-L467 HydrophobicContact CZ-CD2 4.1Å; F463-L467 WeakPolarHBondContact O-CB 3.36Å; F463-L467 PolarHBondContact O-N 3.29Å; F464-L467 PolarHBondContact O-N 3Å; T465-L467 VanDerWaalsContact C-N 3.32Å; T465-L467 PolarHBondContact O-N 2.82Å; L467-T470 PolarHBondContact O-N 2.88Å; L467-A471 WeakPolarHBondContact O-CB 3.35Å; L467-A471 PolarHBondContact O-N 3.21Å; L467-W492 HydrophobicContact CD1-CE3 4.35Å; L467-W492 HydrophobicContact CD1-CH2 3.63Å; L467-W492 HydrophobicContact CD1-CZ3 3.33Å; L467-A493 HydrophobicContact CD1-CB 4.35Å; L467-L532 HydrophobicContact CB-CD2 4.29Å; L467-L532 HydrophobicContact CD2-CD2 3.33Å; L467-L532 HydrophobicContact CG-CD2 3.6Å; L467-L539 HydrophobicContact CD2-CD1 3.95Å
468	L	87.7	Confident	87.4	Confident	37 Å²	37	42 Å²	42	19%	0.194	20%	0.203	C	C	.	.	H	α-helix	trans	-62	-46.4	176.2	-165.5	88.6	0	0	0	112	F464 T465 A471 R472 I535	F464-L468 VanDerWaalsContact O-CB 3.25Å; F464-L468 WeakPolarHBondContact O-CB 3.09Å; F464-L468 PolarHBondContact O-N 3.23Å; T465-L468 WeakPolarHBondContact O-CB 3.19Å; T465-L468 PolarHBondContact O-N 3.04Å; L468-A471 PolarHBondContact O-N 3.05Å; L468-R472 WeakPolarHBondContact O-CG 3.4Å; L468-R472 PolarHBondContact O-N 3.38Å; L468-I535 HydrophobicContact CB-CD1 4.47Å; L468-I535 HydrophobicContact CD1-CD1 3.13Å; L468-I535 HydrophobicContact CD1-CG1 3.73Å; L468-I535 HydrophobicContact CG-CD1 3.55Å
469	E	86.3	Confident	86.7	Confident	101 Å²	101	40.2 Å²	40.2	47%	0.472	21%	0.207	S	C	.	.	H	α-helix	trans	-61.5	-45.2	175.4	-74.1	171.9	-179.9	0	0	110.9	T465 A471 R472 E473	T465-E469 WeakPolarHBondContact O-CB 3.35Å; T465-E469 VanDerWaalsContact O-CG 3.29Å; T465-E469 WeakPolarHBondContact O-CG 3.35Å; T465-E469 PolarHBondContact O-N 3.32Å; E469-A471 VanDerWaalsContact C-N 3.33Å; E469-A471 PolarHBondContact O-N 3.27Å; E469-R472 PolarHBondContact O-N 3.3Å; E469-E473 WeakPolarHBondContact O-CB 3.27Å; E469-E473 VanDerWaalsContact O-CG 3.29Å; E469-E473 WeakPolarHBondContact O-CG 3.45Å; E469-E473 PolarHBondContact O-N 3.47Å
470	T	88.4	Confident	85.6	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-63.5	-39.6	178.2	-55.3	0	0	0	0	111.8	F431 R435 S466 L467 E473 F474 F489 W492	F431-T470 HydrophobicContact CE1-CG2 3.86Å; F431-T470 HydrophobicContact CZ-CG2 4.1Å; R435-T470 HydrophobicContact CB-CG2 4.04Å; R435-T470 HydrophobicContact CG-CG2 3.74Å; S466-T470 WeakPolarHBondContact O-CB 3.26Å; S466-T470 PolarHBondContact O-N 2.92Å; S466-T470 PolarHBondContact O-OG1 3.28Å; L467-T470 PolarHBondContact O-N 2.88Å; T470-E473 PolarHBondContact O-N 3.39Å; T470-F474 VanDerWaalsContact O-CB 3.24Å; T470-F474 WeakPolarHBondContact O-CB 3.38Å; T470-F474 PolarHBondContact O-N 3.21Å; T470-F489 HydrophobicContact CG2-CE2 4.36Å; T470-W492 HydrophobicContact CG2-CH2 3.58Å; T470-W492 HydrophobicContact CG2-CZ2 4.27Å; T470-W492 HydrophobicContact CG2-CZ3 3.85Å
471	A	86.9	Confident	84.3	Confident	7 Å²	7	45.6 Å²	45.6	6%	0.058	26%	0.255	C	S	.	.	H	α-helix	trans	-63.2	-46.6	176.3	0	0	0	0	0	111.9	L467 L468 E469 E473 F474 E475 F489 I535	L467-A471 WeakPolarHBondContact O-CB 3.35Å; L467-A471 PolarHBondContact O-N 3.21Å; L468-A471 PolarHBondContact O-N 3.05Å; E469-A471 VanDerWaalsContact C-N 3.33Å; E469-A471 PolarHBondContact O-N 3.27Å; A471-E473 PolarHBondContact O-N 2.98Å; A471-F474 PolarHBondContact O-N 2.85Å; A471-E475 PolarHBondContact O-N 3.23Å; A471-F489 HydrophobicContact CB-CE1 4.39Å; A471-F489 HydrophobicContact CB-CE2 4.37Å; A471-F489 HydrophobicContact CB-CZ 3.64Å; A471-I535 HydrophobicContact CB-CD1 4.25Å; A471-I535 HydrophobicContact CB-CG2 4.02Å
472	R	86.2	Confident	82.8	Confident	136 Å²	136	48.8 Å²	48.8	51%	0.513	28%	0.276	S	S	.	.	H	α-helix	trans	-62.8	-42	177.3	-72.2	174.1	178.1	168.5	0.1	112.2	L468 E469 E475 I476 I535	L468-R472 WeakPolarHBondContact O-CG 3.4Å; L468-R472 PolarHBondContact O-N 3.38Å; E469-R472 PolarHBondContact O-N 3.3Å; R472-E475 PolarHBondContact O-N 3.12Å; R472-I476 WeakPolarHBondContact O-CD1 3.48Å; R472-I476 VanDerWaalsContact O-CG1 3.27Å; R472-I476 WeakPolarHBondContact O-CG1 2.95Å; R472-I476 PolarHBondContact O-N 2.92Å; R472-I535 HydrophobicContact CG-CD1 3.97Å
473	E	84.2	Confident	81.3	Confident	17 Å²	17	48 Å²	48	8%	0.079	27%	0.273	C	S	.	.	H	α-helix	trans	-67.2	-39.2	177.2	-70.6	-172.8	-109.1	0	0	111.7	R412 F431 R435 E469 T470 A471 E475 I476 D477	R412-E473 IonicContact CZ-OE2 3.25Å; R412-E473 IonicContact NE-OE2 3.43Å; R412-E473 PolarHBondContact NE-OE2 3.36Å; R412-E473 IonicContact NH2-OE2 2.7Å; R412-E473 PolarHBondContact NH2-OE2 2.93Å; F431-E473 HydrophobicContact CZ-CB 4.26Å; R435-E473 IonicContact CZ-OE1 3.02Å; R435-E473 VanDerWaalsContact CZ-OE1 3.27Å; R435-E473 IonicContact CZ-OE2 3.49Å; R435-E473 IonicContact NH1-OE1 3.62Å; R435-E473 PolarHBondContact NH1-OE1 3.31Å; R435-E473 IonicContact NH2-OE1 2.82Å; R435-E473 PolarHBondContact NH2-OE1 2.93Å; R435-E473 IonicContact NH2-OE2 3.57Å; R435-E473 PolarHBondContact NH2-OE2 2.91Å; E469-E473 WeakPolarHBondContact O-CB 3.27Å; E469-E473 VanDerWaalsContact O-CG 3.29Å; E469-E473 WeakPolarHBondContact O-CG 3.45Å; E469-E473 PolarHBondContact O-N 3.47Å; T470-E473 PolarHBondContact O-N 3.39Å; A471-E473 PolarHBondContact O-N 2.98Å; E473-E475 PolarHBondContact O-N 3.39Å; E473-I476 PolarHBondContact O-N 3.05Å; E473-D477 WeakPolarHBondContact O-CB 3.37Å; E473-D477 PolarHBondContact O-N 3.45Å
474	F	86.6	Confident	80.4	Confident	3 Å²	3	50.6 Å²	50.6	1%	0.013	30%	0.3	C	S	.	.	H	α-helix	trans	-62.7	-42.2	174.8	-169.2	-90.1	0	0	0	112.1	F431 L432 T470 A471 F478 C485 Y486 F489	F431-F474 HydrophobicContact CD1-CD2 4.08Å; F431-F474 HydrophobicContact CE1-CB 4.31Å; F431-F474 AromaticContact CE1-CD2 3.95Å; F431-F474 HydrophobicContact CE1-CD2 3.95Å; L432-F474 HydrophobicContact CD2-CD2 4.47Å; T470-F474 VanDerWaalsContact O-CB 3.24Å; T470-F474 WeakPolarHBondContact O-CB 3.38Å; T470-F474 PolarHBondContact O-N 3.21Å; A471-F474 PolarHBondContact O-N 2.85Å; F474-F478 HydrophobicContact CD1-CD2 4.41Å; F474-F478 AromaticContact CD2-CD2 3.63Å; F474-F478 HydrophobicContact CD2-CD2 3.63Å; F474-F478 AromaticContact CD2-CE2 3.79Å; F474-F478 HydrophobicContact CD2-CE2 3.79Å; F474-F478 HydrophobicContact CD2-CG 4.49Å; F474-F478 HydrophobicContact CE1-CB 4.26Å; F474-F478 HydrophobicContact CE1-CD2 4.39Å; F474-F478 HydrophobicContact CE1-CG 4.43Å; F474-F478 AromaticContact CE2-CD2 3.61Å; F474-F478 HydrophobicContact CE2-CD2 3.61Å; F474-F478 AromaticContact CE2-CE2 3.72Å; F474-F478 HydrophobicContact CE2-CE2 3.72Å; F474-F478 HydrophobicContact CE2-CG 4.14Å; F474-F478 HydrophobicContact CE2-CZ 4.32Å; F474-F478 HydrophobicContact CG-CD2 4.05Å; F474-F478 HydrophobicContact CZ-CB 4.4Å; F474-F478 HydrophobicContact CZ-CD2 4.01Å; F474-F478 HydrophobicContact CZ-CE2 4.48Å; F474-F478 HydrophobicContact CZ-CG 4.1Å; F474-F478 WeakPolarHBondContact O-CB 3.22Å; F474-F478 WeakPolarHBondContact O-CD2 3.32Å; F474-F478 PolarHBondContact O-N 3.47Å; F474-C485 HydrophobicContact CZ-CB 3.9Å; F474-C485 WeakPolarHBondContact CZ-O 3.36Å; F474-Y486 HydrophobicContact CD1-CD1 4.23Å; F474-Y486 HydrophobicContact CD1-CE1 4.09Å; F474-Y486 AromaticContact CE1-CD1 3.74Å; F474-Y486 HydrophobicContact CE1-CD1 3.74Å; F474-Y486 AromaticContact CE1-CE1 3.89Å; F474-Y486 HydrophobicContact CE1-CE1 3.89Å; F474-Y486 HydrophobicContact CE1-CG 4.12Å; F474-F489 HydrophobicContact CB-CD2 4.22Å; F474-F489 HydrophobicContact CB-CE2 4.36Å; F474-F489 HydrophobicContact CD1-CB 4.17Å; F474-F489 HydrophobicContact CD1-CD2 4.24Å; F474-F489 HydrophobicContact CD1-CG 4.14Å; F474-F489 HydrophobicContact CD2-CB 4.42Å; F474-F489 HydrophobicContact CD2-CD2 4.08Å; F474-F489 HydrophobicContact CE1-CB 3.84Å; F474-F489 HydrophobicContact CE1-CG 4.3Å; F474-F489 HydrophobicContact CE2-CB 4.1Å; F474-F489 HydrophobicContact CG-CB 4.45Å; F474-F489 AromaticContact CG-CD2 3.9Å; F474-F489 HydrophobicContact CG-CD2 3.9Å; F474-F489 HydrophobicContact CG-CG 4.26Å; F474-F489 HydrophobicContact CZ-CB 3.79Å
475	E	84.3	Confident	79.9	Confident	115 Å²	115	50.4 Å²	50.4	54%	0.537	30%	0.3	S	S	.	.	H	α-helix	trans	-62.8	-41.5	175.9	-170	-179.1	-176.3	0	0	111.7	A471 R472 E473 A479	A471-E475 PolarHBondContact O-N 3.23Å; R472-E475 PolarHBondContact O-N 3.12Å; E473-E475 PolarHBondContact O-N 3.39Å; E475-A479 WeakPolarHBondContact O-CA 3.3Å; E475-A479 WeakPolarHBondContact O-CB 3.48Å; E475-A479 PolarHBondContact O-N 2.98Å; E475-A479 VanDerWaalsContact O-N 3.07Å
476	I	83.7	Confident	79.7	Confident	109 Å²	109	53 Å²	53	56%	0.559	31%	0.305	S	S	*	.	H	α-helix	trans	-66.2	-47.5	178.1	-68	164.2	0	0	0	111.5	R472 E473	R472-I476 WeakPolarHBondContact O-CD1 3.48Å; R472-I476 VanDerWaalsContact O-CG1 3.27Å; R472-I476 WeakPolarHBondContact O-CG1 2.95Å; R472-I476 PolarHBondContact O-N 2.92Å; E473-I476 PolarHBondContact O-N 3.05Å
477	D	80.6	Confident	79.6	Confident	19 Å²	19	55.8 Å²	55.8	10%	0.102	32%	0.324	C	S	.	.	H	α-helix	trans	-77.5	-31.3	-171.8	-67.7	-23.3	0	0	0	112.5	R412 V415 I419 E473	R412-D477 WeakPolarHBondContact CG-OD1 3.46Å; R412-D477 WeakPolarHBondContact CG-OD2 3.31Å; V415-D477 HydrophobicContact CG1-CB 4.47Å; I419-D477 HydrophobicContact CD1-CB 4.3Å; I419-D477 WeakPolarHBondContact CD1-O 3.44Å; E473-D477 WeakPolarHBondContact O-CB 3.37Å; E473-D477 PolarHBondContact O-N 3.45Å
478	F	81.3	Confident	79.6	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-109.3	12.2	-176.9	-63.4	-91.9	0	0	0	113.6	V415 I419 A427 C428 F474 G480 T481 C485 Y486	V415-F478 HydrophobicContact CG1-CE2 3.97Å; V415-F478 HydrophobicContact CG1-CZ 3.88Å; I419-F478 HydrophobicContact CD1-CD1 3.77Å; I419-F478 HydrophobicContact CD1-CD2 4.31Å; I419-F478 HydrophobicContact CD1-CE1 3.56Å; I419-F478 HydrophobicContact CD1-CE2 4.12Å; I419-F478 HydrophobicContact CD1-CG 4.15Å; I419-F478 HydrophobicContact CD1-CZ 3.75Å; I419-F478 HydrophobicContact CG1-CD1 4.37Å; I419-F478 HydrophobicContact CG1-CE1 3.91Å; I419-F478 HydrophobicContact CG1-CZ 4.31Å; A427-F478 HydrophobicContact CB-CZ 4.49Å; C428-F478 HydrophobicContact CB-CE1 3.89Å; C428-F478 HydrophobicContact CB-CZ 3.89Å; F474-F478 HydrophobicContact CD1-CD2 4.41Å; F474-F478 AromaticContact CD2-CD2 3.63Å; F474-F478 HydrophobicContact CD2-CD2 3.63Å; F474-F478 AromaticContact CD2-CE2 3.79Å; F474-F478 HydrophobicContact CD2-CE2 3.79Å; F474-F478 HydrophobicContact CD2-CG 4.49Å; F474-F478 HydrophobicContact CE1-CB 4.26Å; F474-F478 HydrophobicContact CE1-CD2 4.39Å; F474-F478 HydrophobicContact CE1-CG 4.43Å; F474-F478 AromaticContact CE2-CD2 3.61Å; F474-F478 HydrophobicContact CE2-CD2 3.61Å; F474-F478 AromaticContact CE2-CE2 3.72Å; F474-F478 HydrophobicContact CE2-CE2 3.72Å; F474-F478 HydrophobicContact CE2-CG 4.14Å; F474-F478 HydrophobicContact CE2-CZ 4.32Å; F474-F478 HydrophobicContact CG-CD2 4.05Å; F474-F478 HydrophobicContact CZ-CB 4.4Å; F474-F478 HydrophobicContact CZ-CD2 4.01Å; F474-F478 HydrophobicContact CZ-CE2 4.48Å; F474-F478 HydrophobicContact CZ-CG 4.1Å; F474-F478 WeakPolarHBondContact O-CB 3.22Å; F474-F478 WeakPolarHBondContact O-CD2 3.32Å; F474-F478 PolarHBondContact O-N 3.47Å; F478-G480 PolarHBondContact O-N 3.26Å; F478-T481 PolarHBondContact O-N 3.25Å; F478-C485 HydrophobicContact CD1-CB 4.19Å; F478-Y486 PolarHBondContact O-OH 3.16Å
479	A	74	Confident	79.6	Confident	67 Å²	67	56.5 Å²	56.5	55%	0.554	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	124.5	171.3	0	0	0	0	0	110.8	E475	E475-A479 WeakPolarHBondContact O-CA 3.3Å; E475-A479 WeakPolarHBondContact O-CB 3.48Å; E475-A479 PolarHBondContact O-N 2.98Å; E475-A479 VanDerWaalsContact O-N 3.07Å
480	G	66.2	Low	79.7	Confident	78 Å²	78	55.1 Å²	55.1	80%	0.804	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.9	6.8	176.2	0	0	0	0	0	115.9	F478	F478-G480 PolarHBondContact O-N 3.26Å
481	T	65.1	Low	79.9	Confident	35 Å²	35	60 Å²	60	22%	0.215	36%	0.361	C	S	.	.			trans	-92.5	118.2	169.5	-49	0	0	0	0	109.4	C424 F478 S483	C424-T481 HydrophobicContact CB-CG2 4.02Å; F478-T481 PolarHBondContact O-N 3.25Å; T481-S483 WeakPolarHBondContact CG2-OG 3.45Å; T481-S483 PolarHBondContact O-N 2.66Å
482	D	57.9	Low	80.1	Confident	175 Å²	175	60.7 Å²	60.7	94%	0.936	36%	0.362	S	S	*	.			trans	-70	15.6	179	-60.3	-31	0	0	0	113.8
483	S	59.7	Low	80.3	Confident	30 Å²	30	54.2 Å²	54.2	21%	0.21	34%	0.338	C	S	.	.	S	Bend	trans	-81.3	146.5	-177	60.5	0	0	0	0	111.2	T481 C485	T481-S483 WeakPolarHBondContact CG2-OG 3.45Å; T481-S483 PolarHBondContact O-N 2.66Å; S483-C485 PolarHBondContact O-N 3.3Å; S483-C485 PolarHBondContact OG-SG 3.28Å
484	G	72.3	Confident	80.7	Confident	56 Å²	56	60.7 Å²	60.7	58%	0.577	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	19.2	173.7	0	0	0	0	0	115.7	Y486 S487	G484-Y486 VanDerWaalsContact C-N 3.32Å; G484-Y486 PolarHBondContact O-N 3.14Å; G484-S487 WeakPolarHBondContact O-CB 3.35Å; G484-S487 PolarHBondContact O-N 3.21Å; G484-S487 VanDerWaalsContact O-N 3.14Å; G484-S487 PolarHBondContact O-OG 2.99Å
485	C	80.1	Confident	80.9	Confident	4 Å²	4	64 Å²	64	3%	0.027	39%	0.385	C	S	.	.	H	α-helix	trans	-61.6	-34.5	-178.7	-69.4	0	0	0	0	112.6	C428 F474 F478 S483 S487 A488 F489	C428-C485 HydrophobicContact CB-CB 4.14Å; F474-C485 HydrophobicContact CZ-CB 3.9Å; F474-C485 WeakPolarHBondContact CZ-O 3.36Å; F478-C485 HydrophobicContact CD1-CB 4.19Å; S483-C485 PolarHBondContact O-N 3.3Å; S483-C485 PolarHBondContact OG-SG 3.28Å; C485-S487 PolarHBondContact O-N 3.05Å; C485-A488 WeakPolarHBondContact O-CB 3.18Å; C485-A488 PolarHBondContact O-N 3.22Å; C485-A488 VanDerWaalsContact O-N 3.08Å; C485-F489 PolarHBondContact O-N 2.91Å
486	Y	84.4	Confident	81.2	Confident	102 Å²	102	58.6 Å²	58.6	40%	0.4	36%	0.36	S	S	.	.	H	α-helix	trans	-60.5	-34.4	174.6	-71.5	-84.2	0	0	0	112.6	F474 F478 G484 F489 V490	F474-Y486 HydrophobicContact CD1-CD1 4.23Å; F474-Y486 HydrophobicContact CD1-CE1 4.09Å; F474-Y486 AromaticContact CE1-CD1 3.74Å; F474-Y486 HydrophobicContact CE1-CD1 3.74Å; F474-Y486 AromaticContact CE1-CE1 3.89Å; F474-Y486 HydrophobicContact CE1-CE1 3.89Å; F474-Y486 HydrophobicContact CE1-CG 4.12Å; F478-Y486 PolarHBondContact O-OH 3.16Å; G484-Y486 VanDerWaalsContact C-N 3.32Å; G484-Y486 PolarHBondContact O-N 3.14Å; Y486-F489 WeakPolarHBondContact O-CB 3.47Å; Y486-F489 PolarHBondContact O-N 2.7Å; Y486-V490 WeakPolarHBondContact O-CG2 3.21Å; Y486-V490 PolarHBondContact O-N 2.87Å; Y486-V490 VanDerWaalsContact O-N 3.11Å
487	S	87.5	Confident	81.5	Confident	79 Å²	79	53.4 Å²	53.4	55%	0.552	33%	0.333	S	S	*	.	H	α-helix	trans	-67.1	-37.7	175.2	75	0	0	0	0	112	G484 C485 V490 V491	G484-S487 WeakPolarHBondContact O-CB 3.35Å; G484-S487 PolarHBondContact O-N 3.21Å; G484-S487 VanDerWaalsContact O-N 3.14Å; G484-S487 PolarHBondContact O-OG 2.99Å; C485-S487 PolarHBondContact O-N 3.05Å; S487-V490 PolarHBondContact O-N 3.31Å; S487-V491 WeakPolarHBondContact O-CG2 3.06Å; S487-V491 PolarHBondContact O-N 2.87Å
488	A	87.4	Confident	82	Confident	38 Å²	38	53.3 Å²	53.3	31%	0.314	34%	0.337	S	S	.	.	H	α-helix	trans	-66.3	-38.1	175.3	0	0	0	0	0	111.8	L432 C485 V491 W492	L432-A488 HydrophobicContact CD1-CB 4.18Å; C485-A488 WeakPolarHBondContact O-CB 3.18Å; C485-A488 PolarHBondContact O-N 3.22Å; C485-A488 VanDerWaalsContact O-N 3.08Å; A488-V491 PolarHBondContact O-N 2.88Å; A488-W492 WeakPolarHBondContact O-CB 3.39Å; A488-W492 PolarHBondContact O-N 2.77Å
489	F	89.1	Confident	82.4	Confident	15 Å²	15	56 Å²	56	7%	0.066	35%	0.35	C	S	.	.	H	α-helix	trans	-59.8	-45.2	172.6	175	-98.9	0	0	0	112.1	L432 T470 A471 F474 C485 Y486 V491 W492 A493 L537	L432-F489 HydrophobicContact CD2-CD2 3.9Å; T470-F489 HydrophobicContact CG2-CE2 4.36Å; A471-F489 HydrophobicContact CB-CE1 4.39Å; A471-F489 HydrophobicContact CB-CE2 4.37Å; A471-F489 HydrophobicContact CB-CZ 3.64Å; F474-F489 HydrophobicContact CB-CD2 4.22Å; F474-F489 HydrophobicContact CB-CE2 4.36Å; F474-F489 HydrophobicContact CD1-CB 4.17Å; F474-F489 HydrophobicContact CD1-CD2 4.24Å; F474-F489 HydrophobicContact CD1-CG 4.14Å; F474-F489 HydrophobicContact CD2-CB 4.42Å; F474-F489 HydrophobicContact CD2-CD2 4.08Å; F474-F489 HydrophobicContact CE1-CB 3.84Å; F474-F489 HydrophobicContact CE1-CG 4.3Å; F474-F489 HydrophobicContact CE2-CB 4.1Å; F474-F489 HydrophobicContact CG-CB 4.45Å; F474-F489 AromaticContact CG-CD2 3.9Å; F474-F489 HydrophobicContact CG-CD2 3.9Å; F474-F489 HydrophobicContact CG-CG 4.26Å; F474-F489 HydrophobicContact CZ-CB 3.79Å; C485-F489 PolarHBondContact O-N 2.91Å; Y486-F489 WeakPolarHBondContact O-CB 3.47Å; Y486-F489 PolarHBondContact O-N 2.7Å; F489-V491 PolarHBondContact O-N 3.38Å; F489-W492 HydrophobicContact CD2-CE3 4.01Å; F489-W492 HydrophobicContact CD2-CZ3 4.26Å; F489-W492 AromaticContact CE2-CE3 3.86Å; F489-W492 HydrophobicContact CE2-CE3 3.86Å; F489-W492 AromaticContact CE2-CZ3 3.67Å; F489-W492 HydrophobicContact CE2-CZ3 3.67Å; F489-W492 HydrophobicContact CZ-CZ3 4.31Å; F489-W492 PolarHBondContact O-N 2.76Å; F489-A493 WeakPolarHBondContact O-CB 3.27Å; F489-A493 PolarHBondContact O-N 3.03Å; F489-L537 HydrophobicContact CE1-CD1 4.43Å; F489-L537 HydrophobicContact CE1-CD2 4.16Å
490	V	89	Confident	83.2	Confident	73 Å²	73	52.9 Å²	52.9	44%	0.442	32%	0.324	S	S	.	.	H	α-helix	trans	-64.1	-40.5	177.7	175.7	0	0	0	0	111.6	Y486 S487 W492 A493 R494 L537	Y486-V490 WeakPolarHBondContact O-CG2 3.21Å; Y486-V490 PolarHBondContact O-N 2.87Å; Y486-V490 VanDerWaalsContact O-N 3.11Å; S487-V490 PolarHBondContact O-N 3.31Å; V490-W492 VanDerWaalsContact C-N 3.34Å; V490-A493 PolarHBondContact O-N 3.08Å; V490-R494 PolarHBondContact O-N 3.21Å; V490-L537 HydrophobicContact CG2-CD1 4.36Å
491	V	90.7	Very high	84.4	Confident	103 Å²	103	49.3 Å²	49.3	62%	0.624	29%	0.287	S	S	*	.	H	α-helix	trans	-62.1	-43.5	175.1	172	0	0	0	0	111	S487 A488 F489 R494 S495	S487-V491 WeakPolarHBondContact O-CG2 3.06Å; S487-V491 PolarHBondContact O-N 2.87Å; A488-V491 PolarHBondContact O-N 2.88Å; F489-V491 PolarHBondContact O-N 3.38Å; V491-R494 PolarHBondContact O-N 3.49Å; V491-S495 PolarHBondContact O-N 2.92Å; V491-S495 VanDerWaalsContact O-N 3.08Å
492	W	92.1	Very high	85.6	Confident	21 Å²	21	52.5 Å²	52.5	8%	0.08	30%	0.302	C	S	.	.	H	α-helix	trans	-63.4	-45.9	175.1	169.6	87.2	0	0	0	112	L432 R435 L467 T470 A488 F489 V490 R494 S495 A496	L432-W492 HydrophobicContact CB-CB 4.28Å; L432-W492 HydrophobicContact CB-CG 3.96Å; L432-W492 HydrophobicContact CD1-CB 3.94Å; L432-W492 HydrophobicContact CD1-CG 4.42Å; L432-W492 HydrophobicContact CD2-CB 4.1Å; L432-W492 HydrophobicContact CD2-CD2 3.8Å; L432-W492 HydrophobicContact CD2-CE3 3.95Å; L432-W492 HydrophobicContact CD2-CG 3.85Å; L432-W492 HydrophobicContact CG-CB 4.33Å; L432-W492 HydrophobicContact CG-CG 4.28Å; L432-W492 PolarHBondContact O-NE1 3.47Å; R435-W492 HydrophobicContact CB-CZ2 3.87Å; L467-W492 HydrophobicContact CD1-CE3 4.35Å; L467-W492 HydrophobicContact CD1-CH2 3.63Å; L467-W492 HydrophobicContact CD1-CZ3 3.33Å; T470-W492 HydrophobicContact CG2-CH2 3.58Å; T470-W492 HydrophobicContact CG2-CZ2 4.27Å; T470-W492 HydrophobicContact CG2-CZ3 3.85Å; A488-W492 WeakPolarHBondContact O-CB 3.39Å; A488-W492 PolarHBondContact O-N 2.77Å; F489-W492 HydrophobicContact CD2-CE3 4.01Å; F489-W492 HydrophobicContact CD2-CZ3 4.26Å; F489-W492 AromaticContact CE2-CE3 3.86Å; F489-W492 HydrophobicContact CE2-CE3 3.86Å; F489-W492 AromaticContact CE2-CZ3 3.67Å; F489-W492 HydrophobicContact CE2-CZ3 3.67Å; F489-W492 HydrophobicContact CZ-CZ3 4.31Å; F489-W492 PolarHBondContact O-N 2.76Å; V490-W492 VanDerWaalsContact C-N 3.34Å; W492-R494 VanDerWaalsContact C-N 3.27Å; W492-R494 PolarHBondContact O-N 2.46Å; W492-S495 CarbonylContact O-C 3.5Å; W492-S495 WeakPolarHBondContact O-CA 3.42Å; W492-S495 WeakPolarHBondContact O-CB 3.39Å; W492-S495 PolarHBondContact O-N 3.25Å; W492-A496 HydrophobicContact CZ2-CB 4.4Å; W492-A496 WeakPolarHBondContact O-CB 3.34Å; W492-A496 PolarHBondContact O-N 2.75Å
493	A	91.1	Very high	87	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-59.5	-39.6	179.3	0	0	0	0	0	111.5	L467 F489 V490 A496 M497 L537 L539	L467-A493 HydrophobicContact CD1-CB 4.35Å; F489-A493 WeakPolarHBondContact O-CB 3.27Å; F489-A493 PolarHBondContact O-N 3.03Å; V490-A493 PolarHBondContact O-N 3.08Å; A493-A496 PolarHBondContact O-N 2.75Å; A493-M497 WeakPolarHBondContact O-CB 3.31Å; A493-M497 PolarHBondContact O-N 3.43Å; A493-L537 HydrophobicContact CB-CD2 4.19Å; A493-L539 HydrophobicContact CB-CD1 4.38Å
494	R	91.3	Very high	88.4	Confident	152 Å²	152	43.8 Å²	43.8	57%	0.574	26%	0.257	S	S	*	.	H	α-helix	trans	-61.6	-44.7	171.6	177.4	179.8	176.9	124.3	2.3	112.2	V490 V491 W492 M497 G498 I542	V490-R494 PolarHBondContact O-N 3.21Å; V491-R494 PolarHBondContact O-N 3.49Å; W492-R494 VanDerWaalsContact C-N 3.27Å; W492-R494 PolarHBondContact O-N 2.46Å; R494-M497 WeakPolarHBondContact O-CB 3.22Å; R494-M497 PolarHBondContact O-N 2.84Å; R494-G498 PolarHBondContact O-N 2.76Å; R494-G498 VanDerWaalsContact O-N 3.08Å; R494-I542 HydrophobicContact CB-CD1 4.09Å; R494-I542 HydrophobicContact CG-CD1 4.12Å; R494-I542 HydrophobicContact CG-CG2 4.35Å
495	S	91.1	Very high	89.2	Confident	73 Å²	73	41.5 Å²	41.5	51%	0.51	23%	0.232	S	C	.	.	H	α-helix	trans	-66.4	-40.5	178.2	-178	0	0	0	0	112.1	V491 W492 M497 G498 M499	V491-S495 PolarHBondContact O-N 2.92Å; V491-S495 VanDerWaalsContact O-N 3.08Å; W492-S495 CarbonylContact O-C 3.5Å; W492-S495 WeakPolarHBondContact O-CA 3.42Å; W492-S495 WeakPolarHBondContact O-CB 3.39Å; W492-S495 PolarHBondContact O-N 3.25Å; S495-M497 VanDerWaalsContact C-N 3.33Å; S495-G498 PolarHBondContact O-N 2.86Å; S495-G498 VanDerWaalsContact O-N 3.16Å; S495-M499 PolarHBondContact O-N 2.85Å; S495-M499 VanDerWaalsContact O-N 3.16Å
496	A	90.9	Very high	89.4	Confident	1 Å²	1	47.9 Å²	47.9	1%	0.008	26%	0.259	C	S	.	.	H	α-helix	trans	-62.2	-41.1	174.6	0	0	0	0	0	111.5	F463 W492 A493 G498 M499 F500	F463-A496 HydrophobicContact CE2-CB 4.08Å; F463-A496 WeakPolarHBondContact CE2-O 3.3Å; F463-A496 HydrophobicContact CZ-CB 4.25Å; W492-A496 HydrophobicContact CZ2-CB 4.4Å; W492-A496 WeakPolarHBondContact O-CB 3.34Å; W492-A496 PolarHBondContact O-N 2.75Å; A493-A496 PolarHBondContact O-N 2.75Å; A496-G498 VanDerWaalsContact C-N 3.29Å; A496-G498 PolarHBondContact O-N 2.77Å; A496-M499 HydrophobicContact CB-CE 4.4Å; A496-M499 PolarHBondContact O-N 3.09Å; A496-F500 PolarHBondContact O-N 2.96Å
497	M	90.5	Very high	89.4	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-60	-39.8	173	-167.4	61.2	71	0	0	112	F463 F464 A493 R494 S495 M499 F500 V501 L539 I542 I543 L546	F463-M497 HydrophobicContact CE1-CE 3.96Å; F463-M497 HydrophobicContact CE1-SD 3.88Å; F463-M497 HydrophobicContact CZ-CE 4.45Å; F463-M497 HydrophobicContact CZ-SD 4.31Å; F464-M497 HydrophobicContact CE1-CE 3.96Å; A493-M497 WeakPolarHBondContact O-CB 3.31Å; A493-M497 PolarHBondContact O-N 3.43Å; R494-M497 WeakPolarHBondContact O-CB 3.22Å; R494-M497 PolarHBondContact O-N 2.84Å; S495-M497 VanDerWaalsContact C-N 3.33Å; M497-M499 PolarHBondContact O-N 3.15Å; M497-F500 PolarHBondContact O-N 3.38Å; M497-F500 HydrophobicContact SD-CD1 3.86Å; M497-V501 HydrophobicContact CG-CG2 4.47Å; M497-V501 WeakPolarHBondContact O-CG2 3.43Å; M497-V501 PolarHBondContact O-N 2.68Å; M497-L539 HydrophobicContact CE-CB 3.82Å; M497-L539 HydrophobicContact CE-CD1 3.47Å; M497-L539 VanDerWaalsContact CE-CD1 3.47Å; M497-L539 HydrophobicContact CE-CG 4.31Å; M497-I542 HydrophobicContact CB-CG2 4.31Å; M497-I542 HydrophobicContact CG-CG2 4.04Å; M497-I543 HydrophobicContact CE-CD1 3.94Å; M497-I543 HydrophobicContact CE-CG1 3.95Å; M497-I543 HydrophobicContact CG-CG1 3.89Å; M497-I543 HydrophobicContact SD-CD1 3.65Å; M497-I543 HydrophobicContact SD-CG1 3.38Å; M497-I543 WeakPolarHBondContact SD-CG1 3.33Å; M497-L546 HydrophobicContact CG-CD1 4.23Å
498	G	90.9	Very high	89.2	Confident	18 Å²	18	41 Å²	41	19%	0.186	22%	0.222	C	C	.	.	H	α-helix	trans	-56.8	-47.9	173	0	0	0	0	0	112.6	R494 S495 A496 F500 V501 D502	R494-G498 PolarHBondContact O-N 2.76Å; R494-G498 VanDerWaalsContact O-N 3.08Å; S495-G498 PolarHBondContact O-N 2.86Å; S495-G498 VanDerWaalsContact O-N 3.16Å; A496-G498 VanDerWaalsContact C-N 3.29Å; A496-G498 PolarHBondContact O-N 2.77Å; G498-F500 VanDerWaalsContact C-N 3.33Å; G498-F500 PolarHBondContact O-N 3.46Å; G498-V501 PolarHBondContact O-N 3.39Å; G498-D502 PolarHBondContact O-N 3.32Å
499	M	88.5	Confident	89	Confident	55 Å²	55	41 Å²	41	27%	0.271	22%	0.215	S	C	.	.	H	α-helix	trans	-63.2	-38.4	177.4	-66.7	-171.7	-72.9	0	0	112.8	S495 A496 M497 A503	S495-M499 PolarHBondContact O-N 2.85Å; S495-M499 VanDerWaalsContact O-N 3.16Å; A496-M499 HydrophobicContact CB-CE 4.4Å; A496-M499 PolarHBondContact O-N 3.09Å; M497-M499 PolarHBondContact O-N 3.15Å; M499-A503 PolarHBondContact O-N 3.29Å; M499-A503 VanDerWaalsContact O-N 3.16Å
500	F	91.7	Very high	88.4	Confident	2 Å²	2	46.2 Å²	46.2	1%	0.009	24%	0.244	C	C	.	.	H	α-helix	trans	-63	-48.6	174.2	165.1	-97.9	0	0	0	111.3	L459 F463 F464 A496 M497 G498 D502 A503 F504 A525	L459-F500 HydrophobicContact CD2-CD2 4.44Å; L459-F500 HydrophobicContact CD2-CE2 4.15Å; L459-F500 HydrophobicContact CG-CD2 4.21Å; L459-F500 HydrophobicContact CG-CE2 3.95Å; F463-F500 HydrophobicContact CB-CD2 3.79Å; F463-F500 HydrophobicContact CB-CE2 4.33Å; F463-F500 HydrophobicContact CD1-CB 3.87Å; F463-F500 HydrophobicContact CD1-CD1 4.32Å; F463-F500 AromaticContact CD1-CD2 3.65Å; F463-F500 HydrophobicContact CD1-CD2 3.65Å; F463-F500 HydrophobicContact CD1-CE2 4.28Å; F463-F500 AromaticContact CD1-CG 3.67Å; F463-F500 HydrophobicContact CD1-CG 3.67Å; F463-F500 HydrophobicContact CD2-CB 3.84Å; F463-F500 HydrophobicContact CD2-CD2 4.35Å; F463-F500 HydrophobicContact CD2-CG 4.4Å; F463-F500 HydrophobicContact CE1-CB 3.77Å; F463-F500 HydrophobicContact CE1-CD1 4.31Å; F463-F500 HydrophobicContact CE1-CD2 4.34Å; F463-F500 AromaticContact CE1-CG 3.88Å; F463-F500 HydrophobicContact CE1-CG 3.88Å; F463-F500 HydrophobicContact CE2-CB 3.73Å; F463-F500 HydrophobicContact CG-CB 3.91Å; F463-F500 AromaticContact CG-CD2 3.66Å; F463-F500 HydrophobicContact CG-CD2 3.66Å; F463-F500 HydrophobicContact CG-CE2 4.48Å; F463-F500 AromaticContact CG-CG 3.95Å; F463-F500 HydrophobicContact CG-CG 3.95Å; F463-F500 HydrophobicContact CZ-CB 3.7Å; F463-F500 HydrophobicContact CZ-CG 4.34Å; F464-F500 HydrophobicContact CE2-CE1 4.42Å; F464-F500 HydrophobicContact CE2-CE2 4.47Å; F464-F500 HydrophobicContact CE2-CZ 4.04Å; F464-F500 HydrophobicContact CZ-CE1 4.29Å; F464-F500 HydrophobicContact CZ-CZ 4.37Å; A496-F500 PolarHBondContact O-N 2.96Å; M497-F500 PolarHBondContact O-N 3.38Å; M497-F500 HydrophobicContact SD-CD1 3.86Å; G498-F500 VanDerWaalsContact C-N 3.33Å; G498-F500 PolarHBondContact O-N 3.46Å; F500-D502 VanDerWaalsContact C-N 3.34Å; F500-D502 PolarHBondContact O-N 3.11Å; F500-A503 PolarHBondContact O-N 2.88Å; F500-F504 HydrophobicContact CZ-CD2 4.14Å; F500-F504 VanDerWaalsContact O-CB 3.3Å; F500-F504 WeakPolarHBondContact O-CB 3.35Å; F500-F504 PolarHBondContact O-N 3.47Å; F500-A525 HydrophobicContact CZ-CB 4.32Å
501	V	91.3	Very high	87.2	Confident	4 Å²	4	45 Å²	45	2%	0.024	24%	0.238	C	C	.	.	H	α-helix	trans	-62.8	-41	179	174.4	0	0	0	0	110.8	M497 G498 A503 F504 S505 L546 L547	M497-V501 HydrophobicContact CG-CG2 4.47Å; M497-V501 WeakPolarHBondContact O-CG2 3.43Å; M497-V501 PolarHBondContact O-N 2.68Å; G498-V501 PolarHBondContact O-N 3.39Å; V501-A503 VanDerWaalsContact C-N 3.3Å; V501-A503 PolarHBondContact O-N 3.5Å; V501-F504 PolarHBondContact O-N 3.1Å; V501-S505 WeakPolarHBondContact O-CB 3.07Å; V501-S505 PolarHBondContact O-N 3.07Å; V501-S505 PolarHBondContact O-OG 3.04Å; V501-S505 VanDerWaalsContact O-OG 3.12Å; V501-L546 HydrophobicContact CB-CB 4.24Å; V501-L546 HydrophobicContact CB-CD1 4.23Å; V501-L546 HydrophobicContact CG1-CB 3.88Å; V501-L546 HydrophobicContact CG2-CB 4.05Å; V501-L546 HydrophobicContact CG2-CD1 3.9Å; V501-L547 HydrophobicContact CG1-CD2 3.71Å; V501-L547 HydrophobicContact CG1-CG 4.25Å
502	D	89.1	Confident	86.2	Confident	101 Å²	101	49.7 Å²	49.7	54%	0.54	25%	0.25	S	S	.	.	H	α-helix	trans	-60	-38.9	176.1	-75.4	-12	0	0	0	112.6	G498 F500 K506	G498-D502 PolarHBondContact O-N 3.32Å; F500-D502 VanDerWaalsContact C-N 3.34Å; F500-D502 PolarHBondContact O-N 3.11Å; D502-K506 WeakPolarHBondContact O-CD 3.49Å; D502-K506 VanDerWaalsContact O-CG 3.26Å; D502-K506 WeakPolarHBondContact O-CG 3.05Å; D502-K506 PolarHBondContact O-N 3.44Å
503	A	87.5	Confident	85.3	Confident	22 Å²	22	51.2 Å²	51.2	18%	0.182	26%	0.258	C	S	.	.	H	α-helix	trans	-73.4	-39	176.1	0	0	0	0	0	112	I443 M499 F500 V501 Q507	I443-A503 HydrophobicContact CG2-CB 4.04Å; M499-A503 PolarHBondContact O-N 3.29Å; M499-A503 VanDerWaalsContact O-N 3.16Å; F500-A503 PolarHBondContact O-N 2.88Å; V501-A503 VanDerWaalsContact C-N 3.3Å; V501-A503 PolarHBondContact O-N 3.5Å; A503-Q507 PolarHBondContact O-N 2.62Å
504	F	89.8	Confident	84.8	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-63.5	-50.2	176.5	177.3	-84.7	0	0	0	111.1	I456 L459 F500 V501 K506 Q507 V508 F509 C521 V522 A525 L547	I456-F504 HydrophobicContact CD1-CD2 3.78Å; I456-F504 HydrophobicContact CD1-CE2 4.1Å; I456-F504 HydrophobicContact CG1-CE2 4.49Å; I456-F504 HydrophobicContact CG2-CD2 4.1Å; I456-F504 HydrophobicContact CG2-CE2 3.66Å; L459-F504 HydrophobicContact CD2-CB 4.48Å; F500-F504 HydrophobicContact CZ-CD2 4.14Å; F500-F504 VanDerWaalsContact O-CB 3.3Å; F500-F504 WeakPolarHBondContact O-CB 3.35Å; F500-F504 PolarHBondContact O-N 3.47Å; V501-F504 PolarHBondContact O-N 3.1Å; F504-K506 PolarHBondContact O-N 3.15Å; F504-Q507 PolarHBondContact O-N 3.05Å; F504-V508 HydrophobicContact CD1-CB 4.47Å; F504-V508 HydrophobicContact CD1-CG2 4.21Å; F504-V508 HydrophobicContact CD2-CG2 4.28Å; F504-V508 HydrophobicContact CE1-CB 4.12Å; F504-V508 HydrophobicContact CE1-CG1 4.34Å; F504-V508 HydrophobicContact CE1-CG2 3.91Å; F504-V508 HydrophobicContact CE2-CG2 4.01Å; F504-V508 HydrophobicContact CG-CG2 4.37Å; F504-V508 HydrophobicContact CZ-CB 4.41Å; F504-V508 HydrophobicContact CZ-CG1 4.46Å; F504-V508 HydrophobicContact CZ-CG2 3.81Å; F504-V508 WeakPolarHBondContact O-CG2 3.35Å; F504-V508 PolarHBondContact O-N 3.41Å; F504-F509 HydrophobicContact CD1-CE2 4.42Å; F504-F509 HydrophobicContact CE1-CE2 4.03Å; F504-C521 HydrophobicContact CE2-CB 4.1Å; F504-C521 HydrophobicContact CZ-CB 3.92Å; F504-V522 HydrophobicContact CE1-CG2 4.06Å; F504-V522 HydrophobicContact CZ-CG2 3.92Å; F504-A525 HydrophobicContact CE2-CB 4.08Å; F504-L547 HydrophobicContact CD1-CD2 3.79Å; F504-L547 HydrophobicContact CE1-CD2 3.89Å
505	S	88.7	Confident	84.4	Confident	9 Å²	9	46.9 Å²	46.9	6%	0.063	25%	0.251	C	S	.	.	H	α-helix	trans	-65.5	-38.2	-174.3	-66.1	0	0	0	0	112.5	V501 Q507 V508 F509 D510 D550	V501-S505 WeakPolarHBondContact O-CB 3.07Å; V501-S505 PolarHBondContact O-N 3.07Å; V501-S505 PolarHBondContact O-OG 3.04Å; V501-S505 VanDerWaalsContact O-OG 3.12Å; S505-Q507 PolarHBondContact O-N 3.32Å; S505-V508 PolarHBondContact O-N 3.03Å; S505-F509 WeakPolarHBondContact O-CB 3.2Å; S505-F509 PolarHBondContact O-N 3.26Å; S505-D510 PolarHBondContact O-N 3.14Å; S505-D550 VanDerWaalsContact CB-OD2 3.27Å; S505-D550 WeakPolarHBondContact CB-OD2 3.42Å; S505-D550 PolarHBondContact OG-OD2 2.94Å
506	K	85.5	Confident	84.2	Confident	137 Å²	137	45.4 Å²	45.4	60%	0.596	24%	0.241	S	C	*	.	H	α-helix	trans	-60.9	-33.1	172.9	-74.1	171.9	-173.1	168.3	0	113.2	D502 F504 D510	D502-K506 WeakPolarHBondContact O-CD 3.49Å; D502-K506 VanDerWaalsContact O-CG 3.26Å; D502-K506 WeakPolarHBondContact O-CG 3.05Å; D502-K506 PolarHBondContact O-N 3.44Å; F504-K506 PolarHBondContact O-N 3.15Å; K506-D510 WeakPolarHBondContact O-CB 3.26Å
507	Q	83	Confident	83.9	Confident	35 Å²	35	47.3 Å²	47.3	16%	0.164	25%	0.252	C	S	.	.	H	α-helix	trans	-88.7	-29.1	-177.7	-171.9	61.6	31.8	0	0	112.8	T452 Y455 I456 A503 F504 S505 S511	T452-Q507 HydrophobicContact CG2-CG 3.94Å; Y455-Q507 HydrophobicContact CD1-CB 4.47Å; Y455-Q507 HydrophobicContact CD1-CG 3.67Å; Y455-Q507 HydrophobicContact CE1-CB 4.09Å; Y455-Q507 HydrophobicContact CE1-CG 3.71Å; I456-Q507 HydrophobicContact CD1-CB 4.39Å; I456-Q507 HydrophobicContact CD1-CG 4.4Å; A503-Q507 PolarHBondContact O-N 2.62Å; F504-Q507 PolarHBondContact O-N 3.05Å; S505-Q507 PolarHBondContact O-N 3.32Å; Q507-S511 VanDerWaalsContact O-CB 3.26Å; Q507-S511 WeakPolarHBondContact O-CB 3.16Å; Q507-S511 PolarHBondContact O-OG 3.48Å
508	V	84.2	Confident	83.7	Confident	3 Å²	3	47.5 Å²	47.5	2%	0.018	25%	0.254	C	S	.	.	H	α-helix	trans	-97.1	-39.5	-174.8	178.1	0	0	0	0	112.5	I456 F504 S505 S511 A518 C521	I456-V508 HydrophobicContact CD1-CG2 3.64Å; I456-V508 HydrophobicContact CG1-CG2 3.85Å; F504-V508 HydrophobicContact CD1-CB 4.47Å; F504-V508 HydrophobicContact CD1-CG2 4.21Å; F504-V508 HydrophobicContact CD2-CG2 4.28Å; F504-V508 HydrophobicContact CE1-CB 4.12Å; F504-V508 HydrophobicContact CE1-CG1 4.34Å; F504-V508 HydrophobicContact CE1-CG2 3.91Å; F504-V508 HydrophobicContact CE2-CG2 4.01Å; F504-V508 HydrophobicContact CG-CG2 4.37Å; F504-V508 HydrophobicContact CZ-CB 4.41Å; F504-V508 HydrophobicContact CZ-CG1 4.46Å; F504-V508 HydrophobicContact CZ-CG2 3.81Å; F504-V508 WeakPolarHBondContact O-CG2 3.35Å; F504-V508 PolarHBondContact O-N 3.41Å; S505-V508 PolarHBondContact O-N 3.03Å; V508-S511 PolarHBondContact O-OG 3.14Å; V508-A518 HydrophobicContact CG1-CB 3.68Å; V508-C521 HydrophobicContact CG1-CB 4.25Å; V508-C521 HydrophobicContact CG2-CB 3.99Å
509	F	82.3	Confident	83.5	Confident	38 Å²	38	46.8 Å²	46.8	17%	0.167	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.1	-35.1	-172.8	-59.7	-67.5	0	0	0	113.4	F504 S505 S511 A518 V522 L547 D550 I551 A554	F504-F509 HydrophobicContact CD1-CE2 4.42Å; F504-F509 HydrophobicContact CE1-CE2 4.03Å; S505-F509 WeakPolarHBondContact O-CB 3.2Å; S505-F509 PolarHBondContact O-N 3.26Å; F509-S511 VanDerWaalsContact C-N 3.32Å; F509-S511 PolarHBondContact O-N 3.32Å; F509-A518 HydrophobicContact CE1-CB 4.28Å; F509-V522 HydrophobicContact CZ-CG2 4.28Å; F509-L547 HydrophobicContact CE2-CD2 4.12Å; F509-D550 HydrophobicContact CD2-CB 3.43Å; F509-D550 VanDerWaalsContact CD2-CB 3.43Å; F509-D550 HydrophobicContact CE2-CB 3.54Å; F509-D550 HydrophobicContact CG-CB 4.01Å; F509-D550 HydrophobicContact CZ-CB 4.18Å; F509-I551 HydrophobicContact CE1-CG1 4.22Å; F509-I551 HydrophobicContact CZ-CG1 3.7Å; F509-A554 HydrophobicContact CD1-CB 3.61Å; F509-A554 HydrophobicContact CE1-CB 3.79Å
510	D	76.3	Confident	83.5	Confident	124 Å²	124	48.1 Å²	48.1	66%	0.663	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.5	-18.7	178	-65.8	-23.2	0	0	0	113	S505 K506 K512	S505-D510 PolarHBondContact O-N 3.14Å; K506-D510 WeakPolarHBondContact O-CB 3.26Å; D510-K512 VanDerWaalsContact C-N 3.26Å; D510-K512 PolarHBondContact O-N 3.07Å
511	S	64.5	Low	83.4	Confident	47 Å²	47	48 Å²	48	33%	0.329	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.8	4.7	-174.1	53.2	0	0	0	0	115.2	Q507 V508 F509 E513	Q507-S511 VanDerWaalsContact O-CB 3.26Å; Q507-S511 WeakPolarHBondContact O-CB 3.16Å; Q507-S511 PolarHBondContact O-OG 3.48Å; V508-S511 PolarHBondContact O-OG 3.14Å; F509-S511 VanDerWaalsContact C-N 3.32Å; F509-S511 PolarHBondContact O-N 3.32Å; S511-E513 PolarHBondContact O-N 3.45Å; S511-E513 WeakPolarHBondContact OG-CG 2.81Å; S511-E513 PolarHBondContact OG-OE1 2.89Å; S511-E513 VanDerWaalsContact OG-OE1 3.12Å
512	K	69.5	Low	83.3	Confident	201 Å²	201	48.7 Å²	48.7	87%	0.874	26%	0.256	S	S	*	.			trans	54.1	31.7	-175.1	-59	-175.6	178.1	-177.7	0	113.7	D510	D510-K512 VanDerWaalsContact C-N 3.26Å; D510-K512 PolarHBondContact O-N 3.07Å
513	E	72.7	Confident	83.3	Confident	53 Å²	53	50 Å²	50	25%	0.248	26%	0.257	C	S	.	.			trans	-71.8	163	178.7	-80.3	-179.4	-145.2	0	0	113	T452 S511	T452-E513 VanDerWaalsContact CB-CD 3.47Å; T452-E513 WeakPolarHBondContact CB-OE1 3.41Å; T452-E513 WeakPolarHBondContact CB-OE2 3.44Å; T452-E513 WeakPolarHBondContact CG2-OE1 3.35Å; T452-E513 VanDerWaalsContact CG2-OE2 3.26Å; T452-E513 WeakPolarHBondContact CG2-OE2 3.42Å; T452-E513 VanDerWaalsContact OG1-CD 3.25Å; T452-E513 PolarHBondContact OG1-OE1 2.96Å; T452-E513 PolarHBondContact OG1-OE2 3.48Å; S511-E513 PolarHBondContact O-N 3.45Å; S511-E513 WeakPolarHBondContact OG-CG 2.81Å; S511-E513 PolarHBondContact OG-OE1 2.89Å; S511-E513 VanDerWaalsContact OG-OE1 3.12Å
514	S	81.4	Confident	83.4	Confident	57 Å²	57	49.6 Å²	49.6	40%	0.399	25%	0.251	S	S	.	.			trans	-66.6	147.9	178.1	72.1	0	0	0	0	111.2	S516 T517 A518	S514-S516 PolarHBondContact O-N 3.46Å; S514-S516 VanDerWaalsContact O-N 3.14Å; S514-T517 PolarHBondContact N-OG1 2.94Å; S514-T517 PolarHBondContact O-N 3.42Å; S514-T517 VanDerWaalsContact O-N 3.15Å; S514-T517 PolarHBondContact O-OG1 3.48Å; S514-T517 WeakPolarHBondContact OG-CG2 3.37Å; S514-T517 PolarHBondContact OG-N 3.34Å; S514-T517 PolarHBondContact OG-OG1 2.87Å; S514-A518 PolarHBondContact O-N 3.44Å; S514-A518 VanDerWaalsContact O-N 3.1Å
515	L	83.8	Confident	83.4	Confident	5 Å²	5	49.6 Å²	49.6	3%	0.026	25%	0.251	C	S	.	.	H	α-helix	trans	-57.5	-30.9	175.5	-172.9	63.7	0	0	0	112.2	A518 A519 L555 Y558 F627 E630 L634	L515-A518 PolarHBondContact O-N 2.87Å; L515-A519 WeakPolarHBondContact O-CB 3.26Å; L515-A519 PolarHBondContact O-N 2.87Å; L515-L555 HydrophobicContact CD1-CD2 4.2Å; L515-L555 HydrophobicContact CD2-CD2 4.12Å; L515-Y558 HydrophobicContact CB-CD1 4.34Å; L515-Y558 HydrophobicContact CB-CD2 3.94Å; L515-Y558 HydrophobicContact CB-CE1 4.4Å; L515-Y558 HydrophobicContact CB-CE2 4.05Å; L515-Y558 HydrophobicContact CB-CG 4.09Å; L515-Y558 HydrophobicContact CD2-CD1 3.84Å; L515-Y558 HydrophobicContact CD2-CE1 4.22Å; L515-Y558 HydrophobicContact CD2-CG 4.12Å; L515-F627 HydrophobicContact CD2-CD2 3.74Å; L515-F627 HydrophobicContact CD2-CE2 3.93Å; L515-E630 HydrophobicContact CD2-CB 3.95Å; L515-E630 HydrophobicContact CG-CB 4.02Å; L515-L634 HydrophobicContact CD1-CD1 3.66Å; L515-L634 HydrophobicContact CG-CD1 4.37Å
516	S	85.5	Confident	83.4	Confident	41 Å²	41	53 Å²	53	29%	0.287	27%	0.265	S	S	.	.	H	α-helix	trans	-65.6	-46	176.6	175.9	0	0	0	0	112.7	S514 A518 A519 E520 E630	S514-S516 PolarHBondContact O-N 3.46Å; S514-S516 VanDerWaalsContact O-N 3.14Å; S516-A518 VanDerWaalsContact C-N 3.32Å; S516-A518 PolarHBondContact O-N 3.47Å; S516-A519 PolarHBondContact O-N 2.58Å; S516-E520 PolarHBondContact O-N 3.42Å; S516-E630 WeakPolarHBondContact CA-OE2 3.16Å
517	T	85.4	Confident	83.6	Confident	42 Å²	42	50.4 Å²	50.4	26%	0.258	26%	0.255	S	S	.	.	H	α-helix	trans	-67.1	-36.8	177.1	49	0	0	0	0	111.1	S514 E520 C521	S514-T517 PolarHBondContact N-OG1 2.94Å; S514-T517 PolarHBondContact O-N 3.42Å; S514-T517 VanDerWaalsContact O-N 3.15Å; S514-T517 PolarHBondContact O-OG1 3.48Å; S514-T517 WeakPolarHBondContact OG-CG2 3.37Å; S514-T517 PolarHBondContact OG-N 3.34Å; S514-T517 PolarHBondContact OG-OG1 2.87Å; T517-E520 PolarHBondContact O-N 3.45Å; T517-C521 WeakPolarHBondContact O-CB 3.32Å; T517-C521 PolarHBondContact O-N 2.81Å; T517-C521 PolarHBondContact O-SG 3.49Å
518	A	86.8	Confident	83.8	Confident	4 Å²	4	50.1 Å²	50.1	3%	0.033	25%	0.254	C	S	.	.	H	α-helix	trans	-62.8	-43.2	172.8	0	0	0	0	0	112.3	V508 F509 S514 L515 S516 E520 C521 V522	V508-A518 HydrophobicContact CG1-CB 3.68Å; F509-A518 HydrophobicContact CE1-CB 4.28Å; S514-A518 PolarHBondContact O-N 3.44Å; S514-A518 VanDerWaalsContact O-N 3.1Å; L515-A518 PolarHBondContact O-N 2.87Å; S516-A518 VanDerWaalsContact C-N 3.32Å; S516-A518 PolarHBondContact O-N 3.47Å; A518-E520 PolarHBondContact O-N 3.39Å; A518-C521 PolarHBondContact O-N 2.98Å; A518-V522 WeakPolarHBondContact O-CG2 3.42Å; A518-V522 PolarHBondContact O-N 3.08Å
519	A	87	Confident	83.9	Confident	3 Å²	3	50 Å²	50	3%	0.025	25%	0.253	C	S	.	.	H	α-helix	trans	-60.7	-43.1	176.3	0	0	0	0	0	112.6	L515 S516 K523 K633 L634	L515-A519 WeakPolarHBondContact O-CB 3.26Å; L515-A519 PolarHBondContact O-N 2.87Å; S516-A519 PolarHBondContact O-N 2.58Å; A519-K523 WeakPolarHBondContact O-CB 3.35Å; A519-K523 PolarHBondContact O-N 2.91Å; A519-K633 HydrophobicContact CB-CB 4.15Å; A519-K633 HydrophobicContact CB-CD 4.32Å; A519-L634 HydrophobicContact CB-CD1 4.16Å; A519-L634 HydrophobicContact CB-CD2 4.21Å; A519-L634 HydrophobicContact CB-CG 3.89Å
520	E	88.4	Confident	84.1	Confident	82 Å²	82	53.3 Å²	53.3	38%	0.383	27%	0.269	S	S	.	.	H	α-helix	trans	-64.5	-44	174.6	-71.4	-178.7	179.9	0	0	112.1	L453 S516 T517 A518 V522 K523 V524	L453-E520 HydrophobicContact CD1-CB 4.04Å; S516-E520 PolarHBondContact O-N 3.42Å; T517-E520 PolarHBondContact O-N 3.45Å; A518-E520 PolarHBondContact O-N 3.39Å; E520-V522 PolarHBondContact O-N 2.8Å; E520-K523 WeakPolarHBondContact O-CB 3.28Å; E520-K523 PolarHBondContact O-N 2.88Å; E520-V524 WeakPolarHBondContact O-CG2 3.14Å; E520-V524 PolarHBondContact O-N 2.93Å
521	C	88.8	Confident	84.5	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-61.3	-43.6	178.2	-70	0	0	0	0	112.3	I456 F504 V508 T517 A518 K523 V524 A525	I456-C521 HydrophobicContact CG1-CB 4.33Å; I456-C521 HydrophobicContact CG2-CB 4.03Å; F504-C521 HydrophobicContact CE2-CB 4.1Å; F504-C521 HydrophobicContact CZ-CB 3.92Å; V508-C521 HydrophobicContact CG1-CB 4.25Å; V508-C521 HydrophobicContact CG2-CB 3.99Å; T517-C521 WeakPolarHBondContact O-CB 3.32Å; T517-C521 PolarHBondContact O-N 2.81Å; T517-C521 PolarHBondContact O-SG 3.49Å; A518-C521 PolarHBondContact O-N 2.98Å; C521-K523 VanDerWaalsContact C-N 3.33Å; C521-V524 PolarHBondContact O-N 3.33Å; C521-A525 PolarHBondContact O-N 2.91Å
522	V	89.3	Confident	85.4	Confident	19 Å²	19	50.3 Å²	50.3	12%	0.115	25%	0.246	C	C	.	.	H	α-helix	trans	-65.4	-38.4	176.8	172.4	0	0	0	0	110.9	F504 F509 A518 E520 A525 K526 L547 I551 L634	F504-V522 HydrophobicContact CE1-CG2 4.06Å; F504-V522 HydrophobicContact CZ-CG2 3.92Å; F509-V522 HydrophobicContact CZ-CG2 4.28Å; A518-V522 WeakPolarHBondContact O-CG2 3.42Å; A518-V522 PolarHBondContact O-N 3.08Å; E520-V522 PolarHBondContact O-N 2.8Å; V522-A525 PolarHBondContact O-N 3.19Å; V522-K526 WeakPolarHBondContact O-CB 3.27Å; V522-K526 PolarHBondContact O-N 3.4Å; V522-L547 HydrophobicContact CG1-CD1 4.36Å; V522-L547 HydrophobicContact CG2-CD1 4.48Å; V522-I551 HydrophobicContact CG1-CD1 4.42Å; V522-I551 HydrophobicContact CG2-CD1 4.44Å; V522-L634 HydrophobicContact CB-CD2 3.69Å; V522-L634 HydrophobicContact CG1-CD2 3.85Å; V522-L634 HydrophobicContact CG2-CD2 3.8Å
523	K	88.6	Confident	85.8	Confident	129 Å²	129	42.6 Å²	42.6	56%	0.561	22%	0.223	S	C	*	.	H	α-helix	trans	-60.4	-47.2	175.1	-171.1	-169.3	-178.9	-127.3	0	111.6	A519 E520 C521 A525 K526 E527	A519-K523 WeakPolarHBondContact O-CB 3.35Å; A519-K523 PolarHBondContact O-N 2.91Å; E520-K523 WeakPolarHBondContact O-CB 3.28Å; E520-K523 PolarHBondContact O-N 2.88Å; C521-K523 VanDerWaalsContact C-N 3.33Å; K523-A525 PolarHBondContact O-N 3.4Å; K523-K526 WeakPolarHBondContact O-CB 3.26Å; K523-K526 PolarHBondContact O-N 3.45Å; K523-E527 WeakPolarHBondContact CE-OE1 3.3Å; K523-E527 IonicContact NZ-OE1 2.77Å; K523-E527 PolarHBondContact NZ-OE1 2.9Å; K523-E527 WeakPolarHBondContact O-CG 3.37Å; K523-E527 PolarHBondContact O-N 2.89Å
524	V	90.2	Very high	86	Confident	12 Å²	12	47 Å²	47	7%	0.073	25%	0.249	C	C	.	.	H	α-helix	trans	-60.2	-45.8	177.8	169.8	0	0	0	0	111.2	L453 H457 E520 C521 K526 E527 H528	L453-V524 HydrophobicContact CD1-CG2 4.44Å; H457-V524 VanDerWaalsContact CE1-CG1 3.45Å; H457-V524 WeakPolarHBondContact CE1-CG1 3.34Å; H457-V524 VanDerWaalsContact CE1-CG2 3.47Å; H457-V524 WeakPolarHBondContact CE1-CG2 3.45Å; H457-V524 WeakPolarHBondContact ND1-CG1 3.07Å; H457-V524 WeakPolarHBondContact NE2-CG2 3.15Å; E520-V524 WeakPolarHBondContact O-CG2 3.14Å; E520-V524 PolarHBondContact O-N 2.93Å; C521-V524 PolarHBondContact O-N 3.33Å; V524-K526 VanDerWaalsContact C-N 3.28Å; V524-K526 PolarHBondContact O-N 3.34Å; V524-E527 PolarHBondContact O-N 3.24Å; V524-H528 PolarHBondContact O-CD2 3.31Å; V524-H528 VanDerWaalsContact O-CD2 3.3Å; V524-H528 PolarHBondContact O-N 3.41Å
525	A	89.6	Confident	85.8	Confident	0 Å²	0	47 Å²	47	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-60.2	-39	177.1	0	0	0	0	0	112	F500 F504 C521 V522 K523 C529	F500-A525 HydrophobicContact CZ-CB 4.32Å; F504-A525 HydrophobicContact CE2-CB 4.08Å; C521-A525 PolarHBondContact O-N 2.91Å; V522-A525 PolarHBondContact O-N 3.19Å; K523-A525 PolarHBondContact O-N 3.4Å; A525-C529 WeakPolarHBondContact O-CB 3.45Å; A525-C529 PolarHBondContact O-N 3.49Å
526	K	88	Confident	85.7	Confident	80 Å²	80	50.1 Å²	50.1	35%	0.348	28%	0.277	S	S	.	.	H	α-helix	trans	-67.5	-44.5	176.4	-174.4	178	179.6	177.2	0	112.6	V522 K523 V524 H528 C529 Q530 T540	V522-K526 WeakPolarHBondContact O-CB 3.27Å; V522-K526 PolarHBondContact O-N 3.4Å; K523-K526 WeakPolarHBondContact O-CB 3.26Å; K523-K526 PolarHBondContact O-N 3.45Å; V524-K526 VanDerWaalsContact C-N 3.28Å; V524-K526 PolarHBondContact O-N 3.34Å; K526-H528 VanDerWaalsContact C-N 3.33Å; K526-H528 PolarHBondContact O-N 2.91Å; K526-C529 PolarHBondContact O-N 3.47Å; K526-Q530 WeakPolarHBondContact O-CG 3.17Å; K526-Q530 PolarHBondContact O-N 2.9Å; K526-T540 HydrophobicContact CG-CG2 4.49Å
527	E	89.5	Confident	85.5	Confident	84 Å²	84	49.2 Å²	49.2	39%	0.393	27%	0.269	S	S	.	.	H	α-helix	trans	-59.7	-43.8	177.5	-73.9	173.8	-174.7	0	0	111.1	K523 V524 Q530	K523-E527 WeakPolarHBondContact CE-OE1 3.3Å; K523-E527 IonicContact NZ-OE1 2.77Å; K523-E527 PolarHBondContact NZ-OE1 2.9Å; K523-E527 WeakPolarHBondContact O-CG 3.37Å; K523-E527 PolarHBondContact O-N 2.89Å; V524-E527 PolarHBondContact O-N 3.24Å; E527-Q530 PolarHBondContact O-N 3.43Å
528	H	87.2	Confident	85.6	Confident	29 Å²	29	51.8 Å²	51.8	13%	0.134	28%	0.281	C	S	.	.	H	α-helix	trans	-68.7	-36.2	175.2	-77.4	-70.4	0	0	0	113.1	C460 F464 V524 K526 Q530 Q531 L532	C460-H528 HydrophobicContact CB-CB 4.45Å; F464-H528 HydrophobicContact CB-CB 4.47Å; F464-H528 HydrophobicContact CD2-CB 3.27Å; F464-H528 HydrophobicContact CE2-CB 3.52Å; F464-H528 HydrophobicContact CG-CB 3.96Å; F464-H528 HydrophobicContact CZ-CB 4.32Å; V524-H528 PolarHBondContact O-CD2 3.31Å; V524-H528 VanDerWaalsContact O-CD2 3.3Å; V524-H528 PolarHBondContact O-N 3.41Å; K526-H528 VanDerWaalsContact C-N 3.33Å; K526-H528 PolarHBondContact O-N 2.91Å; H528-Q530 VanDerWaalsContact C-N 3.29Å; H528-Q530 PolarHBondContact O-N 2.88Å; H528-Q531 PolarHBondContact ND1-OE1 3.45Å; H528-Q531 WeakPolarHBondContact O-CB 3.21Å; H528-Q531 PolarHBondContact O-N 3.46Å; H528-L532 WeakPolarHBondContact O-CD1 3.39Å
529	C	87.7	Confident	85.5	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-63.6	-35.2	175.2	-172.1	0	0	0	0	112.6	F464 A525 K526 Q531 L532 L539 I543	F464-C529 HydrophobicContact CE1-CB 3.98Å; F464-C529 HydrophobicContact CZ-CB 3.95Å; A525-C529 WeakPolarHBondContact O-CB 3.45Å; A525-C529 PolarHBondContact O-N 3.49Å; K526-C529 PolarHBondContact O-N 3.47Å; C529-Q531 PolarHBondContact O-N 2.87Å; C529-L532 WeakPolarHBondContact O-CB 3.26Å; C529-L532 PolarHBondContact O-N 3.33Å; C529-L532 VanDerWaalsContact O-N 3.1Å; C529-L539 VanDerWaalsContact SG-C 3.58Å; C529-I543 HydrophobicContact CB-CD1 3.45Å; C529-I543 VanDerWaalsContact CB-CD1 3.45Å; C529-I543 WeakPolarHBondContact SG-CD1 3.48Å
530	Q	86.7	Confident	85.4	Confident	107 Å²	107	52.7 Å²	52.7	50%	0.5	29%	0.286	S	S	.	.	H	α-helix	trans	-63.5	-29.2	176.9	-74.5	175.3	-11.2	0	0	112.5	K526 E527 H528 L532 G533	K526-Q530 WeakPolarHBondContact O-CG 3.17Å; K526-Q530 PolarHBondContact O-N 2.9Å; E527-Q530 PolarHBondContact O-N 3.43Å; H528-Q530 VanDerWaalsContact C-N 3.29Å; H528-Q530 PolarHBondContact O-N 2.88Å; Q530-L532 PolarHBondContact O-N 2.8Å; Q530-G533 WeakPolarHBondContact O-CA 3.34Å; Q530-G533 PolarHBondContact O-N 3.38Å
531	Q	83.9	Confident	85.4	Confident	104 Å²	104	54.6 Å²	54.6	49%	0.486	29%	0.293	S	S	.	.	H	α-helix	trans	-64.2	-22.8	175.3	-61.8	171.3	-7.6	0	0	112.5	H528 C529 G533 D534	H528-Q531 PolarHBondContact ND1-OE1 3.45Å; H528-Q531 WeakPolarHBondContact O-CB 3.21Å; H528-Q531 PolarHBondContact O-N 3.46Å; C529-Q531 PolarHBondContact O-N 2.87Å; Q531-G533 PolarHBondContact O-N 3.27Å; Q531-D534 WeakPolarHBondContact O-CB 3.1Å; Q531-D534 PolarHBondContact O-N 2.96Å
532	L	82.4	Confident	85.3	Confident	5 Å²	5	55 Å²	55	3%	0.026	30%	0.295	C	S	.	.	G	3₁₀ helix	trans	-74.1	-19.1	173.1	-72.6	94.4	0	0	0	112.9	F464 L467 H528 C529 Q530 D534 I535 L537 L539	F464-L532 HydrophobicContact CB-CD1 4.24Å; F464-L532 HydrophobicContact CD1-CD1 3.22Å; F464-L532 HydrophobicContact CD1-CG 4.48Å; F464-L532 HydrophobicContact CE1-CD1 3.76Å; F464-L532 HydrophobicContact CG-CD1 4.04Å; L467-L532 HydrophobicContact CB-CD2 4.29Å; L467-L532 HydrophobicContact CD2-CD2 3.33Å; L467-L532 HydrophobicContact CG-CD2 3.6Å; H528-L532 WeakPolarHBondContact O-CD1 3.39Å; C529-L532 WeakPolarHBondContact O-CB 3.26Å; C529-L532 PolarHBondContact O-N 3.33Å; C529-L532 VanDerWaalsContact O-N 3.1Å; Q530-L532 PolarHBondContact O-N 2.8Å; L532-D534 PolarHBondContact O-N 3.2Å; L532-I535 PolarHBondContact O-N 2.93Å; L532-I535 VanDerWaalsContact O-N 3.07Å; L532-L537 CarbonylContact C-O 3.6Å; L532-L537 WeakPolarHBondContact CB-O 3.36Å; L532-L537 HydrophobicContact CD2-CD2 4.23Å; L532-L537 PolarHBondContact O-N 3.06Å; L532-L539 HydrophobicContact CD2-CD1 4.43Å
533	G	79.7	Confident	85.2	Confident	38 Å²	38	54.3 Å²	54.3	39%	0.392	29%	0.29	S	S	.	.	G	3₁₀ helix	trans	-57.9	-29.1	170.7	0	0	0	0	0	112.5	Q530 Q531 I535 G536	Q530-G533 WeakPolarHBondContact O-CA 3.34Å; Q530-G533 PolarHBondContact O-N 3.38Å; Q531-G533 PolarHBondContact O-N 3.27Å; G533-I535 PolarHBondContact O-N 2.67Å; G533-G536 WeakPolarHBondContact O-CA 3.22Å; G533-G536 PolarHBondContact O-N 2.65Å
534	D	76.9	Confident	85.1	Confident	147 Å²	147	50.6 Å²	50.6	79%	0.786	28%	0.275	S	S	*	.	G	3₁₀ helix	trans	-66	-25	177.4	-64.8	-20	0	0	0	112.8	Q531 L532 G536	Q531-D534 WeakPolarHBondContact O-CB 3.1Å; Q531-D534 PolarHBondContact O-N 2.96Å; L532-D534 PolarHBondContact O-N 3.2Å; D534-G536 VanDerWaalsContact C-N 3.33Å
535	I	76.7	Confident	85	Confident	56 Å²	56	53.1 Å²	53.1	29%	0.287	30%	0.297	S	S	.	.	G	3₁₀ helix	trans	-89	-3.4	173.7	-61.1	-162.8	0	0	0	111.4	L468 A471 R472 L532 G533	L468-I535 HydrophobicContact CB-CD1 4.47Å; L468-I535 HydrophobicContact CD1-CD1 3.13Å; L468-I535 HydrophobicContact CD1-CG1 3.73Å; L468-I535 HydrophobicContact CG-CD1 3.55Å; A471-I535 HydrophobicContact CB-CD1 4.25Å; A471-I535 HydrophobicContact CB-CG2 4.02Å; R472-I535 HydrophobicContact CG-CD1 3.97Å; L532-I535 PolarHBondContact O-N 2.93Å; L532-I535 VanDerWaalsContact O-N 3.07Å; G533-I535 PolarHBondContact O-N 2.67Å
536	G	80.4	Confident	84.9	Confident	71 Å²	71	56.2 Å²	56.2	73%	0.732	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.7	14.2	-175	0	0	0	0	0	113.9	G533 D534	G533-G536 WeakPolarHBondContact O-CA 3.22Å; G533-G536 PolarHBondContact O-N 2.65Å; D534-G536 VanDerWaalsContact C-N 3.33Å
537	L	83.1	Confident	85	Confident	21 Å²	21	52.6 Å²	52.6	11%	0.11	30%	0.298	C	S	.	.			trans	-107.9	94.3	176.7	-168.4	74.4	0	0	0	110.5	F489 V490 A493 L532 L539	F489-L537 HydrophobicContact CE1-CD1 4.43Å; F489-L537 HydrophobicContact CE1-CD2 4.16Å; V490-L537 HydrophobicContact CG2-CD1 4.36Å; A493-L537 HydrophobicContact CB-CD2 4.19Å; L532-L537 CarbonylContact C-O 3.6Å; L532-L537 WeakPolarHBondContact CB-O 3.36Å; L532-L537 HydrophobicContact CD2-CD2 4.23Å; L532-L537 PolarHBondContact O-N 3.06Å; L537-L539 HydrophobicContact CD1-CD2 4.11Å; L537-L539 HydrophobicContact CD2-CD1 3.71Å; L537-L539 HydrophobicContact CD2-CD2 4.12Å; L537-L539 HydrophobicContact CD2-CG 3.94Å; L537-L539 HydrophobicContact CG-CD1 4.21Å; L537-L539 HydrophobicContact CG-CD2 3.85Å; L537-L539 HydrophobicContact CG-CG 3.85Å; L537-L539 PolarHBondContact O-N 3.27Å
538	D	86.3	Confident	84.9	Confident	97 Å²	97	49.6 Å²	49.6	52%	0.519	29%	0.285	S	S	.	.			trans	-86.1	106	173.3	-175.2	12.9	0	0	0	111	T540 F541	D538-T540 WeakPolarHBondContact OD1-CB 3.29Å; D538-T540 PolarHBondContact OD1-N 2.87Å; D538-T540 PolarHBondContact OD1-OG1 3.46Å; D538-F541 VanDerWaalsContact O-CE1 3.28Å; D538-F541 WeakPolarHBondContact O-CE1 3.41Å
539	L	85.6	Confident	85	Confident	4 Å²	4	56.1 Å²	56.1	2%	0.021	31%	0.313	C	S	.	.			trans	-106.6	8.5	175.3	-54	178.3	0	0	0	112.7	L467 A493 M497 C529 L532 L537 F541 I542 I543	L467-L539 HydrophobicContact CD2-CD1 3.95Å; A493-L539 HydrophobicContact CB-CD1 4.38Å; M497-L539 HydrophobicContact CE-CB 3.82Å; M497-L539 HydrophobicContact CE-CD1 3.47Å; M497-L539 VanDerWaalsContact CE-CD1 3.47Å; M497-L539 HydrophobicContact CE-CG 4.31Å; C529-L539 VanDerWaalsContact SG-C 3.58Å; L532-L539 HydrophobicContact CD2-CD1 4.43Å; L537-L539 HydrophobicContact CD1-CD2 4.11Å; L537-L539 HydrophobicContact CD2-CD1 3.71Å; L537-L539 HydrophobicContact CD2-CD2 4.12Å; L537-L539 HydrophobicContact CD2-CG 3.94Å; L537-L539 HydrophobicContact CG-CD1 4.21Å; L537-L539 HydrophobicContact CG-CD2 3.85Å; L537-L539 HydrophobicContact CG-CG 3.85Å; L537-L539 PolarHBondContact O-N 3.27Å; L539-F541 VanDerWaalsContact C-N 3.26Å; L539-F541 PolarHBondContact O-N 2.94Å; L539-I542 HydrophobicContact CD2-CD1 3.73Å; L539-I542 WeakPolarHBondContact O-CB 3.43Å; L539-I542 PolarHBondContact O-N 3.42Å; L539-I543 PolarHBondContact O-N 3.1Å; L539-I543 VanDerWaalsContact O-N 3.12Å
540	T	85.4	Confident	85	Confident	22 Å²	22	58.7 Å²	58.7	14%	0.135	33%	0.327	C	S	.	.	H	α-helix	trans	-59.2	-40.9	-174.4	-49.5	0	0	0	0	111	K526 D538 I542 I543 H544	K526-T540 HydrophobicContact CG-CG2 4.49Å; D538-T540 WeakPolarHBondContact OD1-CB 3.29Å; D538-T540 PolarHBondContact OD1-N 2.87Å; D538-T540 PolarHBondContact OD1-OG1 3.46Å; T540-I542 VanDerWaalsContact C-N 3.28Å; T540-I542 PolarHBondContact O-N 3.26Å; T540-I543 PolarHBondContact O-N 3.39Å; T540-H544 VanDerWaalsContact O-CG 3.31Å; T540-H544 PolarHBondContact O-N 3.5Å
541	F	86.6	Confident	85.1	Confident	122 Å²	122	53.7 Å²	53.7	54%	0.535	30%	0.304	S	S	.	.	H	α-helix	trans	-64.9	-30.5	177.2	77.5	-87.7	0	0	0	112.9	D538 L539 A545	D538-F541 VanDerWaalsContact O-CE1 3.28Å; D538-F541 WeakPolarHBondContact O-CE1 3.41Å; L539-F541 VanDerWaalsContact C-N 3.26Å; L539-F541 PolarHBondContact O-N 2.94Å; F541-A545 VanDerWaalsContact O-CB 3.23Å; F541-A545 WeakPolarHBondContact O-CB 3.3Å; F541-A545 PolarHBondContact O-N 2.92Å
542	I	86.6	Confident	85.3	Confident	8 Å²	8	51.8 Å²	51.8	4%	0.041	30%	0.295	C	S	.	.	H	α-helix	trans	-72.9	-45.1	178.9	-56.5	-174.3	0	0	0	109.7	R494 M497 L539 T540 H544 A545 L546	R494-I542 HydrophobicContact CB-CD1 4.09Å; R494-I542 HydrophobicContact CG-CD1 4.12Å; R494-I542 HydrophobicContact CG-CG2 4.35Å; M497-I542 HydrophobicContact CB-CG2 4.31Å; M497-I542 HydrophobicContact CG-CG2 4.04Å; L539-I542 HydrophobicContact CD2-CD1 3.73Å; L539-I542 WeakPolarHBondContact O-CB 3.43Å; L539-I542 PolarHBondContact O-N 3.42Å; T540-I542 VanDerWaalsContact C-N 3.28Å; T540-I542 PolarHBondContact O-N 3.26Å; I542-H544 VanDerWaalsContact C-N 3.32Å; I542-H544 PolarHBondContact O-N 3.23Å; I542-A545 PolarHBondContact O-N 3.22Å; I542-L546 HydrophobicContact CG2-CD1 3.81Å; I542-L546 HydrophobicContact CG2-CG 4.26Å; I542-L546 WeakPolarHBondContact O-CB 3.44Å; I542-L546 VanDerWaalsContact O-CG 3.29Å; I542-L546 WeakPolarHBondContact O-CG 3.38Å; I542-L546 PolarHBondContact O-N 3.04Å
543	I	87.4	Confident	85.5	Confident	4 Å²	4	53.5 Å²	53.5	2%	0.021	31%	0.314	C	S	.	.	H	α-helix	trans	-58.4	-47.9	174.8	-70.4	-176.2	0	0	0	110.2	F464 M497 C529 L539 T540 A545 L546 L547	F464-I543 HydrophobicContact CE1-CD1 4.28Å; F464-I543 HydrophobicContact CZ-CD1 3.85Å; M497-I543 HydrophobicContact CE-CD1 3.94Å; M497-I543 HydrophobicContact CE-CG1 3.95Å; M497-I543 HydrophobicContact CG-CG1 3.89Å; M497-I543 HydrophobicContact SD-CD1 3.65Å; M497-I543 HydrophobicContact SD-CG1 3.38Å; M497-I543 WeakPolarHBondContact SD-CG1 3.33Å; C529-I543 HydrophobicContact CB-CD1 3.45Å; C529-I543 VanDerWaalsContact CB-CD1 3.45Å; C529-I543 WeakPolarHBondContact SG-CD1 3.48Å; L539-I543 PolarHBondContact O-N 3.1Å; L539-I543 VanDerWaalsContact O-N 3.12Å; T540-I543 PolarHBondContact O-N 3.39Å; I543-A545 PolarHBondContact O-N 3.1Å; I543-L546 PolarHBondContact O-N 2.83Å; I543-L547 HydrophobicContact CG2-CD1 3.5Å; I543-L547 HydrophobicContact CG2-CG 4.26Å; I543-L547 WeakPolarHBondContact O-CB 3.44Å; I543-L547 VanDerWaalsContact O-CG 3.3Å; I543-L547 WeakPolarHBondContact O-CG 3.44Å; I543-L547 PolarHBondContact O-N 3.38Å
544	H	86.5	Confident	85.9	Confident	52 Å²	52	52.8 Å²	52.8	24%	0.241	30%	0.304	C	S	.	.	H	α-helix	trans	-57.7	-51.5	176.2	-67	173.1	0	0	0	111	T540 I542 L546 L547 V548	T540-H544 VanDerWaalsContact O-CG 3.31Å; T540-H544 PolarHBondContact O-N 3.5Å; I542-H544 VanDerWaalsContact C-N 3.32Å; I542-H544 PolarHBondContact O-N 3.23Å; H544-L546 VanDerWaalsContact C-N 3.31Å; H544-L546 PolarHBondContact O-N 3.18Å; H544-L547 PolarHBondContact O-N 3.3Å; H544-V548 WeakPolarHBondContact O-CG2 3.03Å; H544-V548 PolarHBondContact O-N 3.42Å
545	A	88.3	Confident	86.4	Confident	65 Å²	65	45.8 Å²	45.8	54%	0.537	27%	0.267	S	S	.	.	H	α-helix	trans	-58.8	-38.3	-178.1	0	0	0	0	0	113.6	F541 I542 I543	F541-A545 VanDerWaalsContact O-CB 3.23Å; F541-A545 WeakPolarHBondContact O-CB 3.3Å; F541-A545 PolarHBondContact O-N 2.92Å; I542-A545 PolarHBondContact O-N 3.22Å; I543-A545 PolarHBondContact O-N 3.1Å
546	L	88.6	Confident	87	Confident	65 Å²	65	47.9 Å²	47.9	34%	0.34	28%	0.275	S	S	.	.	H	α-helix	trans	-75.4	-41.5	179.1	-67.4	173.3	0	0	0	111.8	M497 V501 I542 I543 H544 V548	M497-L546 HydrophobicContact CG-CD1 4.23Å; V501-L546 HydrophobicContact CB-CB 4.24Å; V501-L546 HydrophobicContact CB-CD1 4.23Å; V501-L546 HydrophobicContact CG1-CB 3.88Å; V501-L546 HydrophobicContact CG2-CB 4.05Å; V501-L546 HydrophobicContact CG2-CD1 3.9Å; I542-L546 HydrophobicContact CG2-CD1 3.81Å; I542-L546 HydrophobicContact CG2-CG 4.26Å; I542-L546 WeakPolarHBondContact O-CB 3.44Å; I542-L546 VanDerWaalsContact O-CG 3.29Å; I542-L546 WeakPolarHBondContact O-CG 3.38Å; I542-L546 PolarHBondContact O-N 3.04Å; I543-L546 PolarHBondContact O-N 2.83Å; H544-L546 VanDerWaalsContact C-N 3.31Å; H544-L546 PolarHBondContact O-N 3.18Å; L546-V548 VanDerWaalsContact C-N 3.29Å; L546-V548 PolarHBondContact O-N 2.86Å
547	L	89.2	Confident	87.4	Confident	3 Å²	3	47.7 Å²	47.7	2%	0.016	26%	0.262	C	S	.	.	H	α-helix	trans	-75.4	-12.3	-179.4	-68.9	175.5	0	0	0	113.9	V501 F504 F509 V522 I543 H544 K549 D550 I551	V501-L547 HydrophobicContact CG1-CD2 3.71Å; V501-L547 HydrophobicContact CG1-CG 4.25Å; F504-L547 HydrophobicContact CD1-CD2 3.79Å; F504-L547 HydrophobicContact CE1-CD2 3.89Å; F509-L547 HydrophobicContact CE2-CD2 4.12Å; V522-L547 HydrophobicContact CG1-CD1 4.36Å; V522-L547 HydrophobicContact CG2-CD1 4.48Å; I543-L547 HydrophobicContact CG2-CD1 3.5Å; I543-L547 HydrophobicContact CG2-CG 4.26Å; I543-L547 WeakPolarHBondContact O-CB 3.44Å; I543-L547 VanDerWaalsContact O-CG 3.3Å; I543-L547 WeakPolarHBondContact O-CG 3.44Å; I543-L547 PolarHBondContact O-N 3.38Å; H544-L547 PolarHBondContact O-N 3.3Å; L547-K549 VanDerWaalsContact C-N 3.31Å; L547-K549 PolarHBondContact O-N 3.49Å; L547-D550 PolarHBondContact O-N 2.99Å; L547-I551 HydrophobicContact CB-CD1 3.83Å; L547-I551 HydrophobicContact CB-CG1 4.35Å; L547-I551 WeakPolarHBondContact O-CG1 3.49Å; L547-I551 PolarHBondContact O-N 3.16Å
548	V	88.8	Confident	87.6	Confident	22 Å²	22	50.1 Å²	50.1	13%	0.133	27%	0.271	C	S	.	.	H	α-helix	trans	-53.1	-49.3	-176.3	178.3	0	0	0	0	112.4	H544 L546 D550 I551 Q552 F636 L639	H544-V548 WeakPolarHBondContact O-CG2 3.03Å; H544-V548 PolarHBondContact O-N 3.42Å; L546-V548 VanDerWaalsContact C-N 3.29Å; L546-V548 PolarHBondContact O-N 2.86Å; V548-D550 VanDerWaalsContact C-N 3.32Å; V548-D550 PolarHBondContact O-N 2.79Å; V548-I551 PolarHBondContact O-N 3.2Å; V548-Q552 HydrophobicContact CG1-CG 4.2Å; V548-Q552 WeakPolarHBondContact O-CB 3.22Å; V548-Q552 WeakPolarHBondContact O-CG 3.39Å; V548-Q552 PolarHBondContact O-N 2.96Å; V548-F636 HydrophobicContact CB-CE2 3.94Å; V548-F636 HydrophobicContact CB-CZ 4.07Å; V548-F636 HydrophobicContact CG1-CE2 3.83Å; V548-F636 HydrophobicContact CG1-CZ 4.18Å; V548-F636 HydrophobicContact CG2-CD2 4.27Å; V548-F636 HydrophobicContact CG2-CE2 3.31Å; V548-F636 HydrophobicContact CG2-CZ 3.73Å; V548-L639 HydrophobicContact CG1-CD2 4.35Å
549	K	88.6	Confident	87.7	Confident	165 Å²	165	45.7 Å²	45.7	72%	0.717	25%	0.247	S	C	*	.	H	α-helix	trans	-64.7	-41.1	-175.6	-67.4	-177.5	178.9	178.2	0	111.5	L547 Q552 G553	L547-K549 VanDerWaalsContact C-N 3.31Å; L547-K549 PolarHBondContact O-N 3.49Å; K549-Q552 PolarHBondContact O-N 3.42Å; K549-G553 PolarHBondContact O-N 2.87Å
550	D	87.7	Confident	87.9	Confident	54 Å²	54	48.6 Å²	48.6	29%	0.289	26%	0.26	S	S	.	.	H	α-helix	trans	-70.9	-41.6	-177.8	-56.2	-35.8	0	0	0	111.1	S505 F509 L547 V548 G553 A554	S505-D550 VanDerWaalsContact CB-OD2 3.27Å; S505-D550 WeakPolarHBondContact CB-OD2 3.42Å; S505-D550 PolarHBondContact OG-OD2 2.94Å; F509-D550 HydrophobicContact CD2-CB 3.43Å; F509-D550 VanDerWaalsContact CD2-CB 3.43Å; F509-D550 HydrophobicContact CE2-CB 3.54Å; F509-D550 HydrophobicContact CG-CB 4.01Å; F509-D550 HydrophobicContact CZ-CB 4.18Å; L547-D550 PolarHBondContact O-N 2.99Å; V548-D550 VanDerWaalsContact C-N 3.32Å; V548-D550 PolarHBondContact O-N 2.79Å; D550-G553 PolarHBondContact O-N 2.93Å; D550-A554 WeakPolarHBondContact O-CB 3.31Å; D550-A554 PolarHBondContact O-N 3.39Å
551	I	88	Confident	88.1	Confident	3 Å²	3	51.7 Å²	51.7	2%	0.015	28%	0.275	C	S	.	.	H	α-helix	trans	-66.9	-39.9	176	-63.3	168.2	0	0	0	110.9	F509 V522 L547 V548 G553 A554 L555 L634 F636 L639	F509-I551 HydrophobicContact CE1-CG1 4.22Å; F509-I551 HydrophobicContact CZ-CG1 3.7Å; V522-I551 HydrophobicContact CG1-CD1 4.42Å; V522-I551 HydrophobicContact CG2-CD1 4.44Å; L547-I551 HydrophobicContact CB-CD1 3.83Å; L547-I551 HydrophobicContact CB-CG1 4.35Å; L547-I551 WeakPolarHBondContact O-CG1 3.49Å; L547-I551 PolarHBondContact O-N 3.16Å; V548-I551 PolarHBondContact O-N 3.2Å; I551-G553 VanDerWaalsContact C-N 3.34Å; I551-G553 PolarHBondContact O-N 3.24Å; I551-A554 PolarHBondContact O-N 2.96Å; I551-L555 HydrophobicContact CG2-CD1 4.08Å; I551-L555 HydrophobicContact CG2-CG 4.26Å; I551-L555 WeakPolarHBondContact O-CB 3.24Å; I551-L555 VanDerWaalsContact O-CG 3.3Å; I551-L555 WeakPolarHBondContact O-CG 3.22Å; I551-L555 PolarHBondContact O-N 3.49Å; I551-L634 HydrophobicContact CD1-CD2 4.36Å; I551-L634 HydrophobicContact CG2-CB 4.2Å; I551-L634 HydrophobicContact CG2-CD1 4.31Å; I551-F636 HydrophobicContact CD1-CE1 3.67Å; I551-F636 HydrophobicContact CD1-CZ 4.23Å; I551-F636 HydrophobicContact CG2-CE1 4.48Å; I551-L639 HydrophobicContact CB-CD1 4.44Å; I551-L639 HydrophobicContact CG2-CD1 3.54Å; I551-L639 HydrophobicContact CG2-CD2 4.47Å
552	Q	88.9	Confident	88.2	Confident	63 Å²	63	45.9 Å²	45.9	29%	0.294	25%	0.25	S	C	.	.	H	α-helix	trans	-59.3	-45.5	172.6	-76	178.2	-15.4	0	0	111.5	V548 K549 L555 H556 L639 V642	V548-Q552 HydrophobicContact CG1-CG 4.2Å; V548-Q552 WeakPolarHBondContact O-CB 3.22Å; V548-Q552 WeakPolarHBondContact O-CG 3.39Å; V548-Q552 PolarHBondContact O-N 2.96Å; K549-Q552 PolarHBondContact O-N 3.42Å; Q552-L555 PolarHBondContact O-N 2.93Å; Q552-H556 WeakPolarHBondContact O-CB 3.37Å; Q552-H556 PolarHBondContact O-N 3.19Å; Q552-L639 HydrophobicContact CG-CD2 3.37Å; Q552-V642 HydrophobicContact CG-CG1 4.39Å; Q552-V642 HydrophobicContact CG-CG2 4.14Å
553	G	87.4	Confident	88.4	Confident	42 Å²	42	45.8 Å²	45.8	43%	0.433	25%	0.249	S	C	.	.	H	α-helix	trans	-60.3	-44.3	175.6	0	0	0	0	0	112.6	K549 D550 I551 H556 S557	K549-G553 PolarHBondContact O-N 2.87Å; D550-G553 PolarHBondContact O-N 2.93Å; I551-G553 VanDerWaalsContact C-N 3.34Å; I551-G553 PolarHBondContact O-N 3.24Å; G553-H556 PolarHBondContact O-N 3.12Å; G553-S557 WeakPolarHBondContact O-CB 3.41Å; G553-S557 PolarHBondContact O-N 3.44Å
554	A	87.3	Confident	88.5	Confident	22 Å²	22	51.8 Å²	51.8	18%	0.182	28%	0.277	C	S	.	.	H	α-helix	trans	-63.9	-45.3	177.9	0	0	0	0	0	112.4	F509 D550 I551 H556 S557 Y558	F509-A554 HydrophobicContact CD1-CB 3.61Å; F509-A554 HydrophobicContact CE1-CB 3.79Å; D550-A554 WeakPolarHBondContact O-CB 3.31Å; D550-A554 PolarHBondContact O-N 3.39Å; I551-A554 PolarHBondContact O-N 2.96Å; A554-H556 PolarHBondContact O-N 2.94Å; A554-S557 PolarHBondContact O-N 2.91Å; A554-Y558 WeakPolarHBondContact O-CB 2.96Å; A554-Y558 PolarHBondContact O-N 2.9Å
555	L	87.8	Confident	88.6	Confident	1 Å²	1	50.6 Å²	50.6	1%	0.005	28%	0.276	C	S	.	.	H	α-helix	trans	-62	-43	176.3	-72.5	175.3	0	0	0	111.4	L515 I551 Q552 Y558 K559 F627 A631 L639	L515-L555 HydrophobicContact CD1-CD2 4.2Å; L515-L555 HydrophobicContact CD2-CD2 4.12Å; I551-L555 HydrophobicContact CG2-CD1 4.08Å; I551-L555 HydrophobicContact CG2-CG 4.26Å; I551-L555 WeakPolarHBondContact O-CB 3.24Å; I551-L555 VanDerWaalsContact O-CG 3.3Å; I551-L555 WeakPolarHBondContact O-CG 3.22Å; I551-L555 PolarHBondContact O-N 3.49Å; Q552-L555 PolarHBondContact O-N 2.93Å; L555-Y558 PolarHBondContact O-N 2.87Å; L555-K559 VanDerWaalsContact O-CB 3.23Å; L555-K559 WeakPolarHBondContact O-CB 3.35Å; L555-K559 PolarHBondContact O-N 3.36Å; L555-F627 HydrophobicContact CD2-CE2 3.89Å; L555-F627 HydrophobicContact CD2-CZ 4.19Å; L555-A631 HydrophobicContact CD2-CB 3.65Å; L555-L639 HydrophobicContact CD1-CD1 4.08Å
556	H	88.9	Confident	88.6	Confident	99 Å²	99	47.6 Å²	47.6	46%	0.458	25%	0.251	S	S	.	.	H	α-helix	trans	-65.6	-45.3	177.8	-169.5	83.9	0	0	0	111.9	Q552 G553 A554 Y558 K559 E560	Q552-H556 WeakPolarHBondContact O-CB 3.37Å; Q552-H556 PolarHBondContact O-N 3.19Å; G553-H556 PolarHBondContact O-N 3.12Å; A554-H556 PolarHBondContact O-N 2.94Å; H556-Y558 VanDerWaalsContact C-N 3.34Å; H556-Y558 PolarHBondContact O-N 2.84Å; H556-K559 PolarHBondContact CE1-NZ 3.03Å; H556-K559 PolarHBondContact ND1-NZ 3.01Å; H556-K559 WeakPolarHBondContact O-CB 3.43Å; H556-K559 PolarHBondContact O-N 2.93Å; H556-E560 IonicContact CE1-OE1 2.93Å; H556-E560 IonicContact NE2-OE1 3.93Å; H556-E560 WeakPolarHBondContact O-CG 3.42Å; H556-E560 PolarHBondContact O-N 3.13Å
557	S	87.9	Confident	88.6	Confident	67 Å²	67	50.1 Å²	50.1	47%	0.469	26%	0.26	S	S	.	.	H	α-helix	trans	-60.5	-44.2	176.4	-179.9	0	0	0	0	111.6	G553 A554 E560 I561	G553-S557 WeakPolarHBondContact O-CB 3.41Å; G553-S557 PolarHBondContact O-N 3.44Å; A554-S557 PolarHBondContact O-N 2.91Å; S557-E560 PolarHBondContact O-N 3.41Å; S557-I561 WeakPolarHBondContact O-CG1 3.14Å; S557-I561 PolarHBondContact O-N 3.16Å
558	Y	86.9	Confident	88.7	Confident	73 Å²	73	55.3 Å²	55.3	29%	0.286	28%	0.283	S	S	.	.	H	α-helix	trans	-68.9	-37.3	179.3	-158.3	-98.3	0	0	0	112.2	L515 A554 L555 H556 I561 I562 F627	L515-Y558 HydrophobicContact CB-CD1 4.34Å; L515-Y558 HydrophobicContact CB-CD2 3.94Å; L515-Y558 HydrophobicContact CB-CE1 4.4Å; L515-Y558 HydrophobicContact CB-CE2 4.05Å; L515-Y558 HydrophobicContact CB-CG 4.09Å; L515-Y558 HydrophobicContact CD2-CD1 3.84Å; L515-Y558 HydrophobicContact CD2-CE1 4.22Å; L515-Y558 HydrophobicContact CD2-CG 4.12Å; A554-Y558 WeakPolarHBondContact O-CB 2.96Å; A554-Y558 PolarHBondContact O-N 2.9Å; L555-Y558 PolarHBondContact O-N 2.87Å; H556-Y558 VanDerWaalsContact C-N 3.34Å; H556-Y558 PolarHBondContact O-N 2.84Å; Y558-I561 PolarHBondContact O-N 2.98Å; Y558-I562 HydrophobicContact CD1-CD1 3.55Å; Y558-I562 HydrophobicContact CD1-CG1 4.08Å; Y558-I562 HydrophobicContact CE1-CD1 3.66Å; Y558-I562 HydrophobicContact CE1-CG1 4.07Å; Y558-I562 VanDerWaalsContact O-CG1 3.28Å; Y558-I562 WeakPolarHBondContact O-CG1 3.33Å; Y558-I562 PolarHBondContact O-N 3.26Å; Y558-F627 AromaticContact CD1-CD2 3.46Å; Y558-F627 HydrophobicContact CD1-CD2 3.46Å; Y558-F627 VanDerWaalsContact CD1-CD2 3.46Å; Y558-F627 AromaticContact CD1-CE2 3.98Å; Y558-F627 HydrophobicContact CD1-CE2 3.98Å; Y558-F627 HydrophobicContact CD1-CG 4.41Å; Y558-F627 HydrophobicContact CE1-CB 4.43Å; Y558-F627 AromaticContact CE1-CD2 3.98Å; Y558-F627 HydrophobicContact CE1-CD2 3.98Å
559	K	89.4	Confident	88.6	Confident	4 Å²	4	57 Å²	57	2%	0.017	29%	0.288	C	S	.	.	H	α-helix	trans	-56.1	-49.1	170.4	179.8	-148.7	66.4	159.7	0	111.1	L555 H556 I561 I562 I563 E649 I650	L555-K559 VanDerWaalsContact O-CB 3.23Å; L555-K559 WeakPolarHBondContact O-CB 3.35Å; L555-K559 PolarHBondContact O-N 3.36Å; H556-K559 PolarHBondContact CE1-NZ 3.03Å; H556-K559 PolarHBondContact ND1-NZ 3.01Å; H556-K559 WeakPolarHBondContact O-CB 3.43Å; H556-K559 PolarHBondContact O-N 2.93Å; K559-I561 PolarHBondContact O-N 3.46Å; K559-I562 PolarHBondContact O-N 2.94Å; K559-I563 HydrophobicContact CD-CD1 4.2Å; K559-I563 HydrophobicContact CG-CD1 3.95Å; K559-I563 WeakPolarHBondContact O-CG1 3.48Å; K559-I563 PolarHBondContact O-N 3.17Å; K559-E649 HydrophobicContact CD-CB 4.48Å; K559-E649 WeakPolarHBondContact CD-OE2 3.47Å; K559-E649 IonicContact NZ-OE2 3.99Å; K559-E649 PolarHBondContact NZ-OE2 3.38Å; K559-I650 HydrophobicContact CB-CD1 4.33Å; K559-I650 HydrophobicContact CG-CD1 3.89Å; K559-I650 HydrophobicContact CG-CG1 3.82Å
560	E	90.2	Very high	88.5	Confident	65 Å²	65	50.2 Å²	50.2	30%	0.304	26%	0.259	S	S	.	.	H	α-helix	trans	-60.8	-43.2	177.3	-68.2	-55.8	139.7	0	0	112	H556 S557 I562 I563 E564	H556-E560 IonicContact CE1-OE1 2.93Å; H556-E560 IonicContact NE2-OE1 3.93Å; H556-E560 WeakPolarHBondContact O-CG 3.42Å; H556-E560 PolarHBondContact O-N 3.13Å; S557-E560 PolarHBondContact O-N 3.41Å; E560-I562 VanDerWaalsContact C-N 3.3Å; E560-I562 PolarHBondContact O-N 3.31Å; E560-I563 PolarHBondContact O-N 3.47Å; E560-I563 VanDerWaalsContact O-N 3.16Å; E560-E564 WeakPolarHBondContact O-CB 3.39Å; E560-E564 WeakPolarHBondContact O-CG 3.38Å; E560-E564 PolarHBondContact O-N 3.26Å
561	I	89.3	Confident	88.4	Confident	86 Å²	86	52.2 Å²	52.2	44%	0.441	28%	0.277	S	S	.	.	H	α-helix	trans	-58.6	-42.2	175.2	-67.2	165.6	0	0	0	111.2	S557 Y558 K559 A565	S557-I561 WeakPolarHBondContact O-CG1 3.14Å; S557-I561 PolarHBondContact O-N 3.16Å; Y558-I561 PolarHBondContact O-N 2.98Å; K559-I561 PolarHBondContact O-N 3.46Å; I561-A565 VanDerWaalsContact O-CB 3.23Å; I561-A565 WeakPolarHBondContact O-CB 3.35Å; I561-A565 PolarHBondContact O-N 3.5Å
562	I	88.4	Confident	88.3	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-65.1	-44.5	176.7	-66.1	165.4	0	0	0	111	Y558 K559 E560 A565 T566 Q623 F627 I650	Y558-I562 HydrophobicContact CD1-CD1 3.55Å; Y558-I562 HydrophobicContact CD1-CG1 4.08Å; Y558-I562 HydrophobicContact CE1-CD1 3.66Å; Y558-I562 HydrophobicContact CE1-CG1 4.07Å; Y558-I562 VanDerWaalsContact O-CG1 3.28Å; Y558-I562 WeakPolarHBondContact O-CG1 3.33Å; Y558-I562 PolarHBondContact O-N 3.26Å; K559-I562 PolarHBondContact O-N 2.94Å; E560-I562 VanDerWaalsContact C-N 3.3Å; E560-I562 PolarHBondContact O-N 3.31Å; I562-A565 PolarHBondContact O-N 3.02Å; I562-T566 VanDerWaalsContact O-CB 3.27Å; I562-T566 WeakPolarHBondContact O-CB 3.16Å; I562-T566 PolarHBondContact O-N 2.82Å; I562-T566 PolarHBondContact O-OG1 3.34Å; I562-Q623 HydrophobicContact CB-CG 4.48Å; I562-Q623 HydrophobicContact CD1-CG 4.48Å; I562-Q623 HydrophobicContact CG1-CG 3.93Å; I562-Q623 HydrophobicContact CG2-CG 3.96Å; I562-F627 HydrophobicContact CD1-CB 3.52Å; I562-F627 HydrophobicContact CD1-CD1 4.26Å; I562-F627 HydrophobicContact CD1-CD2 3.77Å; I562-F627 HydrophobicContact CD1-CG 3.57Å; I562-I650 HydrophobicContact CB-CD1 4.39Å; I562-I650 HydrophobicContact CD1-CD1 3.96Å; I562-I650 HydrophobicContact CG2-CD1 4.21Å; I562-I650 HydrophobicContact CG2-CG1 4.19Å; I562-I650 HydrophobicContact CG2-CG2 3.85Å
563	I	90.3	Very high	88.1	Confident	7 Å²	7	56.9 Å²	56.9	4%	0.036	30%	0.299	C	S	.	.	H	α-helix	trans	-62.1	-47.5	179.7	-73.3	172.1	0	0	0	110.4	K559 E560 T566 K567 E649 I650 V653	K559-I563 HydrophobicContact CD-CD1 4.2Å; K559-I563 HydrophobicContact CG-CD1 3.95Å; K559-I563 WeakPolarHBondContact O-CG1 3.48Å; K559-I563 PolarHBondContact O-N 3.17Å; E560-I563 PolarHBondContact O-N 3.47Å; E560-I563 VanDerWaalsContact O-N 3.16Å; I563-T566 PolarHBondContact O-N 2.75Å; I563-K567 HydrophobicContact CG2-CD 3.94Å; I563-K567 VanDerWaalsContact CG2-CE 3.49Å; I563-K567 HydrophobicContact CG2-CG 4.48Å; I563-K567 WeakPolarHBondContact O-CB 3.29Å; I563-K567 VanDerWaalsContact O-CG 3.32Å; I563-K567 WeakPolarHBondContact O-CG 3.31Å; I563-K567 PolarHBondContact O-N 2.89Å; I563-E649 HydrophobicContact CD1-CB 4.38Å; I563-I650 HydrophobicContact CD1-CG1 4.44Å; I563-I650 HydrophobicContact CG1-CG1 4.07Å; I563-V653 HydrophobicContact CG1-CG2 4.3Å; I563-V653 HydrophobicContact CG2-CG2 4.04Å
564	E	90	Very high	87.8	Confident	129 Å²	129	60.1 Å²	60.1	60%	0.603	30%	0.304	S	S	*	.	H	α-helix	trans	-62.8	-46.1	177.7	-72.4	-175.9	166.2	0	0	111.8	E560 T566 K567 H568	E560-E564 WeakPolarHBondContact O-CB 3.39Å; E560-E564 WeakPolarHBondContact O-CG 3.38Å; E560-E564 PolarHBondContact O-N 3.26Å; E564-T566 VanDerWaalsContact C-N 3.28Å; E564-T566 PolarHBondContact O-N 2.89Å; E564-K567 PolarHBondContact O-N 3.39Å; E564-H568 WeakPolarHBondContact O-CB 3.5Å; E564-H568 PolarHBondContact O-N 2.94Å
565	A	88.8	Confident	87.7	Confident	27 Å²	27	60 Å²	60	22%	0.223	30%	0.299	C	S	.	.	H	α-helix	trans	-61.8	-37.6	176.6	0	0	0	0	0	112	I561 I562 R569	I561-A565 VanDerWaalsContact O-CB 3.23Å; I561-A565 WeakPolarHBondContact O-CB 3.35Å; I561-A565 PolarHBondContact O-N 3.5Å; I562-A565 PolarHBondContact O-N 3.02Å; A565-R569 WeakPolarHBondContact O-CG 3.21Å; A565-R569 PolarHBondContact O-N 3.11Å; A565-R569 VanDerWaalsContact O-N 3.13Å
566	T	88.6	Confident	87.5	Confident	3 Å²	3	67.7 Å²	67.7	2%	0.018	33%	0.328	C	S	.	.	H	α-helix	trans	-67.8	-46.8	176	-58.4	0	0	0	0	110.8	I562 I563 E564 H568 R569 N570 F620 V653	I562-T566 VanDerWaalsContact O-CB 3.27Å; I562-T566 WeakPolarHBondContact O-CB 3.16Å; I562-T566 PolarHBondContact O-N 2.82Å; I562-T566 PolarHBondContact O-OG1 3.34Å; I563-T566 PolarHBondContact O-N 2.75Å; E564-T566 VanDerWaalsContact C-N 3.28Å; E564-T566 PolarHBondContact O-N 2.89Å; T566-H568 VanDerWaalsContact C-N 3.34Å; T566-H568 PolarHBondContact O-N 3.46Å; T566-R569 PolarHBondContact O-N 3.43Å; T566-N570 WeakPolarHBondContact O-CB 3.41Å; T566-N570 PolarHBondContact O-N 3.26Å; T566-N570 PolarHBondContact O-ND2 2.91Å; T566-N570 PolarHBondContact O-OD1 2.86Å; T566-F620 HydrophobicContact CG2-CD2 3.8Å; T566-F620 HydrophobicContact CG2-CE2 4.36Å; T566-V653 HydrophobicContact CG2-CG1 4.24Å
567	K	89.1	Confident	87.2	Confident	118 Å²	118	70 Å²	70	51%	0.513	33%	0.333	S	S	.	.	H	α-helix	trans	-59.4	-41.8	176.2	-75	171.7	178.7	170.3	0	112.4	I563 E564 N570 S571 V653	I563-K567 HydrophobicContact CG2-CD 3.94Å; I563-K567 VanDerWaalsContact CG2-CE 3.49Å; I563-K567 HydrophobicContact CG2-CG 4.48Å; I563-K567 WeakPolarHBondContact O-CB 3.29Å; I563-K567 VanDerWaalsContact O-CG 3.32Å; I563-K567 WeakPolarHBondContact O-CG 3.31Å; I563-K567 PolarHBondContact O-N 2.89Å; E564-K567 PolarHBondContact O-N 3.39Å; K567-N570 WeakPolarHBondContact O-CB 3.37Å; K567-N570 PolarHBondContact O-N 2.95Å; K567-S571 PolarHBondContact O-N 2.99Å; K567-S571 VanDerWaalsContact O-N 3.09Å; K567-V653 HydrophobicContact CG-CG1 4Å
568	H	89.6	Confident	87	Confident	111 Å²	111	68 Å²	68	51%	0.514	32%	0.316	S	S	.	.	H	α-helix	trans	-60.5	-51.1	176	-174.2	-73.8	0	0	0	111.2	E564 T566 N570 S571 E572	E564-H568 WeakPolarHBondContact O-CB 3.5Å; E564-H568 PolarHBondContact O-N 2.94Å; T566-H568 VanDerWaalsContact C-N 3.34Å; T566-H568 PolarHBondContact O-N 3.46Å; H568-N570 VanDerWaalsContact C-N 3.29Å; H568-N570 PolarHBondContact O-N 3.48Å; H568-S571 WeakPolarHBondContact O-CB 3.38Å; H568-S571 PolarHBondContact O-N 3.36Å; H568-S571 VanDerWaalsContact O-N 3.08Å; H568-S571 PolarHBondContact O-OG 2.76Å; H568-E572 IonicContact CE1-OE1 3.34Å; H568-E572 PolarHBondContact CE1-OE1 3.11Å; H568-E572 IonicContact CE1-OE2 3.89Å; H568-E572 IonicContact ND1-OE2 3.98Å
569	R	87.6	Confident	86.8	Confident	59 Å²	59	67.2 Å²	67.2	22%	0.223	32%	0.317	C	S	.	.	H	α-helix	trans	-61.1	-38.2	177.5	-70.7	-177.6	-142.1	119.3	-2.4	112.5	A565 T566 S571 E572 E573 T616 Q623	A565-R569 WeakPolarHBondContact O-CG 3.21Å; A565-R569 PolarHBondContact O-N 3.11Å; A565-R569 VanDerWaalsContact O-N 3.13Å; T566-R569 PolarHBondContact O-N 3.43Å; R569-S571 VanDerWaalsContact C-N 3.25Å; R569-S571 PolarHBondContact O-N 3Å; R569-E572 PolarHBondContact O-N 2.8Å; R569-E573 PolarHBondContact O-N 3.01Å; R569-T616 HydrophobicContact CB-CG2 4.05Å; R569-T616 WeakPolarHBondContact O-CG2 3.47Å; R569-Q623 VanDerWaalsContact CZ-OE1 3.23Å
570	N	86.4	Confident	86.4	Confident	22 Å²	22	68.9 Å²	68.9	12%	0.118	33%	0.326	C	S	.	.	H	α-helix	trans	-63.2	-30.1	176.2	-72.2	-3.9	0	0	0	112.5	T566 K567 H568 E572 H657	T566-N570 WeakPolarHBondContact O-CB 3.41Å; T566-N570 PolarHBondContact O-N 3.26Å; T566-N570 PolarHBondContact O-ND2 2.91Å; T566-N570 PolarHBondContact O-OD1 2.86Å; K567-N570 WeakPolarHBondContact O-CB 3.37Å; K567-N570 PolarHBondContact O-N 2.95Å; H568-N570 VanDerWaalsContact C-N 3.29Å; H568-N570 PolarHBondContact O-N 3.48Å; N570-E572 VanDerWaalsContact C-N 3.33Å; N570-H657 HydrophobicContact CB-CB 4.49Å; N570-H657 VanDerWaalsContact CG-CG 3.45Å; N570-H657 VanDerWaalsContact ND2-CB 3.33Å; N570-H657 WeakPolarHBondContact ND2-CB 3.42Å; N570-H657 PolarHBondContact O-CE1 3.43Å; N570-H657 PolarHBondContact OD1-CD2 2.84Å
571	S	85.2	Confident	85.8	Confident	95 Å²	95	73 Å²	73	66%	0.664	35%	0.347	S	S	*	.	H	α-helix	trans	-73.4	-23.9	177	75.4	0	0	0	0	113.8	K567 H568 R569	K567-S571 PolarHBondContact O-N 2.99Å; K567-S571 VanDerWaalsContact O-N 3.09Å; H568-S571 WeakPolarHBondContact O-CB 3.38Å; H568-S571 PolarHBondContact O-N 3.36Å; H568-S571 VanDerWaalsContact O-N 3.08Å; H568-S571 PolarHBondContact O-OG 2.76Å; R569-S571 VanDerWaalsContact C-N 3.25Å; R569-S571 PolarHBondContact O-N 3Å
572	E	85.9	Confident	85.6	Confident	132 Å²	132	71.9 Å²	71.9	62%	0.617	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.2	2.9	178.3	-61.9	-179.7	156.2	0	0	112.5	H568 R569 N570	H568-E572 IonicContact CE1-OE1 3.34Å; H568-E572 PolarHBondContact CE1-OE1 3.11Å; H568-E572 IonicContact CE1-OE2 3.89Å; H568-E572 IonicContact ND1-OE2 3.98Å; R569-E572 PolarHBondContact O-N 2.8Å; N570-E572 VanDerWaalsContact C-N 3.33Å
573	E	84.7	Confident	85.1	Confident	33 Å²	33	76.5 Å²	76.5	15%	0.154	37%	0.374	C	S	.	.			trans	-71.8	131.7	-175.4	-177.5	56	-91.3	0	0	111.8	R569 W575 S614 T616	R569-E573 PolarHBondContact O-N 3.01Å; E573-W575 HydrophobicContact CG-CD2 3.81Å; E573-W575 HydrophobicContact CG-CE3 4.38Å; E573-W575 HydrophobicContact CG-CG 4.04Å; E573-W575 HydrophobicContact CG-CZ2 4.16Å; E573-W575 WeakPolarHBondContact OE1-CA 3.25Å; E573-W575 PolarHBondContact OE1-N 2.98Å; E573-S614 WeakPolarHBondContact OE2-CB 3.42Å; E573-S614 PolarHBondContact OE2-OG 3.28Å; E573-S614 VanDerWaalsContact OE2-OG 3.04Å; E573-T616 HydrophobicContact CB-CG2 4.04Å; E573-T616 HydrophobicContact CG-CG2 4.21Å; E573-T616 WeakPolarHBondContact OE2-CB 3.42Å; E573-T616 WeakPolarHBondContact OE2-CG2 3.47Å; E573-T616 PolarHBondContact OE2-OG1 3.03Å
574	M	81.9	Confident	84.6	Confident	110 Å²	110	83.3 Å²	83.3	54%	0.542	41%	0.406	S	S	.	.			trans	-116.4	-0.7	-177.9	-63.1	-65.1	-75	0	0	112.8	R576	M574-R576 HydrophobicContact CB-CG 4.21Å
575	W	84.3	Confident	84.2	Confident	18 Å²	18	78.7 Å²	78.7	7%	0.068	39%	0.39	C	S	.	.			trans	53.7	56.1	-179.8	-65.9	108.2	0	0	0	113	E573 V617 H657 V658 S661 F673 I674 N677	E573-W575 HydrophobicContact CG-CD2 3.81Å; E573-W575 HydrophobicContact CG-CE3 4.38Å; E573-W575 HydrophobicContact CG-CG 4.04Å; E573-W575 HydrophobicContact CG-CZ2 4.16Å; E573-W575 WeakPolarHBondContact OE1-CA 3.25Å; E573-W575 PolarHBondContact OE1-N 2.98Å; W575-V617 HydrophobicContact CZ3-CG2 4.4Å; W575-H657 AromaticContact CZ2-CD2 3.98Å; W575-H657 AromaticContact CZ2-NE2 3.75Å; W575-V658 HydrophobicContact CH2-CG2 4Å; W575-S661 PolarHBondContact NE1-OG 3.42Å; W575-F673 VanDerWaalsContact C-CE1 3.47Å; W575-F673 HydrophobicContact CB-CD1 4.24Å; W575-F673 HydrophobicContact CE3-CD1 4.5Å; W575-F673 HydrophobicContact CE3-CE1 4.49Å; W575-F673 VanDerWaalsContact O-CD1 3.26Å; W575-F673 WeakPolarHBondContact O-CD1 3.27Å; W575-I674 HydrophobicContact CB-CD1 4.48Å; W575-I674 HydrophobicContact CB-CG1 4.08Å; W575-I674 HydrophobicContact CD2-CD1 4.19Å; W575-I674 HydrophobicContact CD2-CG1 3.53Å; W575-I674 HydrophobicContact CE3-CB 4.42Å; W575-I674 HydrophobicContact CE3-CG1 3.77Å; W575-I674 HydrophobicContact CE3-CG2 4.43Å; W575-I674 HydrophobicContact CG-CD1 3.98Å; W575-I674 HydrophobicContact CG-CG1 3.66Å; W575-I674 HydrophobicContact CH2-CG2 4.22Å; W575-I674 HydrophobicContact CZ2-CG2 4.28Å; W575-I674 HydrophobicContact CZ3-CG1 4.43Å; W575-I674 HydrophobicContact CZ3-CG2 4.28Å; W575-N677 HydrophobicContact CZ3-CB 3.88Å
576	R	83.8	Confident	83.8	Confident	163 Å²	163	78.1 Å²	78.1	62%	0.615	38%	0.383	S	S	*	.			trans	-119.5	153.4	179.9	-59.6	180	-174.9	175.8	-0.6	111.4	M574	M574-R576 HydrophobicContact CB-CG 4.21Å
577	R	84.2	Confident	83.5	Confident	148 Å²	148	79.4 Å²	79.4	56%	0.558	40%	0.397	S	S	*	.			trans	-61.4	138	170.6	-63.3	-178.1	-176.6	177.9	1.2	109.7	W610 N612 F673	R577-W610 HydrophobicContact CB-CE3 3.89Å; R577-W610 HydrophobicContact CB-CZ3 4.16Å; R577-N612 WeakPolarHBondContact CD-OD1 3.41Å; R577-N612 PolarHBondContact NE-OD1 2.57Å; R577-F673 HydrophobicContact CG-CD2 4.33Å; R577-F673 HydrophobicContact CG-CE2 3.66Å; R577-F673 HydrophobicContact CG-CZ 4.13Å
578	M	82.2	Confident	83.3	Confident	26 Å²	26	79.9 Å²	79.9	13%	0.128	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	134.2	178.2	176.4	176.3	64.1	0	0	109.9	L580 L589 W610 V611 Y615 V618	M578-L580 HydrophobicContact CE-CD1 4.36Å; M578-L580 HydrophobicContact CE-CD2 3.84Å; M578-L580 HydrophobicContact CE-CG 4.2Å; M578-L580 HydrophobicContact CG-CD2 4.06Å; M578-L580 HydrophobicContact CG-CG 4.44Å; M578-L580 HydrophobicContact SD-CD2 3.78Å; M578-L589 HydrophobicContact CE-CD2 3.66Å; M578-W610 WeakPolarHBondContact O-CA 3.28Å; M578-V611 HydrophobicContact CB-CB 4.3Å; M578-V611 HydrophobicContact CE-CB 3.75Å; M578-V611 HydrophobicContact CE-CG1 4.02Å; M578-V611 HydrophobicContact CE-CG2 3.67Å; M578-V611 PolarHBondContact N-O 2.82Å; M578-V611 VanDerWaalsContact N-O 3.13Å; M578-V611 PolarHBondContact O-N 3.39Å; M578-Y615 HydrophobicContact SD-CD2 4.01Å; M578-V618 HydrophobicContact CE-CG1 4.38Å; M578-V618 HydrophobicContact CE-CG2 4.33Å
579	N	82.9	Confident	83	Confident	56 Å²	56	75 Å²	75	30%	0.299	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	120.4	170.4	-173.5	-11.7	0	0	0	109.1	M581 W610	N579-M581 VanDerWaalsContact C-N 3.3Å; N579-M581 WeakPolarHBondContact OD1-CA 3.48Å; N579-M581 PolarHBondContact OD1-N 2.99Å; N579-W610 HydrophobicContact CB-CD2 4.02Å; N579-W610 HydrophobicContact CB-CE3 3.8Å; N579-W610 HydrophobicContact CB-CH2 3.81Å; N579-W610 HydrophobicContact CB-CZ2 4Å; N579-W610 HydrophobicContact CB-CZ3 3.7Å; N579-W610 VanDerWaalsContact ND2-CZ2 3.33Å; N579-W610 WeakPolarHBondContact ND2-CZ2 3.43Å
580	L	80.4	Confident	82.8	Confident	39 Å²	39	75.2 Å²	75.2	20%	0.204	38%	0.379	C	S	.	.			trans	-88.6	2.7	-179.3	-64.7	174.6	0	0	0	113.5	M578 T582 A585 L586 L589 C609 V611	M578-L580 HydrophobicContact CE-CD1 4.36Å; M578-L580 HydrophobicContact CE-CD2 3.84Å; M578-L580 HydrophobicContact CE-CG 4.2Å; M578-L580 HydrophobicContact CG-CD2 4.06Å; M578-L580 HydrophobicContact CG-CG 4.44Å; M578-L580 HydrophobicContact SD-CD2 3.78Å; L580-T582 PolarHBondContact O-N 3.49Å; L580-A585 HydrophobicContact CB-CB 4.06Å; L580-L586 HydrophobicContact CD1-CB 3.96Å; L580-L586 HydrophobicContact CD1-CD1 3.74Å; L580-L586 HydrophobicContact CD1-CG 4.49Å; L580-L589 HydrophobicContact CD1-CB 4.21Å; L580-L589 HydrophobicContact CD1-CD2 3.71Å; L580-C609 PolarHBondContact N-O 3.41Å; L580-V611 HydrophobicContact CD1-CG2 3.88Å; L580-V611 HydrophobicContact CG-CG2 4.34Å
581	M	79.4	Confident	82.7	Confident	151 Å²	151	80.9 Å²	80.9	74%	0.744	41%	0.405	S	S	*	.	S	Bend	trans	63.1	-26.5	178.6	-53.6	-64.1	-172.3	0	0	115.7	N579	N579-M581 VanDerWaalsContact C-N 3.3Å; N579-M581 WeakPolarHBondContact OD1-CA 3.48Å; N579-M581 PolarHBondContact OD1-N 2.99Å
582	T	83.5	Confident	82.6	Confident	63 Å²	63	80.7 Å²	80.7	39%	0.387	39%	0.393	S	S	.	.	S	Bend	trans	-135.8	144.3	-176.9	60.8	0	0	0	0	111.6	L580 E584 A585 L586	L580-T582 PolarHBondContact O-N 3.49Å; T582-E584 PolarHBondContact O-N 2.96Å; T582-A585 PolarHBondContact O-N 2.86Å; T582-A585 WeakPolarHBondContact OG1-CB 3.44Å; T582-A585 PolarHBondContact OG1-N 3.39Å; T582-L586 PolarHBondContact O-N 3.44Å
583	P	78.6	Confident	82.5	Confident	97 Å²	97	74.4 Å²	74.4	63%	0.63	36%	0.364	S	S	*	.	H	α-helix	trans	-69.8	-26.3	178	27.4	-33.4	0	0	0	111.6	L586 G587 C609	P583-L586 PolarHBondContact O-N 2.91Å; P583-G587 PolarHBondContact O-N 3.43Å; P583-C609 VanDerWaalsContact CD-SG 3.58Å
584	E	80.7	Confident	82.4	Confident	149 Å²	149	80.1 Å²	80.1	70%	0.696	39%	0.388	S	S	*	.	H	α-helix	trans	-65.5	-41.8	173.8	-64.3	-179.9	-176.7	0	0	112.3	T582 L586 G587 K588	T582-E584 PolarHBondContact O-N 2.96Å; E584-L586 VanDerWaalsContact C-N 3.3Å; E584-L586 PolarHBondContact O-N 3.42Å; E584-G587 PolarHBondContact O-N 2.83Å; E584-K588 WeakPolarHBondContact O-CG 3.46Å; E584-K588 PolarHBondContact O-N 3.27Å
585	A	80.9	Confident	82.4	Confident	32 Å²	32	78.5 Å²	78.5	26%	0.264	39%	0.388	S	S	.	.	H	α-helix	trans	-65.7	-35	175.3	0	0	0	0	0	112	L580 T582 K588 L589	L580-A585 HydrophobicContact CB-CB 4.06Å; T582-A585 PolarHBondContact O-N 2.86Å; T582-A585 WeakPolarHBondContact OG1-CB 3.44Å; T582-A585 PolarHBondContact OG1-N 3.39Å; A585-K588 PolarHBondContact O-N 3.34Å; A585-L589 WeakPolarHBondContact O-CB 3.19Å; A585-L589 PolarHBondContact O-N 3.45Å
586	L	81.1	Confident	82	Confident	16 Å²	16	78.4 Å²	78.4	8%	0.084	39%	0.389	C	S	.	.	H	α-helix	trans	-65.6	-40.5	171.5	-176.8	65.3	0	0	0	111.7	L580 T582 P583 E584 L589 K590 T605 V611	L580-L586 HydrophobicContact CD1-CB 3.96Å; L580-L586 HydrophobicContact CD1-CD1 3.74Å; L580-L586 HydrophobicContact CD1-CG 4.49Å; T582-L586 PolarHBondContact O-N 3.44Å; P583-L586 PolarHBondContact O-N 2.91Å; E584-L586 VanDerWaalsContact C-N 3.3Å; E584-L586 PolarHBondContact O-N 3.42Å; L586-L589 PolarHBondContact O-N 2.9Å; L586-K590 WeakPolarHBondContact O-CG 3.48Å; L586-K590 PolarHBondContact O-N 2.96Å; L586-T605 HydrophobicContact CD1-CG2 3.87Å; L586-V611 HydrophobicContact CD1-CG2 3.6Å
587	G	82.3	Confident	81.6	Confident	30 Å²	30	71.8 Å²	71.8	31%	0.309	37%	0.372	S	S	.	.	H	α-helix	trans	-58.9	-49.3	172.9	0	0	0	0	0	112.4	P583 E584 L589 K590 E591	P583-G587 PolarHBondContact O-N 3.43Å; E584-G587 PolarHBondContact O-N 2.83Å; G587-L589 PolarHBondContact O-N 3.22Å; G587-K590 WeakPolarHBondContact O-CB 3.36Å; G587-K590 PolarHBondContact O-N 3.48Å; G587-K590 VanDerWaalsContact O-N 3.16Å; G587-E591 PolarHBondContact O-N 2.94Å
588	K	84.3	Confident	81.3	Confident	128 Å²	128	64.9 Å²	64.9	56%	0.557	35%	0.347	S	S	*	.	H	α-helix	trans	-59	-44	175.4	-70.9	179	-178.1	178.3	0	112.3	E584 A585 K590 E591 E592	E584-K588 WeakPolarHBondContact O-CG 3.46Å; E584-K588 PolarHBondContact O-N 3.27Å; A585-K588 PolarHBondContact O-N 3.34Å; K588-K590 VanDerWaalsContact C-N 3.32Å; K588-K590 PolarHBondContact O-N 3.49Å; K588-E591 PolarHBondContact O-N 2.96Å; K588-E592 WeakPolarHBondContact O-CG 3.43Å; K588-E592 PolarHBondContact O-N 3.48Å
589	L	83.9	Confident	80.8	Confident	9 Å²	9	68.1 Å²	68.1	5%	0.047	37%	0.372	C	S	.	.	H	α-helix	trans	-62.4	-39.7	176.8	180	64	0	0	0	112.2	M578 L580 A585 L586 G587 E592 M593 F601 V611 V618	M578-L589 HydrophobicContact CE-CD2 3.66Å; L580-L589 HydrophobicContact CD1-CB 4.21Å; L580-L589 HydrophobicContact CD1-CD2 3.71Å; A585-L589 WeakPolarHBondContact O-CB 3.19Å; A585-L589 PolarHBondContact O-N 3.45Å; L586-L589 PolarHBondContact O-N 2.9Å; G587-L589 PolarHBondContact O-N 3.22Å; L589-E592 PolarHBondContact O-N 3.21Å; L589-M593 HydrophobicContact CD1-CE 4.23Å; L589-M593 HydrophobicContact CD1-CG 4.24Å; L589-M593 HydrophobicContact CG-CG 4.46Å; L589-M593 WeakPolarHBondContact O-CB 3.34Å; L589-M593 VanDerWaalsContact O-CG 3.31Å; L589-M593 WeakPolarHBondContact O-CG 3.42Å; L589-M593 PolarHBondContact O-N 3.41Å; L589-F601 HydrophobicContact CD2-CE1 3.93Å; L589-F601 HydrophobicContact CD2-CZ 3.84Å; L589-F601 HydrophobicContact CG-CE1 3.94Å; L589-F601 HydrophobicContact CG-CZ 4.1Å; L589-V611 HydrophobicContact CD2-CG2 4.11Å; L589-V618 HydrophobicContact CD1-CG1 3.87Å; L589-V618 HydrophobicContact CD2-CG1 4.38Å
590	K	82.8	Confident	80.4	Confident	63 Å²	63	69.4 Å²	69.4	27%	0.274	38%	0.379	S	S	.	.	H	α-helix	trans	-62.5	-43.2	175.4	-75.6	176.5	176.4	-168.8	0	111.3	L586 G587 K588 M593 K594 F601 E602 T605	L586-K590 WeakPolarHBondContact O-CG 3.48Å; L586-K590 PolarHBondContact O-N 2.96Å; G587-K590 WeakPolarHBondContact O-CB 3.36Å; G587-K590 PolarHBondContact O-N 3.48Å; G587-K590 VanDerWaalsContact O-N 3.16Å; K588-K590 VanDerWaalsContact C-N 3.32Å; K588-K590 PolarHBondContact O-N 3.49Å; K590-M593 PolarHBondContact O-N 2.69Å; K590-K594 VanDerWaalsContact O-CB 3.29Å; K590-K594 WeakPolarHBondContact O-CB 3.45Å; K590-K594 PolarHBondContact O-N 3.41Å; K590-F601 HydrophobicContact CG-CD1 4.06Å; K590-F601 HydrophobicContact CG-CE1 4.48Å; K590-E602 HydrophobicContact CD-CG 4.5Å; K590-T605 WeakPolarHBondContact CE-OG1 3.38Å; K590-T605 PolarHBondContact NZ-OG1 3.36Å
591	E	83.7	Confident	80.3	Confident	141 Å²	141	67.8 Å²	67.8	66%	0.659	37%	0.37	S	S	*	.	H	α-helix	trans	-63.3	-44.8	175.9	-72.3	178.8	175.6	0	0	112	G587 K588 K594 S595	G587-E591 PolarHBondContact O-N 2.94Å; K588-E591 PolarHBondContact O-N 2.96Å; E591-K594 WeakPolarHBondContact O-CB 3.25Å; E591-K594 PolarHBondContact O-N 2.91Å; E591-S595 PolarHBondContact O-N 3.43Å; E591-S595 PolarHBondContact O-OG 2.89Å
592	E	83.4	Confident	80	Confident	91 Å²	91	67 Å²	67	43%	0.425	36%	0.364	S	S	.	.	H	α-helix	trans	-64.5	-40.7	177.2	-71.9	172.2	-169.1	0	0	112.5	K588 L589 K594 S595 C596 K622	K588-E592 WeakPolarHBondContact O-CG 3.43Å; K588-E592 PolarHBondContact O-N 3.48Å; L589-E592 PolarHBondContact O-N 3.21Å; E592-K594 VanDerWaalsContact C-N 3.29Å; E592-K594 PolarHBondContact O-N 3.5Å; E592-S595 WeakPolarHBondContact CA-OG 3.39Å; E592-S595 PolarHBondContact O-N 2.79Å; E592-S595 PolarHBondContact O-OG 3.44Å; E592-C596 PolarHBondContact O-N 2.97Å; E592-C596 VanDerWaalsContact O-N 3.07Å; E592-C596 PolarHBondContact O-SG 3.31Å; E592-K622 WeakPolarHBondContact OE2-CE 3.2Å; E592-K622 IonicContact OE2-NZ 3.02Å; E592-K622 PolarHBondContact OE2-NZ 2.88Å
593	M	83.3	Confident	79.7	Confident	0 Å²	0	70.5 Å²	70.5	0%	0	38%	0.376	C	S	.	.	H	α-helix	trans	-66.5	-34.8	174.9	-75.2	-64.2	-177.5	0	0	111.8	L589 K590 C596 G597 V598 F601 V618 T621 K622	L589-M593 HydrophobicContact CD1-CE 4.23Å; L589-M593 HydrophobicContact CD1-CG 4.24Å; L589-M593 HydrophobicContact CG-CG 4.46Å; L589-M593 WeakPolarHBondContact O-CB 3.34Å; L589-M593 VanDerWaalsContact O-CG 3.31Å; L589-M593 WeakPolarHBondContact O-CG 3.42Å; L589-M593 PolarHBondContact O-N 3.41Å; K590-M593 PolarHBondContact O-N 2.69Å; M593-C596 PolarHBondContact O-N 3.22Å; M593-G597 PolarHBondContact O-N 3.06Å; M593-V598 HydrophobicContact CB-CB 4.46Å; M593-V598 WeakPolarHBondContact O-CB 3.2Å; M593-V598 PolarHBondContact O-N 2.93Å; M593-F601 HydrophobicContact CB-CB 4.1Å; M593-F601 HydrophobicContact CB-CD1 4.14Å; M593-F601 HydrophobicContact CB-CD2 4.09Å; M593-F601 HydrophobicContact CB-CG 3.84Å; M593-F601 HydrophobicContact CE-CE2 4.09Å; M593-F601 HydrophobicContact CE-CZ 4.47Å; M593-F601 HydrophobicContact CG-CD1 4.09Å; M593-F601 HydrophobicContact CG-CD2 3.76Å; M593-F601 HydrophobicContact CG-CE1 4.13Å; M593-F601 HydrophobicContact CG-CE2 3.81Å; M593-F601 HydrophobicContact CG-CG 3.91Å; M593-F601 HydrophobicContact CG-CZ 4Å; M593-F601 HydrophobicContact SD-CD2 4.35Å; M593-F601 HydrophobicContact SD-CE2 4.3Å; M593-V618 HydrophobicContact CE-CB 4.05Å; M593-V618 HydrophobicContact CE-CG1 3.44Å; M593-V618 VanDerWaalsContact CE-CG1 3.44Å; M593-V618 HydrophobicContact CE-CG2 4.29Å; M593-T621 HydrophobicContact CE-CG2 4.45Å; M593-T621 HydrophobicContact SD-CG2 4.15Å; M593-K622 HydrophobicContact CE-CG 4.1Å
594	K	83.4	Confident	79.5	Confident	153 Å²	153	66.9 Å²	66.9	67%	0.665	35%	0.35	S	S	*	.	H	α-helix	trans	-68.5	-39.2	174.2	-168.9	177.6	-179.1	179.7	0	111.9	K590 E591 E592 C596 G597	K590-K594 VanDerWaalsContact O-CB 3.29Å; K590-K594 WeakPolarHBondContact O-CB 3.45Å; K590-K594 PolarHBondContact O-N 3.41Å; E591-K594 WeakPolarHBondContact O-CB 3.25Å; E591-K594 PolarHBondContact O-N 2.91Å; E592-K594 VanDerWaalsContact C-N 3.29Å; E592-K594 PolarHBondContact O-N 3.5Å; K594-C596 VanDerWaalsContact C-N 3.3Å; K594-C596 PolarHBondContact O-N 3.47Å; K594-G597 PolarHBondContact O-N 3.22Å
595	S	81.1	Confident	79.4	Confident	76 Å²	76	61.1 Å²	61.1	53%	0.531	33%	0.325	S	S	.	.	H	α-helix	trans	-63.2	-37.4	173.9	55.2	0	0	0	0	111.9	E591 E592 G597 R692	E591-S595 PolarHBondContact O-N 3.43Å; E591-S595 PolarHBondContact O-OG 2.89Å; E592-S595 WeakPolarHBondContact CA-OG 3.39Å; E592-S595 PolarHBondContact O-N 2.79Å; E592-S595 PolarHBondContact O-OG 3.44Å; S595-G597 PolarHBondContact O-N 3.34Å; S595-G597 VanDerWaalsContact O-N 3.09Å; S595-R692 PolarHBondContact O-NH2 3.13Å
596	C	77.4	Confident	78.9	Confident	15 Å²	15	60.7 Å²	60.7	10%	0.101	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.7	0	171.1	-65.3	0	0	0	0	114.1	E592 M593 K594 M625 V688	E592-C596 PolarHBondContact O-N 2.97Å; E592-C596 VanDerWaalsContact O-N 3.07Å; E592-C596 PolarHBondContact O-SG 3.31Å; M593-C596 PolarHBondContact O-N 3.22Å; K594-C596 VanDerWaalsContact C-N 3.3Å; K594-C596 PolarHBondContact O-N 3.47Å; C596-M625 HydrophobicContact CB-CB 4.07Å; C596-M625 HydrophobicContact CB-CG 4.01Å; C596-M625 WeakPolarHBondContact O-CE 3.41Å; C596-V688 VanDerWaalsContact O-CG1 3.3Å; C596-V688 WeakPolarHBondContact O-CG1 3.36Å
597	G	73.4	Confident	78	Confident	25 Å²	25	67 Å²	67	26%	0.258	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.6	6.7	177.3	0	0	0	0	0	115.3	M593 K594 S595 S599	M593-G597 PolarHBondContact O-N 3.06Å; K594-G597 PolarHBondContact O-N 3.22Å; S595-G597 PolarHBondContact O-N 3.34Å; S595-G597 VanDerWaalsContact O-N 3.09Å; G597-S599 PolarHBondContact O-N 2.79Å
598	V	79.4	Confident	76.9	Confident	3 Å²	3	72.3 Å²	72.3	2%	0.018	38%	0.379	C	S	.	.			trans	-88.4	92.9	175.8	-176.6	0	0	0	0	109.8	M593 F601 F680 T684 V688	M593-V598 HydrophobicContact CB-CB 4.46Å; M593-V598 WeakPolarHBondContact O-CB 3.2Å; M593-V598 PolarHBondContact O-N 2.93Å; V598-F601 HydrophobicContact CG1-CB 4.05Å; V598-F680 HydrophobicContact CG1-CE2 4.18Å; V598-F680 HydrophobicContact CG1-CZ 4.39Å; V598-T684 HydrophobicContact CG1-CG2 3.45Å; V598-T684 VanDerWaalsContact CG1-CG2 3.45Å; V598-T684 HydrophobicContact CG2-CG2 4.47Å; V598-V688 HydrophobicContact CG2-CG1 4.4Å; V598-V688 HydrophobicContact CG2-CG2 4.37Å
599	S	70.1	Confident	76.4	Confident	93 Å²	93	67 Å²	67	65%	0.65	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.7	-25.1	-178.4	58.9	0	0	0	0	114.4	G597	G597-S599 PolarHBondContact O-N 2.79Å
600	N	74.5	Confident	76.2	Confident	84 Å²	84	71.8 Å²	71.8	45%	0.449	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.1	17.8	-172.4	-65.1	-1.6	0	0	0	113.5	E602 Q603	N600-E602 PolarHBondContact O-N 3.18Å; N600-E602 VanDerWaalsContact O-N 3.16Å; N600-Q603 PolarHBondContact O-N 2.68Å
601	F	78.3	Confident	76.2	Confident	4 Å²	4	68.8 Å²	68.8	2%	0.018	36%	0.363	C	S	.	.	G	3₁₀ helix	trans	-61	-26.2	-176.1	-170.3	-106.2	0	0	0	113.4	L589 K590 M593 V598 Q603 Y604 T605 V611 L613 F680	L589-F601 HydrophobicContact CD2-CE1 3.93Å; L589-F601 HydrophobicContact CD2-CZ 3.84Å; L589-F601 HydrophobicContact CG-CE1 3.94Å; L589-F601 HydrophobicContact CG-CZ 4.1Å; K590-F601 HydrophobicContact CG-CD1 4.06Å; K590-F601 HydrophobicContact CG-CE1 4.48Å; M593-F601 HydrophobicContact CB-CB 4.1Å; M593-F601 HydrophobicContact CB-CD1 4.14Å; M593-F601 HydrophobicContact CB-CD2 4.09Å; M593-F601 HydrophobicContact CB-CG 3.84Å; M593-F601 HydrophobicContact CE-CE2 4.09Å; M593-F601 HydrophobicContact CE-CZ 4.47Å; M593-F601 HydrophobicContact CG-CD1 4.09Å; M593-F601 HydrophobicContact CG-CD2 3.76Å; M593-F601 HydrophobicContact CG-CE1 4.13Å; M593-F601 HydrophobicContact CG-CE2 3.81Å; M593-F601 HydrophobicContact CG-CG 3.91Å; M593-F601 HydrophobicContact CG-CZ 4Å; M593-F601 HydrophobicContact SD-CD2 4.35Å; M593-F601 HydrophobicContact SD-CE2 4.3Å; V598-F601 HydrophobicContact CG1-CB 4.05Å; F601-Q603 PolarHBondContact O-N 3.41Å; F601-Y604 PolarHBondContact O-N 3.2Å; F601-T605 HydrophobicContact CD1-CG2 4.04Å; F601-T605 HydrophobicContact CE1-CG2 3.87Å; F601-V611 HydrophobicContact CZ-CG1 4.08Å; F601-L613 HydrophobicContact CD2-CD1 4.44Å; F601-L613 HydrophobicContact CE2-CD1 3.72Å; F601-L613 HydrophobicContact CZ-CD1 4.46Å; F601-F680 AromaticContact CD2-CE2 4Å; F601-F680 HydrophobicContact CD2-CE2 4Å; F601-F680 AromaticContact CD2-CZ 3.96Å; F601-F680 HydrophobicContact CD2-CZ 3.96Å; F601-F680 HydrophobicContact CE2-CE2 4.45Å; F601-F680 HydrophobicContact CE2-CZ 4.14Å
602	E	73.8	Confident	76.1	Confident	134 Å²	134	63.4 Å²	63.4	63%	0.626	34%	0.339	S	S	*	.	G	3₁₀ helix	trans	-59.2	-28.7	179.9	-62.3	-172.7	165.3	0	0	113.6	K590 N600 Y604 T605	K590-E602 HydrophobicContact CD-CG 4.5Å; N600-E602 PolarHBondContact O-N 3.18Å; N600-E602 VanDerWaalsContact O-N 3.16Å; E602-Y604 PolarHBondContact O-N 2.93Å; E602-T605 PolarHBondContact O-N 3.47Å; E602-T605 VanDerWaalsContact O-N 3.15Å; E602-T605 PolarHBondContact O-OG1 3.33Å
603	Q	78	Confident	76.2	Confident	137 Å²	137	59.1 Å²	59.1	64%	0.64	32%	0.318	S	S	*	.	G	3₁₀ helix	trans	-66.4	-18	177.9	-61.6	176.7	0.7	0	0	113	N600 F601	N600-Q603 PolarHBondContact O-N 2.68Å; F601-Q603 PolarHBondContact O-N 3.41Å
604	Y	74.8	Confident	76.3	Confident	22 Å²	22	59.1 Å²	59.1	9%	0.086	32%	0.318	C	S	.	.	G	3₁₀ helix	trans	-105.5	6.3	-180	-59.9	-84.9	0	0	0	112.5	F601 E602 N612 L613 Q676 F680	F601-Y604 PolarHBondContact O-N 3.2Å; E602-Y604 PolarHBondContact O-N 2.93Å; Y604-N612 WeakPolarHBondContact O-CB 3.23Å; Y604-N612 PolarHBondContact O-N 3.39Å; Y604-L613 HydrophobicContact CD1-CD1 4.48Å; Y604-L613 HydrophobicContact CD1-CD2 3.88Å; Y604-L613 HydrophobicContact CD1-CG 4.28Å; Y604-L613 HydrophobicContact CG-CD1 4.13Å; Y604-L613 HydrophobicContact CG-CD2 4.36Å; Y604-L613 HydrophobicContact CG-CG 4.33Å; Y604-Q676 HydrophobicContact CD1-CG 4.42Å; Y604-Q676 HydrophobicContact CE1-CG 4.36Å; Y604-F680 HydrophobicContact CD1-CD2 4.39Å; Y604-F680 AromaticContact CD2-CD2 3.73Å; Y604-F680 HydrophobicContact CD2-CD2 3.73Å; Y604-F680 HydrophobicContact CD2-CE2 4.09Å; Y604-F680 HydrophobicContact CE1-CB 4.08Å; Y604-F680 HydrophobicContact CE1-CD2 4.25Å; Y604-F680 AromaticContact CE2-CD2 3.57Å; Y604-F680 HydrophobicContact CE2-CD2 3.57Å; Y604-F680 HydrophobicContact CE2-CE2 4.2Å; Y604-F680 HydrophobicContact CG-CD2 4.14Å; Y604-F680 AromaticContact CZ-CD2 3.84Å
605	T	77.1	Confident	76.4	Confident	27 Å²	27	58.6 Å²	58.6	17%	0.166	31%	0.313	C	S	.	.	B	Isolated β-bridge	trans	-98.1	135	174.6	62.5	0	0	0	0	110.5	L586 K590 F601 E602	L586-T605 HydrophobicContact CD1-CG2 3.87Å; K590-T605 WeakPolarHBondContact CE-OG1 3.38Å; K590-T605 PolarHBondContact NZ-OG1 3.36Å; F601-T605 HydrophobicContact CD1-CG2 4.04Å; F601-T605 HydrophobicContact CE1-CG2 3.87Å; E602-T605 PolarHBondContact O-N 3.47Å; E602-T605 VanDerWaalsContact O-N 3.15Å; E602-T605 PolarHBondContact O-OG1 3.33Å
606	G	70.2	Confident	76.6	Confident	24 Å²	24	55.4 Å²	55.4	25%	0.247	29%	0.291	C	S	.	.			trans	-99.4	-177.1	175.9	0	0	0	0	0	112.3	W610	G606-W610 PolarHBondContact N-O 2.97Å
607	D	61.8	Low	77	Confident	147 Å²	147	55 Å²	55	79%	0.786	29%	0.288	S	S	*	.	S	Bend	trans	-65.9	148.4	175	-58.5	-39.4	0	0	0	111.2
608	D	60	Low	77.7	Confident	143 Å²	143	54.1 Å²	54.1	77%	0.765	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.4	57.8	170.2	-62.6	-24.9	0	0	0	116.8	W610	D608-W610 VanDerWaalsContact C-N 3.34Å; D608-W610 VanDerWaalsContact O-CD1 3.26Å; D608-W610 PolarHBondContact O-N 3.33Å
609	C	74.1	Confident	78.1	Confident	17 Å²	17	54.8 Å²	54.8	12%	0.115	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	76.6	7.8	170.3	-39.1	0	0	0	0	116.3	L580 P583	L580-C609 PolarHBondContact N-O 3.41Å; P583-C609 VanDerWaalsContact CD-SG 3.58Å
610	W	79.1	Confident	79	Confident	109 Å²	109	50.6 Å²	50.6	41%	0.413	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	141.3	177.9	-69.8	89.7	0	0	0	112.8	R577 M578 N579 G606 D608	R577-W610 HydrophobicContact CB-CE3 3.89Å; R577-W610 HydrophobicContact CB-CZ3 4.16Å; M578-W610 WeakPolarHBondContact O-CA 3.28Å; N579-W610 HydrophobicContact CB-CD2 4.02Å; N579-W610 HydrophobicContact CB-CE3 3.8Å; N579-W610 HydrophobicContact CB-CH2 3.81Å; N579-W610 HydrophobicContact CB-CZ2 4Å; N579-W610 HydrophobicContact CB-CZ3 3.7Å; N579-W610 VanDerWaalsContact ND2-CZ2 3.33Å; N579-W610 WeakPolarHBondContact ND2-CZ2 3.43Å; G606-W610 PolarHBondContact N-O 2.97Å; D608-W610 VanDerWaalsContact C-N 3.34Å; D608-W610 VanDerWaalsContact O-CD1 3.26Å; D608-W610 PolarHBondContact O-N 3.33Å
611	V	82.6	Confident	79.6	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	126	172.8	-176.7	0	0	0	0	108.6	M578 L580 L586 L589 F601 L613	M578-V611 HydrophobicContact CB-CB 4.3Å; M578-V611 HydrophobicContact CE-CB 3.75Å; M578-V611 HydrophobicContact CE-CG1 4.02Å; M578-V611 HydrophobicContact CE-CG2 3.67Å; M578-V611 PolarHBondContact N-O 2.82Å; M578-V611 VanDerWaalsContact N-O 3.13Å; M578-V611 PolarHBondContact O-N 3.39Å; L580-V611 HydrophobicContact CD1-CG2 3.88Å; L580-V611 HydrophobicContact CG-CG2 4.34Å; L586-V611 HydrophobicContact CD1-CG2 3.6Å; L589-V611 HydrophobicContact CD2-CG2 4.11Å; F601-V611 HydrophobicContact CZ-CG1 4.08Å; V611-L613 HydrophobicContact CG1-CB 3.98Å; V611-L613 HydrophobicContact CG1-CG 4.4Å; V611-L613 PolarHBondContact O-N 3.42Å
612	N	82.4	Confident	80.1	Confident	28 Å²	28	49.6 Å²	49.6	15%	0.15	25%	0.245	C	C	.	.	S	Bend	trans	-80.7	31.6	179.7	-64.9	-41	0	0	0	112.3	R577 Y604 F673	R577-N612 WeakPolarHBondContact CD-OD1 3.41Å; R577-N612 PolarHBondContact NE-OD1 2.57Å; Y604-N612 WeakPolarHBondContact O-CB 3.23Å; Y604-N612 PolarHBondContact O-N 3.39Å; N612-F673 WeakPolarHBondContact O-CE2 3.41Å
613	L	84.4	Confident	80.8	Confident	0 Å²	0	45 Å²	45	0%	0	22%	0.223	C	C	.	.	S	Bend	trans	-132.3	153.8	175.1	-62.6	170.7	0	0	0	108.8	F601 Y604 V611 V618 N677 F680	F601-L613 HydrophobicContact CD2-CD1 4.44Å; F601-L613 HydrophobicContact CE2-CD1 3.72Å; F601-L613 HydrophobicContact CZ-CD1 4.46Å; Y604-L613 HydrophobicContact CD1-CD1 4.48Å; Y604-L613 HydrophobicContact CD1-CD2 3.88Å; Y604-L613 HydrophobicContact CD1-CG 4.28Å; Y604-L613 HydrophobicContact CG-CD1 4.13Å; Y604-L613 HydrophobicContact CG-CD2 4.36Å; Y604-L613 HydrophobicContact CG-CG 4.33Å; V611-L613 HydrophobicContact CG1-CB 3.98Å; V611-L613 HydrophobicContact CG1-CG 4.4Å; V611-L613 PolarHBondContact O-N 3.42Å; L613-V618 HydrophobicContact CB-CG2 3.99Å; L613-V618 HydrophobicContact CD1-CG2 4.33Å; L613-N677 VanDerWaalsContact CA-OD1 3.27Å; L613-N677 WeakPolarHBondContact CA-OD1 3.46Å; L613-N677 WeakPolarHBondContact CD2-OD1 3.14Å; L613-F680 HydrophobicContact CD1-CD1 3.8Å; L613-F680 HydrophobicContact CD1-CD2 3.91Å; L613-F680 HydrophobicContact CD1-CE1 3.86Å; L613-F680 HydrophobicContact CD1-CE2 3.97Å; L613-F680 HydrophobicContact CD1-CG 3.81Å; L613-F680 HydrophobicContact CD1-CZ 3.94Å; L613-F680 HydrophobicContact CD2-CB 3.69Å; L613-F680 HydrophobicContact CD2-CD1 4.14Å; L613-F680 HydrophobicContact CD2-CD2 4.47Å; L613-F680 HydrophobicContact CD2-CG 3.84Å
614	S	85.6	Confident	81.3	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	19%	0.193	C	C	.	.			trans	-74.8	152.9	174.5	77.2	0	0	0	0	110.8	E573 T616 V617 V618 N677	E573-S614 WeakPolarHBondContact OE2-CB 3.42Å; E573-S614 PolarHBondContact OE2-OG 3.28Å; E573-S614 VanDerWaalsContact OE2-OG 3.04Å; S614-T616 PolarHBondContact O-N 2.94Å; S614-T616 PolarHBondContact OG-OG1 3.18Å; S614-T616 VanDerWaalsContact OG-OG1 3.05Å; S614-V617 PolarHBondContact O-N 2.82Å; S614-V617 WeakPolarHBondContact OG-CG2 3.39Å; S614-V617 PolarHBondContact OG-N 3.26Å; S614-V618 WeakPolarHBondContact O-CG2 3.47Å; S614-V618 PolarHBondContact O-N 2.78Å; S614-N677 PolarHBondContact N-OD1 2.98Å
615	Y	85.4	Confident	82	Confident	143 Å²	143	37.5 Å²	37.5	56%	0.561	19%	0.189	S	C	*	.	H	α-helix	trans	-59.5	-37.6	176.8	170.9	-104.2	0	0	0	111.8	M578 V617 V618 A619	M578-Y615 HydrophobicContact SD-CD2 4.01Å; Y615-V617 PolarHBondContact O-N 3.15Å; Y615-V618 PolarHBondContact O-N 3.2Å; Y615-A619 VanDerWaalsContact O-CB 3.28Å; Y615-A619 WeakPolarHBondContact O-CB 3.25Å; Y615-A619 PolarHBondContact O-N 3.18Å
616	T	86.6	Confident	82.5	Confident	9 Å²	9	37.6 Å²	37.6	6%	0.055	20%	0.195	C	C	.	.	H	α-helix	trans	-65	-42.1	-177.8	61.3	0	0	0	0	112.5	R569 E573 S614 A619 F620	R569-T616 HydrophobicContact CB-CG2 4.05Å; R569-T616 WeakPolarHBondContact O-CG2 3.47Å; E573-T616 HydrophobicContact CB-CG2 4.04Å; E573-T616 HydrophobicContact CG-CG2 4.21Å; E573-T616 WeakPolarHBondContact OE2-CB 3.42Å; E573-T616 WeakPolarHBondContact OE2-CG2 3.47Å; E573-T616 PolarHBondContact OE2-OG1 3.03Å; S614-T616 PolarHBondContact O-N 2.94Å; S614-T616 PolarHBondContact OG-OG1 3.18Å; S614-T616 VanDerWaalsContact OG-OG1 3.05Å; T616-A619 PolarHBondContact O-N 3.39Å; T616-F620 WeakPolarHBondContact O-CB 3.23Å; T616-F620 PolarHBondContact O-N 3.04Å
617	V	86.1	Confident	83.4	Confident	6 Å²	6	36.5 Å²	36.5	4%	0.036	18%	0.184	C	C	.	.	H	α-helix	trans	-68.3	-39.7	179.8	174.1	0	0	0	0	111.1	W575 S614 Y615 T621 N677 F680	W575-V617 HydrophobicContact CZ3-CG2 4.4Å; S614-V617 PolarHBondContact O-N 2.82Å; S614-V617 WeakPolarHBondContact OG-CG2 3.39Å; S614-V617 PolarHBondContact OG-N 3.26Å; Y615-V617 PolarHBondContact O-N 3.15Å; V617-T621 WeakPolarHBondContact O-CB 3.41Å; V617-T621 PolarHBondContact O-N 3.45Å; V617-T621 PolarHBondContact O-OG1 3.49Å; V617-N677 HydrophobicContact CG2-CB 4.24Å; V617-F680 HydrophobicContact CG1-CD1 3.69Å; V617-F680 HydrophobicContact CG1-CE1 4.16Å
618	V	86.6	Confident	84.6	Confident	6 Å²	6	29.6 Å²	29.6	4%	0.036	15%	0.147	C	C	.	.	H	α-helix	trans	-64.1	-47.6	174.7	169.9	0	0	0	0	110.7	M578 L589 M593 L613 S614 Y615 T621 K622	M578-V618 HydrophobicContact CE-CG1 4.38Å; M578-V618 HydrophobicContact CE-CG2 4.33Å; L589-V618 HydrophobicContact CD1-CG1 3.87Å; L589-V618 HydrophobicContact CD2-CG1 4.38Å; M593-V618 HydrophobicContact CE-CB 4.05Å; M593-V618 HydrophobicContact CE-CG1 3.44Å; M593-V618 VanDerWaalsContact CE-CG1 3.44Å; M593-V618 HydrophobicContact CE-CG2 4.29Å; L613-V618 HydrophobicContact CB-CG2 3.99Å; L613-V618 HydrophobicContact CD1-CG2 4.33Å; S614-V618 WeakPolarHBondContact O-CG2 3.47Å; S614-V618 PolarHBondContact O-N 2.78Å; Y615-V618 PolarHBondContact O-N 3.2Å; V618-T621 PolarHBondContact O-N 2.98Å; V618-K622 PolarHBondContact O-N 3.42Å
619	A	87.6	Confident	85.9	Confident	17 Å²	17	26.1 Å²	26.1	14%	0.14	13%	0.126	C	C	.	.	H	α-helix	trans	-64.8	-41.7	178.4	0	0	0	0	0	112.1	Y615 T616 K622 Q623	Y615-A619 VanDerWaalsContact O-CB 3.28Å; Y615-A619 WeakPolarHBondContact O-CB 3.25Å; Y615-A619 PolarHBondContact O-N 3.18Å; T616-A619 PolarHBondContact O-N 3.39Å; A619-K622 PolarHBondContact O-N 3.24Å; A619-Q623 WeakPolarHBondContact O-CB 3.45Å; A619-Q623 PolarHBondContact O-N 2.87Å
620	F	89.9	Confident	86.6	Confident	6 Å²	6	26.7 Å²	26.7	3%	0.026	13%	0.127	C	C	.	.	H	α-helix	trans	-60.5	-44.6	175.1	172.3	-98.7	0	0	0	111.9	T566 T616 K622 Q623 T624 I650 I651 A654 L681	T566-F620 HydrophobicContact CG2-CD2 3.8Å; T566-F620 HydrophobicContact CG2-CE2 4.36Å; T616-F620 WeakPolarHBondContact O-CB 3.23Å; T616-F620 PolarHBondContact O-N 3.04Å; F620-K622 PolarHBondContact O-N 3.47Å; F620-Q623 PolarHBondContact O-N 2.95Å; F620-T624 WeakPolarHBondContact CE2-OG1 3.45Å; F620-T624 VanDerWaalsContact CZ-OG1 3.24Å; F620-T624 WeakPolarHBondContact CZ-OG1 3.39Å; F620-T624 WeakPolarHBondContact O-CB 3.47Å; F620-T624 PolarHBondContact O-N 2.69Å; F620-T624 PolarHBondContact O-OG1 2.71Å; F620-I650 HydrophobicContact CE2-CG2 3.64Å; F620-I650 WeakPolarHBondContact CE2-O 3.4Å; F620-I650 HydrophobicContact CZ-CG2 4.04Å; F620-I651 HydrophobicContact CZ-CG1 4.48Å; F620-A654 HydrophobicContact CD1-CB 3.92Å; F620-A654 HydrophobicContact CD2-CB 3.89Å; F620-A654 HydrophobicContact CE1-CB 3.62Å; F620-A654 HydrophobicContact CE2-CB 3.58Å; F620-A654 HydrophobicContact CG-CB 4.06Å; F620-A654 HydrophobicContact CZ-CB 3.46Å; F620-A654 VanDerWaalsContact CZ-CB 3.46Å; F620-L681 HydrophobicContact CD1-CD1 4.09Å; F620-L681 HydrophobicContact CE1-CD1 4.05Å
621	T	87.8	Confident	86.9	Confident	0 Å²	0	21.6 Å²	21.6	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-58.5	-50.2	178.1	-58.1	0	0	0	0	110.6	M593 V617 V618 Q623 T624 M625 V685	M593-T621 HydrophobicContact CE-CG2 4.45Å; M593-T621 HydrophobicContact SD-CG2 4.15Å; V617-T621 WeakPolarHBondContact O-CB 3.41Å; V617-T621 PolarHBondContact O-N 3.45Å; V617-T621 PolarHBondContact O-OG1 3.49Å; V618-T621 PolarHBondContact O-N 2.98Å; T621-Q623 PolarHBondContact O-N 3.3Å; T621-T624 PolarHBondContact O-N 3.31Å; T621-M625 HydrophobicContact CG2-CG 4.48Å; T621-M625 WeakPolarHBondContact O-CB 3.39Å; T621-M625 WeakPolarHBondContact O-CG 3.27Å; T621-M625 PolarHBondContact O-N 3.46Å; T621-V685 HydrophobicContact CG2-CG1 4.08Å; T621-V685 HydrophobicContact CG2-CG2 3.82Å; T621-V685 WeakPolarHBondContact OG1-CG2 3.4Å
622	K	88.6	Confident	87.2	Confident	66 Å²	66	23.4 Å²	23.4	29%	0.287	12%	0.118	S	C	.	.	H	α-helix	trans	-61.3	-43.9	178	-67.8	-178.3	-177.2	-174.8	0	112.4	E592 M593 V618 A619 F620 M625 G626	E592-K622 WeakPolarHBondContact OE2-CE 3.2Å; E592-K622 IonicContact OE2-NZ 3.02Å; E592-K622 PolarHBondContact OE2-NZ 2.88Å; M593-K622 HydrophobicContact CE-CG 4.1Å; V618-K622 PolarHBondContact O-N 3.42Å; A619-K622 PolarHBondContact O-N 3.24Å; F620-K622 PolarHBondContact O-N 3.47Å; K622-M625 PolarHBondContact O-N 2.96Å; K622-G626 PolarHBondContact O-N 2.87Å
623	Q	88.5	Confident	87.3	Confident	39 Å²	39	28 Å²	28	18%	0.182	14%	0.136	C	C	.	.	H	α-helix	trans	-67.8	-40.3	-177.9	-170.2	171.2	14.3	0	0	112.3	I562 R569 A619 F620 T621 F627	I562-Q623 HydrophobicContact CB-CG 4.48Å; I562-Q623 HydrophobicContact CD1-CG 4.48Å; I562-Q623 HydrophobicContact CG1-CG 3.93Å; I562-Q623 HydrophobicContact CG2-CG 3.96Å; R569-Q623 VanDerWaalsContact CZ-OE1 3.23Å; A619-Q623 WeakPolarHBondContact O-CB 3.45Å; A619-Q623 PolarHBondContact O-N 2.87Å; F620-Q623 PolarHBondContact O-N 2.95Å; T621-Q623 PolarHBondContact O-N 3.3Å; Q623-F627 WeakPolarHBondContact O-CB 3.46Å; Q623-F627 PolarHBondContact O-N 2.83Å
624	T	88.4	Confident	87.3	Confident	0 Å²	0	28.2 Å²	28.2	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-67.5	-41.7	177.2	-55.8	0	0	0	0	111.2	F620 T621 F627 L628 I650 V689	F620-T624 WeakPolarHBondContact CE2-OG1 3.45Å; F620-T624 VanDerWaalsContact CZ-OG1 3.24Å; F620-T624 WeakPolarHBondContact CZ-OG1 3.39Å; F620-T624 WeakPolarHBondContact O-CB 3.47Å; F620-T624 PolarHBondContact O-N 2.69Å; F620-T624 PolarHBondContact O-OG1 2.71Å; T621-T624 PolarHBondContact O-N 3.31Å; T624-F627 PolarHBondContact O-N 3.05Å; T624-L628 WeakPolarHBondContact O-CB 3.41Å; T624-L628 PolarHBondContact O-N 2.98Å; T624-I650 HydrophobicContact CG2-CG2 4.35Å; T624-V689 HydrophobicContact CG2-CG2 4.33Å
625	M	88.3	Confident	87.3	Confident	1 Å²	1	30.7 Å²	30.7	1%	0.005	15%	0.147	C	C	.	.	H	α-helix	trans	-68	-42.1	177.4	-69.3	-59.5	-52.8	0	0	112.2	C596 T621 K622 F627 L628 E629 V688 V689 R692	C596-M625 HydrophobicContact CB-CB 4.07Å; C596-M625 HydrophobicContact CB-CG 4.01Å; C596-M625 WeakPolarHBondContact O-CE 3.41Å; T621-M625 HydrophobicContact CG2-CG 4.48Å; T621-M625 WeakPolarHBondContact O-CB 3.39Å; T621-M625 WeakPolarHBondContact O-CG 3.27Å; T621-M625 PolarHBondContact O-N 3.46Å; K622-M625 PolarHBondContact O-N 2.96Å; M625-F627 VanDerWaalsContact C-N 3.34Å; M625-F627 PolarHBondContact O-N 3.35Å; M625-L628 HydrophobicContact CE-CD2 4.32Å; M625-L628 PolarHBondContact O-N 2.64Å; M625-L628 HydrophobicContact SD-CD2 4.45Å; M625-E629 WeakPolarHBondContact O-CG 3.37Å; M625-E629 PolarHBondContact O-N 3.31Å; M625-V688 HydrophobicContact CE-CG1 4.1Å; M625-V688 HydrophobicContact SD-CG1 4.2Å; M625-V689 HydrophobicContact SD-CG2 3.6Å; M625-V689 VanDerWaalsContact SD-CG2 3.6Å; M625-R692 HydrophobicContact CE-CB 4.38Å; M625-R692 HydrophobicContact CE-CG 3.95Å
626	G	87.6	Confident	87.1	Confident	29 Å²	29	24.6 Å²	24.6	30%	0.299	12%	0.123	S	C	.	.	H	α-helix	trans	-61.3	-42.5	174	0	0	0	0	0	112.1	K622 E629 E630	K622-G626 PolarHBondContact O-N 2.87Å; G626-E629 PolarHBondContact O-N 3.03Å; G626-E630 WeakPolarHBondContact O-CG 3.44Å; G626-E630 PolarHBondContact O-N 3.06Å; G626-E630 VanDerWaalsContact O-N 3.08Å
627	F	89.3	Confident	86.8	Confident	1 Å²	1	28.5 Å²	28.5	0%	0.004	15%	0.149	C	C	.	.	H	α-helix	trans	-60.4	-46.2	173.3	175	-115.1	0	0	0	112.6	L515 L555 Y558 I562 Q623 T624 M625 E629 E630 A631 L643 L647 I650	L515-F627 HydrophobicContact CD2-CD2 3.74Å; L515-F627 HydrophobicContact CD2-CE2 3.93Å; L555-F627 HydrophobicContact CD2-CE2 3.89Å; L555-F627 HydrophobicContact CD2-CZ 4.19Å; Y558-F627 AromaticContact CD1-CD2 3.46Å; Y558-F627 HydrophobicContact CD1-CD2 3.46Å; Y558-F627 VanDerWaalsContact CD1-CD2 3.46Å; Y558-F627 AromaticContact CD1-CE2 3.98Å; Y558-F627 HydrophobicContact CD1-CE2 3.98Å; Y558-F627 HydrophobicContact CD1-CG 4.41Å; Y558-F627 HydrophobicContact CE1-CB 4.43Å; Y558-F627 AromaticContact CE1-CD2 3.98Å; Y558-F627 HydrophobicContact CE1-CD2 3.98Å; I562-F627 HydrophobicContact CD1-CB 3.52Å; I562-F627 HydrophobicContact CD1-CD1 4.26Å; I562-F627 HydrophobicContact CD1-CD2 3.77Å; I562-F627 HydrophobicContact CD1-CG 3.57Å; Q623-F627 WeakPolarHBondContact O-CB 3.46Å; Q623-F627 PolarHBondContact O-N 2.83Å; T624-F627 PolarHBondContact O-N 3.05Å; M625-F627 VanDerWaalsContact C-N 3.34Å; M625-F627 PolarHBondContact O-N 3.35Å; F627-E629 PolarHBondContact O-N 3.49Å; F627-E630 PolarHBondContact O-N 2.81Å; F627-A631 HydrophobicContact CE2-CB 4.4Å; F627-A631 HydrophobicContact CZ-CB 4.5Å; F627-A631 WeakPolarHBondContact O-CB 3.44Å; F627-A631 PolarHBondContact O-N 3.38Å; F627-L643 HydrophobicContact CE1-CD1 4.19Å; F627-L643 HydrophobicContact CZ-CD1 4.34Å; F627-L647 HydrophobicContact CD1-CD2 3.73Å; F627-L647 HydrophobicContact CE1-CD2 3.91Å; F627-L647 HydrophobicContact CE1-CG 4.22Å; F627-I650 HydrophobicContact CD1-CD1 3.64Å; F627-I650 HydrophobicContact CE1-CD1 3.66Å; F627-I650 HydrophobicContact CG-CD1 4.36Å; F627-I650 HydrophobicContact CZ-CD1 4.38Å
628	L	88.6	Confident	86.6	Confident	1 Å²	1	34.1 Å²	34.1	1%	0.005	18%	0.175	C	C	.	.	H	α-helix	trans	-59.3	-46.7	178.1	177	64.6	0	0	0	111.3	T624 M625 A631 L632 L647 V689 R692 F693	T624-L628 WeakPolarHBondContact O-CB 3.41Å; T624-L628 PolarHBondContact O-N 2.98Å; M625-L628 HydrophobicContact CE-CD2 4.32Å; M625-L628 PolarHBondContact O-N 2.64Å; M625-L628 HydrophobicContact SD-CD2 4.45Å; L628-A631 PolarHBondContact O-N 2.7Å; L628-L632 HydrophobicContact CD1-CD1 3.91Å; L628-L632 HydrophobicContact CD1-CD2 4.48Å; L628-L632 HydrophobicContact CD1-CG 3.96Å; L628-L632 HydrophobicContact CG-CD1 3.89Å; L628-L632 HydrophobicContact CG-CG 4.33Å; L628-L632 VanDerWaalsContact O-CB 3.3Å; L628-L632 WeakPolarHBondContact O-CB 3.31Å; L628-L632 WeakPolarHBondContact O-CG 3.38Å; L628-L632 PolarHBondContact O-N 3.47Å; L628-L647 HydrophobicContact CB-CD2 4.32Å; L628-L647 HydrophobicContact CD1-CD1 3.68Å; L628-L647 HydrophobicContact CD1-CD2 4.3Å; L628-V689 HydrophobicContact CD2-CG1 4.23Å; L628-R692 HydrophobicContact CD2-CB 3.74Å; L628-F693 HydrophobicContact CD1-CB 4.25Å; L628-F693 HydrophobicContact CD1-CD2 4.01Å
629	E	87.4	Confident	86.5	Confident	70 Å²	70	34 Å²	34	33%	0.327	17%	0.174	S	C	.	.	H	α-helix	trans	-63.9	-45	-179.1	-72.8	-178.3	171.7	0	0	112.2	M625 G626 F627 L632 K633 R692	M625-E629 WeakPolarHBondContact O-CG 3.37Å; M625-E629 PolarHBondContact O-N 3.31Å; G626-E629 PolarHBondContact O-N 3.03Å; F627-E629 PolarHBondContact O-N 3.49Å; E629-L632 PolarHBondContact O-N 3.4Å; E629-K633 WeakPolarHBondContact O-CG 3.4Å; E629-K633 PolarHBondContact O-N 3.31Å; E629-R692 IonicContact OE1-NH1 3.55Å; E629-R692 PolarHBondContact OE1-NH1 3.26Å; E629-R692 VanDerWaalsContact OE1-NH1 3.11Å
630	E	87.4	Confident	86.4	Confident	30 Å²	30	34.5 Å²	34.5	14%	0.14	17%	0.173	C	C	.	.	H	α-helix	trans	-69.1	-38.4	177.5	-62.3	-48.2	136.5	0	0	112.5	L515 S516 G626 F627 K633 L634	L515-E630 HydrophobicContact CD2-CB 3.95Å; L515-E630 HydrophobicContact CG-CB 4.02Å; S516-E630 WeakPolarHBondContact CA-OE2 3.16Å; G626-E630 WeakPolarHBondContact O-CG 3.44Å; G626-E630 PolarHBondContact O-N 3.06Å; G626-E630 VanDerWaalsContact O-N 3.08Å; F627-E630 PolarHBondContact O-N 2.81Å; E630-K633 WeakPolarHBondContact O-CB 3.45Å; E630-K633 PolarHBondContact O-N 2.98Å; E630-K633 IonicContact OE1-NZ 2.77Å; E630-K633 PolarHBondContact OE1-NZ 3.32Å; E630-K633 WeakPolarHBondContact OE2-CD 3.44Å; E630-K633 IonicContact OE2-NZ 3.79Å; E630-K633 PolarHBondContact OE2-NZ 3.45Å; E630-L634 PolarHBondContact O-N 3.22Å
631	A	87.1	Confident	86.1	Confident	1 Å²	1	39.6 Å²	39.6	1%	0.008	20%	0.199	C	C	.	.	H	α-helix	trans	-69.8	-32	177.2	0	0	0	0	0	112.8	L555 F627 L628 K633 L634 Y635 L643	L555-A631 HydrophobicContact CD2-CB 3.65Å; F627-A631 HydrophobicContact CE2-CB 4.4Å; F627-A631 HydrophobicContact CZ-CB 4.5Å; F627-A631 WeakPolarHBondContact O-CB 3.44Å; F627-A631 PolarHBondContact O-N 3.38Å; L628-A631 PolarHBondContact O-N 2.7Å; A631-K633 VanDerWaalsContact C-N 3.35Å; A631-L634 CarbonylContact O-C 3.55Å; A631-L634 PolarHBondContact O-N 3.18Å; A631-Y635 PolarHBondContact O-N 3.1Å; A631-L643 HydrophobicContact CB-CD1 3.4Å; A631-L643 HydrophobicContact CB-CD2 4.35Å
632	L	86.8	Confident	86.1	Confident	39 Å²	39	41.2 Å²	41.2	20%	0.204	21%	0.208	C	C	.	.	H	α-helix	trans	-67.1	-33.6	173.4	-76.4	174.2	0	0	0	112.2	L628 E629 L634 Y635 L643 V697	L628-L632 HydrophobicContact CD1-CD1 3.91Å; L628-L632 HydrophobicContact CD1-CD2 4.48Å; L628-L632 HydrophobicContact CD1-CG 3.96Å; L628-L632 HydrophobicContact CG-CD1 3.89Å; L628-L632 HydrophobicContact CG-CG 4.33Å; L628-L632 VanDerWaalsContact O-CB 3.3Å; L628-L632 WeakPolarHBondContact O-CB 3.31Å; L628-L632 WeakPolarHBondContact O-CG 3.38Å; L628-L632 PolarHBondContact O-N 3.47Å; E629-L632 PolarHBondContact O-N 3.4Å; L632-L634 PolarHBondContact O-N 3.49Å; L632-Y635 WeakPolarHBondContact O-CB 3.45Å; L632-Y635 PolarHBondContact O-N 2.91Å; L632-Y635 VanDerWaalsContact O-N 3.14Å; L632-L643 HydrophobicContact CD2-CD2 4.29Å; L632-V697 HydrophobicContact CD2-CG2 3.81Å
633	K	85.9	Confident	86	Confident	124 Å²	124	38.1 Å²	38.1	54%	0.539	20%	0.195	S	C	.	.	H	α-helix	trans	-62.6	-30.3	172.8	-67.2	174	-165.1	165.9	0	112.3	A519 E629 E630 A631	A519-K633 HydrophobicContact CB-CB 4.15Å; A519-K633 HydrophobicContact CB-CD 4.32Å; E629-K633 WeakPolarHBondContact O-CG 3.4Å; E629-K633 PolarHBondContact O-N 3.31Å; E630-K633 WeakPolarHBondContact O-CB 3.45Å; E630-K633 PolarHBondContact O-N 2.98Å; E630-K633 IonicContact OE1-NZ 2.77Å; E630-K633 PolarHBondContact OE1-NZ 3.32Å; E630-K633 WeakPolarHBondContact OE2-CD 3.44Å; E630-K633 IonicContact OE2-NZ 3.79Å; E630-K633 PolarHBondContact OE2-NZ 3.45Å; A631-K633 VanDerWaalsContact C-N 3.35Å
634	L	84.3	Confident	85.8	Confident	5 Å²	5	36.6 Å²	36.6	3%	0.026	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.9	2.1	178.1	-70.8	171.2	0	0	0	113.4	L515 A519 V522 I551 E630 A631 L632 F636 L639	L515-L634 HydrophobicContact CD1-CD1 3.66Å; L515-L634 HydrophobicContact CG-CD1 4.37Å; A519-L634 HydrophobicContact CB-CD1 4.16Å; A519-L634 HydrophobicContact CB-CD2 4.21Å; A519-L634 HydrophobicContact CB-CG 3.89Å; V522-L634 HydrophobicContact CB-CD2 3.69Å; V522-L634 HydrophobicContact CG1-CD2 3.85Å; V522-L634 HydrophobicContact CG2-CD2 3.8Å; I551-L634 HydrophobicContact CD1-CD2 4.36Å; I551-L634 HydrophobicContact CG2-CB 4.2Å; I551-L634 HydrophobicContact CG2-CD1 4.31Å; E630-L634 PolarHBondContact O-N 3.22Å; A631-L634 CarbonylContact O-C 3.55Å; A631-L634 PolarHBondContact O-N 3.18Å; L632-L634 PolarHBondContact O-N 3.49Å; L634-F636 WeakPolarHBondContact O-CD1 3.39Å; L634-F636 WeakPolarHBondContact O-CE1 3.22Å; L634-L639 WeakPolarHBondContact O-CD1 3.42Å
635	Y	84.7	Confident	85.8	Confident	52 Å²	52	41.4 Å²	41.4	20%	0.204	21%	0.21	C	C	.	.			trans	-68.9	133.3	-169.1	178.3	-102.2	0	0	0	113.9	A631 L632 H640 L643 V697	A631-Y635 PolarHBondContact O-N 3.1Å; L632-Y635 WeakPolarHBondContact O-CB 3.45Å; L632-Y635 PolarHBondContact O-N 2.91Å; L632-Y635 VanDerWaalsContact O-N 3.14Å; Y635-H640 HydrophobicContact CE2-CB 4.01Å; Y635-H640 PolarHBondContact OH-ND1 3.25Å; Y635-L643 HydrophobicContact CD2-CD2 4.29Å; Y635-V697 HydrophobicContact CD1-CG2 4.38Å; Y635-V697 HydrophobicContact CD2-CG2 4.06Å; Y635-V697 HydrophobicContact CE1-CB 4.38Å; Y635-V697 HydrophobicContact CE1-CG1 4.07Å; Y635-V697 HydrophobicContact CE1-CG2 4.16Å; Y635-V697 HydrophobicContact CE2-CG1 4.18Å; Y635-V697 HydrophobicContact CE2-CG2 3.83Å; Y635-V697 HydrophobicContact CG-CG2 4.35Å; Y635-V697 WeakPolarHBondContact OH-CG1 3.37Å
636	F	81.2	Confident	85.7	Confident	14 Å²	14	41.6 Å²	41.6	6%	0.061	21%	0.212	C	C	.	.			trans	-141.8	159.7	161.8	46.8	-89.3	0	0	0	109.7	V548 I551 L634 E638 L639	V548-F636 HydrophobicContact CB-CE2 3.94Å; V548-F636 HydrophobicContact CB-CZ 4.07Å; V548-F636 HydrophobicContact CG1-CE2 3.83Å; V548-F636 HydrophobicContact CG1-CZ 4.18Å; V548-F636 HydrophobicContact CG2-CD2 4.27Å; V548-F636 HydrophobicContact CG2-CE2 3.31Å; V548-F636 HydrophobicContact CG2-CZ 3.73Å; I551-F636 HydrophobicContact CD1-CE1 3.67Å; I551-F636 HydrophobicContact CD1-CZ 4.23Å; I551-F636 HydrophobicContact CG2-CE1 4.48Å; L634-F636 WeakPolarHBondContact O-CD1 3.39Å; L634-F636 WeakPolarHBondContact O-CE1 3.22Å; F636-E638 HydrophobicContact CD2-CB 3.86Å; F636-E638 WeakPolarHBondContact CD2-OE2 3.4Å; F636-E638 HydrophobicContact CE2-CB 4Å; F636-E638 PolarHBondContact O-N 3.33Å; F636-L639 HydrophobicContact CD1-CD1 3.73Å; F636-L639 HydrophobicContact CD1-CG 4.07Å; F636-L639 HydrophobicContact CD2-CD1 4.37Å; F636-L639 HydrophobicContact CD2-CG 3.79Å; F636-L639 HydrophobicContact CE1-CD1 3.2Å; F636-L639 HydrophobicContact CE1-CD2 4.29Å; F636-L639 HydrophobicContact CE1-CG 3.61Å; F636-L639 HydrophobicContact CE2-CB 4.41Å; F636-L639 HydrophobicContact CE2-CD1 3.94Å; F636-L639 HydrophobicContact CE2-CD2 3.7Å; F636-L639 HydrophobicContact CE2-CG 3.31Å; F636-L639 HydrophobicContact CG-CD1 4.27Å; F636-L639 HydrophobicContact CG-CG 4.14Å; F636-L639 HydrophobicContact CZ-CD1 3.31Å; F636-L639 HydrophobicContact CZ-CD2 3.49Å; F636-L639 VanDerWaalsContact CZ-CD2 3.49Å; F636-L639 HydrophobicContact CZ-CG 3.18Å; F636-L639 PolarHBondContact O-N 2.89Å
637	P	81.4	Confident	85.7	Confident	91 Å²	91	40.2 Å²	40.2	59%	0.591	20%	0.197	S	C	*	.	G	3₁₀ helix	trans	-52.4	-34.3	-171	-29.6	37.2	0	0	0	115	L639 H640	P637-L639 VanDerWaalsContact C-N 3.32Å; P637-L639 PolarHBondContact O-N 3.15Å; P637-H640 WeakPolarHBondContact O-CB 3.37Å; P637-H640 PolarHBondContact O-N 2.65Å
638	E	82.1	Confident	85.6	Confident	125 Å²	125	41.6 Å²	41.6	58%	0.584	21%	0.206	S	C	*	.	G	3₁₀ helix	trans	-71.4	-21.7	-180	-60.7	77.4	-177.6	0	0	113.2	F636 H640	F636-E638 HydrophobicContact CD2-CB 3.86Å; F636-E638 WeakPolarHBondContact CD2-OE2 3.4Å; F636-E638 HydrophobicContact CE2-CB 4Å; F636-E638 PolarHBondContact O-N 3.33Å; E638-H640 VanDerWaalsContact C-N 3.33Å
639	L	83.8	Confident	85.5	Confident	2 Å²	2	45.4 Å²	45.4	1%	0.01	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-84.9	-6.7	172.9	-63.9	-178.2	0	0	0	113.7	V548 I551 Q552 L555 L634 F636 P637 M641 V642 L643	V548-L639 HydrophobicContact CG1-CD2 4.35Å; I551-L639 HydrophobicContact CB-CD1 4.44Å; I551-L639 HydrophobicContact CG2-CD1 3.54Å; I551-L639 HydrophobicContact CG2-CD2 4.47Å; Q552-L639 HydrophobicContact CG-CD2 3.37Å; L555-L639 HydrophobicContact CD1-CD1 4.08Å; L634-L639 WeakPolarHBondContact O-CD1 3.42Å; F636-L639 HydrophobicContact CD1-CD1 3.73Å; F636-L639 HydrophobicContact CD1-CG 4.07Å; F636-L639 HydrophobicContact CD2-CD1 4.37Å; F636-L639 HydrophobicContact CD2-CG 3.79Å; F636-L639 HydrophobicContact CE1-CD1 3.2Å; F636-L639 HydrophobicContact CE1-CD2 4.29Å; F636-L639 HydrophobicContact CE1-CG 3.61Å; F636-L639 HydrophobicContact CE2-CB 4.41Å; F636-L639 HydrophobicContact CE2-CD1 3.94Å; F636-L639 HydrophobicContact CE2-CD2 3.7Å; F636-L639 HydrophobicContact CE2-CG 3.31Å; F636-L639 HydrophobicContact CG-CD1 4.27Å; F636-L639 HydrophobicContact CG-CG 4.14Å; F636-L639 HydrophobicContact CZ-CD1 3.31Å; F636-L639 HydrophobicContact CZ-CD2 3.49Å; F636-L639 VanDerWaalsContact CZ-CD2 3.49Å; F636-L639 HydrophobicContact CZ-CG 3.18Å; F636-L639 PolarHBondContact O-N 2.89Å; P637-L639 VanDerWaalsContact C-N 3.32Å; P637-L639 PolarHBondContact O-N 3.15Å; L639-M641 VanDerWaalsContact C-N 3.33Å; L639-M641 PolarHBondContact O-N 3.18Å; L639-V642 PolarHBondContact O-N 3.26Å; L639-V642 VanDerWaalsContact O-N 3.1Å; L639-L643 WeakPolarHBondContact O-CB 3.45Å; L639-L643 PolarHBondContact O-N 3.38Å
640	H	85.1	Confident	85.6	Confident	29 Å²	29	42.2 Å²	42.2	13%	0.134	21%	0.209	C	C	.	.	H	α-helix	trans	-54.3	-48.3	-169.9	-177.6	77.3	0	0	0	113	Y635 P637 E638 L644 F693 V697	Y635-H640 HydrophobicContact CE2-CB 4.01Å; Y635-H640 PolarHBondContact OH-ND1 3.25Å; P637-H640 WeakPolarHBondContact O-CB 3.37Å; P637-H640 PolarHBondContact O-N 2.65Å; E638-H640 VanDerWaalsContact C-N 3.33Å; H640-L644 VanDerWaalsContact O-CB 3.24Å; H640-L644 WeakPolarHBondContact O-CB 3.28Å; H640-L644 PolarHBondContact O-N 3.41Å; H640-F693 AromaticContact CE1-CE1 3.71Å; H640-F693 AromaticContact CE1-CZ 3.65Å; H640-F693 AromaticContact ND1-CZ 3.87Å; H640-V697 WeakPolarHBondContact ND1-CG1 3.49Å
641	M	85.1	Confident	85.6	Confident	113 Å²	113	40.9 Å²	40.9	56%	0.557	20%	0.203	S	C	*	.	H	α-helix	trans	-68.2	-41.3	179.1	-64.8	-56.6	-175.4	0	0	111.8	L639 L643 L644 E645	L639-M641 VanDerWaalsContact C-N 3.33Å; L639-M641 PolarHBondContact O-N 3.18Å; M641-L643 PolarHBondContact O-N 2.99Å; M641-L644 PolarHBondContact O-N 3.4Å; M641-E645 WeakPolarHBondContact O-CB 2.89Å; M641-E645 VanDerWaalsContact O-CG 3.31Å; M641-E645 WeakPolarHBondContact O-CG 3.33Å; M641-E645 PolarHBondContact O-N 2.86Å
642	V	85.8	Confident	85.5	Confident	34 Å²	34	44.3 Å²	44.3	21%	0.206	22%	0.22	C	C	.	.	H	α-helix	trans	-63.4	-43.6	-179.7	178.9	0	0	0	0	111.5	Q552 L639 S646	Q552-V642 HydrophobicContact CG-CG1 4.39Å; Q552-V642 HydrophobicContact CG-CG2 4.14Å; L639-V642 PolarHBondContact O-N 3.26Å; L639-V642 VanDerWaalsContact O-N 3.1Å; V642-S646 VanDerWaalsContact O-CB 3.23Å; V642-S646 WeakPolarHBondContact O-CB 3.44Å; V642-S646 PolarHBondContact O-N 2.67Å; V642-S646 PolarHBondContact O-OG 3.46Å
643	L	86.8	Confident	85.5	Confident	1 Å²	1	43.3 Å²	43.3	1%	0.005	22%	0.216	C	C	.	.	H	α-helix	trans	-65.2	-43.9	176.6	180	56.5	0	0	0	111.1	F627 A631 L632 Y635 L639 M641 S646 L647 F693	F627-L643 HydrophobicContact CE1-CD1 4.19Å; F627-L643 HydrophobicContact CZ-CD1 4.34Å; A631-L643 HydrophobicContact CB-CD1 3.4Å; A631-L643 HydrophobicContact CB-CD2 4.35Å; L632-L643 HydrophobicContact CD2-CD2 4.29Å; Y635-L643 HydrophobicContact CD2-CD2 4.29Å; L639-L643 WeakPolarHBondContact O-CB 3.45Å; L639-L643 PolarHBondContact O-N 3.38Å; M641-L643 PolarHBondContact O-N 2.99Å; L643-S646 PolarHBondContact O-N 3.23Å; L643-L647 HydrophobicContact CD1-CD1 4.03Å; L643-L647 HydrophobicContact CD1-CG 4.2Å; L643-L647 HydrophobicContact CG-CD1 3.99Å; L643-L647 WeakPolarHBondContact O-CB 3.49Å; L643-L647 VanDerWaalsContact O-CG 3.28Å; L643-L647 WeakPolarHBondContact O-CG 3.24Å; L643-L647 PolarHBondContact O-N 3.44Å; L643-F693 HydrophobicContact CD2-CD2 4.34Å; L643-F693 HydrophobicContact CD2-CE2 3.86Å; L643-F693 HydrophobicContact CG-CE2 3.96Å
644	L	85.7	Confident	85.5	Confident	7 Å²	7	37.8 Å²	37.8	4%	0.037	19%	0.193	C	C	.	.	H	α-helix	trans	-64.3	-48.1	-179.7	-173.6	62.6	0	0	0	111.7	H640 M641 S646 L647 V648 F693 A701 Q703 L704	H640-L644 VanDerWaalsContact O-CB 3.24Å; H640-L644 WeakPolarHBondContact O-CB 3.28Å; H640-L644 PolarHBondContact O-N 3.41Å; M641-L644 PolarHBondContact O-N 3.4Å; L644-S646 PolarHBondContact O-N 3.09Å; L644-L647 PolarHBondContact O-N 3.49Å; L644-V648 WeakPolarHBondContact O-CB 3.24Å; L644-V648 VanDerWaalsContact O-CG2 3.25Å; L644-V648 WeakPolarHBondContact O-CG2 3.48Å; L644-V648 PolarHBondContact O-N 3.06Å; L644-F693 HydrophobicContact CB-CZ 4.32Å; L644-F693 HydrophobicContact CD1-CE1 4.32Å; L644-F693 HydrophobicContact CD1-CE2 4.47Å; L644-F693 HydrophobicContact CD1-CZ 4.05Å; L644-A701 HydrophobicContact CD1-CB 3.83Å; L644-Q703 HydrophobicContact CD2-CB 4.12Å; L644-Q703 HydrophobicContact CD2-CG 4.19Å; L644-Q703 HydrophobicContact CG-CB 4.31Å; L644-Q703 VanDerWaalsContact CG-OE1 3.22Å; L644-L704 HydrophobicContact CD1-CD1 3.93Å; L644-L704 HydrophobicContact CD1-CG 3.77Å
645	E	86.9	Confident	85.5	Confident	100 Å²	100	38.3 Å²	38.3	47%	0.467	20%	0.197	S	C	.	.	H	α-helix	trans	-59.9	-44.7	174.8	-73.4	174.1	176.6	0	0	111.2	M641 L647 V648 E649	M641-E645 WeakPolarHBondContact O-CB 2.89Å; M641-E645 VanDerWaalsContact O-CG 3.31Å; M641-E645 WeakPolarHBondContact O-CG 3.33Å; M641-E645 PolarHBondContact O-N 2.86Å; E645-L647 PolarHBondContact O-N 3.27Å; E645-V648 PolarHBondContact O-N 3.23Å; E645-E649 WeakPolarHBondContact O-CG 3.23Å; E645-E649 PolarHBondContact O-N 3.48Å
646	S	87.7	Confident	85.5	Confident	5 Å²	5	40.7 Å²	40.7	4%	0.035	21%	0.21	C	C	.	.	H	α-helix	trans	-60.6	-43.6	178.1	-61.4	0	0	0	0	112.4	V642 L643 L644 I650	V642-S646 VanDerWaalsContact O-CB 3.23Å; V642-S646 WeakPolarHBondContact O-CB 3.44Å; V642-S646 PolarHBondContact O-N 2.67Å; V642-S646 PolarHBondContact O-OG 3.46Å; L643-S646 PolarHBondContact O-N 3.23Å; L644-S646 PolarHBondContact O-N 3.09Å; S646-I650 WeakPolarHBondContact O-CD1 3.42Å; S646-I650 VanDerWaalsContact O-CG1 3.24Å; S646-I650 WeakPolarHBondContact O-CG1 3.24Å; S646-I650 PolarHBondContact O-N 3.24Å; S646-I650 VanDerWaalsContact O-N 3.09Å
647	L	87.5	Confident	85.6	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-66.1	-44	176.8	-72.9	166.3	0	0	0	111.7	F627 L628 L643 L644 E645 E649 I650 I651 F693	F627-L647 HydrophobicContact CD1-CD2 3.73Å; F627-L647 HydrophobicContact CE1-CD2 3.91Å; F627-L647 HydrophobicContact CE1-CG 4.22Å; L628-L647 HydrophobicContact CB-CD2 4.32Å; L628-L647 HydrophobicContact CD1-CD1 3.68Å; L628-L647 HydrophobicContact CD1-CD2 4.3Å; L643-L647 HydrophobicContact CD1-CD1 4.03Å; L643-L647 HydrophobicContact CD1-CG 4.2Å; L643-L647 HydrophobicContact CG-CD1 3.99Å; L643-L647 WeakPolarHBondContact O-CB 3.49Å; L643-L647 VanDerWaalsContact O-CG 3.28Å; L643-L647 WeakPolarHBondContact O-CG 3.24Å; L643-L647 PolarHBondContact O-N 3.44Å; L644-L647 PolarHBondContact O-N 3.49Å; E645-L647 PolarHBondContact O-N 3.27Å; L647-E649 VanDerWaalsContact C-N 3.34Å; L647-E649 PolarHBondContact O-N 3.06Å; L647-I650 PolarHBondContact O-N 3.47Å; L647-I651 WeakPolarHBondContact O-CB 3.35Å; L647-I651 WeakPolarHBondContact O-CD1 3.46Å; L647-I651 WeakPolarHBondContact O-CG1 3.43Å; L647-I651 PolarHBondContact O-N 2.97Å; L647-F693 HydrophobicContact CD1-CD2 3.67Å; L647-F693 HydrophobicContact CD1-CE2 4.01Å
648	V	86.6	Confident	85.7	Confident	30 Å²	30	37.4 Å²	37.4	18%	0.182	19%	0.187	C	C	.	.	H	α-helix	trans	-59	-46.4	177.5	166.4	0	0	0	0	110.6	L644 E645 I651 L652 Q703 L704 L707	L644-V648 WeakPolarHBondContact O-CB 3.24Å; L644-V648 VanDerWaalsContact O-CG2 3.25Å; L644-V648 WeakPolarHBondContact O-CG2 3.48Å; L644-V648 PolarHBondContact O-N 3.06Å; E645-V648 PolarHBondContact O-N 3.23Å; V648-I651 PolarHBondContact O-N 2.84Å; V648-L652 WeakPolarHBondContact O-CB 3.33Å; V648-L652 PolarHBondContact O-N 3.43Å; V648-Q703 HydrophobicContact CG2-CB 4.33Å; V648-L704 HydrophobicContact CG2-CD2 3.78Å; V648-L704 HydrophobicContact CG2-CG 4.44Å; V648-L707 HydrophobicContact CG1-CD1 3.9Å
649	E	87	Confident	85.7	Confident	82 Å²	82	32.5 Å²	32.5	38%	0.383	16%	0.164	S	C	.	.	H	α-helix	trans	-63.7	-45.2	178.7	-73.8	179.2	-159.4	0	0	112.7	K559 I563 E645 L647 I651 L652 V653	K559-E649 HydrophobicContact CD-CB 4.48Å; K559-E649 WeakPolarHBondContact CD-OE2 3.47Å; K559-E649 IonicContact NZ-OE2 3.99Å; K559-E649 PolarHBondContact NZ-OE2 3.38Å; I563-E649 HydrophobicContact CD1-CB 4.38Å; E645-E649 WeakPolarHBondContact O-CG 3.23Å; E645-E649 PolarHBondContact O-N 3.48Å; L647-E649 VanDerWaalsContact C-N 3.34Å; L647-E649 PolarHBondContact O-N 3.06Å; E649-I651 VanDerWaalsContact C-N 3.31Å; E649-I651 PolarHBondContact O-N 3.39Å; E649-L652 PolarHBondContact O-N 3.08Å; E649-V653 WeakPolarHBondContact O-CG2 3.21Å; E649-V653 PolarHBondContact O-N 2.67Å; E649-V653 VanDerWaalsContact O-N 3.15Å
650	I	88.6	Confident	85.7	Confident	2 Å²	2	40 Å²	40	1%	0.01	19%	0.194	C	C	.	.	H	α-helix	trans	-57.8	-46.6	176.5	-71.3	165.1	0	0	0	110.5	K559 I562 I563 F620 T624 F627 S646 L647 V653	K559-I650 HydrophobicContact CB-CD1 4.33Å; K559-I650 HydrophobicContact CG-CD1 3.89Å; K559-I650 HydrophobicContact CG-CG1 3.82Å; I562-I650 HydrophobicContact CB-CD1 4.39Å; I562-I650 HydrophobicContact CD1-CD1 3.96Å; I562-I650 HydrophobicContact CG2-CD1 4.21Å; I562-I650 HydrophobicContact CG2-CG1 4.19Å; I562-I650 HydrophobicContact CG2-CG2 3.85Å; I563-I650 HydrophobicContact CD1-CG1 4.44Å; I563-I650 HydrophobicContact CG1-CG1 4.07Å; F620-I650 HydrophobicContact CE2-CG2 3.64Å; F620-I650 WeakPolarHBondContact CE2-O 3.4Å; F620-I650 HydrophobicContact CZ-CG2 4.04Å; T624-I650 HydrophobicContact CG2-CG2 4.35Å; F627-I650 HydrophobicContact CD1-CD1 3.64Å; F627-I650 HydrophobicContact CE1-CD1 3.66Å; F627-I650 HydrophobicContact CG-CD1 4.36Å; F627-I650 HydrophobicContact CZ-CD1 4.38Å; S646-I650 WeakPolarHBondContact O-CD1 3.42Å; S646-I650 VanDerWaalsContact O-CG1 3.24Å; S646-I650 WeakPolarHBondContact O-CG1 3.24Å; S646-I650 PolarHBondContact O-N 3.24Å; S646-I650 VanDerWaalsContact O-N 3.09Å; L647-I650 PolarHBondContact O-N 3.47Å; I650-V653 PolarHBondContact O-N 2.94Å
651	I	87	Confident	85.6	Confident	2 Å²	2	39.2 Å²	39.2	1%	0.01	19%	0.192	C	C	.	.	H	α-helix	trans	-63.5	-43.6	178.6	-73	166.7	0	0	0	111.4	F620 L647 V648 E649 V653 A654 V655 L686 V689 L704 L707	F620-I651 HydrophobicContact CZ-CG1 4.48Å; L647-I651 WeakPolarHBondContact O-CB 3.35Å; L647-I651 WeakPolarHBondContact O-CD1 3.46Å; L647-I651 WeakPolarHBondContact O-CG1 3.43Å; L647-I651 PolarHBondContact O-N 2.97Å; V648-I651 PolarHBondContact O-N 2.84Å; E649-I651 VanDerWaalsContact C-N 3.31Å; E649-I651 PolarHBondContact O-N 3.39Å; I651-V653 VanDerWaalsContact C-N 3.28Å; I651-V653 PolarHBondContact O-N 3.18Å; I651-A654 PolarHBondContact O-N 2.98Å; I651-A654 VanDerWaalsContact O-N 3.12Å; I651-V655 HydrophobicContact CG2-CG2 4.18Å; I651-V655 WeakPolarHBondContact O-CG2 3.2Å; I651-V655 PolarHBondContact O-N 3.24Å; I651-L686 HydrophobicContact CB-CD2 4.47Å; I651-L686 HydrophobicContact CD1-CD2 3.81Å; I651-L686 HydrophobicContact CG1-CD2 4.21Å; I651-L686 HydrophobicContact CG2-CD2 3.47Å; I651-L686 VanDerWaalsContact CG2-CD2 3.47Å; I651-V689 HydrophobicContact CD1-CG1 4.2Å; I651-L704 HydrophobicContact CD1-CD2 3.81Å; I651-L707 HydrophobicContact CG2-CD1 4.12Å; I651-L707 HydrophobicContact CG2-CD2 3.56Å
652	L	85.6	Confident	85.4	Confident	73 Å²	73	35.4 Å²	35.4	38%	0.382	17%	0.173	S	C	.	.	H	α-helix	trans	-62	-36.3	-177.3	-173.6	133	0	0	0	111.7	V648 E649 A654 V655 Q656	V648-L652 WeakPolarHBondContact O-CB 3.33Å; V648-L652 PolarHBondContact O-N 3.43Å; E649-L652 PolarHBondContact O-N 3.08Å; L652-A654 PolarHBondContact O-N 3.11Å; L652-V655 PolarHBondContact O-N 3.39Å; L652-Q656 VanDerWaalsContact CD2-CD 3.48Å; L652-Q656 HydrophobicContact CD2-CG 4.23Å; L652-Q656 HydrophobicContact CG-CG 4.41Å; L652-Q656 WeakPolarHBondContact O-CB 3.34Å; L652-Q656 VanDerWaalsContact O-CG 3.24Å; L652-Q656 WeakPolarHBondContact O-CG 3.36Å; L652-Q656 PolarHBondContact O-N 2.76Å
653	V	86.9	Confident	85.2	Confident	19 Å²	19	41 Å²	41	12%	0.115	19%	0.191	C	C	.	.	H	α-helix	trans	-61.7	-42.1	174.3	172.7	0	0	0	0	112	I563 T566 K567 E649 I650 I651 H657	I563-V653 HydrophobicContact CG1-CG2 4.3Å; I563-V653 HydrophobicContact CG2-CG2 4.04Å; T566-V653 HydrophobicContact CG2-CG1 4.24Å; K567-V653 HydrophobicContact CG-CG1 4Å; E649-V653 WeakPolarHBondContact O-CG2 3.21Å; E649-V653 PolarHBondContact O-N 2.67Å; E649-V653 VanDerWaalsContact O-N 3.15Å; I650-V653 PolarHBondContact O-N 2.94Å; I651-V653 VanDerWaalsContact C-N 3.28Å; I651-V653 PolarHBondContact O-N 3.18Å; V653-H657 PolarHBondContact O-N 2.83Å
654	A	85.3	Confident	85	Confident	7 Å²	7	44.2 Å²	44.2	6%	0.058	21%	0.213	C	C	.	.	H	α-helix	trans	-69.4	-42.1	177.6	0	0	0	0	0	111.9	F620 I651 L652 H657 V658 L681	F620-A654 HydrophobicContact CD1-CB 3.92Å; F620-A654 HydrophobicContact CD2-CB 3.89Å; F620-A654 HydrophobicContact CE1-CB 3.62Å; F620-A654 HydrophobicContact CE2-CB 3.58Å; F620-A654 HydrophobicContact CG-CB 4.06Å; F620-A654 HydrophobicContact CZ-CB 3.46Å; F620-A654 VanDerWaalsContact CZ-CB 3.46Å; I651-A654 PolarHBondContact O-N 2.98Å; I651-A654 VanDerWaalsContact O-N 3.12Å; L652-A654 PolarHBondContact O-N 3.11Å; A654-H657 PolarHBondContact O-N 3.47Å; A654-V658 WeakPolarHBondContact O-CG2 3.45Å; A654-V658 PolarHBondContact O-N 3.31Å; A654-V658 VanDerWaalsContact O-N 3.11Å; A654-L681 HydrophobicContact CB-CD1 3.96Å
655	V	83.8	Confident	84.9	Confident	16 Å²	16	46.1 Å²	46.1	10%	0.097	22%	0.221	C	C	.	.	H	α-helix	trans	-60.1	-49.8	176.1	162.1	0	0	0	0	111.5	I651 L652 H657 V658 D659 L681 Y682	I651-V655 HydrophobicContact CG2-CG2 4.18Å; I651-V655 WeakPolarHBondContact O-CG2 3.2Å; I651-V655 PolarHBondContact O-N 3.24Å; L652-V655 PolarHBondContact O-N 3.39Å; V655-H657 VanDerWaalsContact C-N 3.28Å; V655-H657 PolarHBondContact O-N 3.29Å; V655-V658 PolarHBondContact O-N 3.02Å; V655-D659 WeakPolarHBondContact O-CB 3.36Å; V655-D659 PolarHBondContact O-N 3.44Å; V655-L681 HydrophobicContact CG2-CD2 3.65Å; V655-Y682 HydrophobicContact CB-CE1 4.48Å; V655-Y682 HydrophobicContact CG1-CE1 4.28Å; V655-Y682 WeakPolarHBondContact CG1-OH 3.42Å; V655-Y682 HydrophobicContact CG2-CE1 3.56Å
656	Q	85	Confident	84.5	Confident	103 Å²	103	50.1 Å²	50.1	48%	0.481	24%	0.24	S	C	.	.	H	α-helix	trans	-59.8	-38.2	178.7	-76.2	178.8	-16	0	0	112.4	L652 Y660	L652-Q656 VanDerWaalsContact CD2-CD 3.48Å; L652-Q656 HydrophobicContact CD2-CG 4.23Å; L652-Q656 HydrophobicContact CG-CG 4.41Å; L652-Q656 WeakPolarHBondContact O-CB 3.34Å; L652-Q656 VanDerWaalsContact O-CG 3.24Å; L652-Q656 WeakPolarHBondContact O-CG 3.36Å; L652-Q656 PolarHBondContact O-N 2.76Å; Q656-Y660 VanDerWaalsContact O-CB 3.23Å; Q656-Y660 WeakPolarHBondContact O-CB 3.5Å; Q656-Y660 PolarHBondContact O-N 2.87Å
657	H	84.3	Confident	84.3	Confident	33 Å²	33	52.5 Å²	52.5	15%	0.153	25%	0.253	C	S	.	.	H	α-helix	trans	-67	-43.4	177.5	178.2	60.2	0	0	0	112.7	N570 W575 V653 A654 V655 S661	N570-H657 HydrophobicContact CB-CB 4.49Å; N570-H657 VanDerWaalsContact CG-CG 3.45Å; N570-H657 VanDerWaalsContact ND2-CB 3.33Å; N570-H657 WeakPolarHBondContact ND2-CB 3.42Å; N570-H657 PolarHBondContact O-CE1 3.43Å; N570-H657 PolarHBondContact OD1-CD2 2.84Å; W575-H657 AromaticContact CZ2-CD2 3.98Å; W575-H657 AromaticContact CZ2-NE2 3.75Å; V653-H657 PolarHBondContact O-N 2.83Å; A654-H657 PolarHBondContact O-N 3.47Å; V655-H657 VanDerWaalsContact C-N 3.28Å; V655-H657 PolarHBondContact O-N 3.29Å; H657-S661 WeakPolarHBondContact O-CB 3.3Å; H657-S661 PolarHBondContact O-N 3.4Å; H657-S661 PolarHBondContact O-OG 3.34Å
658	V	83.7	Confident	84	Confident	3 Å²	3	57.1 Å²	57.1	2%	0.018	28%	0.282	C	S	.	.	H	α-helix	trans	-62.5	-45.6	175.6	174.3	0	0	0	0	110.4	W575 A654 V655 S661 L662 I674 A678	W575-V658 HydrophobicContact CH2-CG2 4Å; A654-V658 WeakPolarHBondContact O-CG2 3.45Å; A654-V658 PolarHBondContact O-N 3.31Å; A654-V658 VanDerWaalsContact O-N 3.11Å; V655-V658 PolarHBondContact O-N 3.02Å; V658-S661 PolarHBondContact O-N 3.36Å; V658-L662 HydrophobicContact CG1-CD1 4.11Å; V658-L662 WeakPolarHBondContact O-CG 3.47Å; V658-L662 PolarHBondContact O-N 3.31Å; V658-I674 HydrophobicContact CG1-CG2 4.17Å; V658-A678 HydrophobicContact CG1-CB 3.61Å
659	D	81.4	Confident	83.8	Confident	21 Å²	21	63.1 Å²	63.1	11%	0.112	31%	0.309	C	S	.	.	H	α-helix	trans	-65.6	-42.2	179.7	-77.4	-7.7	0	0	0	112.3	V655 L662 R663	V655-D659 WeakPolarHBondContact O-CB 3.36Å; V655-D659 PolarHBondContact O-N 3.44Å; D659-L662 PolarHBondContact O-N 3.26Å; D659-R663 WeakPolarHBondContact O-CG 3.24Å; D659-R663 PolarHBondContact O-N 3.44Å
660	Y	83.2	Confident	83.5	Confident	160 Å²	160	63 Å²	63	63%	0.627	31%	0.307	S	S	*	.	H	α-helix	trans	-60.8	-46.2	174	178.4	-97.8	0	0	0	111.1	Q656 L662 R663 C664	Q656-Y660 VanDerWaalsContact O-CB 3.23Å; Q656-Y660 WeakPolarHBondContact O-CB 3.5Å; Q656-Y660 PolarHBondContact O-N 2.87Å; Y660-L662 VanDerWaalsContact C-N 3.35Å; Y660-L662 PolarHBondContact O-N 2.82Å; Y660-R663 PolarHBondContact O-N 2.81Å; Y660-R663 VanDerWaalsContact O-N 3.15Å; Y660-C664 VanDerWaalsContact CZ-SG 3.51Å; Y660-C664 PolarHBondContact O-N 2.88Å; Y660-C664 PolarHBondContact O-SG 3.41Å
661	S	83.7	Confident	83.2	Confident	13 Å²	13	66 Å²	66	9%	0.091	32%	0.32	C	S	.	.	H	α-helix	trans	-62.8	-39.3	179	-59.7	0	0	0	0	112.2	W575 H657 V658 R663 C664 E665	W575-S661 PolarHBondContact NE1-OG 3.42Å; H657-S661 WeakPolarHBondContact O-CB 3.3Å; H657-S661 PolarHBondContact O-N 3.4Å; H657-S661 PolarHBondContact O-OG 3.34Å; V658-S661 PolarHBondContact O-N 3.36Å; S661-R663 VanDerWaalsContact C-N 3.3Å; S661-R663 PolarHBondContact O-N 2.73Å; S661-C664 PolarHBondContact O-N 3.42Å; S661-E665 WeakPolarHBondContact O-CB 3.3Å; S661-E665 PolarHBondContact O-N 3.5Å
662	L	81.7	Confident	83	Confident	32 Å²	32	68.4 Å²	68.4	17%	0.168	34%	0.34	C	S	.	.	H	α-helix	trans	-64.2	-31.3	175.2	-77.9	170.4	0	0	0	113.9	V658 D659 Y660 K671 I674 R675	V658-L662 HydrophobicContact CG1-CD1 4.11Å; V658-L662 WeakPolarHBondContact O-CG 3.47Å; V658-L662 PolarHBondContact O-N 3.31Å; D659-L662 PolarHBondContact O-N 3.26Å; Y660-L662 VanDerWaalsContact C-N 3.35Å; Y660-L662 PolarHBondContact O-N 2.82Å; L662-K671 HydrophobicContact CD2-CG 4.23Å; L662-K671 WeakPolarHBondContact O-CE 3.28Å; L662-I674 HydrophobicContact CD1-CG2 4.35Å; L662-I674 HydrophobicContact CD2-CB 3.71Å; L662-I674 HydrophobicContact CD2-CG2 3.48Å; L662-I674 VanDerWaalsContact CD2-CG2 3.48Å; L662-I674 HydrophobicContact CG-CB 4.3Å; L662-I674 HydrophobicContact CG-CG2 3.5Å; L662-R675 HydrophobicContact CD2-CG 3.81Å
663	R	81.2	Confident	83	Confident	151 Å²	151	65.8 Å²	65.8	57%	0.57	33%	0.326	S	S	*	.	H	α-helix	trans	-78.8	-39.9	178.4	-70	174.1	-172.1	-146.1	0.5	112	D659 Y660 S661	D659-R663 WeakPolarHBondContact O-CG 3.24Å; D659-R663 PolarHBondContact O-N 3.44Å; Y660-R663 PolarHBondContact O-N 2.81Å; Y660-R663 VanDerWaalsContact O-N 3.15Å; S661-R663 VanDerWaalsContact C-N 3.3Å; S661-R663 PolarHBondContact O-N 2.73Å
664	C	82.5	Confident	82.9	Confident	70 Å²	70	64.9 Å²	64.9	47%	0.473	32%	0.32	S	S	.	.	H	α-helix	trans	-81.7	-28.9	-176.4	-68	0	0	0	0	113.6	Y660 S661	Y660-C664 VanDerWaalsContact CZ-SG 3.51Å; Y660-C664 PolarHBondContact O-N 2.88Å; Y660-C664 PolarHBondContact O-SG 3.41Å; S661-C664 PolarHBondContact O-N 3.42Å
665	E	82.8	Confident	82.8	Confident	46 Å²	46	70.1 Å²	70.1	22%	0.215	34%	0.338	C	S	.	.			trans	-74.9	126.2	-176	-171.5	58.6	-91.9	0	0	112.4	S661 D667 K670 I674	S661-E665 WeakPolarHBondContact O-CB 3.3Å; S661-E665 PolarHBondContact O-N 3.5Å; E665-D667 HydrophobicContact CG-CB 4.45Å; E665-D667 PolarHBondContact OE1-N 3.36Å; E665-K670 HydrophobicContact CG-CB 3.79Å; E665-K670 VanDerWaalsContact OE2-CD 3.24Å; E665-K670 WeakPolarHBondContact OE2-CD 3.42Å; E665-I674 HydrophobicContact CB-CD1 3.93Å; E665-I674 HydrophobicContact CG-CD1 3.99Å
666	Q	79.1	Confident	82.7	Confident	184 Å²	184	72.4 Å²	72.4	86%	0.86	35%	0.348	S	S	*	.			trans	-99.5	-22.1	-179.4	-61.9	-167.3	5.7	0	0	112.4
667	D	83.6	Confident	82.8	Confident	56 Å²	56	67.5 Å²	67.5	30%	0.299	33%	0.325	S	S	.	.			trans	-72.1	120	179.2	-178.7	-11.8	0	0	0	111.1	E665 E669 K670 K671	E665-D667 HydrophobicContact CG-CB 4.45Å; E665-D667 PolarHBondContact OE1-N 3.36Å; D667-E669 VanDerWaalsContact C-N 3.31Å; D667-E669 PolarHBondContact O-N 3.3Å; D667-E669 PolarHBondContact OD1-N 2.86Å; D667-K670 HydrophobicContact CB-CB 4.11Å; D667-K670 HydrophobicContact CB-CD 4.08Å; D667-K670 HydrophobicContact CB-CG 4.2Å; D667-K670 PolarHBondContact O-N 3.46Å; D667-K670 WeakPolarHBondContact OD2-CE 3.17Å; D667-K670 WeakPolarHBondContact OD2-CG 3.41Å; D667-K671 VanDerWaalsContact O-CB 3.24Å; D667-K671 WeakPolarHBondContact O-CB 3.39Å; D667-K671 PolarHBondContact O-N 2.96Å
668	P	81.5	Confident	82.7	Confident	96 Å²	96	66.1 Å²	66.1	62%	0.623	32%	0.319	S	S	*	.	H	α-helix	trans	-64.2	-32.3	-176.8	26.7	-35.1	0	0	0	113.3	A672	P668-A672 WeakPolarHBondContact O-CB 3.36Å; P668-A672 PolarHBondContact O-N 3.19Å
669	E	81.7	Confident	82.7	Confident	157 Å²	157	66.9 Å²	66.9	73%	0.734	33%	0.325	S	S	*	.	H	α-helix	trans	-72.8	-45.8	-179.2	-66.4	-172.8	176.1	0	0	110.8	D667 K671 A672 F673	D667-E669 VanDerWaalsContact C-N 3.31Å; D667-E669 PolarHBondContact O-N 3.3Å; D667-E669 PolarHBondContact OD1-N 2.86Å; E669-K671 VanDerWaalsContact C-N 3.34Å; E669-K671 PolarHBondContact O-N 3.35Å; E669-A672 WeakPolarHBondContact O-CB 3.43Å; E669-A672 PolarHBondContact O-N 3.04Å; E669-F673 PolarHBondContact O-N 3.48Å
670	K	81.9	Confident	82.8	Confident	79 Å²	79	65.9 Å²	65.9	34%	0.343	32%	0.319	S	S	.	.	H	α-helix	trans	-63.9	-40.1	173	-68.2	-179	-169.4	170.4	0	111.6	E665 D667 A672 F673 I674	E665-K670 HydrophobicContact CG-CB 3.79Å; E665-K670 VanDerWaalsContact OE2-CD 3.24Å; E665-K670 WeakPolarHBondContact OE2-CD 3.42Å; D667-K670 HydrophobicContact CB-CB 4.11Å; D667-K670 HydrophobicContact CB-CD 4.08Å; D667-K670 HydrophobicContact CB-CG 4.2Å; D667-K670 PolarHBondContact O-N 3.46Å; D667-K670 WeakPolarHBondContact OD2-CE 3.17Å; D667-K670 WeakPolarHBondContact OD2-CG 3.41Å; K670-A672 VanDerWaalsContact C-N 3.29Å; K670-A672 PolarHBondContact O-N 3.46Å; K670-F673 CarbonylContact O-C 3.59Å; K670-F673 WeakPolarHBondContact O-CB 3.48Å; K670-F673 PolarHBondContact O-N 3.5Å; K670-F673 VanDerWaalsContact O-N 3.08Å; K670-I674 VanDerWaalsContact O-CG1 3.22Å; K670-I674 WeakPolarHBondContact O-CG1 3.15Å; K670-I674 PolarHBondContact O-N 3.2Å
671	K	82	Confident	82.8	Confident	65 Å²	65	58.4 Å²	58.4	28%	0.283	29%	0.29	S	S	.	.	H	α-helix	trans	-61.9	-36.7	175.8	-162.8	171.1	-172.8	158.5	0	112	L662 D667 E669 R675	L662-K671 HydrophobicContact CD2-CG 4.23Å; L662-K671 WeakPolarHBondContact O-CE 3.28Å; D667-K671 VanDerWaalsContact O-CB 3.24Å; D667-K671 WeakPolarHBondContact O-CB 3.39Å; D667-K671 PolarHBondContact O-N 2.96Å; E669-K671 VanDerWaalsContact C-N 3.34Å; E669-K671 PolarHBondContact O-N 3.35Å; K671-R675 VanDerWaalsContact O-CG 3.29Å; K671-R675 WeakPolarHBondContact O-CG 3.44Å; K671-R675 PolarHBondContact O-N 2.98Å; K671-R675 VanDerWaalsContact O-N 3.08Å
672	A	83.1	Confident	82.7	Confident	53 Å²	53	58 Å²	58	44%	0.438	29%	0.287	S	S	.	.	H	α-helix	trans	-65.6	-41.7	171.8	0	0	0	0	0	112.1	P668 E669 K670 R675 Q676	P668-A672 WeakPolarHBondContact O-CB 3.36Å; P668-A672 PolarHBondContact O-N 3.19Å; E669-A672 WeakPolarHBondContact O-CB 3.43Å; E669-A672 PolarHBondContact O-N 3.04Å; K670-A672 VanDerWaalsContact C-N 3.29Å; K670-A672 PolarHBondContact O-N 3.46Å; A672-R675 PolarHBondContact O-N 2.91Å; A672-Q676 PolarHBondContact O-N 3.48Å; A672-Q676 VanDerWaalsContact O-N 3.08Å
673	F	84.9	Confident	82.6	Confident	18 Å²	18	61 Å²	61	8%	0.079	30%	0.3	C	S	.	.	H	α-helix	trans	-64.6	-42.3	175.7	-175.9	-108.6	0	0	0	112.9	W575 R577 N612 E669 K670 R675 Q676 N677	W575-F673 VanDerWaalsContact C-CE1 3.47Å; W575-F673 HydrophobicContact CB-CD1 4.24Å; W575-F673 HydrophobicContact CE3-CD1 4.5Å; W575-F673 HydrophobicContact CE3-CE1 4.49Å; W575-F673 VanDerWaalsContact O-CD1 3.26Å; W575-F673 WeakPolarHBondContact O-CD1 3.27Å; R577-F673 HydrophobicContact CG-CD2 4.33Å; R577-F673 HydrophobicContact CG-CE2 3.66Å; R577-F673 HydrophobicContact CG-CZ 4.13Å; N612-F673 WeakPolarHBondContact O-CE2 3.41Å; E669-F673 PolarHBondContact O-N 3.48Å; K670-F673 CarbonylContact O-C 3.59Å; K670-F673 WeakPolarHBondContact O-CB 3.48Å; K670-F673 PolarHBondContact O-N 3.5Å; K670-F673 VanDerWaalsContact O-N 3.08Å; F673-R675 VanDerWaalsContact C-N 3.32Å; F673-R675 PolarHBondContact O-N 2.84Å; F673-Q676 WeakPolarHBondContact O-CB 3.23Å; F673-Q676 PolarHBondContact O-N 2.85Å; F673-N677 VanDerWaalsContact CE1-ND2 3.31Å; F673-N677 WeakPolarHBondContact CE1-ND2 3.27Å; F673-N677 WeakPolarHBondContact CZ-ND2 3.33Å; F673-N677 PolarHBondContact O-N 3.16Å; F673-N677 VanDerWaalsContact O-N 3.07Å; F673-N677 PolarHBondContact O-ND2 3.37Å
674	I	83.6	Confident	82.6	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-63.2	-39.8	175.5	-59.4	162.7	0	0	0	110.2	W575 V658 L662 E665 K670 Q676 N677 A678	W575-I674 HydrophobicContact CB-CD1 4.48Å; W575-I674 HydrophobicContact CB-CG1 4.08Å; W575-I674 HydrophobicContact CD2-CD1 4.19Å; W575-I674 HydrophobicContact CD2-CG1 3.53Å; W575-I674 HydrophobicContact CE3-CB 4.42Å; W575-I674 HydrophobicContact CE3-CG1 3.77Å; W575-I674 HydrophobicContact CE3-CG2 4.43Å; W575-I674 HydrophobicContact CG-CD1 3.98Å; W575-I674 HydrophobicContact CG-CG1 3.66Å; W575-I674 HydrophobicContact CH2-CG2 4.22Å; W575-I674 HydrophobicContact CZ2-CG2 4.28Å; W575-I674 HydrophobicContact CZ3-CG1 4.43Å; W575-I674 HydrophobicContact CZ3-CG2 4.28Å; V658-I674 HydrophobicContact CG1-CG2 4.17Å; L662-I674 HydrophobicContact CD1-CG2 4.35Å; L662-I674 HydrophobicContact CD2-CB 3.71Å; L662-I674 HydrophobicContact CD2-CG2 3.48Å; L662-I674 VanDerWaalsContact CD2-CG2 3.48Å; L662-I674 HydrophobicContact CG-CB 4.3Å; L662-I674 HydrophobicContact CG-CG2 3.5Å; E665-I674 HydrophobicContact CB-CD1 3.93Å; E665-I674 HydrophobicContact CG-CD1 3.99Å; K670-I674 VanDerWaalsContact O-CG1 3.22Å; K670-I674 WeakPolarHBondContact O-CG1 3.15Å; K670-I674 PolarHBondContact O-N 3.2Å; I674-Q676 VanDerWaalsContact C-N 3.31Å; I674-Q676 PolarHBondContact O-N 2.86Å; I674-N677 PolarHBondContact O-N 2.86Å; I674-A678 WeakPolarHBondContact O-CB 3.42Å; I674-A678 PolarHBondContact O-N 3.35Å
675	R	83.3	Confident	82.6	Confident	117 Å²	117	51.7 Å²	51.7	44%	0.442	26%	0.258	S	S	.	.	H	α-helix	trans	-62.4	-35.4	174.4	-74.8	-178.8	-166	113.5	-8.7	113.2	L662 K671 A672 F673 A678 S679	L662-R675 HydrophobicContact CD2-CG 3.81Å; K671-R675 VanDerWaalsContact O-CG 3.29Å; K671-R675 WeakPolarHBondContact O-CG 3.44Å; K671-R675 PolarHBondContact O-N 2.98Å; K671-R675 VanDerWaalsContact O-N 3.08Å; A672-R675 PolarHBondContact O-N 2.91Å; F673-R675 VanDerWaalsContact C-N 3.32Å; F673-R675 PolarHBondContact O-N 2.84Å; R675-A678 PolarHBondContact O-N 3.25Å; R675-S679 PolarHBondContact O-N 3.07Å
676	Q	83.5	Confident	82.6	Confident	63 Å²	63	49.9 Å²	49.9	29%	0.294	25%	0.249	S	C	.	.	H	α-helix	trans	-66.1	-44.1	175.1	-174.2	175.7	13.1	0	0	111.2	Y604 A672 F673 I674 S679 F680	Y604-Q676 HydrophobicContact CD1-CG 4.42Å; Y604-Q676 HydrophobicContact CE1-CG 4.36Å; A672-Q676 PolarHBondContact O-N 3.48Å; A672-Q676 VanDerWaalsContact O-N 3.08Å; F673-Q676 WeakPolarHBondContact O-CB 3.23Å; F673-Q676 PolarHBondContact O-N 2.85Å; I674-Q676 VanDerWaalsContact C-N 3.31Å; I674-Q676 PolarHBondContact O-N 2.86Å; Q676-S679 WeakPolarHBondContact O-CB 2.97Å; Q676-S679 PolarHBondContact O-N 3.47Å; Q676-F680 PolarHBondContact O-N 3.33Å
677	N	85.3	Confident	82.9	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-64.3	-39.6	174.6	-78.3	-84.3	0	0	0	112.2	W575 L613 S614 V617 F673 I674 S679 F680 L681	W575-N677 HydrophobicContact CZ3-CB 3.88Å; L613-N677 VanDerWaalsContact CA-OD1 3.27Å; L613-N677 WeakPolarHBondContact CA-OD1 3.46Å; L613-N677 WeakPolarHBondContact CD2-OD1 3.14Å; S614-N677 PolarHBondContact N-OD1 2.98Å; V617-N677 HydrophobicContact CG2-CB 4.24Å; F673-N677 VanDerWaalsContact CE1-ND2 3.31Å; F673-N677 WeakPolarHBondContact CE1-ND2 3.27Å; F673-N677 WeakPolarHBondContact CZ-ND2 3.33Å; F673-N677 PolarHBondContact O-N 3.16Å; F673-N677 VanDerWaalsContact O-N 3.07Å; F673-N677 PolarHBondContact O-ND2 3.37Å; I674-N677 PolarHBondContact O-N 2.86Å; N677-S679 VanDerWaalsContact C-N 3.34Å; N677-S679 PolarHBondContact O-N 3.12Å; N677-F680 PolarHBondContact O-N 3.35Å; N677-L681 PolarHBondContact O-N 3.31Å
678	A	83.6	Confident	83	Confident	4 Å²	4	41.1 Å²	41.1	3%	0.033	21%	0.211	C	C	.	.	H	α-helix	trans	-60.6	-43.1	171.7	0	0	0	0	0	111.4	V658 I674 R675 F680 L681 Y682	V658-A678 HydrophobicContact CG1-CB 3.61Å; I674-A678 WeakPolarHBondContact O-CB 3.42Å; I674-A678 PolarHBondContact O-N 3.35Å; R675-A678 PolarHBondContact O-N 3.25Å; A678-F680 VanDerWaalsContact C-N 3.3Å; A678-F680 PolarHBondContact O-N 3.36Å; A678-L681 PolarHBondContact O-N 3.41Å; A678-Y682 HydrophobicContact CB-CD2 4.21Å; A678-Y682 HydrophobicContact CB-CE2 4.08Å; A678-Y682 WeakPolarHBondContact O-CD2 3.43Å; A678-Y682 PolarHBondContact O-N 3.11Å
679	S	83.4	Confident	83.1	Confident	19 Å²	19	36.6 Å²	36.6	13%	0.133	18%	0.182	C	C	.	.	H	α-helix	trans	-53	-50.3	173.1	-144.5	0	0	0	0	111.5	R675 Q676 N677 L681 Y682 E683 R715	R675-S679 PolarHBondContact O-N 3.07Å; Q676-S679 WeakPolarHBondContact O-CB 2.97Å; Q676-S679 PolarHBondContact O-N 3.47Å; N677-S679 VanDerWaalsContact C-N 3.34Å; N677-S679 PolarHBondContact O-N 3.12Å; S679-L681 PolarHBondContact O-N 3.4Å; S679-Y682 PolarHBondContact O-N 3.35Å; S679-E683 VanDerWaalsContact O-CB 3.23Å; S679-E683 WeakPolarHBondContact O-CB 3.15Å; S679-E683 PolarHBondContact O-N 3.15Å; S679-E683 PolarHBondContact OG-OE2 2.86Å; S679-R715 PolarHBondContact OG-NH2 3.18Å
680	F	84	Confident	83.2	Confident	0 Å²	0	29.7 Å²	29.7	0%	0	15%	0.149	C	C	.	.	I	π-helix	trans	-61.6	-45.9	-177.9	179	-103.6	0	0	0	111.3	V598 F601 Y604 L613 V617 Q676 N677 A678 Y682 T684 V685	V598-F680 HydrophobicContact CG1-CE2 4.18Å; V598-F680 HydrophobicContact CG1-CZ 4.39Å; F601-F680 AromaticContact CD2-CE2 4Å; F601-F680 HydrophobicContact CD2-CE2 4Å; F601-F680 AromaticContact CD2-CZ 3.96Å; F601-F680 HydrophobicContact CD2-CZ 3.96Å; F601-F680 HydrophobicContact CE2-CE2 4.45Å; F601-F680 HydrophobicContact CE2-CZ 4.14Å; Y604-F680 HydrophobicContact CD1-CD2 4.39Å; Y604-F680 AromaticContact CD2-CD2 3.73Å; Y604-F680 HydrophobicContact CD2-CD2 3.73Å; Y604-F680 HydrophobicContact CD2-CE2 4.09Å; Y604-F680 HydrophobicContact CE1-CB 4.08Å; Y604-F680 HydrophobicContact CE1-CD2 4.25Å; Y604-F680 AromaticContact CE2-CD2 3.57Å; Y604-F680 HydrophobicContact CE2-CD2 3.57Å; Y604-F680 HydrophobicContact CE2-CE2 4.2Å; Y604-F680 HydrophobicContact CG-CD2 4.14Å; Y604-F680 AromaticContact CZ-CD2 3.84Å; L613-F680 HydrophobicContact CD1-CD1 3.8Å; L613-F680 HydrophobicContact CD1-CD2 3.91Å; L613-F680 HydrophobicContact CD1-CE1 3.86Å; L613-F680 HydrophobicContact CD1-CE2 3.97Å; L613-F680 HydrophobicContact CD1-CG 3.81Å; L613-F680 HydrophobicContact CD1-CZ 3.94Å; L613-F680 HydrophobicContact CD2-CB 3.69Å; L613-F680 HydrophobicContact CD2-CD1 4.14Å; L613-F680 HydrophobicContact CD2-CD2 4.47Å; L613-F680 HydrophobicContact CD2-CG 3.84Å; V617-F680 HydrophobicContact CG1-CD1 3.69Å; V617-F680 HydrophobicContact CG1-CE1 4.16Å; Q676-F680 PolarHBondContact O-N 3.33Å; N677-F680 PolarHBondContact O-N 3.35Å; A678-F680 VanDerWaalsContact C-N 3.3Å; A678-F680 PolarHBondContact O-N 3.36Å; F680-Y682 PolarHBondContact O-N 3.4Å; F680-T684 HydrophobicContact CD2-CG2 4.2Å; F680-T684 HydrophobicContact CE2-CG2 3.85Å; F680-T684 WeakPolarHBondContact O-CA 3.34Å; F680-T684 WeakPolarHBondContact O-CB 3.24Å; F680-T684 PolarHBondContact O-N 3.04Å; F680-V685 HydrophobicContact CD1-CG2 3.88Å; F680-V685 HydrophobicContact CE1-CG2 3.52Å; F680-V685 HydrophobicContact CZ-CG2 4.02Å; F680-V685 PolarHBondContact O-N 3.33Å
681	L	83.4	Confident	83.3	Confident	3 Å²	3	31.8 Å²	31.8	2%	0.016	16%	0.159	C	C	.	.	I	π-helix	trans	-62.1	-45.7	178.5	-167.9	136.9	0	0	0	112.1	F620 A654 V655 N677 A678 S679 V685 L686	F620-L681 HydrophobicContact CD1-CD1 4.09Å; F620-L681 HydrophobicContact CE1-CD1 4.05Å; A654-L681 HydrophobicContact CB-CD1 3.96Å; V655-L681 HydrophobicContact CG2-CD2 3.65Å; N677-L681 PolarHBondContact O-N 3.31Å; A678-L681 PolarHBondContact O-N 3.41Å; S679-L681 PolarHBondContact O-N 3.4Å; L681-V685 WeakPolarHBondContact O-CB 3.44Å; L681-V685 PolarHBondContact O-N 3.13Å; L681-L686 WeakPolarHBondContact O-CG 3.46Å; L681-L686 PolarHBondContact O-N 2.86Å
682	Y	79.6	Confident	83.4	Confident	6 Å²	6	32 Å²	32	2%	0.024	16%	0.158	C	C	.	.	I	π-helix	trans	-81.4	-37.5	-175.4	-65.6	-56.1	0	0	0	115.2	V655 A678 S679 F680 L686 P687 S711	V655-Y682 HydrophobicContact CB-CE1 4.48Å; V655-Y682 HydrophobicContact CG1-CE1 4.28Å; V655-Y682 WeakPolarHBondContact CG1-OH 3.42Å; V655-Y682 HydrophobicContact CG2-CE1 3.56Å; A678-Y682 HydrophobicContact CB-CD2 4.21Å; A678-Y682 HydrophobicContact CB-CE2 4.08Å; A678-Y682 WeakPolarHBondContact O-CD2 3.43Å; A678-Y682 PolarHBondContact O-N 3.11Å; S679-Y682 PolarHBondContact O-N 3.35Å; F680-Y682 PolarHBondContact O-N 3.4Å; Y682-L686 HydrophobicContact CD1-CD1 3.66Å; Y682-L686 HydrophobicContact CE1-CD1 4.36Å; Y682-P687 WeakPolarHBondContact O-CD 3.46Å; Y682-S711 VanDerWaalsContact CD1-CB 3.5Å; Y682-S711 WeakPolarHBondContact CD1-OG 3.32Å
683	E	80.2	Confident	83.4	Confident	94 Å²	94	29.5 Å²	29.5	44%	0.439	14%	0.137	S	C	.	.	I	π-helix	trans	-96	-22.6	-173.8	-62.3	176.4	156.7	0	0	112.8	S679 P687 R715	S679-E683 VanDerWaalsContact O-CB 3.23Å; S679-E683 WeakPolarHBondContact O-CB 3.15Å; S679-E683 PolarHBondContact O-N 3.15Å; S679-E683 PolarHBondContact OG-OE2 2.86Å; E683-P687 WeakPolarHBondContact O-CG 3.42Å; E683-R715 IonicContact OE1-CZ 3.94Å; E683-R715 IonicContact OE1-NH1 2.69Å; E683-R715 PolarHBondContact OE1-NH1 3Å; E683-R715 IonicContact OE2-NH1 2.67Å
684	T	81.4	Confident	83.4	Confident	21 Å²	21	31.4 Å²	31.4	13%	0.129	15%	0.146	C	C	.	.	I	π-helix	trans	-114.7	-53.2	-176.7	-50	0	0	0	0	111.7	V598 F680 V688	V598-T684 HydrophobicContact CG1-CG2 3.45Å; V598-T684 VanDerWaalsContact CG1-CG2 3.45Å; V598-T684 HydrophobicContact CG2-CG2 4.47Å; F680-T684 HydrophobicContact CD2-CG2 4.2Å; F680-T684 HydrophobicContact CE2-CG2 3.85Å; F680-T684 WeakPolarHBondContact O-CA 3.34Å; F680-T684 WeakPolarHBondContact O-CB 3.24Å; F680-T684 PolarHBondContact O-N 3.04Å; T684-V688 WeakPolarHBondContact O-CB 3.33Å; T684-V688 WeakPolarHBondContact O-CG2 3.33Å; T684-V688 PolarHBondContact O-N 3.05Å
685	V	83.4	Confident	83.4	Confident	4 Å²	4	36.8 Å²	36.8	2%	0.024	17%	0.171	C	C	.	.	I	π-helix	trans	-72.6	-51.2	-174.3	-178.3	0	0	0	0	112	T621 F680 L681 V688 V689	T621-V685 HydrophobicContact CG2-CG1 4.08Å; T621-V685 HydrophobicContact CG2-CG2 3.82Å; T621-V685 WeakPolarHBondContact OG1-CG2 3.4Å; F680-V685 HydrophobicContact CD1-CG2 3.88Å; F680-V685 HydrophobicContact CE1-CG2 3.52Å; F680-V685 HydrophobicContact CZ-CG2 4.02Å; F680-V685 PolarHBondContact O-N 3.33Å; L681-V685 WeakPolarHBondContact O-CB 3.44Å; L681-V685 PolarHBondContact O-N 3.13Å; V685-V688 PolarHBondContact O-N 2.48Å; V685-V689 HydrophobicContact CG1-CG2 4.24Å; V685-V689 WeakPolarHBondContact O-CG2 3.25Å; V685-V689 PolarHBondContact O-N 3.36Å
686	L	82.9	Confident	83	Confident	8 Å²	8	33.2 Å²	33.2	4%	0.042	17%	0.171	C	C	.	.	H	α-helix	trans	-57.6	-46.9	-179.8	-71.8	-178.4	0	0	0	113.8	I651 L681 Y682 V688 V689 E690 L707 R708	I651-L686 HydrophobicContact CB-CD2 4.47Å; I651-L686 HydrophobicContact CD1-CD2 3.81Å; I651-L686 HydrophobicContact CG1-CD2 4.21Å; I651-L686 HydrophobicContact CG2-CD2 3.47Å; I651-L686 VanDerWaalsContact CG2-CD2 3.47Å; L681-L686 WeakPolarHBondContact O-CG 3.46Å; L681-L686 PolarHBondContact O-N 2.86Å; Y682-L686 HydrophobicContact CD1-CD1 3.66Å; Y682-L686 HydrophobicContact CE1-CD1 4.36Å; L686-V688 VanDerWaalsContact C-N 3.29Å; L686-V688 PolarHBondContact O-N 3.04Å; L686-V689 PolarHBondContact O-N 3.36Å; L686-E690 WeakPolarHBondContact O-CB 3.38Å; L686-E690 PolarHBondContact O-N 3.28Å; L686-L707 HydrophobicContact CD1-CD2 3.86Å; L686-L707 HydrophobicContact CD2-CD2 4.06Å; L686-R708 HydrophobicContact CD1-CB 4.42Å
687	P	84.2	Confident	82.8	Confident	33 Å²	33	31.1 Å²	31.1	21%	0.214	16%	0.162	C	C	.	.	H	α-helix	trans	-66.7	-31.2	178.6	-24.2	38.5	0	0	0	112.8	Y682 E683 K691	Y682-P687 WeakPolarHBondContact O-CD 3.46Å; E683-P687 WeakPolarHBondContact O-CG 3.42Å; P687-K691 VanDerWaalsContact O-CB 3.22Å; P687-K691 WeakPolarHBondContact O-CB 3.26Å; P687-K691 PolarHBondContact O-N 3.41Å
688	V	85.1	Confident	82.2	Confident	23 Å²	23	34.2 Å²	34.2	14%	0.139	20%	0.195	C	C	.	.	H	α-helix	trans	-69.4	-43.3	175.6	170.1	0	0	0	0	110.7	C596 V598 M625 T684 V685 L686 K691 R692	C596-V688 VanDerWaalsContact O-CG1 3.3Å; C596-V688 WeakPolarHBondContact O-CG1 3.36Å; V598-V688 HydrophobicContact CG2-CG1 4.4Å; V598-V688 HydrophobicContact CG2-CG2 4.37Å; M625-V688 HydrophobicContact CE-CG1 4.1Å; M625-V688 HydrophobicContact SD-CG1 4.2Å; T684-V688 WeakPolarHBondContact O-CB 3.33Å; T684-V688 WeakPolarHBondContact O-CG2 3.33Å; T684-V688 PolarHBondContact O-N 3.05Å; V685-V688 PolarHBondContact O-N 2.48Å; L686-V688 VanDerWaalsContact C-N 3.29Å; L686-V688 PolarHBondContact O-N 3.04Å; V688-K691 PolarHBondContact O-N 2.89Å; V688-R692 HydrophobicContact CG1-CG 4.46Å; V688-R692 WeakPolarHBondContact O-CB 3.47Å; V688-R692 WeakPolarHBondContact O-CG 3.22Å; V688-R692 PolarHBondContact O-N 2.87Å
689	V	85	Confident	81.7	Confident	1 Å²	1	40.1 Å²	40.1	1%	0.006	22%	0.219	C	C	.	.	H	α-helix	trans	-61.3	-47	174.4	171.2	0	0	0	0	110.9	T624 M625 L628 I651 V685 L686 R692 F693 L704	T624-V689 HydrophobicContact CG2-CG2 4.33Å; M625-V689 HydrophobicContact SD-CG2 3.6Å; M625-V689 VanDerWaalsContact SD-CG2 3.6Å; L628-V689 HydrophobicContact CD2-CG1 4.23Å; I651-V689 HydrophobicContact CD1-CG1 4.2Å; V685-V689 HydrophobicContact CG1-CG2 4.24Å; V685-V689 WeakPolarHBondContact O-CG2 3.25Å; V685-V689 PolarHBondContact O-N 3.36Å; L686-V689 PolarHBondContact O-N 3.36Å; V689-R692 PolarHBondContact O-N 3.08Å; V689-F693 VanDerWaalsContact O-CB 3.29Å; V689-F693 WeakPolarHBondContact O-CB 3.45Å; V689-F693 PolarHBondContact O-N 3.18Å; V689-L704 HydrophobicContact CG1-CD1 4.45Å
690	E	83.5	Confident	81	Confident	13 Å²	13	43 Å²	43	6%	0.061	24%	0.238	C	C	.	.	H	α-helix	trans	-58.1	-52.3	176.5	-178.1	-173.4	158	0	0	110.9	L686 R692 F693 E694 Q705 R708	L686-E690 WeakPolarHBondContact O-CB 3.38Å; L686-E690 PolarHBondContact O-N 3.28Å; E690-R692 PolarHBondContact O-N 3.39Å; E690-F693 PolarHBondContact O-N 3.01Å; E690-E694 WeakPolarHBondContact O-CB 3.49Å; E690-E694 VanDerWaalsContact O-CG 3.3Å; E690-E694 WeakPolarHBondContact O-CG 3.5Å; E690-E694 PolarHBondContact O-N 3.31Å; E690-Q705 HydrophobicContact CG-CG 4.41Å; E690-Q705 WeakPolarHBondContact OE1-CG 3.31Å; E690-Q705 PolarHBondContact OE1-NE2 3.13Å; E690-R708 VanDerWaalsContact CD-NH1 3.3Å; E690-R708 IonicContact OE1-CZ 3.79Å; E690-R708 IonicContact OE1-NH1 2.91Å; E690-R708 PolarHBondContact OE1-NH1 3.37Å; E690-R708 IonicContact OE2-CZ 3.46Å; E690-R708 IonicContact OE2-NE 3.82Å; E690-R708 IonicContact OE2-NH1 2.76Å; E690-R708 PolarHBondContact OE2-NH1 2.67Å
691	K	84.6	Confident	80.5	Confident	123 Å²	123	43 Å²	43	54%	0.535	24%	0.238	S	C	.	.	H	α-helix	trans	-61.1	-43.7	-179.4	-168.2	-172.5	-174.9	-122	0	112	P687 V688 E694 E695	P687-K691 VanDerWaalsContact O-CB 3.22Å; P687-K691 WeakPolarHBondContact O-CB 3.26Å; P687-K691 PolarHBondContact O-N 3.41Å; V688-K691 PolarHBondContact O-N 2.89Å; K691-E694 PolarHBondContact O-N 3.23Å; K691-E695 WeakPolarHBondContact CE-OE1 2.98Å; K691-E695 HydrophobicContact CG-CG 4.49Å; K691-E695 IonicContact NZ-OE1 3.32Å; K691-E695 PolarHBondContact NZ-OE1 3.27Å; K691-E695 WeakPolarHBondContact O-CB 3.16Å; K691-E695 VanDerWaalsContact O-CG 3.26Å; K691-E695 WeakPolarHBondContact O-CG 3.33Å; K691-E695 PolarHBondContact O-N 3.45Å
692	R	83.2	Confident	79.9	Confident	69 Å²	69	50 Å²	50	26%	0.26	27%	0.268	S	S	.	.	H	α-helix	trans	-67.9	-36.3	178.4	-73.8	-60.7	-165.8	92.5	4.7	112.3	S595 M625 L628 E629 V688 V689 E690 E695 G696	S595-R692 PolarHBondContact O-NH2 3.13Å; M625-R692 HydrophobicContact CE-CB 4.38Å; M625-R692 HydrophobicContact CE-CG 3.95Å; L628-R692 HydrophobicContact CD2-CB 3.74Å; E629-R692 IonicContact OE1-NH1 3.55Å; E629-R692 PolarHBondContact OE1-NH1 3.26Å; E629-R692 VanDerWaalsContact OE1-NH1 3.11Å; V688-R692 HydrophobicContact CG1-CG 4.46Å; V688-R692 WeakPolarHBondContact O-CB 3.47Å; V688-R692 WeakPolarHBondContact O-CG 3.22Å; V688-R692 PolarHBondContact O-N 2.87Å; V689-R692 PolarHBondContact O-N 3.08Å; E690-R692 PolarHBondContact O-N 3.39Å; R692-E695 WeakPolarHBondContact CD-OE2 3.5Å; R692-E695 IonicContact NE-OE2 2.57Å; R692-G696 PolarHBondContact O-N 2.81Å
693	F	84	Confident	79.6	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-64.8	-44.1	172.3	-177.4	-85.4	0	0	0	111.2	L628 H640 L643 L644 L647 V689 E690 G696 V697 A701 L704	L628-F693 HydrophobicContact CD1-CB 4.25Å; L628-F693 HydrophobicContact CD1-CD2 4.01Å; H640-F693 AromaticContact CE1-CE1 3.71Å; H640-F693 AromaticContact CE1-CZ 3.65Å; H640-F693 AromaticContact ND1-CZ 3.87Å; L643-F693 HydrophobicContact CD2-CD2 4.34Å; L643-F693 HydrophobicContact CD2-CE2 3.86Å; L643-F693 HydrophobicContact CG-CE2 3.96Å; L644-F693 HydrophobicContact CB-CZ 4.32Å; L644-F693 HydrophobicContact CD1-CE1 4.32Å; L644-F693 HydrophobicContact CD1-CE2 4.47Å; L644-F693 HydrophobicContact CD1-CZ 4.05Å; L647-F693 HydrophobicContact CD1-CD2 3.67Å; L647-F693 HydrophobicContact CD1-CE2 4.01Å; V689-F693 VanDerWaalsContact O-CB 3.29Å; V689-F693 WeakPolarHBondContact O-CB 3.45Å; V689-F693 PolarHBondContact O-N 3.18Å; E690-F693 PolarHBondContact O-N 3.01Å; F693-G696 PolarHBondContact O-N 3.41Å; F693-V697 HydrophobicContact CD1-CB 4.44Å; F693-V697 HydrophobicContact CD1-CG2 4.25Å; F693-V697 HydrophobicContact CD2-CG2 4.3Å; F693-V697 HydrophobicContact CE1-CB 4.22Å; F693-V697 HydrophobicContact CE1-CG1 4.36Å; F693-V697 HydrophobicContact CE1-CG2 4.01Å; F693-V697 HydrophobicContact CE2-CG2 4.06Å; F693-V697 HydrophobicContact CG-CG2 4.4Å; F693-V697 HydrophobicContact CZ-CG2 3.92Å; F693-V697 VanDerWaalsContact O-CB 3.27Å; F693-V697 WeakPolarHBondContact O-CB 3.48Å; F693-V697 WeakPolarHBondContact O-CG2 3.33Å; F693-V697 PolarHBondContact O-N 3.08Å; F693-A701 HydrophobicContact CD1-CB 3.65Å; F693-A701 HydrophobicContact CE1-CB 3.72Å; F693-L704 HydrophobicContact CG-CD1 4.46Å
694	E	84.6	Confident	79.2	Confident	58 Å²	58	49.6 Å²	49.6	27%	0.271	27%	0.267	S	S	.	.	H	α-helix	trans	-63.8	-42	176.4	-71.9	-174.5	169.3	0	0	112.6	E690 K691 G696 G698 P700 Q705	E690-E694 WeakPolarHBondContact O-CB 3.49Å; E690-E694 VanDerWaalsContact O-CG 3.3Å; E690-E694 WeakPolarHBondContact O-CG 3.5Å; E690-E694 PolarHBondContact O-N 3.31Å; K691-E694 PolarHBondContact O-N 3.23Å; E694-G696 VanDerWaalsContact C-N 3.33Å; E694-G698 VanDerWaalsContact O-CA 3.25Å; E694-G698 WeakPolarHBondContact O-CA 3.23Å; E694-G698 PolarHBondContact O-N 3.45Å; E694-P700 VanDerWaalsContact OE1-CA 3.31Å; E694-P700 WeakPolarHBondContact OE1-CA 3.42Å; E694-P700 WeakPolarHBondContact OE1-CB 3.35Å; E694-Q705 PolarHBondContact OE1-NE2 3.08Å
695	E	82.9	Confident	78.8	Confident	113 Å²	113	51 Å²	51	53%	0.528	27%	0.272	S	S	.	.	H	α-helix	trans	-62.8	-38.7	174.7	-75.6	172	-176	0	0	111.6	K691 R692	K691-E695 WeakPolarHBondContact CE-OE1 2.98Å; K691-E695 HydrophobicContact CG-CG 4.49Å; K691-E695 IonicContact NZ-OE1 3.32Å; K691-E695 PolarHBondContact NZ-OE1 3.27Å; K691-E695 WeakPolarHBondContact O-CB 3.16Å; K691-E695 VanDerWaalsContact O-CG 3.26Å; K691-E695 WeakPolarHBondContact O-CG 3.33Å; K691-E695 PolarHBondContact O-N 3.45Å; R692-E695 WeakPolarHBondContact CD-OE2 3.5Å; R692-E695 IonicContact NE-OE2 2.57Å
696	G	75.8	Confident	78.3	Confident	43 Å²	43	55.5 Å²	55.5	44%	0.443	30%	0.296	S	S	.	.	H	α-helix	trans	-79.2	-33.5	-179.4	0	0	0	0	0	114.9	R692 F693 E694	R692-G696 PolarHBondContact O-N 2.81Å; F693-G696 PolarHBondContact O-N 3.41Å; E694-G696 VanDerWaalsContact C-N 3.33Å
697	V	79.4	Confident	77.6	Confident	18 Å²	18	56.3 Å²	56.3	11%	0.109	30%	0.3	C	S	.	.	H	α-helix	trans	-101.8	-23	-174	173.6	0	0	0	0	112.7	L632 Y635 H640 F693 K699	L632-V697 HydrophobicContact CD2-CG2 3.81Å; Y635-V697 HydrophobicContact CD1-CG2 4.38Å; Y635-V697 HydrophobicContact CD2-CG2 4.06Å; Y635-V697 HydrophobicContact CE1-CB 4.38Å; Y635-V697 HydrophobicContact CE1-CG1 4.07Å; Y635-V697 HydrophobicContact CE1-CG2 4.16Å; Y635-V697 HydrophobicContact CE2-CG1 4.18Å; Y635-V697 HydrophobicContact CE2-CG2 3.83Å; Y635-V697 HydrophobicContact CG-CG2 4.35Å; Y635-V697 WeakPolarHBondContact OH-CG1 3.37Å; H640-V697 WeakPolarHBondContact ND1-CG1 3.49Å; F693-V697 HydrophobicContact CD1-CB 4.44Å; F693-V697 HydrophobicContact CD1-CG2 4.25Å; F693-V697 HydrophobicContact CD2-CG2 4.3Å; F693-V697 HydrophobicContact CE1-CB 4.22Å; F693-V697 HydrophobicContact CE1-CG1 4.36Å; F693-V697 HydrophobicContact CE1-CG2 4.01Å; F693-V697 HydrophobicContact CE2-CG2 4.06Å; F693-V697 HydrophobicContact CG-CG2 4.4Å; F693-V697 HydrophobicContact CZ-CG2 3.92Å; F693-V697 VanDerWaalsContact O-CB 3.27Å; F693-V697 WeakPolarHBondContact O-CB 3.48Å; F693-V697 WeakPolarHBondContact O-CG2 3.33Å; F693-V697 PolarHBondContact O-N 3.08Å; V697-K699 HydrophobicContact CG1-CB 4.19Å; V697-K699 PolarHBondContact O-N 2.93Å
698	G	72.3	Confident	76.9	Confident	66 Å²	66	57.3 Å²	57.3	68%	0.68	30%	0.299	S	S	*	.	S	Bend	trans	71.7	10.6	-176	0	0	0	0	0	114.6	E694	E694-G698 VanDerWaalsContact O-CA 3.25Å; E694-G698 WeakPolarHBondContact O-CA 3.23Å; E694-G698 PolarHBondContact O-N 3.45Å
699	K	73.2	Confident	76	Confident	127 Å²	127	59.6 Å²	59.6	55%	0.552	31%	0.311	S	S	*	.	S	Bend	trans	-130.7	142	176.9	-66.7	-179.3	-179.3	173.8	0	111.3	V697	V697-K699 HydrophobicContact CG1-CB 4.19Å; V697-K699 PolarHBondContact O-N 2.93Å
700	P	68.6	Low	74.9	Confident	80 Å²	80	62.1 Å²	62.1	52%	0.519	33%	0.332	S	S	.	.			trans	-68.3	133.2	177.3	27.8	-33.6	0	0	0	112.2	E694 K702	E694-P700 VanDerWaalsContact OE1-CA 3.31Å; E694-P700 WeakPolarHBondContact OE1-CA 3.42Å; E694-P700 WeakPolarHBondContact OE1-CB 3.35Å; P700-K702 PolarHBondContact O-N 2.93Å
701	A	72.9	Confident	73.6	Confident	1 Å²	1	61.8 Å²	61.8	1%	0.008	33%	0.331	C	S	.	.			trans	-88.2	84.9	179	0	0	0	0	0	111.1	L644 F693 Q703 L704 Q705	L644-A701 HydrophobicContact CD1-CB 3.83Å; F693-A701 HydrophobicContact CD1-CB 3.65Å; F693-A701 HydrophobicContact CE1-CB 3.72Å; A701-Q703 VanDerWaalsContact C-N 3.26Å; A701-Q703 PolarHBondContact O-N 2.96Å; A701-L704 HydrophobicContact CB-CB 3.98Å; A701-L704 HydrophobicContact CB-CD1 3.77Å; A701-L704 HydrophobicContact CB-CG 4.06Å; A701-L704 PolarHBondContact O-N 3.32Å; A701-L704 VanDerWaalsContact O-N 3.1Å; A701-Q705 PolarHBondContact O-N 3.24Å
702	K	71.4	Confident	72.1	Confident	150 Å²	150	61.6 Å²	61.6	65%	0.652	33%	0.327	S	S	*	.	H	α-helix	trans	-54.7	-38.8	-179.4	-69.1	-173.9	178.9	-178.8	0	113.2	P700 L704 Q705 D706	P700-K702 PolarHBondContact O-N 2.93Å; K702-L704 PolarHBondContact O-N 3.32Å; K702-Q705 WeakPolarHBondContact O-CB 3.48Å; K702-Q705 PolarHBondContact O-N 2.88Å; K702-D706 WeakPolarHBondContact O-CB 3.46Å; K702-D706 PolarHBondContact O-N 3.09Å
703	Q	72.4	Confident	70.3	Confident	84 Å²	84	64.2 Å²	64.2	39%	0.393	35%	0.346	S	S	.	.	H	α-helix	trans	-66.3	-35.9	178.9	-67.9	178.8	-28.2	0	0	113.2	L644 V648 A701 L707	L644-Q703 HydrophobicContact CD2-CB 4.12Å; L644-Q703 HydrophobicContact CD2-CG 4.19Å; L644-Q703 HydrophobicContact CG-CB 4.31Å; L644-Q703 VanDerWaalsContact CG-OE1 3.22Å; V648-Q703 HydrophobicContact CG2-CB 4.33Å; A701-Q703 VanDerWaalsContact C-N 3.26Å; A701-Q703 PolarHBondContact O-N 2.96Å; Q703-L707 WeakPolarHBondContact O-CB 3.49Å; Q703-L707 PolarHBondContact O-N 3.34Å
704	L	72.6	Confident	68.5	Low	6 Å²	6	68 Å²	68	3%	0.031	37%	0.365	C	S	.	.	H	α-helix	trans	-71.4	-36.2	173.8	-69	174.9	0	0	0	111.2	L644 V648 I651 V689 F693 A701 K702 L707 R708	L644-L704 HydrophobicContact CD1-CD1 3.93Å; L644-L704 HydrophobicContact CD1-CG 3.77Å; V648-L704 HydrophobicContact CG2-CD2 3.78Å; V648-L704 HydrophobicContact CG2-CG 4.44Å; I651-L704 HydrophobicContact CD1-CD2 3.81Å; V689-L704 HydrophobicContact CG1-CD1 4.45Å; F693-L704 HydrophobicContact CG-CD1 4.46Å; A701-L704 HydrophobicContact CB-CB 3.98Å; A701-L704 HydrophobicContact CB-CD1 3.77Å; A701-L704 HydrophobicContact CB-CG 4.06Å; A701-L704 PolarHBondContact O-N 3.32Å; A701-L704 VanDerWaalsContact O-N 3.1Å; K702-L704 PolarHBondContact O-N 3.32Å; L704-L707 PolarHBondContact O-N 3.2Å; L704-R708 WeakPolarHBondContact O-CB 3.32Å; L704-R708 PolarHBondContact O-N 2.75Å
705	Q	71.9	Confident	66.7	Low	52 Å²	52	70.1 Å²	70.1	24%	0.243	37%	0.37	C	S	.	.	H	α-helix	trans	-64.2	-43.1	172.8	-73.3	174.2	-0.1	0	0	111.9	E690 E694 A701 K702 R708 N709	E690-Q705 HydrophobicContact CG-CG 4.41Å; E690-Q705 WeakPolarHBondContact OE1-CG 3.31Å; E690-Q705 PolarHBondContact OE1-NE2 3.13Å; E694-Q705 PolarHBondContact OE1-NE2 3.08Å; A701-Q705 PolarHBondContact O-N 3.24Å; K702-Q705 WeakPolarHBondContact O-CB 3.48Å; K702-Q705 PolarHBondContact O-N 2.88Å; Q705-R708 WeakPolarHBondContact O-CB 3.4Å; Q705-R708 PolarHBondContact O-N 3.31Å; Q705-N709 WeakPolarHBondContact O-CB 3.49Å; Q705-N709 PolarHBondContact O-N 3.08Å; Q705-N709 PolarHBondContact O-ND2 3.27Å; Q705-N709 VanDerWaalsContact O-ND2 3.13Å
706	D	73.3	Confident	64.7	Low	97 Å²	97	70.3 Å²	70.3	52%	0.519	38%	0.379	S	S	.	.	H	α-helix	trans	-64.9	-41.3	176.7	-68.8	-26.5	0	0	0	110.9	K702 R708 N709 A710	K702-D706 WeakPolarHBondContact O-CB 3.46Å; K702-D706 PolarHBondContact O-N 3.09Å; D706-R708 PolarHBondContact O-N 3.22Å; D706-N709 PolarHBondContact O-N 3.09Å; D706-A710 VanDerWaalsContact O-CB 3.27Å; D706-A710 WeakPolarHBondContact O-CB 3.29Å; D706-A710 PolarHBondContact O-N 2.88Å
707	L	69	Low	63	Low	26 Å²	26	72.9 Å²	72.9	14%	0.136	38%	0.383	C	S	.	.	H	α-helix	trans	-63.1	-41.6	174.1	-169.9	148.6	0	0	0	111.8	V648 I651 L686 Q703 L704 N709 S711	V648-L707 HydrophobicContact CG1-CD1 3.9Å; I651-L707 HydrophobicContact CG2-CD1 4.12Å; I651-L707 HydrophobicContact CG2-CD2 3.56Å; L686-L707 HydrophobicContact CD1-CD2 3.86Å; L686-L707 HydrophobicContact CD2-CD2 4.06Å; Q703-L707 WeakPolarHBondContact O-CB 3.49Å; Q703-L707 PolarHBondContact O-N 3.34Å; L704-L707 PolarHBondContact O-N 3.2Å; L707-N709 VanDerWaalsContact C-N 3.33Å; L707-N709 PolarHBondContact O-N 3.25Å; L707-S711 VanDerWaalsContact O-CB 3.3Å; L707-S711 WeakPolarHBondContact O-CB 3.33Å; L707-S711 PolarHBondContact O-N 3.36Å; L707-S711 PolarHBondContact O-OG 3.47Å
708	R	68.4	Low	61.2	Low	53 Å²	53	77.3 Å²	77.3	20%	0.2	41%	0.412	C	S	.	.	H	α-helix	trans	-62.4	-38.9	173.3	-173	-174.4	73.3	-169.2	1.1	112.1	L686 E690 L704 Q705 D706 S711 R712	L686-R708 HydrophobicContact CD1-CB 4.42Å; E690-R708 VanDerWaalsContact CD-NH1 3.3Å; E690-R708 IonicContact OE1-CZ 3.79Å; E690-R708 IonicContact OE1-NH1 2.91Å; E690-R708 PolarHBondContact OE1-NH1 3.37Å; E690-R708 IonicContact OE2-CZ 3.46Å; E690-R708 IonicContact OE2-NE 3.82Å; E690-R708 IonicContact OE2-NH1 2.76Å; E690-R708 PolarHBondContact OE2-NH1 2.67Å; L704-R708 WeakPolarHBondContact O-CB 3.32Å; L704-R708 PolarHBondContact O-N 2.75Å; Q705-R708 WeakPolarHBondContact O-CB 3.4Å; Q705-R708 PolarHBondContact O-N 3.31Å; D706-R708 PolarHBondContact O-N 3.22Å; R708-S711 WeakPolarHBondContact CA-OG 3.22Å; R708-S711 PolarHBondContact O-OG 3.17Å; R708-S711 VanDerWaalsContact O-OG 3.08Å; R708-R712 WeakPolarHBondContact O-CB 3.44Å; R708-R712 VanDerWaalsContact O-CG 3.24Å; R708-R712 WeakPolarHBondContact O-CG 3.24Å; R708-R712 PolarHBondContact O-N 3.26Å
709	N	67.3	Low	59.7	Low	72 Å²	72	82.5 Å²	82.5	39%	0.385	42%	0.418	S	S	.	.	H	α-helix	trans	-75.6	-41	-179.1	-66.3	-23.4	0	0	0	111.9	Q705 D706 L707 R712 L713	Q705-N709 WeakPolarHBondContact O-CB 3.49Å; Q705-N709 PolarHBondContact O-N 3.08Å; Q705-N709 PolarHBondContact O-ND2 3.27Å; Q705-N709 VanDerWaalsContact O-ND2 3.13Å; D706-N709 PolarHBondContact O-N 3.09Å; L707-N709 VanDerWaalsContact C-N 3.33Å; L707-N709 PolarHBondContact O-N 3.25Å; N709-R712 PolarHBondContact O-N 2.78Å; N709-L713 PolarHBondContact O-N 3.15Å
710	A	61.3	Low	58.2	Low	54 Å²	54	78.7 Å²	78.7	45%	0.446	41%	0.408	S	S	.	.	H	α-helix	trans	-65.4	-41.3	176.2	0	0	0	0	0	112	D706 L713 I714	D706-A710 VanDerWaalsContact O-CB 3.27Å; D706-A710 WeakPolarHBondContact O-CB 3.29Å; D706-A710 PolarHBondContact O-N 2.88Å; A710-L713 WeakPolarHBondContact O-CB 3.24Å; A710-L713 PolarHBondContact O-N 3.19Å; A710-I714 PolarHBondContact O-N 2.99Å
711	S	55.3	Low	56.9	Low	6 Å²	6	81.3 Å²	81.3	4%	0.042	42%	0.422	C	S	.	.	H	α-helix	trans	-70.4	-31.6	176.5	53.1	0	0	0	0	113.9	Y682 L707 R708 L713 I714 R715	Y682-S711 VanDerWaalsContact CD1-CB 3.5Å; Y682-S711 WeakPolarHBondContact CD1-OG 3.32Å; L707-S711 VanDerWaalsContact O-CB 3.3Å; L707-S711 WeakPolarHBondContact O-CB 3.33Å; L707-S711 PolarHBondContact O-N 3.36Å; L707-S711 PolarHBondContact O-OG 3.47Å; R708-S711 WeakPolarHBondContact CA-OG 3.22Å; R708-S711 PolarHBondContact O-OG 3.17Å; R708-S711 VanDerWaalsContact O-OG 3.08Å; S711-L713 VanDerWaalsContact C-N 3.27Å; S711-L713 PolarHBondContact O-N 3.49Å; S711-I714 PolarHBondContact O-N 2.89Å; S711-R715 PolarHBondContact O-N 3.41Å
712	R	54.1	Low	55	Low	119 Å²	119	86.1 Å²	86.1	45%	0.449	45%	0.452	S	S	.	.	H	α-helix	trans	-62.1	-33.1	170	-80.7	175.9	-179.3	-155.6	0.8	112.6	R708 N709 R715	R708-R712 WeakPolarHBondContact O-CB 3.44Å; R708-R712 VanDerWaalsContact O-CG 3.24Å; R708-R712 WeakPolarHBondContact O-CG 3.24Å; R708-R712 PolarHBondContact O-N 3.26Å; N709-R712 PolarHBondContact O-N 2.78Å; R712-R715 VanDerWaalsContact O-CB 3.3Å; R712-R715 WeakPolarHBondContact O-CB 3.46Å; R712-R715 PolarHBondContact O-N 3.4Å
713	L	46.1	Very low	53.1	Low	124 Å²	124	83.3 Å²	83.3	65%	0.649	45%	0.451	S	S	*	.	H	α-helix	trans	-68.9	-36.9	176.1	-78.4	154.1	0	0	0	112.5	N709 A710 S711 R715 V716	N709-L713 PolarHBondContact O-N 3.15Å; A710-L713 WeakPolarHBondContact O-CB 3.24Å; A710-L713 PolarHBondContact O-N 3.19Å; S711-L713 VanDerWaalsContact C-N 3.27Å; S711-L713 PolarHBondContact O-N 3.49Å; L713-R715 PolarHBondContact O-N 3.47Å; L713-V716 PolarHBondContact O-N 3.5Å
714	I	46.5	Very low	51.1	Low	80 Å²	80	86.1 Å²	86.1	41%	0.41	47%	0.474	S	S	.	.	H	α-helix	trans	-62.3	-34.8	175.3	-63.6	171.4	0	0	0	111	A710 S711 V716 N717	A710-I714 PolarHBondContact O-N 2.99Å; S711-I714 PolarHBondContact O-N 2.89Å; I714-V716 VanDerWaalsContact C-N 3.27Å; I714-V716 PolarHBondContact O-N 3.02Å; I714-N717 PolarHBondContact O-N 3.42Å
715	R	44.8	Very low	49.2	Very low	101 Å²	101	94.8 Å²	94.8	38%	0.381	53%	0.527	S	S	.	.	H	α-helix	trans	-64.4	-26.3	177	-129.3	173.4	176.5	-134.6	-15.8	114.6	S679 E683 S711 R712 L713	S679-R715 PolarHBondContact OG-NH2 3.18Å; E683-R715 IonicContact OE1-CZ 3.94Å; E683-R715 IonicContact OE1-NH1 2.69Å; E683-R715 PolarHBondContact OE1-NH1 3Å; E683-R715 IonicContact OE2-NH1 2.67Å; S711-R715 PolarHBondContact O-N 3.41Å; R712-R715 VanDerWaalsContact O-CB 3.3Å; R712-R715 WeakPolarHBondContact O-CB 3.46Å; R712-R715 PolarHBondContact O-N 3.4Å; L713-R715 PolarHBondContact O-N 3.47Å
716	V	41.3	Very low	48	Very low	117 Å²	117	97 Å²	97	71%	0.709	54%	0.541	S	S	*	.	H	α-helix	trans	-87.6	-18.2	-176.5	178.6	0	0	0	0	112	L713 I714 P718	L713-V716 PolarHBondContact O-N 3.5Å; I714-V716 VanDerWaalsContact C-N 3.27Å; I714-V716 PolarHBondContact O-N 3.02Å; V716-P718 VanDerWaalsContact O-CD 3.25Å; V716-P718 WeakPolarHBondContact O-CD 3.21Å
717	N	40.2	Very low	46.7	Very low	98 Å²	98	96.9 Å²	96.9	52%	0.524	54%	0.542	S	S	.	.			trans	-123.2	76	-172.2	-136.7	-2.3	0	0	0	113.3	I714 E719 S720	I714-N717 PolarHBondContact O-N 3.42Å; N717-E719 PolarHBondContact O-N 3.01Å; N717-E719 VanDerWaalsContact O-N 3.09Å; N717-S720 PolarHBondContact O-N 3.37Å
718	P	42.5	Very low	45.4	Very low	111 Å²	111	100.9 Å²	100.9	72%	0.721	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.6	-5.3	-176.7	26.5	-33.6	0	0	0	115.4	V716	V716-P718 VanDerWaalsContact O-CD 3.25Å; V716-P718 WeakPolarHBondContact O-CD 3.21Å
719	E	41.2	Very low	44.1	Very low	175 Å²	175	103.7 Å²	103.7	82%	0.818	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114	3	178	-63.4	-161.5	161.1	0	0	114.2	N717 T721	N717-E719 PolarHBondContact O-N 3.01Å; N717-E719 VanDerWaalsContact O-N 3.09Å; E719-T721 PolarHBondContact O-N 3.35Å
720	S	41.5	Very low	42.6	Very low	47 Å²	47	105.7 Å²	105.7	33%	0.329	60%	0.598	S	S	.	*			trans	-76	100	-179.7	-172.2	0	0	0	0	110.8	N717 T722	N717-S720 PolarHBondContact O-N 3.37Å; S720-T722 PolarHBondContact O-N 3.31Å; S720-T722 PolarHBondContact OG-OG1 3.02Å
721	T	40.4	Very low	41.4	Very low	134 Å²	134	109.1 Å²	109.1	82%	0.822	61%	0.609	S	S	*	*			trans	-75.5	3.1	172	39.4	0	0	0	0	113.8	E719 S723	E719-T721 PolarHBondContact O-N 3.35Å; T721-S723 PolarHBondContact O-N 3.22Å
722	T	32.7	Very low	40.4	Very low	103 Å²	103	116.5 Å²	116.5	63%	0.632	65%	0.649	S	S	*	*			trans	-82.9	111.7	179.9	40.9	0	0	0	0	111.1	S720	S720-T722 PolarHBondContact O-N 3.31Å; S720-T722 PolarHBondContact OG-OG1 3.02Å
723	S	32.8	Very low	39.4	Very low	91 Å²	91	116.3 Å²	116.3	64%	0.636	66%	0.664	S	S	*	*			trans	-49.1	139.1	167.7	54.3	0	0	0	0	112.2	T721	T721-S723 PolarHBondContact O-N 3.22Å
724	V	30.8	Very low	38.8	Very low	142 Å²	142	115.7 Å²	115.7	86%	0.861	67%	0.666	S	S	*	*			trans	-115.6	111.8	147.8	-171.1	0	0	0	0	105.4
725	V	30.8	Very low	38.1	Very low	189 Å²	189	118.9 Å²	118.9	100%	1.145	69%	0.689	S	S	*	*			trans	-62.2	0	165.2	171.2	0	0	0	0	108.7

Retrieved 725 of 725 residues in 317.6 ms (Link to these results)

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