A0A087Y2W5_POEFO Loading...

Nuclear pore complex protein Nup85

Functions as a component of the nuclear pore complex (NPC).

AlphaFold DB , UniProt , Accession A0A087Y2W5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 656 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	37.2	Very low	49.1	Very low	196 Å²	196	140.7 Å²	140.7	97%	0.966	76%	0.756	S	S	*	*				0	96.8	0	-139.4	170.5	70.6	0	0	105
2	E	32.1	Very low	50.9	Low	186 Å²	186	140.8 Å²	140.8	87%	0.869	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-63.3	149.6	173.2	-75.8	174.9	153.6	0	0	109	V4	E2-V4 PolarHBondContact O-N 3.48Å
3	E	34.8	Very low	52.3	Low	196 Å²	196	133.9 Å²	133.9	92%	0.916	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-49	129.1	-179.2	-73.6	177.1	149.7	0	0	110.6	D5	E3-D5 PolarHBondContact O-N 3.26Å
4	V	45.7	Very low	53.2	Low	67 Å²	67	131.6 Å²	131.6	41%	0.406	71%	0.714	S	S	.	*	P	Polyproline II helix	trans	-80.8	116.5	-173.7	180	0	0	0	0	108.5	E2 V6 I366	E2-V4 PolarHBondContact O-N 3.48Å; V4-V6 HydrophobicContact CG1-CB 4.06Å; V4-V6 HydrophobicContact CG1-CG2 3.66Å; V4-V6 PolarHBondContact O-N 3.36Å; V4-I366 HydrophobicContact CG1-CD1 3.88Å
5	D	41	Very low	53.8	Low	173 Å²	173	127.5 Å²	127.5	93%	0.925	71%	0.714	S	S	*	*			trans	-69	59.4	170.9	-82.5	-33.4	0	0	0	111.6	E3	E3-D5 PolarHBondContact O-N 3.26Å
6	V	50.2	Low	54.3	Low	89 Å²	89	121.8 Å²	121.8	54%	0.539	68%	0.681	S	S	.	*	S	Bend	trans	-124	124.1	169.3	178.7	0	0	0	0	107.3	V4 I366	V4-V6 HydrophobicContact CG1-CB 4.06Å; V4-V6 HydrophobicContact CG1-CG2 3.66Å; V4-V6 PolarHBondContact O-N 3.36Å; V6-I366 HydrophobicContact CG2-CG2 4.49Å
7	E	44.8	Very low	54.6	Low	182 Å²	182	116.5 Å²	116.5	85%	0.85	66%	0.661	S	S	*	*	P	Polyproline II helix	trans	-56.2	125.2	176.1	-76.1	-170.7	162.1	0	0	109.3	T9	E7-T9 PolarHBondContact O-N 3.32Å
8	P	57.7	Low	54.8	Low	109 Å²	109	121.4 Å²	121.4	71%	0.708	68%	0.677	S	S	*	*	P	Polyproline II helix	trans	-63.2	134.8	-177.5	24.5	-32.8	0	0	0	109.9	V10	P8-V10 PolarHBondContact O-N 3Å; P8-V10 VanDerWaalsContact O-N 3.13Å
9	T	60.8	Low	55.1	Low	120 Å²	120	119.7 Å²	119.7	74%	0.736	69%	0.689	S	S	*	*	P	Polyproline II helix	trans	-57.2	119.4	174.7	47.5	0	0	0	0	110	E7 T11	E7-T9 PolarHBondContact O-N 3.32Å; T9-T11 PolarHBondContact O-N 2.79Å
10	V	68.4	Low	55.7	Low	125 Å²	125	119.1 Å²	119.1	76%	0.758	68%	0.678	S	S	*	*			trans	-81.2	109.7	-177.3	-178.2	0	0	0	0	109.7	P8	P8-V10 PolarHBondContact O-N 3Å; P8-V10 VanDerWaalsContact O-N 3.13Å
11	T	67.7	Low	56.4	Low	105 Å²	105	118.9 Å²	118.9	64%	0.644	67%	0.671	S	S	*	*			trans	-92.6	114.8	170.6	-48.5	0	0	0	0	110	T9 I13	T9-T11 PolarHBondContact O-N 2.79Å; T11-I13 PolarHBondContact O-N 2.98Å
12	N	69.9	Low	58.3	Low	141 Å²	141	114.9 Å²	114.9	75%	0.754	65%	0.652	S	S	*	*			trans	-74.9	120	176.1	-72.4	-33.8	0	0	0	110.5	P14	N12-P14 WeakPolarHBondContact O-CD 3.25Å
13	I	69.6	Low	60.5	Low	52 Å²	52	106.6 Å²	106.6	27%	0.267	62%	0.616	S	S	.	*			trans	-87.4	112.1	175	-56.1	175.1	0	0	0	108.4	T11 I16 V33 H54 V56	T11-I13 PolarHBondContact O-N 2.98Å; I13-I16 HydrophobicContact CB-CD1 4.14Å; I13-I16 HydrophobicContact CG2-CD1 3.69Å; I13-I16 HydrophobicContact CG2-CG1 4.26Å; I13-V33 HydrophobicContact CD1-CB 4.2Å; I13-V33 HydrophobicContact CD1-CG1 3.95Å; I13-V33 HydrophobicContact CD1-CG2 3.94Å; I13-H54 HydrophobicContact CG2-CB 3.93Å; I13-V56 HydrophobicContact CD1-CG2 3.94Å; I13-V56 HydrophobicContact CG1-CG2 4.09Å
14	P	65.3	Low	62.7	Low	101 Å²	101	103.7 Å²	103.7	66%	0.656	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.5	139.1	-175.4	26.6	-33.4	0	0	0	111.2	N12 H54	N12-P14 WeakPolarHBondContact O-CD 3.25Å; P14-H54 PolarHBondContact O-CE1 3.29Å; P14-H54 PolarHBondContact O-ND1 2.94Å
15	G	61.7	Low	64.4	Low	70 Å²	70	102.6 Å²	102.6	72%	0.722	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	94.4	-2.1	170.6	0	0	0	0	0	116.5
16	I	62	Low	66.2	Low	36 Å²	36	102.5 Å²	102.5	19%	0.185	59%	0.585	C	S	.	*	P	Polyproline II helix	trans	-93.3	123.3	175.1	-59.1	178.8	0	0	0	109.9	I13 M22 V33 E35	I13-I16 HydrophobicContact CB-CD1 4.14Å; I13-I16 HydrophobicContact CG2-CD1 3.69Å; I13-I16 HydrophobicContact CG2-CG1 4.26Å; I16-M22 HydrophobicContact CD1-CG 4.37Å; I16-M22 HydrophobicContact CD1-SD 3.75Å; I16-M22 HydrophobicContact CG2-CG 4.11Å; I16-M22 HydrophobicContact CG2-SD 3.99Å; I16-V33 HydrophobicContact CD1-CG1 3.86Å; I16-E35 WeakPolarHBondContact CA-OE1 3.3Å; I16-E35 HydrophobicContact CG1-CG 4.3Å; I16-E35 HydrophobicContact CG2-CG 4.2Å
17	G	59.5	Low	67.1	Low	33 Å²	33	99.7 Å²	99.7	34%	0.34	57%	0.574	S	S	.	*	P	Polyproline II helix	trans	-73.2	136	178.6	0	0	0	0	0	112.6	G19 K20 E35	G17-G19 PolarHBondContact O-N 2.92Å; G17-K20 PolarHBondContact O-N 2.8Å; G17-E35 PolarHBondContact N-OE1 2.78Å; G17-E35 VanDerWaalsContact N-OE1 3.16Å
18	H	57.7	Low	68	Low	205 Å²	205	96.2 Å²	96.2	95%	0.949	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.3	127.9	172.7	-73.4	-72	0	0	0	111.1
19	G	60.8	Low	68.2	Low	88 Å²	88	92.6 Å²	92.6	91%	0.907	55%	0.55	S	S	*	*	T	Hydrogen-bonded Turn	trans	93.2	7.1	176.8	0	0	0	0	0	116.3	G17	G17-G19 PolarHBondContact O-N 2.92Å
20	K	66.7	Low	68.8	Low	107 Å²	107	88.7 Å²	88.7	47%	0.465	53%	0.525	S	S	.	.			trans	-95.7	151	171.1	-68	177.7	176	178.5	0	111.9	G17 E35	G17-K20 PolarHBondContact O-N 2.8Å; K20-E35 VanDerWaalsContact CD-CD 3.45Å; K20-E35 HydrophobicContact CD-CG 4.47Å; K20-E35 WeakPolarHBondContact CD-OE1 3.39Å; K20-E35 WeakPolarHBondContact CD-OE2 3.2Å; K20-E35 VanDerWaalsContact NZ-CD 3.32Å; K20-E35 IonicContact NZ-OE1 3.59Å; K20-E35 PolarHBondContact NZ-OE1 3.46Å; K20-E35 VanDerWaalsContact NZ-OE1 3.11Å; K20-E35 IonicContact NZ-OE2 3.33Å; K20-E35 PolarHBondContact NZ-OE2 3.22Å
21	H	71.1	Confident	69.3	Low	116 Å²	116	84.2 Å²	84.2	54%	0.537	50%	0.496	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	136.4	174.8	-72.3	-78.8	0	0	0	110.8	T36 F38	H21-T36 WeakPolarHBondContact CB-O 3.07Å; H21-T36 WeakPolarHBondContact CB-OG1 3.26Å; H21-T36 PolarHBondContact O-N 3.18Å; H21-T36 PolarHBondContact O-OG1 3.12Å; H21-F38 HydrophobicContact CB-CB 4.36Å
22	M	76.3	Confident	69.9	Low	112 Å²	112	82.5 Å²	82.5	55%	0.552	48%	0.483	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.5	134.7	176.3	-64.2	-172.4	-64	0	0	110.1	I16 V33	I16-M22 HydrophobicContact CD1-CG 4.37Å; I16-M22 HydrophobicContact CD1-SD 3.75Å; I16-M22 HydrophobicContact CG2-CG 4.11Å; I16-M22 HydrophobicContact CG2-SD 3.99Å; M22-V33 HydrophobicContact SD-CG1 4.37Å
23	G	78.1	Confident	70.5	Confident	11 Å²	11	76.2 Å²	76.2	11%	0.113	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	143.9	161.7	0	0	0	0	0	109.1	Y34	G23-Y34 PolarHBondContact N-O 3.4Å; G23-Y34 WeakPolarHBondContact O-CD1 3.44Å; G23-Y34 PolarHBondContact O-N 2.97Å
24	F	82.2	Confident	70.9	Confident	135 Å²	135	78.3 Å²	78.3	59%	0.592	46%	0.455	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-132	147.2	170.2	67.4	-89	0	0	0	110.3	W26 I31 L32 V33	F24-W26 AromaticContact CD2-CD1 3.92Å; F24-W26 AromaticContact CD2-NE1 3.78Å; F24-W26 AromaticContact CE2-CD1 3.82Å; F24-W26 AromaticContact CE2-NE1 3.51Å; F24-I31 HydrophobicContact CB-CG2 4.3Å; F24-L32 CarbonylContact C-O 3.5Å; F24-L32 VanDerWaalsContact CA-O 3.25Å; F24-L32 WeakPolarHBondContact CA-O 3.34Å; F24-V33 HydrophobicContact CB-CG2 4.41Å
25	A	81.1	Confident	71.3	Confident	45 Å²	45	74.8 Å²	74.8	37%	0.372	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	128.5	172.8	0	0	0	0	0	109.3	G27 L32	A25-G27 PolarHBondContact O-N 3.44Å; A25-L32 PolarHBondContact N-O 3.26Å; A25-L32 PolarHBondContact O-N 2.95Å
26	W	78.6	Confident	71.7	Confident	171 Å²	171	73 Å²	73	65%	0.648	41%	0.405	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.7	115.4	173.7	-72.9	90.5	0	0	0	109.7	F24 I31	F24-W26 AromaticContact CD2-CD1 3.92Å; F24-W26 AromaticContact CD2-NE1 3.78Å; F24-W26 AromaticContact CE2-CD1 3.82Å; F24-W26 AromaticContact CE2-NE1 3.51Å; W26-I31 HydrophobicContact CD2-CG1 4.13Å; W26-I31 HydrophobicContact CE3-CD1 4.1Å; W26-I31 HydrophobicContact CE3-CG1 3.66Å; W26-I31 HydrophobicContact CH2-CD1 3.38Å; W26-I31 HydrophobicContact CH2-CG1 3.92Å; W26-I31 HydrophobicContact CZ2-CD1 3.85Å; W26-I31 HydrophobicContact CZ2-CG1 4.35Å; W26-I31 HydrophobicContact CZ3-CD1 3.53Å; W26-I31 HydrophobicContact CZ3-CG1 3.55Å
27	G	69.4	Low	71.7	Confident	30 Å²	30	77.6 Å²	77.6	31%	0.309	43%	0.425	S	S	.	.			trans	-87.4	-177.7	166.9	0	0	0	0	0	112.2	A25 G29 D30	A25-G27 PolarHBondContact O-N 3.44Å; G27-G29 PolarHBondContact O-N 3.44Å; G27-D30 WeakPolarHBondContact CA-O 3.32Å; G27-D30 PolarHBondContact N-O 3.1Å
28	P	62.8	Low	71.4	Confident	109 Å²	109	83.2 Å²	83.2	71%	0.708	44%	0.44	S	S	*	.	S	Bend	trans	-63.6	-24.2	-176.7	-19.8	31.1	0	0	0	114.7	T412	P28-T412 VanDerWaalsContact O-CG2 3.32Å; P28-T412 WeakPolarHBondContact O-CG2 3.46Å
29	G	62.4	Low	71.2	Confident	33 Å²	33	78.6 Å²	78.6	34%	0.34	42%	0.418	S	S	.	.	S	Bend	trans	-155.1	6.4	176.9	0	0	0	0	0	113.6	G27	G27-G29 PolarHBondContact O-N 3.44Å
30	D	73.3	Confident	70.5	Confident	37 Å²	37	79.7 Å²	79.7	20%	0.198	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	145.7	-176	-48.7	-80.8	0	0	0	109.2	G27 K55 R57	G27-D30 WeakPolarHBondContact CA-O 3.32Å; G27-D30 PolarHBondContact N-O 3.1Å; D30-K55 HydrophobicContact CB-CD 4.44Å; D30-K55 VanDerWaalsContact CB-CE 3.44Å; D30-K55 HydrophobicContact CB-CG 4.01Å; D30-K55 VanDerWaalsContact CG-NZ 3.27Å; D30-K55 WeakPolarHBondContact OD1-CE 3.31Å; D30-K55 IonicContact OD1-NZ 3.83Å; D30-K55 PolarHBondContact OD1-NZ 2.78Å; D30-K55 WeakPolarHBondContact OD2-CE 3.45Å; D30-K55 IonicContact OD2-NZ 2.94Å; D30-K55 PolarHBondContact OD2-NZ 3.05Å; D30-R57 WeakPolarHBondContact OD1-CD 3.11Å; D30-R57 VanDerWaalsContact OD1-CG 3.23Å; D30-R57 WeakPolarHBondContact OD1-CG 3.28Å; D30-R57 IonicContact OD1-NE 2.72Å; D30-R57 PolarHBondContact OD1-NE 3.1Å
31	I	79.3	Confident	69.4	Low	31 Å²	31	80.7 Å²	80.7	16%	0.159	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	120.5	173.4	-52.7	171.2	0	0	0	107.3	F24 W26 V33 V56	F24-I31 HydrophobicContact CB-CG2 4.3Å; W26-I31 HydrophobicContact CD2-CG1 4.13Å; W26-I31 HydrophobicContact CE3-CD1 4.1Å; W26-I31 HydrophobicContact CE3-CG1 3.66Å; W26-I31 HydrophobicContact CH2-CD1 3.38Å; W26-I31 HydrophobicContact CH2-CG1 3.92Å; W26-I31 HydrophobicContact CZ2-CD1 3.85Å; W26-I31 HydrophobicContact CZ2-CG1 4.35Å; W26-I31 HydrophobicContact CZ3-CD1 3.53Å; W26-I31 HydrophobicContact CZ3-CG1 3.55Å; I31-V33 HydrophobicContact CG2-CG2 3.9Å; I31-V56 HydrophobicContact CB-CB 4.28Å; I31-V56 PolarHBondContact N-O 2.92Å; I31-V56 PolarHBondContact O-N 2.74Å
32	L	81	Confident	68.3	Low	69 Å²	69	78.8 Å²	78.8	36%	0.361	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	119.3	172.9	-60.6	177.1	0	0	0	108.2	F24 A25 I53 H54 K55	F24-L32 CarbonylContact C-O 3.5Å; F24-L32 VanDerWaalsContact CA-O 3.25Å; F24-L32 WeakPolarHBondContact CA-O 3.34Å; A25-L32 PolarHBondContact N-O 3.26Å; A25-L32 PolarHBondContact O-N 2.95Å; L32-I53 HydrophobicContact CB-CG2 4.26Å; L32-I53 HydrophobicContact CD2-CG2 4.22Å; L32-H54 CarbonylContact C-O 3.59Å; L32-H54 WeakPolarHBondContact CA-O 2.99Å; L32-K55 HydrophobicContact CD2-CB 4.28Å; L32-K55 HydrophobicContact CD2-CG 4.23Å
33	V	81.9	Confident	66.8	Low	10 Å²	10	79.9 Å²	79.9	6%	0.061	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	131.3	178.9	-174.2	0	0	0	0	108.6	I13 I16 M22 F24 I31 H54 V56	I13-V33 HydrophobicContact CD1-CB 4.2Å; I13-V33 HydrophobicContact CD1-CG1 3.95Å; I13-V33 HydrophobicContact CD1-CG2 3.94Å; I16-V33 HydrophobicContact CD1-CG1 3.86Å; M22-V33 HydrophobicContact SD-CG1 4.37Å; F24-V33 HydrophobicContact CB-CG2 4.41Å; I31-V33 HydrophobicContact CG2-CG2 3.9Å; V33-H54 HydrophobicContact CB-CB 4.49Å; V33-H54 PolarHBondContact N-O 3.15Å; V33-H54 PolarHBondContact O-N 2.93Å; V33-V56 HydrophobicContact CG2-CG2 3.93Å
34	Y	78.1	Confident	65.4	Low	96 Å²	96	85.3 Å²	85.3	38%	0.376	48%	0.479	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	146.3	-178.8	57.7	-81.8	0	0	0	110.8	G23 T36	G23-Y34 PolarHBondContact N-O 3.4Å; G23-Y34 WeakPolarHBondContact O-CD1 3.44Å; G23-Y34 PolarHBondContact O-N 2.97Å; Y34-T36 HydrophobicContact CD2-CG2 3.53Å; Y34-T36 HydrophobicContact CE2-CG2 3.24Å; Y34-T36 PolarHBondContact O-N 3.31Å
35	E	74	Confident	63.7	Low	27 Å²	27	84.6 Å²	84.6	13%	0.126	49%	0.488	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	132.6	171.9	-69.5	-168	159.3	0	0	109.3	I16 G17 K20	I16-E35 WeakPolarHBondContact CA-OE1 3.3Å; I16-E35 HydrophobicContact CG1-CG 4.3Å; I16-E35 HydrophobicContact CG2-CG 4.2Å; G17-E35 PolarHBondContact N-OE1 2.78Å; G17-E35 VanDerWaalsContact N-OE1 3.16Å; K20-E35 VanDerWaalsContact CD-CD 3.45Å; K20-E35 HydrophobicContact CD-CG 4.47Å; K20-E35 WeakPolarHBondContact CD-OE1 3.39Å; K20-E35 WeakPolarHBondContact CD-OE2 3.2Å; K20-E35 VanDerWaalsContact NZ-CD 3.32Å; K20-E35 IonicContact NZ-OE1 3.59Å; K20-E35 PolarHBondContact NZ-OE1 3.46Å; K20-E35 VanDerWaalsContact NZ-OE1 3.11Å; K20-E35 IonicContact NZ-OE2 3.33Å; K20-E35 PolarHBondContact NZ-OE2 3.22Å
36	T	69.3	Low	62	Low	33 Å²	33	87.7 Å²	87.7	20%	0.202	51%	0.507	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	142.4	174.8	57.8	0	0	0	0	110.6	H21 Y34 F38	H21-T36 WeakPolarHBondContact CB-O 3.07Å; H21-T36 WeakPolarHBondContact CB-OG1 3.26Å; H21-T36 PolarHBondContact O-N 3.18Å; H21-T36 PolarHBondContact O-OG1 3.12Å; Y34-T36 HydrophobicContact CD2-CG2 3.53Å; Y34-T36 HydrophobicContact CE2-CG2 3.24Å; Y34-T36 PolarHBondContact O-N 3.31Å; T36-F38 VanDerWaalsContact C-N 3.32Å; T36-F38 PolarHBondContact O-N 3.05Å
37	H	62.2	Low	60.7	Low	132 Å²	132	82.2 Å²	82.2	61%	0.611	50%	0.504	S	S	*	.			trans	-94.3	65.3	165.1	-66.9	-71.5	0	0	0	109	K39 G49	H37-K39 PolarHBondContact O-N 3.27Å; H37-K39 VanDerWaalsContact O-N 3.08Å; H37-G49 WeakPolarHBondContact NE2-CA 3.27Å
38	F	52.9	Low	59.6	Low	150 Å²	150	87.3 Å²	87.3	66%	0.658	53%	0.532	S	S	*	.			trans	-72.6	103	172.2	-160.1	-95	0	0	0	108.8	H21 T36	H21-F38 HydrophobicContact CB-CB 4.36Å; T36-F38 VanDerWaalsContact C-N 3.32Å; T36-F38 PolarHBondContact O-N 3.05Å
39	K	54.8	Low	59	Low	109 Å²	109	83.8 Å²	83.8	47%	0.474	52%	0.515	S	S	.	.			trans	-108.3	138.9	164.3	-76.3	-172.4	-178.9	178.8	0	108.8	H37 L43	H37-K39 PolarHBondContact O-N 3.27Å; H37-K39 VanDerWaalsContact O-N 3.08Å; K39-L43 HydrophobicContact CD-CB 4.26Å
40	P	45.6	Very low	58.6	Low	111 Å²	111	84 Å²	84	72%	0.721	52%	0.517	S	S	*	.			trans	-58.2	140.1	164.8	6.6	0.9	0	0	0	108.7	G42	P40-G42 PolarHBondContact O-N 3.39Å
41	S	42.3	Very low	57.9	Low	128 Å²	128	87.6 Å²	87.6	90%	0.895	55%	0.545	S	S	*	.	S	Bend	trans	-45.9	125	-168.1	64.3	0	0	0	0	113.8
42	G	47.9	Very low	57.3	Low	76 Å²	76	93.4 Å²	93.4	78%	0.784	57%	0.569	S	S	*	*	S	Bend	trans	144.5	-2.9	163.5	0	0	0	0	0	119.2	P40	P40-G42 PolarHBondContact O-N 3.39Å
43	L	45.8	Very low	57	Low	135 Å²	135	96 Å²	96	71%	0.707	58%	0.582	S	S	*	*			trans	-128.6	128.7	-178.6	-80.2	143.3	0	0	0	112.2	K39	K39-L43 HydrophobicContact CD-CB 4.26Å
44	T	48.3	Very low	56.8	Low	124 Å²	124	97.4 Å²	97.4	76%	0.761	59%	0.588	S	S	*	*			trans	-62.2	149.2	178.3	40.1	0	0	0	0	112.2
45	P	47.3	Very low	56.6	Low	121 Å²	121	98.1 Å²	98.1	79%	0.786	59%	0.593	S	S	*	*			trans	-76.4	129.6	-175.4	22.6	-18.1	0	0	0	111.1
46	S	45.8	Very low	56.6	Low	109 Å²	109	98.4 Å²	98.4	76%	0.762	60%	0.597	S	S	*	*			trans	-108.3	106.9	169.3	59.1	0	0	0	0	109.4
47	G	50.8	Low	56.5	Low	57 Å²	57	102 Å²	102	59%	0.588	61%	0.607	S	S	*	*	S	Bend	trans	108.6	150.1	167.7	0	0	0	0	0	115.4	G49	G47-G49 PolarHBondContact O-N 2.95Å
48	P	46.3	Very low	56.5	Low	137 Å²	137	103.1 Å²	103.1	89%	0.89	61%	0.61	S	S	*	*			trans	-69.4	115.6	177.7	28.9	-30.3	0	0	0	109.2
49	G	49.6	Very low	56.9	Low	35 Å²	35	98.3 Å²	98.3	36%	0.361	59%	0.591	S	S	.	*			trans	-62.7	149.3	173.5	0	0	0	0	0	111.6	H37 G47 S51	H37-G49 WeakPolarHBondContact NE2-CA 3.27Å; G47-G49 PolarHBondContact O-N 2.95Å; G49-S51 PolarHBondContact O-N 3.47Å; G49-S51 VanDerWaalsContact O-N 3.08Å
50	G	53.8	Low	57.3	Low	37 Å²	37	99 Å²	99	38%	0.381	60%	0.596	S	S	.	*			trans	-55.4	115.6	174.9	0	0	0	0	0	110.2	F52	G50-F52 PolarHBondContact O-N 3.3Å
51	S	59.4	Low	58.1	Low	112 Å²	112	95.9 Å²	95.9	78%	0.783	57%	0.573	S	S	*	*			trans	-84.2	17.4	-170.6	-171.7	0	0	0	0	113.8	G49	G49-S51 PolarHBondContact O-N 3.47Å; G49-S51 VanDerWaalsContact O-N 3.08Å
52	F	66.1	Low	59.3	Low	153 Å²	153	90.4 Å²	90.4	67%	0.671	53%	0.534	S	S	*	.			trans	-104.6	128.8	-172	-61.7	-74.6	0	0	0	111.2	G50	G50-F52 PolarHBondContact O-N 3.3Å
53	I	75.5	Confident	60.1	Low	123 Å²	123	90 Å²	90	63%	0.631	51%	0.513	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.6	118.8	168.2	-60.7	174.3	0	0	0	106.3	L32	L32-I53 HydrophobicContact CB-CG2 4.26Å; L32-I53 HydrophobicContact CD2-CG2 4.22Å
54	H	76.3	Confident	61.4	Low	41 Å²	41	84 Å²	84	19%	0.19	48%	0.483	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	135.3	177	-63.1	-84.7	0	0	0	109.6	I13 P14 L32 V33	I13-H54 HydrophobicContact CG2-CB 3.93Å; P14-H54 PolarHBondContact O-CE1 3.29Å; P14-H54 PolarHBondContact O-ND1 2.94Å; L32-H54 CarbonylContact C-O 3.59Å; L32-H54 WeakPolarHBondContact CA-O 2.99Å; V33-H54 HydrophobicContact CB-CB 4.49Å; V33-H54 PolarHBondContact N-O 3.15Å; V33-H54 PolarHBondContact O-N 2.93Å
55	K	75.4	Confident	62.6	Low	110 Å²	110	81.8 Å²	81.8	48%	0.478	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	110.9	177.5	-176.5	178.2	180	170.9	0	108.1	D30 L32	D30-K55 HydrophobicContact CB-CD 4.44Å; D30-K55 VanDerWaalsContact CB-CE 3.44Å; D30-K55 HydrophobicContact CB-CG 4.01Å; D30-K55 VanDerWaalsContact CG-NZ 3.27Å; D30-K55 WeakPolarHBondContact OD1-CE 3.31Å; D30-K55 IonicContact OD1-NZ 3.83Å; D30-K55 PolarHBondContact OD1-NZ 2.78Å; D30-K55 WeakPolarHBondContact OD2-CE 3.45Å; D30-K55 IonicContact OD2-NZ 2.94Å; D30-K55 PolarHBondContact OD2-NZ 3.05Å; L32-K55 HydrophobicContact CD2-CB 4.28Å; L32-K55 HydrophobicContact CD2-CG 4.23Å
56	V	73.1	Confident	64.1	Low	34 Å²	34	76.5 Å²	76.5	21%	0.206	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	133.1	178.3	-178.1	0	0	0	0	108.7	I13 I31 V33	I13-V56 HydrophobicContact CD1-CG2 3.94Å; I13-V56 HydrophobicContact CG1-CG2 4.09Å; I31-V56 HydrophobicContact CB-CB 4.28Å; I31-V56 PolarHBondContact N-O 2.92Å; I31-V56 PolarHBondContact O-N 2.74Å; V33-V56 HydrophobicContact CG2-CG2 3.93Å
57	R	68.2	Low	65.8	Low	107 Å²	107	71.7 Å²	71.7	40%	0.404	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	139.7	176.9	-62.9	-160.5	177.5	146.9	17.2	110.1	D30 E60	D30-R57 WeakPolarHBondContact OD1-CD 3.11Å; D30-R57 VanDerWaalsContact OD1-CG 3.23Å; D30-R57 WeakPolarHBondContact OD1-CG 3.28Å; D30-R57 IonicContact OD1-NE 2.72Å; D30-R57 PolarHBondContact OD1-NE 3.1Å; R57-E60 HydrophobicContact CB-CG 4.44Å
58	K	61	Low	67.3	Low	156 Å²	156	74 Å²	74	68%	0.678	39%	0.393	S	S	*	.	S	Bend	trans	-81.4	-34.6	179.9	-163.5	179.4	176.1	-171.3	0	112
59	D	62.5	Low	69.1	Low	50 Å²	50	72.5 Å²	72.5	27%	0.267	37%	0.372	S	S	.	.			trans	-126.5	79	-173.7	-54.4	-44.5	0	0	0	111.3	D61 I62 N63	D59-D61 PolarHBondContact O-N 3.12Å; D59-I62 HydrophobicContact CB-CB 4.38Å; D59-I62 HydrophobicContact CB-CD1 3.69Å; D59-I62 HydrophobicContact CB-CG1 3.98Å; D59-N63 PolarHBondContact O-ND2 3.45Å
60	E	61.5	Low	71	Confident	124 Å²	124	71 Å²	71	58%	0.579	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-32.1	176.9	-67.8	-164.8	161.1	0	0	112.1	R57 I62 N63	R57-E60 HydrophobicContact CB-CG 4.44Å; E60-I62 VanDerWaalsContact C-N 3.33Å; E60-I62 PolarHBondContact O-N 3.43Å; E60-N63 WeakPolarHBondContact O-CB 3.47Å; E60-N63 PolarHBondContact O-N 3.32Å; E60-N63 VanDerWaalsContact O-N 3.1Å
61	D	64	Low	72.7	Confident	45 Å²	45	69.4 Å²	69.4	24%	0.241	34%	0.338	C	S	.	.	G	3₁₀ helix	trans	-63.1	-34.8	-178.3	-67.1	-37.5	0	0	0	113.3	D59 N63 S64 L67 Q135	D59-D61 PolarHBondContact O-N 3.12Å; D61-N63 PolarHBondContact O-N 2.65Å; D61-S64 WeakPolarHBondContact O-CB 3.13Å; D61-S64 PolarHBondContact O-N 2.91Å; D61-L67 HydrophobicContact CB-CD1 3.93Å; D61-L67 WeakPolarHBondContact O-CD1 3.49Å; D61-Q135 PolarHBondContact OD1-NE2 3.06Å
62	I	65.9	Low	74.1	Confident	13 Å²	13	66.6 Å²	66.6	7%	0.067	32%	0.315	C	S	.	.	G	3₁₀ helix	trans	-64.8	-25.3	178.7	-63	177	0	0	0	111.5	D59 E60 S64 F71 H413 L416	D59-I62 HydrophobicContact CB-CB 4.38Å; D59-I62 HydrophobicContact CB-CD1 3.69Å; D59-I62 HydrophobicContact CB-CG1 3.98Å; E60-I62 VanDerWaalsContact C-N 3.33Å; E60-I62 PolarHBondContact O-N 3.43Å; I62-S64 VanDerWaalsContact C-N 3.33Å; I62-F71 HydrophobicContact CG1-CE2 4.45Å; I62-F71 HydrophobicContact CG1-CZ 4.44Å; I62-F71 HydrophobicContact CG2-CE2 4.48Å; I62-H413 HydrophobicContact CG2-CB 4.03Å; I62-L416 HydrophobicContact CG2-CD1 4.04Å
63	N	64.7	Low	75.3	Confident	66 Å²	66	64.2 Å²	64.2	35%	0.353	31%	0.306	S	S	.	.	G	3₁₀ helix	trans	-85.3	-4.9	179.4	-62.4	-68	0	0	0	113.1	D59 E60 D61 H413	D59-N63 PolarHBondContact O-ND2 3.45Å; E60-N63 WeakPolarHBondContact O-CB 3.47Å; E60-N63 PolarHBondContact O-N 3.32Å; E60-N63 VanDerWaalsContact O-N 3.1Å; D61-N63 PolarHBondContact O-N 2.65Å; N63-H413 PolarHBondContact OD1-CD2 3.4Å; N63-H413 VanDerWaalsContact OD1-CD2 3.24Å
64	S	73.9	Confident	76	Confident	10 Å²	10	58.4 Å²	58.4	7%	0.07	28%	0.276	C	S	.	.			trans	-67	125	175.9	176.7	0	0	0	0	110.2	D61 I62 I66 L67 R68	D61-S64 WeakPolarHBondContact O-CB 3.13Å; D61-S64 PolarHBondContact O-N 2.91Å; I62-S64 VanDerWaalsContact C-N 3.33Å; S64-I66 PolarHBondContact O-N 3.07Å; S64-L67 PolarHBondContact O-N 3.46Å; S64-R68 PolarHBondContact O-N 3.47Å
65	P	74.3	Confident	76.9	Confident	78 Å²	78	57 Å²	57	51%	0.506	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-23.8	-178.1	26	-33.7	0	0	0	112.7	R68	P65-R68 WeakPolarHBondContact O-CB 3.39Å
66	I	77.8	Confident	77.6	Confident	9 Å²	9	57.5 Å²	57.5	5%	0.046	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.5	-48.5	-179.7	-57.1	164.3	0	0	0	109.8	S64 R68 K69 E114 L115 V118 Y132	S64-I66 PolarHBondContact O-N 3.07Å; I66-R68 PolarHBondContact O-N 3.3Å; I66-R68 VanDerWaalsContact O-N 3.17Å; I66-K69 WeakPolarHBondContact O-CB 3.09Å; I66-K69 PolarHBondContact O-N 2.91Å; I66-E114 HydrophobicContact CG2-CB 4.25Å; I66-E114 HydrophobicContact CG2-CG 4.12Å; I66-L115 HydrophobicContact CB-CD2 4.03Å; I66-L115 HydrophobicContact CB-CG 4.36Å; I66-L115 HydrophobicContact CD1-CD2 3.52Å; I66-L115 HydrophobicContact CD1-CG 4.24Å; I66-L115 HydrophobicContact CG1-CD2 4.38Å; I66-L115 HydrophobicContact CG2-CD2 4Å; I66-L115 HydrophobicContact CG2-CG 3.76Å; I66-V118 HydrophobicContact CD1-CB 4.18Å; I66-V118 HydrophobicContact CD1-CG1 4.27Å; I66-V118 HydrophobicContact CD1-CG2 4.05Å; I66-Y132 HydrophobicContact CD1-CE1 4.31Å
67	L	80.8	Confident	78.5	Confident	9 Å²	9	57.1 Å²	57.1	5%	0.047	27%	0.269	C	S	.	.	H	α-helix	trans	-62	-24.9	174.6	-64.7	177.8	0	0	0	112.5	D61 S64 K69 L70 F71 L115 L139	D61-L67 HydrophobicContact CB-CD1 3.93Å; D61-L67 WeakPolarHBondContact O-CD1 3.49Å; S64-L67 PolarHBondContact O-N 3.46Å; L67-K69 VanDerWaalsContact C-N 3.25Å; L67-K69 PolarHBondContact O-N 3.2Å; L67-L70 HydrophobicContact CD2-CD2 4.02Å; L67-L70 VanDerWaalsContact O-CB 3.31Å; L67-L70 WeakPolarHBondContact O-CB 3.47Å; L67-L70 PolarHBondContact O-N 3.02Å; L67-L70 VanDerWaalsContact O-N 3.14Å; L67-F71 HydrophobicContact CB-CE2 3.96Å; L67-F71 HydrophobicContact CB-CZ 4.23Å; L67-F71 WeakPolarHBondContact O-CD2 3.26Å; L67-F71 WeakPolarHBondContact O-CG 3.43Å; L67-F71 PolarHBondContact O-N 3.44Å; L67-L115 HydrophobicContact CD2-CD1 4.47Å; L67-L139 HydrophobicContact CD2-CD1 4.07Å; L67-L139 HydrophobicContact CD2-CD2 4.3Å
68	R	83.4	Confident	79.7	Confident	105 Å²	105	52 Å²	52	40%	0.396	25%	0.25	S	S	.	.	H	α-helix	trans	-58.2	-35.4	171	-168.1	-179.3	62.1	157.8	-0.9	113.1	S64 P65 I66 F71 N72 L416	S64-R68 PolarHBondContact O-N 3.47Å; P65-R68 WeakPolarHBondContact O-CB 3.39Å; I66-R68 PolarHBondContact O-N 3.3Å; I66-R68 VanDerWaalsContact O-N 3.17Å; R68-F71 PolarHBondContact O-N 3.04Å; R68-N72 PolarHBondContact O-N 3.49Å; R68-N72 PolarHBondContact O-ND2 2.94Å; R68-L416 HydrophobicContact CG-CD1 4.49Å; R68-L416 HydrophobicContact CG-CD2 4Å; R68-L416 HydrophobicContact CG-CG 4.42Å
69	K	85.1	Confident	81.1	Confident	106 Å²	106	46.9 Å²	46.9	46%	0.461	23%	0.232	S	C	.	.	H	α-helix	trans	-66.9	-45	175.2	-66.1	-179.6	-177.6	174.1	0	110.4	I66 L67 F71 N72 E73 E114	I66-K69 WeakPolarHBondContact O-CB 3.09Å; I66-K69 PolarHBondContact O-N 2.91Å; L67-K69 VanDerWaalsContact C-N 3.25Å; L67-K69 PolarHBondContact O-N 3.2Å; K69-F71 VanDerWaalsContact C-N 3.29Å; K69-F71 PolarHBondContact O-N 3.36Å; K69-N72 PolarHBondContact O-N 3.36Å; K69-N72 VanDerWaalsContact O-N 3.16Å; K69-E73 WeakPolarHBondContact O-CG 3.33Å; K69-E73 PolarHBondContact O-N 3.32Å; K69-E114 WeakPolarHBondContact CD-OE2 3.46Å; K69-E114 IonicContact NZ-OE1 3.85Å; K69-E114 PolarHBondContact NZ-OE1 3.09Å; K69-E114 IonicContact NZ-OE2 3.3Å; K69-E114 PolarHBondContact NZ-OE2 3.22Å
70	L	88	Confident	82.2	Confident	4 Å²	4	46 Å²	46	2%	0.021	24%	0.235	C	C	.	.	H	α-helix	trans	-52.7	-46.8	173.7	173.2	68.1	0	0	0	111.1	L67 N72 S74 V107 I108 C111 L139 W372	L67-L70 HydrophobicContact CD2-CD2 4.02Å; L67-L70 VanDerWaalsContact O-CB 3.31Å; L67-L70 WeakPolarHBondContact O-CB 3.47Å; L67-L70 PolarHBondContact O-N 3.02Å; L67-L70 VanDerWaalsContact O-N 3.14Å; L70-N72 PolarHBondContact O-N 3.44Å; L70-S74 WeakPolarHBondContact O-CB 3.39Å; L70-S74 PolarHBondContact O-N 3.04Å; L70-S74 PolarHBondContact O-OG 3.32Å; L70-V107 HydrophobicContact CD1-CB 4.37Å; L70-V107 HydrophobicContact CD1-CG1 3.58Å; L70-I108 HydrophobicContact CD1-CG1 4.24Å; L70-C111 HydrophobicContact CB-CB 4.34Å; L70-L139 HydrophobicContact CD2-CD2 4.01Å; L70-W372 HydrophobicContact CD1-CH2 4.42Å; L70-W372 HydrophobicContact CD1-CZ2 3.97Å; L70-W372 HydrophobicContact CG-CZ2 4.45Å
71	F	89.6	Confident	83.5	Confident	2 Å²	2	40.2 Å²	40.2	1%	0.009	21%	0.208	C	C	.	.	H	α-helix	trans	-65.2	-37.1	179.3	-59.2	-43.5	0	0	0	114.2	I62 L67 R68 K69 S74 H75 W372 Y406 L410 L416	I62-F71 HydrophobicContact CG1-CE2 4.45Å; I62-F71 HydrophobicContact CG1-CZ 4.44Å; I62-F71 HydrophobicContact CG2-CE2 4.48Å; L67-F71 HydrophobicContact CB-CE2 3.96Å; L67-F71 HydrophobicContact CB-CZ 4.23Å; L67-F71 WeakPolarHBondContact O-CD2 3.26Å; L67-F71 WeakPolarHBondContact O-CG 3.43Å; L67-F71 PolarHBondContact O-N 3.44Å; R68-F71 PolarHBondContact O-N 3.04Å; K69-F71 VanDerWaalsContact C-N 3.29Å; K69-F71 PolarHBondContact O-N 3.36Å; F71-S74 WeakPolarHBondContact CA-OG 3.35Å; F71-S74 PolarHBondContact O-OG 2.88Å; F71-H75 WeakPolarHBondContact O-CB 3.45Å; F71-H75 PolarHBondContact O-N 2.94Å; F71-W372 AromaticContact CD1-CD1 3.62Å; F71-W372 HydrophobicContact CD1-CG 4.33Å; F71-W372 HydrophobicContact CE1-CB 4.15Å; F71-W372 AromaticContact CE1-CD1 3.81Å; F71-W372 HydrophobicContact CE1-CG 4.07Å; F71-Y406 WeakPolarHBondContact CD1-OH 3.46Å; F71-L410 HydrophobicContact CG-CD2 4.38Å; F71-L416 HydrophobicContact CB-CD1 4.44Å; F71-L416 HydrophobicContact CB-CD2 4.19Å; F71-L416 HydrophobicContact CD2-CD1 3.77Å; F71-L416 HydrophobicContact CG-CD1 4.46Å
72	N	89.5	Confident	84.6	Confident	53 Å²	53	40 Å²	40	28%	0.283	21%	0.205	S	C	.	.	H	α-helix	trans	-73	-45	178.4	-73.2	-70.2	0	0	0	111.9	R68 K69 L70 H75 H76 C419	R68-N72 PolarHBondContact O-N 3.49Å; R68-N72 PolarHBondContact O-ND2 2.94Å; K69-N72 PolarHBondContact O-N 3.36Å; K69-N72 VanDerWaalsContact O-N 3.16Å; L70-N72 PolarHBondContact O-N 3.44Å; N72-H75 WeakPolarHBondContact O-CB 3.49Å; N72-H75 PolarHBondContact O-N 3.44Å; N72-H76 PolarHBondContact O-CD2 2.77Å; N72-H76 PolarHBondContact O-N 3.43Å; N72-H76 VanDerWaalsContact O-N 3.08Å; N72-C419 PolarHBondContact OD1-SG 2.92Å
73	E	90.6	Very high	85.3	Confident	104 Å²	104	44.2 Å²	44.2	49%	0.486	23%	0.232	S	C	.	.	H	α-helix	trans	-66.6	-43.1	178.6	-67.1	-60.9	150	0	0	111.4	K69 H75 H76 I77 V107	K69-E73 WeakPolarHBondContact O-CG 3.33Å; K69-E73 PolarHBondContact O-N 3.32Å; E73-H75 VanDerWaalsContact C-N 3.31Å; E73-H75 PolarHBondContact O-N 3.02Å; E73-H76 WeakPolarHBondContact O-CB 3.48Å; E73-H76 PolarHBondContact O-N 3.17Å; E73-H76 VanDerWaalsContact O-N 3.16Å; E73-I77 WeakPolarHBondContact O-CG1 3.48Å; E73-I77 PolarHBondContact O-N 2.95Å; E73-I77 VanDerWaalsContact O-N 3.09Å; E73-V107 HydrophobicContact CB-CG1 3.62Å; E73-V107 HydrophobicContact CB-CG2 3.96Å; E73-V107 HydrophobicContact CG-CG1 4.4Å
74	S	91.4	Very high	86.1	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-62.6	-37.3	174.6	54.8	0	0	0	0	112.5	L70 F71 H76 I77 F78 W372	L70-S74 WeakPolarHBondContact O-CB 3.39Å; L70-S74 PolarHBondContact O-N 3.04Å; L70-S74 PolarHBondContact O-OG 3.32Å; F71-S74 WeakPolarHBondContact CA-OG 3.35Å; F71-S74 PolarHBondContact O-OG 2.88Å; S74-H76 PolarHBondContact O-N 3.01Å; S74-I77 PolarHBondContact O-N 3.29Å; S74-F78 WeakPolarHBondContact O-CB 3.43Å; S74-F78 PolarHBondContact O-N 3.42Å; S74-W372 PolarHBondContact OG-NE1 3.14Å
75	H	93.3	Very high	85.4	Confident	13 Å²	13	50.3 Å²	50.3	6%	0.06	26%	0.256	C	S	.	.	H	α-helix	trans	-61.5	-40.9	172.7	167.9	86.2	0	0	0	112.7	F71 N72 E73 I77 F78 V79 C419 D422 Y423	F71-H75 WeakPolarHBondContact O-CB 3.45Å; F71-H75 PolarHBondContact O-N 2.94Å; N72-H75 WeakPolarHBondContact O-CB 3.49Å; N72-H75 PolarHBondContact O-N 3.44Å; E73-H75 VanDerWaalsContact C-N 3.31Å; E73-H75 PolarHBondContact O-N 3.02Å; H75-I77 VanDerWaalsContact C-N 3.31Å; H75-I77 PolarHBondContact O-N 3.28Å; H75-F78 WeakPolarHBondContact O-CB 3.37Å; H75-F78 PolarHBondContact O-N 2.68Å; H75-V79 WeakPolarHBondContact O-CG2 3.45Å; H75-V79 PolarHBondContact O-N 3Å; H75-C419 HydrophobicContact CB-CB 4.47Å; H75-C419 PolarHBondContact CE1-O 3.4Å; H75-D422 IonicContact CE1-OD2 3.65Å; H75-D422 PolarHBondContact CE1-OD2 2.61Å; H75-D422 IonicContact NE2-OD2 2.66Å; H75-D422 PolarHBondContact NE2-OD2 3.14Å; H75-Y423 VanDerWaalsContact CA-OH 3.28Å; H75-Y423 WeakPolarHBondContact CA-OH 3.33Å; H75-Y423 HydrophobicContact CB-CE2 4.27Å; H75-Y423 WeakPolarHBondContact CB-OH 3.49Å; H75-Y423 AromaticContact ND1-CE2 3.5Å; H75-Y423 WeakPolarHBondContact ND1-CE2 3.49Å; H75-Y423 AromaticContact ND1-CZ 3.87Å
76	H	91	Very high	84.7	Confident	120 Å²	120	51.9 Å²	51.9	56%	0.556	26%	0.26	S	S	*	.	H	α-helix	trans	-62.6	-39.2	173.9	-72.4	-55	0	0	0	112.4	N72 E73 S74 G80	N72-H76 PolarHBondContact O-CD2 2.77Å; N72-H76 PolarHBondContact O-N 3.43Å; N72-H76 VanDerWaalsContact O-N 3.08Å; E73-H76 WeakPolarHBondContact O-CB 3.48Å; E73-H76 PolarHBondContact O-N 3.17Å; E73-H76 VanDerWaalsContact O-N 3.16Å; S74-H76 PolarHBondContact O-N 3.01Å; H76-G80 PolarHBondContact O-N 3.28Å
77	I	91.6	Very high	83.6	Confident	25 Å²	25	58.3 Å²	58.3	13%	0.128	30%	0.295	C	S	.	.	H	α-helix	trans	-65.2	-43.8	174.8	-59.6	167.5	0	0	0	110.4	E73 S74 H75 G80 L81 I100 N103 Y104 V107	E73-I77 WeakPolarHBondContact O-CG1 3.48Å; E73-I77 PolarHBondContact O-N 2.95Å; E73-I77 VanDerWaalsContact O-N 3.09Å; S74-I77 PolarHBondContact O-N 3.29Å; H75-I77 VanDerWaalsContact C-N 3.31Å; H75-I77 PolarHBondContact O-N 3.28Å; I77-G80 PolarHBondContact O-N 3.4Å; I77-L81 PolarHBondContact O-N 2.9Å; I77-I100 HydrophobicContact CG2-CG2 3.76Å; I77-N103 HydrophobicContact CD1-CB 3.9Å; I77-N103 HydrophobicContact CG1-CB 4.39Å; I77-Y104 HydrophobicContact CB-CD1 4.44Å; I77-Y104 HydrophobicContact CB-CE1 3.89Å; I77-Y104 HydrophobicContact CB-CE2 4.3Å; I77-Y104 HydrophobicContact CD1-CD1 4.03Å; I77-Y104 HydrophobicContact CD1-CE1 4.3Å; I77-Y104 HydrophobicContact CD1-CG 4.32Å; I77-Y104 HydrophobicContact CG2-CD1 4.3Å; I77-Y104 HydrophobicContact CG2-CD2 3.83Å; I77-Y104 HydrophobicContact CG2-CE1 3.87Å; I77-Y104 HydrophobicContact CG2-CE2 3.37Å; I77-Y104 HydrophobicContact CG2-CG 4.28Å; I77-V107 HydrophobicContact CD1-CG2 3.79Å
78	F	92.9	Very high	82.4	Confident	0 Å²	0	63 Å²	63	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-58.5	-54.9	177.1	172.8	-94.9	0	0	0	111.2	S74 H75 G80 L81 Q82 Y104 D379 L403 Y423 H426	S74-F78 WeakPolarHBondContact O-CB 3.43Å; S74-F78 PolarHBondContact O-N 3.42Å; H75-F78 WeakPolarHBondContact O-CB 3.37Å; H75-F78 PolarHBondContact O-N 2.68Å; F78-G80 PolarHBondContact O-N 3.49Å; F78-L81 WeakPolarHBondContact O-CB 3.42Å; F78-L81 PolarHBondContact O-N 3.26Å; F78-Q82 HydrophobicContact CD1-CG 4.37Å; F78-Q82 HydrophobicContact CE1-CG 4Å; F78-Q82 HydrophobicContact CZ-CG 4.11Å; F78-Q82 WeakPolarHBondContact O-CG 3.41Å; F78-Q82 PolarHBondContact O-N 3.45Å; F78-Q82 VanDerWaalsContact O-N 3.13Å; F78-Y104 WeakPolarHBondContact CA-OH 3.22Å; F78-Y104 PolarHBondContact N-OH 3Å; F78-D379 HydrophobicContact CD2-CB 4.49Å; F78-D379 VanDerWaalsContact CD2-OD2 3.3Å; F78-D379 WeakPolarHBondContact CD2-OD2 3.25Å; F78-D379 HydrophobicContact CE2-CB 4.18Å; F78-D379 VanDerWaalsContact CE2-CG 3.47Å; F78-D379 WeakPolarHBondContact CE2-OD2 3.46Å; F78-L403 HydrophobicContact CE2-CD1 4.41Å; F78-L403 HydrophobicContact CE2-CD2 3.83Å; F78-L403 HydrophobicContact CZ-CD1 4.49Å; F78-L403 HydrophobicContact CZ-CD2 4.21Å; F78-Y423 HydrophobicContact CB-CE1 4.02Å; F78-Y423 AromaticContact CD1-CD1 3.65Å; F78-Y423 HydrophobicContact CD1-CD1 3.65Å; F78-Y423 AromaticContact CD1-CE1 3.4Å; F78-Y423 HydrophobicContact CD1-CE1 3.4Å; F78-Y423 VanDerWaalsContact CD1-CE1 3.4Å; F78-Y423 HydrophobicContact CD2-CD1 4.2Å; F78-Y423 AromaticContact CD2-CE1 3.75Å; F78-Y423 HydrophobicContact CD2-CE1 3.75Å; F78-Y423 AromaticContact CE1-CD1 3.43Å; F78-Y423 HydrophobicContact CE1-CD1 3.43Å; F78-Y423 VanDerWaalsContact CE1-CD1 3.43Å; F78-Y423 AromaticContact CE1-CE1 3.72Å; F78-Y423 HydrophobicContact CE1-CE1 3.72Å; F78-Y423 HydrophobicContact CE1-CG 4.27Å; F78-Y423 AromaticContact CE2-CD1 3.98Å; F78-Y423 HydrophobicContact CE2-CD1 3.98Å; F78-Y423 HydrophobicContact CE2-CE1 4.01Å; F78-Y423 HydrophobicContact CG-CD1 4.04Å; F78-Y423 AromaticContact CG-CE1 3.43Å; F78-Y423 HydrophobicContact CG-CE1 3.43Å; F78-Y423 VanDerWaalsContact CG-CE1 3.43Å; F78-Y423 AromaticContact CZ-CD1 3.6Å; F78-Y423 HydrophobicContact CZ-CD1 3.6Å; F78-Y423 HydrophobicContact CZ-CE1 4.01Å; F78-H426 HydrophobicContact CE1-CB 4.24Å; F78-H426 AromaticContact CE1-ND1 3.93Å; F78-H426 HydrophobicContact CZ-CB 4.01Å
79	V	90.3	Very high	81.2	Confident	48 Å²	48	62.5 Å²	62.5	29%	0.291	33%	0.329	S	S	.	.	H	α-helix	trans	-59.1	-39.4	178.7	174.5	0	0	0	0	110.7	H75 L81 Q82 T83 D422	H75-V79 WeakPolarHBondContact O-CG2 3.45Å; H75-V79 PolarHBondContact O-N 3Å; V79-L81 PolarHBondContact O-N 3.46Å; V79-Q82 PolarHBondContact O-N 2.89Å; V79-T83 PolarHBondContact O-N 3.29Å; V79-D422 HydrophobicContact CG2-CB 4.38Å
80	G	86.6	Confident	80	Confident	33 Å²	33	60.1 Å²	60.1	34%	0.34	33%	0.326	S	S	.	.	H	α-helix	trans	-58.9	-43.7	173.8	0	0	0	0	0	112.9	H76 I77 F78 Q82 T83	H76-G80 PolarHBondContact O-N 3.28Å; I77-G80 PolarHBondContact O-N 3.4Å; F78-G80 PolarHBondContact O-N 3.49Å; G80-Q82 VanDerWaalsContact C-N 3.34Å; G80-Q82 PolarHBondContact O-N 3.49Å; G80-T83 PolarHBondContact O-N 2.95Å; G80-T83 PolarHBondContact O-OG1 3.29Å
81	L	87.9	Confident	78.5	Confident	1 Å²	1	67.9 Å²	67.9	1%	0.005	36%	0.36	C	S	.	.	H	α-helix	trans	-60.9	-40.5	177.2	175.7	60.4	0	0	0	111.9	I77 F78 V79 T83 I84 F97 I100 D379 L380 H383	I77-L81 PolarHBondContact O-N 2.9Å; F78-L81 WeakPolarHBondContact O-CB 3.42Å; F78-L81 PolarHBondContact O-N 3.26Å; V79-L81 PolarHBondContact O-N 3.46Å; L81-T83 PolarHBondContact O-N 3Å; L81-I84 HydrophobicContact CD1-CD1 4.06Å; L81-I84 WeakPolarHBondContact O-CB 3.44Å; L81-I84 WeakPolarHBondContact O-CG1 3.31Å; L81-I84 PolarHBondContact O-N 3.18Å; L81-I84 VanDerWaalsContact O-N 3.09Å; L81-F97 HydrophobicContact CD1-CD1 4.1Å; L81-F97 HydrophobicContact CD1-CE1 3.89Å; L81-I100 HydrophobicContact CD1-CD1 3.86Å; L81-D379 WeakPolarHBondContact CD2-OD2 3.38Å; L81-L380 HydrophobicContact CD1-CD1 4.33Å; L81-L380 HydrophobicContact CD2-CB 4.4Å; L81-L380 HydrophobicContact CD2-CD1 4.01Å; L81-H383 HydrophobicContact CD1-CB 4.14Å
82	Q	86.9	Confident	77.2	Confident	40 Å²	40	70.8 Å²	70.8	19%	0.187	38%	0.38	C	S	.	.	H	α-helix	trans	-64.8	-21.4	179.1	-52.4	-55.5	-50.6	0	0	113.3	F78 V79 G80 I84 D379 H383 R399 H426	F78-Q82 HydrophobicContact CD1-CG 4.37Å; F78-Q82 HydrophobicContact CE1-CG 4Å; F78-Q82 HydrophobicContact CZ-CG 4.11Å; F78-Q82 WeakPolarHBondContact O-CG 3.41Å; F78-Q82 PolarHBondContact O-N 3.45Å; F78-Q82 VanDerWaalsContact O-N 3.13Å; V79-Q82 PolarHBondContact O-N 2.89Å; G80-Q82 VanDerWaalsContact C-N 3.34Å; G80-Q82 PolarHBondContact O-N 3.49Å; Q82-I84 VanDerWaalsContact C-N 3.25Å; Q82-I84 PolarHBondContact O-N 2.88Å; Q82-D379 PolarHBondContact NE2-OD1 3.2Å; Q82-D379 VanDerWaalsContact NE2-OD1 3.08Å; Q82-D379 PolarHBondContact NE2-OD2 3.33Å; Q82-H383 PolarHBondContact NE2-CE1 3.17Å; Q82-H383 VanDerWaalsContact NE2-CE1 3.34Å; Q82-R399 VanDerWaalsContact OE1-NH2 3.16Å; Q82-H426 VanDerWaalsContact CB-CD2 3.46Å; Q82-H426 WeakPolarHBondContact CB-CD2 3.37Å; Q82-H426 WeakPolarHBondContact CB-NE2 3.32Å; Q82-H426 HydrophobicContact CG-CB 4.44Å; Q82-H426 WeakPolarHBondContact CG-CD2 3.43Å
83	T	82.5	Confident	76.3	Confident	103 Å²	103	68.7 Å²	68.7	63%	0.632	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.9	-10.7	176.9	69	0	0	0	0	113.8	V79 G80 L81 K85	V79-T83 PolarHBondContact O-N 3.29Å; G80-T83 PolarHBondContact O-N 2.95Å; G80-T83 PolarHBondContact O-OG1 3.29Å; L81-T83 PolarHBondContact O-N 3Å; T83-K85 PolarHBondContact O-N 3.29Å
84	I	79.7	Confident	75.6	Confident	43 Å²	43	68.8 Å²	68.8	22%	0.221	37%	0.365	C	S	.	.	S	Bend	trans	-75.6	97	-177.5	-58.7	-177.7	0	0	0	109.3	L81 Q82 K93 I100	L81-I84 HydrophobicContact CD1-CD1 4.06Å; L81-I84 WeakPolarHBondContact O-CB 3.44Å; L81-I84 WeakPolarHBondContact O-CG1 3.31Å; L81-I84 PolarHBondContact O-N 3.18Å; L81-I84 VanDerWaalsContact O-N 3.09Å; Q82-I84 VanDerWaalsContact C-N 3.25Å; Q82-I84 PolarHBondContact O-N 2.88Å; I84-K93 HydrophobicContact CG2-CD 4.44Å; I84-I100 HydrophobicContact CD1-CD1 3.4Å; I84-I100 VanDerWaalsContact CD1-CD1 3.4Å
85	K	60.3	Low	75.1	Confident	161 Å²	161	73 Å²	73	70%	0.7	39%	0.391	S	S	*	.			trans	-54.6	138.2	-179.5	-66.3	-172.5	177.3	-173.6	0	112.7	T83 D87 K93	T83-K85 PolarHBondContact O-N 3.29Å; K85-D87 PolarHBondContact O-N 3.32Å; K85-D87 VanDerWaalsContact O-N 3.11Å; K85-K93 WeakPolarHBondContact O-CE 3.19Å; K85-K93 PolarHBondContact O-NZ 3.35Å
86	D	60.2	Low	74.8	Confident	111 Å²	111	76.9 Å²	76.9	59%	0.594	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-14.6	-179.8	-99	-44.3	0	0	0	115.3	L88 K93 K385	D86-L88 VanDerWaalsContact C-N 3.28Å; D86-L88 PolarHBondContact O-N 3.04Å; D86-L88 VanDerWaalsContact O-N 3.08Å; D86-K93 PolarHBondContact O-NZ 2.92Å; D86-K385 IonicContact OD1-NZ 3.74Å
87	D	54.8	Low	74.6	Confident	144 Å²	144	71.6 Å²	71.6	77%	0.77	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.7	-9.3	-166	-64.6	-31.6	0	0	0	116.7	K85	K85-D87 PolarHBondContact O-N 3.32Å; K85-D87 VanDerWaalsContact O-N 3.11Å
88	L	54.6	Low	74.4	Confident	107 Å²	107	70.8 Å²	70.8	56%	0.56	38%	0.382	S	S	*	.	S	Bend	trans	-103.3	140.4	179	-81.1	152.6	0	0	0	112.1	D86 K93	D86-L88 VanDerWaalsContact C-N 3.28Å; D86-L88 PolarHBondContact O-N 3.04Å; D86-L88 VanDerWaalsContact O-N 3.08Å; L88-K93 HydrophobicContact CB-CD 4.49Å; L88-K93 VanDerWaalsContact CB-CE 3.46Å; L88-K93 HydrophobicContact CB-CG 4.37Å; L88-K93 WeakPolarHBondContact O-CE 3.29Å; L88-K93 PolarHBondContact O-NZ 3.4Å
89	P	59.3	Low	74.2	Confident	94 Å²	94	73.6 Å²	73.6	61%	0.61	40%	0.401	S	S	*	.			trans	-61.5	139.6	-178.9	23.3	-31.6	0	0	0	112.5	K91 S92	P89-K91 PolarHBondContact O-N 3.38Å; P89-S92 PolarHBondContact O-N 2.92Å; P89-S92 PolarHBondContact O-OG 2.93Å
90	S	58	Low	74.2	Confident	56 Å²	56	72.2 Å²	72.2	39%	0.392	39%	0.392	S	S	.	.	H	α-helix	trans	-57.6	-30.2	-168	77.8	0	0	0	0	114.7	S92 K93 R94	S90-S92 VanDerWaalsContact C-N 3.32Å; S90-S92 PolarHBondContact O-N 3.47Å; S90-K93 PolarHBondContact O-N 3.43Å; S90-K93 VanDerWaalsContact O-N 3.09Å; S90-R94 PolarHBondContact O-N 3.18Å; S90-R94 VanDerWaalsContact O-N 3.14Å
91	K	57.8	Low	74.4	Confident	167 Å²	167	70.7 Å²	70.7	73%	0.726	38%	0.376	S	S	*	.	H	α-helix	trans	-62.9	-32.2	178.6	-71	-173.1	179	-178	0	113.7	P89 K93	P89-K91 PolarHBondContact O-N 3.38Å; K91-K93 VanDerWaalsContact C-N 3.33Å
92	S	61.9	Low	74.6	Confident	63 Å²	63	77.5 Å²	77.5	44%	0.441	40%	0.401	S	S	.	.	H	α-helix	trans	-81.1	-16.1	176.3	60.5	0	0	0	0	113	P89 S90	P89-S92 PolarHBondContact O-N 2.92Å; P89-S92 PolarHBondContact O-OG 2.93Å; S90-S92 VanDerWaalsContact C-N 3.32Å; S90-S92 PolarHBondContact O-N 3.47Å
93	K	70.1	Confident	74.8	Confident	9 Å²	9	79 Å²	79	4%	0.039	41%	0.411	C	S	.	.	H	α-helix	trans	-92	-19.7	179.1	-63.7	-179.2	175.6	173.9	0	113.6	I84 K85 D86 L88 S90 K91 Q96 F97	I84-K93 HydrophobicContact CG2-CD 4.44Å; K85-K93 WeakPolarHBondContact O-CE 3.19Å; K85-K93 PolarHBondContact O-NZ 3.35Å; D86-K93 PolarHBondContact O-NZ 2.92Å; L88-K93 HydrophobicContact CB-CD 4.49Å; L88-K93 VanDerWaalsContact CB-CE 3.46Å; L88-K93 HydrophobicContact CB-CG 4.37Å; L88-K93 WeakPolarHBondContact O-CE 3.29Å; L88-K93 PolarHBondContact O-NZ 3.4Å; S90-K93 PolarHBondContact O-N 3.43Å; S90-K93 VanDerWaalsContact O-N 3.09Å; K91-K93 VanDerWaalsContact C-N 3.33Å; K93-Q96 WeakPolarHBondContact O-CA 3.35Å; K93-Q96 VanDerWaalsContact O-CB 3.27Å; K93-Q96 WeakPolarHBondContact O-CB 3.15Å; K93-Q96 PolarHBondContact O-N 2.96Å; K93-F97 HydrophobicContact CB-CD2 3.94Å; K93-F97 HydrophobicContact CB-CE2 3.44Å; K93-F97 VanDerWaalsContact CB-CE2 3.44Å; K93-F97 HydrophobicContact CB-CZ 4.01Å; K93-F97 HydrophobicContact CD-CE2 4.18Å; K93-F97 HydrophobicContact CD-CZ 4.09Å; K93-F97 HydrophobicContact CG-CE2 4.48Å; K93-F97 WeakPolarHBondContact O-CD2 3.43Å; K93-F97 PolarHBondContact O-N 3.1Å
94	R	75.9	Confident	75.3	Confident	107 Å²	107	74.1 Å²	74.1	40%	0.404	38%	0.381	S	S	.	.	H	α-helix	trans	-44.9	-52.3	177	-74.8	-176.2	-177.6	-175.3	-5.6	114.8	S90 Q96 F97 V98	S90-R94 PolarHBondContact O-N 3.18Å; S90-R94 VanDerWaalsContact O-N 3.14Å; R94-Q96 PolarHBondContact O-N 2.97Å; R94-F97 PolarHBondContact O-N 3.17Å; R94-F97 VanDerWaalsContact O-N 3.15Å; R94-V98 WeakPolarHBondContact O-CG2 3.41Å; R94-V98 PolarHBondContact O-N 2.76Å
95	P	82.4	Confident	75.9	Confident	87 Å²	87	73.1 Å²	73.1	57%	0.565	37%	0.374	S	S	*	.	H	α-helix	trans	-63.6	-28.7	178.7	24.6	-34.6	0	0	0	113	S99	P95-S99 WeakPolarHBondContact O-CB 3.35Å; P95-S99 PolarHBondContact O-N 3.3Å
96	Q	85.3	Confident	77.4	Confident	96 Å²	96	68.6 Å²	68.6	45%	0.449	36%	0.363	S	S	.	.	H	α-helix	trans	-70.7	-43.8	174.5	-59.6	176.2	-19.7	0	0	110.8	K93 R94 S99 I100	K93-Q96 WeakPolarHBondContact O-CA 3.35Å; K93-Q96 VanDerWaalsContact O-CB 3.27Å; K93-Q96 WeakPolarHBondContact O-CB 3.15Å; K93-Q96 PolarHBondContact O-N 2.96Å; R94-Q96 PolarHBondContact O-N 2.97Å; Q96-S99 WeakPolarHBondContact O-CB 3.39Å; Q96-S99 PolarHBondContact O-N 3.11Å; Q96-S99 VanDerWaalsContact O-N 3.16Å; Q96-I100 VanDerWaalsContact O-CG1 3.31Å; Q96-I100 WeakPolarHBondContact O-CG1 3.38Å; Q96-I100 PolarHBondContact O-N 3.04Å
97	F	87.2	Confident	78.9	Confident	8 Å²	8	64.3 Å²	64.3	4%	0.035	34%	0.341	C	S	.	.	H	α-helix	trans	-64.7	-39.3	175.6	-63.9	-51.3	0	0	0	112.6	L81 K93 R94 S99 I100 S101 I154 L380 H383	L81-F97 HydrophobicContact CD1-CD1 4.1Å; L81-F97 HydrophobicContact CD1-CE1 3.89Å; K93-F97 HydrophobicContact CB-CD2 3.94Å; K93-F97 HydrophobicContact CB-CE2 3.44Å; K93-F97 VanDerWaalsContact CB-CE2 3.44Å; K93-F97 HydrophobicContact CB-CZ 4.01Å; K93-F97 HydrophobicContact CD-CE2 4.18Å; K93-F97 HydrophobicContact CD-CZ 4.09Å; K93-F97 HydrophobicContact CG-CE2 4.48Å; K93-F97 WeakPolarHBondContact O-CD2 3.43Å; K93-F97 PolarHBondContact O-N 3.1Å; R94-F97 PolarHBondContact O-N 3.17Å; R94-F97 VanDerWaalsContact O-N 3.15Å; F97-S99 VanDerWaalsContact C-N 3.33Å; F97-S99 PolarHBondContact O-N 3.11Å; F97-I100 HydrophobicContact CD1-CD1 4.43Å; F97-I100 PolarHBondContact O-N 3.07Å; F97-S101 WeakPolarHBondContact O-CB 3.45Å; F97-S101 PolarHBondContact O-N 3.01Å; F97-I154 HydrophobicContact CB-CG2 3.93Å; F97-L380 HydrophobicContact CB-CD1 4.44Å; F97-L380 HydrophobicContact CD1-CD1 4.15Å; F97-H383 HydrophobicContact CE1-CB 3.93Å; F97-H383 HydrophobicContact CZ-CB 4.24Å; F97-H383 WeakPolarHBondContact CZ-O 3.35Å
98	V	87.4	Confident	80.6	Confident	9 Å²	9	57.4 Å²	57.4	6%	0.055	30%	0.304	C	S	.	.	H	α-helix	trans	-61.9	-42	171.4	174.1	0	0	0	0	110.6	R94 I100 S101 R102 I154 D155	R94-V98 WeakPolarHBondContact O-CG2 3.41Å; R94-V98 PolarHBondContact O-N 2.76Å; V98-I100 VanDerWaalsContact C-N 3.32Å; V98-I100 PolarHBondContact O-N 3.09Å; V98-S101 PolarHBondContact O-N 3.42Å; V98-R102 VanDerWaalsContact O-CG 3.3Å; V98-R102 WeakPolarHBondContact O-CG 3.41Å; V98-R102 PolarHBondContact O-N 2.93Å; V98-I154 HydrophobicContact CG2-CG2 3.89Å; V98-D155 HydrophobicContact CG2-CB 4.03Å
99	S	89.1	Confident	82.2	Confident	58 Å²	58	55.7 Å²	55.7	41%	0.406	29%	0.29	S	S	.	.	H	α-helix	trans	-61.3	-39.3	174.5	-171.6	0	0	0	0	112.5	P95 Q96 F97 R102 N103	P95-S99 WeakPolarHBondContact O-CB 3.35Å; P95-S99 PolarHBondContact O-N 3.3Å; Q96-S99 WeakPolarHBondContact O-CB 3.39Å; Q96-S99 PolarHBondContact O-N 3.11Å; Q96-S99 VanDerWaalsContact O-N 3.16Å; F97-S99 VanDerWaalsContact C-N 3.33Å; F97-S99 PolarHBondContact O-N 3.11Å; S99-R102 PolarHBondContact O-N 3.05Å; S99-N103 PolarHBondContact O-N 2.98Å; S99-N103 PolarHBondContact O-OD1 3.32Å
100	I	90.6	Very high	83.5	Confident	20 Å²	20	53.8 Å²	53.8	10%	0.103	28%	0.282	C	S	.	.	H	α-helix	trans	-68.5	-43.1	177.7	-68.5	164.9	0	0	0	110.7	I77 L81 I84 Q96 F97 V98 R102 N103 Y104 L380	I77-I100 HydrophobicContact CG2-CG2 3.76Å; L81-I100 HydrophobicContact CD1-CD1 3.86Å; I84-I100 HydrophobicContact CD1-CD1 3.4Å; I84-I100 VanDerWaalsContact CD1-CD1 3.4Å; Q96-I100 VanDerWaalsContact O-CG1 3.31Å; Q96-I100 WeakPolarHBondContact O-CG1 3.38Å; Q96-I100 PolarHBondContact O-N 3.04Å; F97-I100 HydrophobicContact CD1-CD1 4.43Å; F97-I100 PolarHBondContact O-N 3.07Å; V98-I100 VanDerWaalsContact C-N 3.32Å; V98-I100 PolarHBondContact O-N 3.09Å; I100-R102 VanDerWaalsContact C-N 3.32Å; I100-R102 PolarHBondContact O-N 3.05Å; I100-N103 WeakPolarHBondContact O-CB 3.34Å; I100-N103 PolarHBondContact O-N 3.38Å; I100-N103 VanDerWaalsContact O-N 3.12Å; I100-Y104 HydrophobicContact CG2-CD2 4.13Å; I100-Y104 HydrophobicContact CG2-CE2 3.81Å; I100-Y104 WeakPolarHBondContact O-CD2 3.09Å; I100-Y104 PolarHBondContact O-N 3.41Å; I100-L380 HydrophobicContact CG2-CD1 4.2Å
101	S	91.5	Very high	84.9	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-57.1	-45.1	173.2	-175.2	0	0	0	0	111.8	F97 V98 N103 Y104 R105 W146 E150	F97-S101 WeakPolarHBondContact O-CB 3.45Å; F97-S101 PolarHBondContact O-N 3.01Å; V98-S101 PolarHBondContact O-N 3.42Å; S101-N103 VanDerWaalsContact C-N 3.31Å; S101-N103 PolarHBondContact O-N 3.24Å; S101-Y104 WeakPolarHBondContact O-CB 3.44Å; S101-Y104 PolarHBondContact O-N 3.36Å; S101-R105 WeakPolarHBondContact O-CG 3.38Å; S101-R105 PolarHBondContact O-N 3.12Å; S101-W146 PolarHBondContact OG-NE1 3.19Å; S101-E150 WeakPolarHBondContact CB-OE2 3.08Å; S101-E150 WeakPolarHBondContact OG-CG 3.49Å; S101-E150 PolarHBondContact OG-OE2 3.2Å
102	R	91.2	Very high	86.3	Confident	144 Å²	144	44 Å²	44	54%	0.543	23%	0.233	S	C	.	.	H	α-helix	trans	-63.2	-35.4	175.3	-71.9	174.9	-176.2	-179.8	0.9	112.7	V98 S99 I100 R105 S106 E150	V98-R102 VanDerWaalsContact O-CG 3.3Å; V98-R102 WeakPolarHBondContact O-CG 3.41Å; V98-R102 PolarHBondContact O-N 2.93Å; S99-R102 PolarHBondContact O-N 3.05Å; I100-R102 VanDerWaalsContact C-N 3.32Å; I100-R102 PolarHBondContact O-N 3.05Å; R102-R105 PolarHBondContact O-N 3.43Å; R102-S106 WeakPolarHBondContact O-CB 3.28Å; R102-S106 PolarHBondContact O-N 3.18Å; R102-E150 IonicContact NE-OE1 3.13Å
103	N	91.7	Very high	87.4	Confident	73 Å²	73	46.2 Å²	46.2	39%	0.39	24%	0.237	S	C	.	.	H	α-helix	trans	-62.2	-46.9	173.3	-68.1	-14	0	0	0	110.8	I77 S99 I100 S101 R105 S106 V107	I77-N103 HydrophobicContact CD1-CB 3.9Å; I77-N103 HydrophobicContact CG1-CB 4.39Å; S99-N103 PolarHBondContact O-N 2.98Å; S99-N103 PolarHBondContact O-OD1 3.32Å; I100-N103 WeakPolarHBondContact O-CB 3.34Å; I100-N103 PolarHBondContact O-N 3.38Å; I100-N103 VanDerWaalsContact O-N 3.12Å; S101-N103 VanDerWaalsContact C-N 3.31Å; S101-N103 PolarHBondContact O-N 3.24Å; N103-R105 VanDerWaalsContact C-N 3.33Å; N103-R105 PolarHBondContact O-N 3.35Å; N103-S106 PolarHBondContact O-N 2.86Å; N103-S106 VanDerWaalsContact O-N 3.16Å; N103-S106 PolarHBondContact O-OG 2.97Å; N103-V107 WeakPolarHBondContact O-CG2 3.4Å; N103-V107 PolarHBondContact O-N 2.91Å; N103-V107 VanDerWaalsContact O-N 3.07Å
104	Y	93.1	Very high	88.1	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-55.9	-47.6	174.4	-78.5	-68.8	0	0	0	111.9	I77 F78 I100 S101 S106 V107 I108 W146 W372 H376	I77-Y104 HydrophobicContact CB-CD1 4.44Å; I77-Y104 HydrophobicContact CB-CE1 3.89Å; I77-Y104 HydrophobicContact CB-CE2 4.3Å; I77-Y104 HydrophobicContact CD1-CD1 4.03Å; I77-Y104 HydrophobicContact CD1-CE1 4.3Å; I77-Y104 HydrophobicContact CD1-CG 4.32Å; I77-Y104 HydrophobicContact CG2-CD1 4.3Å; I77-Y104 HydrophobicContact CG2-CD2 3.83Å; I77-Y104 HydrophobicContact CG2-CE1 3.87Å; I77-Y104 HydrophobicContact CG2-CE2 3.37Å; I77-Y104 HydrophobicContact CG2-CG 4.28Å; F78-Y104 WeakPolarHBondContact CA-OH 3.22Å; F78-Y104 PolarHBondContact N-OH 3Å; I100-Y104 HydrophobicContact CG2-CD2 4.13Å; I100-Y104 HydrophobicContact CG2-CE2 3.81Å; I100-Y104 WeakPolarHBondContact O-CD2 3.09Å; I100-Y104 PolarHBondContact O-N 3.41Å; S101-Y104 WeakPolarHBondContact O-CB 3.44Å; S101-Y104 PolarHBondContact O-N 3.36Å; Y104-S106 VanDerWaalsContact C-N 3.33Å; Y104-S106 PolarHBondContact O-N 3.09Å; Y104-V107 PolarHBondContact O-N 3.19Å; Y104-I108 WeakPolarHBondContact O-CG1 3.49Å; Y104-I108 PolarHBondContact O-N 3.02Å; Y104-W146 HydrophobicContact CD2-CH2 4.09Å; Y104-W146 AromaticContact CD2-CZ2 3.58Å; Y104-W146 HydrophobicContact CD2-CZ2 3.58Å; Y104-W146 HydrophobicContact CE2-CH2 4.47Å; Y104-W146 HydrophobicContact CE2-CZ2 4.27Å; Y104-W146 HydrophobicContact CG-CH2 4.11Å; Y104-W146 AromaticContact CG-CZ2 3.77Å; Y104-W146 HydrophobicContact CG-CZ2 3.77Å; Y104-W372 HydrophobicContact CD1-CZ2 4.17Å; Y104-H376 HydrophobicContact CE1-CB 4.27Å; Y104-H376 AromaticContact CE1-CD2 3.57Å; Y104-H376 AromaticContact CZ-CD2 3.83Å; Y104-H376 PolarHBondContact OH-CD2 2.95Å
105	R	91.4	Very high	88.5	Confident	21 Å²	21	43.5 Å²	43.5	8%	0.079	23%	0.229	C	C	.	.	H	α-helix	trans	-61.3	-38.6	177.2	-68.8	-179.2	58	-160.2	-2.8	113.3	S101 R102 N103 V107 I108 R109 E143 W146 N147 E150	S101-R105 WeakPolarHBondContact O-CG 3.38Å; S101-R105 PolarHBondContact O-N 3.12Å; R102-R105 PolarHBondContact O-N 3.43Å; N103-R105 VanDerWaalsContact C-N 3.33Å; N103-R105 PolarHBondContact O-N 3.35Å; R105-V107 VanDerWaalsContact C-N 3.31Å; R105-V107 PolarHBondContact O-N 3.4Å; R105-I108 PolarHBondContact O-N 3.32Å; R105-R109 WeakPolarHBondContact O-CG 3.48Å; R105-R109 PolarHBondContact O-N 2.86Å; R105-E143 HydrophobicContact CG-CG 4.5Å; R105-E143 IonicContact CZ-OE1 2.73Å; R105-E143 IonicContact NE-OE1 3.47Å; R105-E143 IonicContact NH2-OE1 3.28Å; R105-E143 PolarHBondContact NH2-OE1 3.2Å; R105-W146 HydrophobicContact CG-CG 4.27Å; R105-N147 VanDerWaalsContact CZ-ND2 3.29Å; R105-N147 PolarHBondContact NH1-ND2 3.31Å; R105-N147 PolarHBondContact NH1-OD1 3.19Å; R105-N147 PolarHBondContact NH2-ND2 3.18Å; R105-E150 WeakPolarHBondContact CD-OE2 3.43Å; R105-E150 IonicContact NH1-OE1 2.78Å; R105-E150 IonicContact NH1-OE2 2.93Å
106	S	91.4	Very high	88.5	Confident	66 Å²	66	44 Å²	44	46%	0.462	22%	0.223	S	C	.	.	H	α-helix	trans	-63.2	-38.5	176.1	75.1	0	0	0	0	112.1	R102 N103 Y104 R109 A110	R102-S106 WeakPolarHBondContact O-CB 3.28Å; R102-S106 PolarHBondContact O-N 3.18Å; N103-S106 PolarHBondContact O-N 2.86Å; N103-S106 VanDerWaalsContact O-N 3.16Å; N103-S106 PolarHBondContact O-OG 2.97Å; Y104-S106 VanDerWaalsContact C-N 3.33Å; Y104-S106 PolarHBondContact O-N 3.09Å; S106-R109 PolarHBondContact O-N 3.44Å; S106-A110 WeakPolarHBondContact O-CB 3.33Å; S106-A110 PolarHBondContact O-N 3.49Å
107	V	91.9	Very high	88.4	Confident	21 Å²	21	45.5 Å²	45.5	13%	0.127	23%	0.231	C	C	.	.	H	α-helix	trans	-69.1	-41.8	176	-179.5	0	0	0	0	110.7	L70 E73 I77 N103 Y104 R105 R109 A110 C111	L70-V107 HydrophobicContact CD1-CB 4.37Å; L70-V107 HydrophobicContact CD1-CG1 3.58Å; E73-V107 HydrophobicContact CB-CG1 3.62Å; E73-V107 HydrophobicContact CB-CG2 3.96Å; E73-V107 HydrophobicContact CG-CG1 4.4Å; I77-V107 HydrophobicContact CD1-CG2 3.79Å; N103-V107 WeakPolarHBondContact O-CG2 3.4Å; N103-V107 PolarHBondContact O-N 2.91Å; N103-V107 VanDerWaalsContact O-N 3.07Å; Y104-V107 PolarHBondContact O-N 3.19Å; R105-V107 VanDerWaalsContact C-N 3.31Å; R105-V107 PolarHBondContact O-N 3.4Å; V107-R109 VanDerWaalsContact C-N 3.34Å; V107-R109 PolarHBondContact O-N 3.26Å; V107-A110 PolarHBondContact O-N 3.39Å; V107-C111 WeakPolarHBondContact O-CB 3.45Å; V107-C111 PolarHBondContact O-N 3.4Å
108	I	90	Very high	88.1	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-57.4	-49.2	174.4	-63.9	159.6	0	0	0	109.8	L70 Y104 R105 C111 M112 L139 I142 E143 W372	L70-I108 HydrophobicContact CD1-CG1 4.24Å; Y104-I108 WeakPolarHBondContact O-CG1 3.49Å; Y104-I108 PolarHBondContact O-N 3.02Å; R105-I108 PolarHBondContact O-N 3.32Å; I108-C111 WeakPolarHBondContact O-CB 3.4Å; I108-C111 PolarHBondContact O-N 3.07Å; I108-M112 HydrophobicContact CG2-CE 4.16Å; I108-M112 HydrophobicContact CG2-CG 4.39Å; I108-M112 HydrophobicContact CG2-SD 4.3Å; I108-M112 WeakPolarHBondContact O-CG 3.46Å; I108-M112 PolarHBondContact O-N 3.31Å; I108-L139 HydrophobicContact CG2-CB 4.39Å; I108-L139 HydrophobicContact CG2-CD2 4.44Å; I108-I142 HydrophobicContact CD1-CG2 3.75Å; I108-I142 HydrophobicContact CG1-CG2 4.35Å; I108-E143 HydrophobicContact CG2-CB 4.11Å; I108-E143 HydrophobicContact CG2-CG 4.38Å; I108-W372 HydrophobicContact CD1-CH2 3.74Å; I108-W372 HydrophobicContact CD1-CZ3 4.09Å; I108-W372 HydrophobicContact CG1-CH2 3.76Å; I108-W372 HydrophobicContact CG1-CZ3 4.27Å
109	R	88.3	Confident	87.4	Confident	71 Å²	71	48.2 Å²	48.2	27%	0.268	25%	0.251	S	S	.	.	H	α-helix	trans	-61.9	-46.8	179	-75	-173.5	179.9	-156.4	-7.3	113.7	R105 S106 V107 C111 M112 E113 E143	R105-R109 WeakPolarHBondContact O-CG 3.48Å; R105-R109 PolarHBondContact O-N 2.86Å; S106-R109 PolarHBondContact O-N 3.44Å; V107-R109 VanDerWaalsContact C-N 3.34Å; V107-R109 PolarHBondContact O-N 3.26Å; R109-C111 PolarHBondContact O-N 3.28Å; R109-M112 HydrophobicContact CB-CE 4.39Å; R109-M112 HydrophobicContact CG-CE 3.84Å; R109-M112 PolarHBondContact O-N 3.4Å; R109-M112 VanDerWaalsContact O-N 3.1Å; R109-E113 WeakPolarHBondContact O-CG 3.24Å; R109-E113 PolarHBondContact O-N 3.07Å; R109-E143 VanDerWaalsContact CG-OE2 3.25Å; R109-E143 WeakPolarHBondContact CG-OE2 3.49Å; R109-E143 IonicContact CZ-OE1 3.07Å; R109-E143 IonicContact CZ-OE2 3.59Å; R109-E143 VanDerWaalsContact NE-CD 3.26Å; R109-E143 IonicContact NE-OE1 2.83Å; R109-E143 PolarHBondContact NE-OE1 2.95Å; R109-E143 IonicContact NE-OE2 2.85Å; R109-E143 PolarHBondContact NE-OE2 3.21Å; R109-E143 VanDerWaalsContact NE-OE2 3.09Å; R109-E143 IonicContact NH2-OE1 3.7Å; R109-E143 PolarHBondContact NH2-OE1 3.43Å; R109-E143 IonicContact NH2-OE2 2.82Å
110	A	88.4	Confident	86.6	Confident	53 Å²	53	48.9 Å²	48.9	44%	0.438	26%	0.26	S	S	.	.	H	α-helix	trans	-58.3	-39	176.6	0	0	0	0	0	111.4	S106 V107 E114	S106-A110 WeakPolarHBondContact O-CB 3.33Å; S106-A110 PolarHBondContact O-N 3.49Å; V107-A110 PolarHBondContact O-N 3.39Å; A110-E114 PolarHBondContact O-N 3.02Å; A110-E114 VanDerWaalsContact O-N 3.13Å
111	C	86.6	Confident	85.7	Confident	6 Å²	6	53.6 Å²	53.6	4%	0.041	29%	0.289	C	S	.	.	H	α-helix	trans	-67.8	-40.3	175.4	-169.9	0	0	0	0	112.4	L70 V107 I108 R109 E114 L115	L70-C111 HydrophobicContact CB-CB 4.34Å; V107-C111 WeakPolarHBondContact O-CB 3.45Å; V107-C111 PolarHBondContact O-N 3.4Å; I108-C111 WeakPolarHBondContact O-CB 3.4Å; I108-C111 PolarHBondContact O-N 3.07Å; R109-C111 PolarHBondContact O-N 3.28Å; C111-E114 PolarHBondContact O-N 2.93Å; C111-L115 WeakPolarHBondContact O-CB 3.27Å; C111-L115 WeakPolarHBondContact O-CG 3.48Å; C111-L115 PolarHBondContact O-N 3.46Å
112	M	86.2	Confident	84.2	Confident	12 Å²	12	55.8 Å²	55.8	6%	0.059	30%	0.304	C	S	.	.	H	α-helix	trans	-64.5	-45.1	176.2	-72.7	-170.1	-57.8	0	0	112.1	I108 R109 E114 L115 Q116 L139 L140 E143	I108-M112 HydrophobicContact CG2-CE 4.16Å; I108-M112 HydrophobicContact CG2-CG 4.39Å; I108-M112 HydrophobicContact CG2-SD 4.3Å; I108-M112 WeakPolarHBondContact O-CG 3.46Å; I108-M112 PolarHBondContact O-N 3.31Å; R109-M112 HydrophobicContact CB-CE 4.39Å; R109-M112 HydrophobicContact CG-CE 3.84Å; R109-M112 PolarHBondContact O-N 3.4Å; R109-M112 VanDerWaalsContact O-N 3.1Å; M112-E114 VanDerWaalsContact C-N 3.32Å; M112-E114 PolarHBondContact O-N 3.37Å; M112-L115 PolarHBondContact O-N 3.41Å; M112-Q116 WeakPolarHBondContact O-CB 3.49Å; M112-Q116 VanDerWaalsContact O-CG 3.31Å; M112-Q116 WeakPolarHBondContact O-CG 3.46Å; M112-Q116 PolarHBondContact O-N 3.08Å; M112-L139 HydrophobicContact CG-CB 3.49Å; M112-L139 VanDerWaalsContact CG-CB 3.49Å; M112-L139 HydrophobicContact CG-CD1 3.74Å; M112-L139 HydrophobicContact CG-CG 4.28Å; M112-L139 HydrophobicContact SD-CB 3.68Å; M112-L140 HydrophobicContact CE-CD2 4.12Å; M112-L140 HydrophobicContact SD-CB 4.46Å; M112-L140 HydrophobicContact SD-CD2 3.67Å; M112-L140 HydrophobicContact SD-CG 3.82Å; M112-E143 HydrophobicContact CE-CB 4.46Å; M112-E143 WeakPolarHBondContact CE-OE2 3.43Å
113	E	85.8	Confident	82.5	Confident	110 Å²	110	54.5 Å²	54.5	51%	0.514	31%	0.313	S	S	.	.	H	α-helix	trans	-61.1	-42	177.4	-72.3	174.8	-167.7	0	0	111.2	R109 Q116 Q117	R109-E113 WeakPolarHBondContact O-CG 3.24Å; R109-E113 PolarHBondContact O-N 3.07Å; E113-Q116 PolarHBondContact O-N 3.38Å; E113-Q117 WeakPolarHBondContact O-CB 3.48Å; E113-Q117 VanDerWaalsContact O-CG 3.24Å; E113-Q117 WeakPolarHBondContact O-CG 3.37Å; E113-Q117 PolarHBondContact O-N 3.32Å
114	E	85	Confident	80.8	Confident	58 Å²	58	62 Å²	62	27%	0.271	34%	0.336	S	S	.	.	H	α-helix	trans	-64.1	-42.8	175.1	-172.6	173	-179.2	0	0	111.7	I66 K69 A110 C111 M112 Q117 V118	I66-E114 HydrophobicContact CG2-CB 4.25Å; I66-E114 HydrophobicContact CG2-CG 4.12Å; K69-E114 WeakPolarHBondContact CD-OE2 3.46Å; K69-E114 IonicContact NZ-OE1 3.85Å; K69-E114 PolarHBondContact NZ-OE1 3.09Å; K69-E114 IonicContact NZ-OE2 3.3Å; K69-E114 PolarHBondContact NZ-OE2 3.22Å; A110-E114 PolarHBondContact O-N 3.02Å; A110-E114 VanDerWaalsContact O-N 3.13Å; C111-E114 PolarHBondContact O-N 2.93Å; M112-E114 VanDerWaalsContact C-N 3.32Å; M112-E114 PolarHBondContact O-N 3.37Å; E114-Q117 PolarHBondContact O-N 2.72Å; E114-V118 WeakPolarHBondContact O-CB 3.27Å; E114-V118 VanDerWaalsContact O-CG2 3.28Å; E114-V118 WeakPolarHBondContact O-CG2 3.28Å; E114-V118 PolarHBondContact O-N 3.11Å
115	L	83.4	Confident	79.5	Confident	0 Å²	0	67.2 Å²	67.2	0%	0	36%	0.363	C	S	.	.	H	α-helix	trans	-61.5	-43.5	175.4	-78.4	164.4	0	0	0	112.1	I66 L67 C111 M112 V118 A119 Y132 V136 L139	I66-L115 HydrophobicContact CB-CD2 4.03Å; I66-L115 HydrophobicContact CB-CG 4.36Å; I66-L115 HydrophobicContact CD1-CD2 3.52Å; I66-L115 HydrophobicContact CD1-CG 4.24Å; I66-L115 HydrophobicContact CG1-CD2 4.38Å; I66-L115 HydrophobicContact CG2-CD2 4Å; I66-L115 HydrophobicContact CG2-CG 3.76Å; L67-L115 HydrophobicContact CD2-CD1 4.47Å; C111-L115 WeakPolarHBondContact O-CB 3.27Å; C111-L115 WeakPolarHBondContact O-CG 3.48Å; C111-L115 PolarHBondContact O-N 3.46Å; M112-L115 PolarHBondContact O-N 3.41Å; L115-V118 PolarHBondContact O-N 3.18Å; L115-A119 VanDerWaalsContact O-CB 3.23Å; L115-A119 WeakPolarHBondContact O-CB 3.35Å; L115-A119 PolarHBondContact O-N 3.22Å; L115-Y132 HydrophobicContact CD2-CD1 3.71Å; L115-Y132 HydrophobicContact CD2-CE1 4.25Å; L115-V136 HydrophobicContact CB-CG2 3.67Å; L115-V136 HydrophobicContact CD1-CG2 4.38Å; L115-L139 HydrophobicContact CD1-CD1 3.35Å
116	Q	83.1	Confident	78.3	Confident	97 Å²	97	72 Å²	72	45%	0.453	40%	0.395	S	S	.	.	H	α-helix	trans	-65.3	-41.1	177.6	-73.3	173.4	-15.9	0	0	111.8	M112 E113 A119 A120 V136	M112-Q116 WeakPolarHBondContact O-CB 3.49Å; M112-Q116 VanDerWaalsContact O-CG 3.31Å; M112-Q116 WeakPolarHBondContact O-CG 3.46Å; M112-Q116 PolarHBondContact O-N 3.08Å; E113-Q116 PolarHBondContact O-N 3.38Å; Q116-A119 PolarHBondContact O-N 2.84Å; Q116-A120 WeakPolarHBondContact O-CB 3.46Å; Q116-A120 PolarHBondContact O-N 3.23Å; Q116-V136 HydrophobicContact CG-CG1 4.13Å; Q116-V136 HydrophobicContact CG-CG2 4.08Å
117	Q	83.2	Confident	77.2	Confident	129 Å²	129	77.1 Å²	77.1	60%	0.603	41%	0.412	S	S	*	.	H	α-helix	trans	-63.3	-46.1	175.2	-74.4	174	20.7	0	0	111.6	E113 E114 A120 V121	E113-Q117 WeakPolarHBondContact O-CB 3.48Å; E113-Q117 VanDerWaalsContact O-CG 3.24Å; E113-Q117 WeakPolarHBondContact O-CG 3.37Å; E113-Q117 PolarHBondContact O-N 3.32Å; E114-Q117 PolarHBondContact O-N 2.72Å; Q117-A120 PolarHBondContact O-N 3.35Å; Q117-V121 WeakPolarHBondContact O-CG2 3.36Å; Q117-V121 PolarHBondContact O-N 2.98Å; Q117-V121 VanDerWaalsContact O-N 3.1Å
118	V	79.8	Confident	76	Confident	45 Å²	45	79.4 Å²	79.4	27%	0.273	42%	0.422	S	S	.	.	H	α-helix	trans	-65.1	-42	178	173.4	0	0	0	0	110.6	I66 E114 L115 A120 V121 S122 Y132	I66-V118 HydrophobicContact CD1-CB 4.18Å; I66-V118 HydrophobicContact CD1-CG1 4.27Å; I66-V118 HydrophobicContact CD1-CG2 4.05Å; E114-V118 WeakPolarHBondContact O-CB 3.27Å; E114-V118 VanDerWaalsContact O-CG2 3.28Å; E114-V118 WeakPolarHBondContact O-CG2 3.28Å; E114-V118 PolarHBondContact O-N 3.11Å; L115-V118 PolarHBondContact O-N 3.18Å; V118-A120 VanDerWaalsContact C-N 3.31Å; V118-A120 PolarHBondContact O-N 2.92Å; V118-V121 PolarHBondContact O-N 3.19Å; V118-S122 VanDerWaalsContact O-CB 3.26Å; V118-S122 WeakPolarHBondContact O-CB 3.42Å; V118-S122 PolarHBondContact O-N 2.84Å; V118-S122 PolarHBondContact O-OG 2.9Å; V118-Y132 HydrophobicContact CG1-CE2 4.34Å
119	A	74.4	Confident	75	Confident	29 Å²	29	80.8 Å²	80.8	24%	0.24	44%	0.436	C	S	.	.	H	α-helix	trans	-60.3	-39.5	175.2	0	0	0	0	0	112.3	L115 Q116	L115-A119 VanDerWaalsContact O-CB 3.23Å; L115-A119 WeakPolarHBondContact O-CB 3.35Å; L115-A119 PolarHBondContact O-N 3.22Å; Q116-A119 PolarHBondContact O-N 2.84Å
120	A	72.5	Confident	74.3	Confident	71 Å²	71	81.1 Å²	81.1	59%	0.587	45%	0.446	S	S	*	.	H	α-helix	trans	-67.6	-32.7	176.7	0	0	0	0	0	113.2	Q116 Q117 V118 T123	Q116-A120 WeakPolarHBondContact O-CB 3.46Å; Q116-A120 PolarHBondContact O-N 3.23Å; Q117-A120 PolarHBondContact O-N 3.35Å; V118-A120 VanDerWaalsContact C-N 3.31Å; V118-A120 PolarHBondContact O-N 2.92Å; A120-T123 WeakPolarHBondContact O-CG2 3.47Å
121	V	70.9	Confident	73.7	Confident	119 Å²	119	81.8 Å²	81.8	72%	0.721	44%	0.44	S	S	*	.	H	α-helix	trans	-83	-31.8	179.2	176.9	0	0	0	0	112.1	Q117 V118 T123	Q117-V121 WeakPolarHBondContact O-CG2 3.36Å; Q117-V121 PolarHBondContact O-N 2.98Å; Q117-V121 VanDerWaalsContact O-N 3.1Å; V118-V121 PolarHBondContact O-N 3.19Å; V121-T123 VanDerWaalsContact C-N 3.25Å; V121-T123 PolarHBondContact O-N 3.49Å
122	S	60.5	Low	73.1	Confident	46 Å²	46	82.9 Å²	82.9	32%	0.322	44%	0.443	S	S	.	.			trans	-83	22.7	-175.2	-69.1	0	0	0	0	115.3	V118 R124 D125	V118-S122 VanDerWaalsContact O-CB 3.26Å; V118-S122 WeakPolarHBondContact O-CB 3.42Å; V118-S122 PolarHBondContact O-N 2.84Å; V118-S122 PolarHBondContact O-OG 2.9Å; S122-R124 PolarHBondContact O-N 3.38Å; S122-D125 PolarHBondContact O-N 2.99Å
123	T	55.8	Low	72.7	Confident	117 Å²	117	83.8 Å²	83.8	72%	0.718	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	2.5	-177.6	43.5	0	0	0	0	116.9	A120 V121	A120-T123 WeakPolarHBondContact O-CG2 3.47Å; V121-T123 VanDerWaalsContact C-N 3.25Å; V121-T123 PolarHBondContact O-N 3.49Å
124	R	55.4	Low	72.4	Confident	232 Å²	232	83.3 Å²	83.3	88%	0.875	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.7	-21.5	178.1	-66.4	-174.6	177.9	-178.5	-0	114.2	S122	S122-R124 PolarHBondContact O-N 3.38Å
125	D	64.6	Low	72.2	Confident	109 Å²	109	81 Å²	81	58%	0.583	45%	0.446	S	S	*	.			trans	-122.7	102.4	180	-72.6	-34.9	0	0	0	111.4	S122 E127 M128 G129	S122-D125 PolarHBondContact O-N 2.99Å; D125-E127 VanDerWaalsContact C-N 3.3Å; D125-E127 PolarHBondContact O-N 3.2Å; D125-M128 HydrophobicContact CB-CB 4.16Å; D125-M128 HydrophobicContact CB-CG 4.19Å; D125-M128 PolarHBondContact O-N 2.82Å; D125-G129 PolarHBondContact O-N 3.45Å; D125-G129 VanDerWaalsContact O-N 3.14Å
126	T	67.7	Low	72.3	Confident	121 Å²	121	81.7 Å²	81.7	74%	0.742	45%	0.45	S	S	*	.	H	α-helix	trans	-60.7	-33.7	-176	-46.8	0	0	0	0	113.6	T130	T126-T130 PolarHBondContact O-N 3.47Å; T126-T130 VanDerWaalsContact O-N 3.13Å; T126-T130 PolarHBondContact O-OG1 3Å
127	E	68.8	Low	72.3	Confident	174 Å²	174	80.5 Å²	80.5	81%	0.813	45%	0.453	S	S	*	.	H	α-helix	trans	-68.4	-44.4	178.5	-69.8	-178.3	167.5	0	0	112	D125 T130 Q131	D125-E127 VanDerWaalsContact C-N 3.3Å; D125-E127 PolarHBondContact O-N 3.2Å; E127-T130 PolarHBondContact O-N 3.05Å; E127-Q131 PolarHBondContact O-N 3.4Å
128	M	65.9	Low	72.4	Confident	69 Å²	69	77.2 Å²	77.2	34%	0.34	44%	0.438	S	S	.	.	H	α-helix	trans	-65.2	-40.4	176.9	-71.2	-60.2	-52.6	0	0	111.6	D125 T130 Q131 Y132	D125-M128 HydrophobicContact CB-CB 4.16Å; D125-M128 HydrophobicContact CB-CG 4.19Å; D125-M128 PolarHBondContact O-N 2.82Å; M128-T130 VanDerWaalsContact C-N 3.31Å; M128-T130 PolarHBondContact O-N 2.99Å; M128-Q131 PolarHBondContact O-N 3.23Å; M128-Y132 HydrophobicContact CB-CE2 4.2Å; M128-Y132 HydrophobicContact CE-CE1 4.4Å; M128-Y132 HydrophobicContact CE-CE2 3.56Å; M128-Y132 VanDerWaalsContact CE-CZ 3.49Å; M128-Y132 VanDerWaalsContact CE-OH 3.25Å; M128-Y132 WeakPolarHBondContact CE-OH 3.43Å; M128-Y132 WeakPolarHBondContact O-CD2 2.99Å; M128-Y132 PolarHBondContact O-N 3.31Å
129	G	69.6	Low	72.7	Confident	28 Å²	28	75.4 Å²	75.4	29%	0.289	43%	0.427	S	S	.	.	H	α-helix	trans	-60.7	-38.9	175	0	0	0	0	0	112.9	D125 G133	D125-G129 PolarHBondContact O-N 3.45Å; D125-G129 VanDerWaalsContact O-N 3.14Å; G129-G133 PolarHBondContact O-N 3.28Å
130	T	73.6	Confident	73.3	Confident	79 Å²	79	77.6 Å²	77.6	49%	0.485	44%	0.435	S	S	.	.	H	α-helix	trans	-68	-40.8	177	-52.2	0	0	0	0	111.6	T126 E127 M128 G133 N134	T126-T130 PolarHBondContact O-N 3.47Å; T126-T130 VanDerWaalsContact O-N 3.13Å; T126-T130 PolarHBondContact O-OG1 3Å; E127-T130 PolarHBondContact O-N 3.05Å; M128-T130 VanDerWaalsContact C-N 3.31Å; M128-T130 PolarHBondContact O-N 2.99Å; T130-G133 PolarHBondContact O-N 3.43Å; T130-N134 PolarHBondContact O-N 2.81Å
131	Q	73.9	Confident	74	Confident	66 Å²	66	75.2 Å²	75.2	31%	0.308	42%	0.415	S	S	.	.	H	α-helix	trans	-62.7	-46.5	176.1	-172.3	179	20.4	0	0	112.1	E127 M128 G133 N134 Q135	E127-Q131 PolarHBondContact O-N 3.4Å; M128-Q131 PolarHBondContact O-N 3.23Å; Q131-G133 VanDerWaalsContact C-N 3.33Å; Q131-G133 PolarHBondContact O-N 3.5Å; Q131-N134 PolarHBondContact O-N 3.35Å; Q131-Q135 WeakPolarHBondContact O-CG 3.49Å; Q131-Q135 PolarHBondContact O-N 3.38Å
132	Y	75.6	Confident	75	Confident	30 Å²	30	69.8 Å²	69.8	12%	0.118	38%	0.382	C	S	.	.	H	α-helix	trans	-65.6	-36.7	176.4	-66.1	-53.5	0	0	0	112.2	I66 L115 V118 M128 Q135 V136	I66-Y132 HydrophobicContact CD1-CE1 4.31Å; L115-Y132 HydrophobicContact CD2-CD1 3.71Å; L115-Y132 HydrophobicContact CD2-CE1 4.25Å; V118-Y132 HydrophobicContact CG1-CE2 4.34Å; M128-Y132 HydrophobicContact CB-CE2 4.2Å; M128-Y132 HydrophobicContact CE-CE1 4.4Å; M128-Y132 HydrophobicContact CE-CE2 3.56Å; M128-Y132 VanDerWaalsContact CE-CZ 3.49Å; M128-Y132 VanDerWaalsContact CE-OH 3.25Å; M128-Y132 WeakPolarHBondContact CE-OH 3.43Å; M128-Y132 WeakPolarHBondContact O-CD2 2.99Å; M128-Y132 PolarHBondContact O-N 3.31Å; Y132-Q135 PolarHBondContact O-N 2.9Å; Y132-V136 WeakPolarHBondContact O-CG2 3.46Å; Y132-V136 PolarHBondContact O-N 3.19Å
133	G	77.5	Confident	76.4	Confident	31 Å²	31	67.8 Å²	67.8	32%	0.32	37%	0.367	S	S	.	.	H	α-helix	trans	-58.6	-46.8	173.2	0	0	0	0	0	112.3	G129 T130 Q131 Q135 V136 S137	G129-G133 PolarHBondContact O-N 3.28Å; T130-G133 PolarHBondContact O-N 3.43Å; Q131-G133 VanDerWaalsContact C-N 3.33Å; Q131-G133 PolarHBondContact O-N 3.5Å; G133-Q135 PolarHBondContact O-N 3.26Å; G133-V136 PolarHBondContact O-N 3.05Å; G133-S137 PolarHBondContact O-N 3.38Å; G133-S137 PolarHBondContact O-OG 3.03Å
134	N	79.8	Confident	78.1	Confident	99 Å²	99	62.6 Å²	62.6	53%	0.529	34%	0.335	S	S	.	.	H	α-helix	trans	-62.2	-41.8	175.9	-69	-13.3	0	0	0	111.9	T130 Q131 V136 S137 I138	T130-N134 PolarHBondContact O-N 2.81Å; Q131-N134 PolarHBondContact O-N 3.35Å; N134-V136 PolarHBondContact O-N 3.37Å; N134-S137 PolarHBondContact O-N 3.37Å; N134-I138 WeakPolarHBondContact O-CG1 3.4Å; N134-I138 PolarHBondContact O-N 2.75Å
135	Q	80.8	Confident	79.8	Confident	10 Å²	10	51.5 Å²	51.5	5%	0.047	29%	0.293	C	S	.	.	H	α-helix	trans	-63	-40.6	176.1	-73.9	-179.4	-12.6	0	0	112.4	D61 Q131 Y132 G133 I138 L139	D61-Q135 PolarHBondContact OD1-NE2 3.06Å; Q131-Q135 WeakPolarHBondContact O-CG 3.49Å; Q131-Q135 PolarHBondContact O-N 3.38Å; Y132-Q135 PolarHBondContact O-N 2.9Å; G133-Q135 PolarHBondContact O-N 3.26Å; Q135-I138 PolarHBondContact O-N 3.39Å; Q135-L139 WeakPolarHBondContact O-CG 3.49Å; Q135-L139 PolarHBondContact O-N 2.98Å
136	V	84.1	Confident	81.2	Confident	14 Å²	14	46.3 Å²	46.3	9%	0.085	27%	0.265	C	S	.	.	H	α-helix	trans	-63.1	-44.2	174.9	171.2	0	0	0	0	110.6	L115 Q116 Y132 G133 N134 I138 L139 L140	L115-V136 HydrophobicContact CB-CG2 3.67Å; L115-V136 HydrophobicContact CD1-CG2 4.38Å; Q116-V136 HydrophobicContact CG-CG1 4.13Å; Q116-V136 HydrophobicContact CG-CG2 4.08Å; Y132-V136 WeakPolarHBondContact O-CG2 3.46Å; Y132-V136 PolarHBondContact O-N 3.19Å; G133-V136 PolarHBondContact O-N 3.05Å; N134-V136 PolarHBondContact O-N 3.37Å; V136-I138 VanDerWaalsContact C-N 3.33Å; V136-I138 PolarHBondContact O-N 2.99Å; V136-L139 PolarHBondContact O-N 3.16Å; V136-L140 HydrophobicContact CG1-CD1 4.01Å; V136-L140 HydrophobicContact CG1-CG 4.34Å; V136-L140 WeakPolarHBondContact O-CB 3.27Å; V136-L140 WeakPolarHBondContact O-CG 3.44Å; V136-L140 PolarHBondContact O-N 3.17Å
137	S	83.9	Confident	82.4	Confident	73 Å²	73	40.8 Å²	40.8	51%	0.51	23%	0.231	S	C	.	.	H	α-helix	trans	-59.5	-41.8	176.2	-61.7	0	0	0	0	112.5	G133 N134 L140 A141	G133-S137 PolarHBondContact O-N 3.38Å; G133-S137 PolarHBondContact O-OG 3.03Å; N134-S137 PolarHBondContact O-N 3.37Å; S137-L140 PolarHBondContact O-N 2.96Å; S137-A141 PolarHBondContact O-N 3.43Å
138	I	84.8	Confident	83.5	Confident	59 Å²	59	32.5 Å²	32.5	30%	0.303	19%	0.193	S	C	.	.	H	α-helix	trans	-65	-43.6	176.2	-66.7	165.5	0	0	0	110.9	N134 Q135 V136 L140 A141 I142 L368	N134-I138 WeakPolarHBondContact O-CG1 3.4Å; N134-I138 PolarHBondContact O-N 2.75Å; Q135-I138 PolarHBondContact O-N 3.39Å; V136-I138 VanDerWaalsContact C-N 3.33Å; V136-I138 PolarHBondContact O-N 2.99Å; I138-L140 VanDerWaalsContact C-N 3.34Å; I138-L140 PolarHBondContact O-N 2.69Å; I138-A141 PolarHBondContact O-N 3.31Å; I138-I142 HydrophobicContact CG2-CD1 3.95Å; I138-I142 WeakPolarHBondContact O-CB 3.39Å; I138-I142 WeakPolarHBondContact O-CG1 3.27Å; I138-I142 PolarHBondContact O-N 3.48Å; I138-L368 HydrophobicContact CG2-CD2 4.27Å
139	L	86.6	Confident	84.7	Confident	8 Å²	8	29.3 Å²	29.3	4%	0.042	18%	0.177	C	C	.	.	H	α-helix	trans	-66.4	-34.9	177.7	-70.7	176	0	0	0	112.7	L67 L70 I108 M112 L115 Q135 V136 I142 E143	L67-L139 HydrophobicContact CD2-CD1 4.07Å; L67-L139 HydrophobicContact CD2-CD2 4.3Å; L70-L139 HydrophobicContact CD2-CD2 4.01Å; I108-L139 HydrophobicContact CG2-CB 4.39Å; I108-L139 HydrophobicContact CG2-CD2 4.44Å; M112-L139 HydrophobicContact CG-CB 3.49Å; M112-L139 VanDerWaalsContact CG-CB 3.49Å; M112-L139 HydrophobicContact CG-CD1 3.74Å; M112-L139 HydrophobicContact CG-CG 4.28Å; M112-L139 HydrophobicContact SD-CB 3.68Å; L115-L139 HydrophobicContact CD1-CD1 3.35Å; Q135-L139 WeakPolarHBondContact O-CG 3.49Å; Q135-L139 PolarHBondContact O-N 2.98Å; V136-L139 PolarHBondContact O-N 3.16Å; L139-I142 HydrophobicContact CD2-CD1 4.3Å; L139-I142 WeakPolarHBondContact O-CB 3.24Å; L139-I142 PolarHBondContact O-N 2.74Å; L139-E143 PolarHBondContact O-N 3.32Å
140	L	87.1	Confident	85.7	Confident	75 Å²	75	28.4 Å²	28.4	39%	0.393	17%	0.165	S	C	.	.	H	α-helix	trans	-63.6	-43.9	172.8	-74.9	170.3	0	0	0	111.1	M112 V136 S137 I138 E143 L144	M112-L140 HydrophobicContact CE-CD2 4.12Å; M112-L140 HydrophobicContact SD-CB 4.46Å; M112-L140 HydrophobicContact SD-CD2 3.67Å; M112-L140 HydrophobicContact SD-CG 3.82Å; V136-L140 HydrophobicContact CG1-CD1 4.01Å; V136-L140 HydrophobicContact CG1-CG 4.34Å; V136-L140 WeakPolarHBondContact O-CB 3.27Å; V136-L140 WeakPolarHBondContact O-CG 3.44Å; V136-L140 PolarHBondContact O-N 3.17Å; S137-L140 PolarHBondContact O-N 2.96Å; I138-L140 VanDerWaalsContact C-N 3.34Å; I138-L140 PolarHBondContact O-N 2.69Å; L140-E143 PolarHBondContact O-N 2.99Å; L140-L144 VanDerWaalsContact O-CB 3.28Å; L140-L144 WeakPolarHBondContact O-CB 3.42Å; L140-L144 PolarHBondContact O-N 3.01Å
141	A	88.1	Confident	86.4	Confident	20 Å²	20	25 Å²	25	17%	0.165	14%	0.144	C	C	.	.	H	α-helix	trans	-62	-43.4	174.2	0	0	0	0	0	111.5	S137 I138 L144 I145 L345 L368	S137-A141 PolarHBondContact O-N 3.43Å; I138-A141 PolarHBondContact O-N 3.31Å; A141-L144 PolarHBondContact O-N 3.42Å; A141-I145 WeakPolarHBondContact O-CD1 3.38Å; A141-I145 VanDerWaalsContact O-CG1 3.23Å; A141-I145 WeakPolarHBondContact O-CG1 3.37Å; A141-I145 PolarHBondContact O-N 2.69Å; A141-L345 HydrophobicContact CB-CD1 4.21Å; A141-L345 HydrophobicContact CB-CD2 4.45Å; A141-L368 HydrophobicContact CB-CD2 4.5Å
142	I	89.9	Confident	87.1	Confident	5 Å²	5	22.2 Å²	22.2	3%	0.026	13%	0.132	C	C	.	.	H	α-helix	trans	-57.4	-49.4	173.9	-80.6	167.1	0	0	0	111.3	I108 I138 L139 L144 W146 L368 W372 F373	I108-I142 HydrophobicContact CD1-CG2 3.75Å; I108-I142 HydrophobicContact CG1-CG2 4.35Å; I138-I142 HydrophobicContact CG2-CD1 3.95Å; I138-I142 WeakPolarHBondContact O-CB 3.39Å; I138-I142 WeakPolarHBondContact O-CG1 3.27Å; I138-I142 PolarHBondContact O-N 3.48Å; L139-I142 HydrophobicContact CD2-CD1 4.3Å; L139-I142 WeakPolarHBondContact O-CB 3.24Å; L139-I142 PolarHBondContact O-N 2.74Å; I142-L144 VanDerWaalsContact C-N 3.32Å; I142-L144 PolarHBondContact O-N 3.4Å; I142-W146 WeakPolarHBondContact O-CB 3.36Å; I142-W146 PolarHBondContact O-N 3.32Å; I142-L368 HydrophobicContact CD1-CD1 4.46Å; I142-L368 HydrophobicContact CG1-CD1 3.75Å; I142-L368 HydrophobicContact CG1-CD2 3.93Å; I142-L368 HydrophobicContact CG1-CG 4.38Å; I142-W372 HydrophobicContact CG2-CZ3 3.78Å; I142-F373 HydrophobicContact CB-CD2 4.3Å; I142-F373 HydrophobicContact CG1-CB 4.44Å; I142-F373 HydrophobicContact CG1-CD2 4.1Å; I142-F373 HydrophobicContact CG2-CD2 3.88Å; I142-F373 HydrophobicContact CG2-CE2 4.43Å
143	E	90.8	Very high	87.7	Confident	5 Å²	5	21.6 Å²	21.6	2%	0.023	13%	0.129	C	C	.	.	H	α-helix	trans	-64.8	-39.5	-179.9	-155.6	-151.4	145.2	0	0	111.5	R105 I108 R109 M112 L139 L140 W146 N147 H173	R105-E143 HydrophobicContact CG-CG 4.5Å; R105-E143 IonicContact CZ-OE1 2.73Å; R105-E143 IonicContact NE-OE1 3.47Å; R105-E143 IonicContact NH2-OE1 3.28Å; R105-E143 PolarHBondContact NH2-OE1 3.2Å; I108-E143 HydrophobicContact CG2-CB 4.11Å; I108-E143 HydrophobicContact CG2-CG 4.38Å; R109-E143 VanDerWaalsContact CG-OE2 3.25Å; R109-E143 WeakPolarHBondContact CG-OE2 3.49Å; R109-E143 IonicContact CZ-OE1 3.07Å; R109-E143 IonicContact CZ-OE2 3.59Å; R109-E143 VanDerWaalsContact NE-CD 3.26Å; R109-E143 IonicContact NE-OE1 2.83Å; R109-E143 PolarHBondContact NE-OE1 2.95Å; R109-E143 IonicContact NE-OE2 2.85Å; R109-E143 PolarHBondContact NE-OE2 3.21Å; R109-E143 VanDerWaalsContact NE-OE2 3.09Å; R109-E143 IonicContact NH2-OE1 3.7Å; R109-E143 PolarHBondContact NH2-OE1 3.43Å; R109-E143 IonicContact NH2-OE2 2.82Å; M112-E143 HydrophobicContact CE-CB 4.46Å; M112-E143 WeakPolarHBondContact CE-OE2 3.43Å; L139-E143 PolarHBondContact O-N 3.32Å; L140-E143 PolarHBondContact O-N 2.99Å; E143-W146 PolarHBondContact O-N 3.08Å; E143-N147 VanDerWaalsContact O-CB 3.23Å; E143-N147 WeakPolarHBondContact O-CB 3.5Å; E143-N147 PolarHBondContact O-N 3.14Å; E143-H173 IonicContact OE1-NE2 3.56Å
144	L	91.3	Very high	88	Confident	7 Å²	7	20.4 Å²	20.4	4%	0.037	12%	0.116	C	C	.	.	H	α-helix	trans	-59.7	-53	178.5	-177.6	73	0	0	0	111.7	L140 A141 I142 L148 W169 H173 Y305 L345 L349	L140-L144 VanDerWaalsContact O-CB 3.28Å; L140-L144 WeakPolarHBondContact O-CB 3.42Å; L140-L144 PolarHBondContact O-N 3.01Å; A141-L144 PolarHBondContact O-N 3.42Å; I142-L144 VanDerWaalsContact C-N 3.32Å; I142-L144 PolarHBondContact O-N 3.4Å; L144-L148 PolarHBondContact O-N 2.87Å; L144-W169 HydrophobicContact CD1-CH2 4.38Å; L144-W169 HydrophobicContact CD1-CZ2 3.43Å; L144-W169 VanDerWaalsContact CD1-CZ2 3.43Å; L144-W169 HydrophobicContact CG-CZ2 3.89Å; L144-W169 PolarHBondContact O-NE1 3.38Å; L144-H173 VanDerWaalsContact CA-NE2 3.29Å; L144-H173 WeakPolarHBondContact CA-NE2 3.49Å; L144-H173 HydrophobicContact CD1-CB 3.81Å; L144-H173 WeakPolarHBondContact CD1-ND1 3.3Å; L144-H173 PolarHBondContact N-NE2 2.76Å; L144-Y305 HydrophobicContact CD1-CE2 4.41Å; L144-Y305 HydrophobicContact CD2-CE1 4.27Å; L144-L345 HydrophobicContact CD2-CD1 4.44Å; L144-L345 HydrophobicContact CD2-CD2 4.02Å; L144-L349 HydrophobicContact CD2-CD1 4.12Å; L144-L349 HydrophobicContact CD2-CD2 4.39Å; L144-L349 HydrophobicContact CG-CD2 4.43Å
145	I	91.6	Very high	88.2	Confident	0 Å²	0	18.1 Å²	18.1	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-66.9	-42.8	-179.9	-57.9	158.1	0	0	0	109.7	A141 N147 L148 C149 L345 I348 L349 V360 F373	A141-I145 WeakPolarHBondContact O-CD1 3.38Å; A141-I145 VanDerWaalsContact O-CG1 3.23Å; A141-I145 WeakPolarHBondContact O-CG1 3.37Å; A141-I145 PolarHBondContact O-N 2.69Å; I145-N147 PolarHBondContact O-N 3.27Å; I145-L148 PolarHBondContact O-N 2.95Å; I145-C149 WeakPolarHBondContact O-CB 3.47Å; I145-C149 PolarHBondContact O-N 3.12Å; I145-C149 PolarHBondContact O-SG 2.68Å; I145-L345 HydrophobicContact CD1-CD1 3.61Å; I145-L345 HydrophobicContact CG1-CD1 3.7Å; I145-I348 HydrophobicContact CD1-CD1 4.17Å; I145-I348 HydrophobicContact CD1-CG2 3.85Å; I145-I348 HydrophobicContact CG1-CG2 3.96Å; I145-I348 HydrophobicContact CG2-CG2 3.76Å; I145-L349 HydrophobicContact CG1-CD2 4.34Å; I145-V360 HydrophobicContact CG2-CG1 4.29Å; I145-F373 HydrophobicContact CB-CE2 4.33Å; I145-F373 HydrophobicContact CB-CZ 3.98Å; I145-F373 HydrophobicContact CG2-CE1 4.28Å; I145-F373 HydrophobicContact CG2-CE2 4.42Å; I145-F373 HydrophobicContact CG2-CZ 3.59Å
146	W	93.4	Very high	88.3	Confident	0 Å²	0	19.9 Å²	19.9	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-60.4	-47.7	179	-167	-70.7	0	0	0	111.6	S101 Y104 R105 I142 E143 L148 C149 E150 W372 F373 H376 L377 L380	S101-W146 PolarHBondContact OG-NE1 3.19Å; Y104-W146 HydrophobicContact CD2-CH2 4.09Å; Y104-W146 AromaticContact CD2-CZ2 3.58Å; Y104-W146 HydrophobicContact CD2-CZ2 3.58Å; Y104-W146 HydrophobicContact CE2-CH2 4.47Å; Y104-W146 HydrophobicContact CE2-CZ2 4.27Å; Y104-W146 HydrophobicContact CG-CH2 4.11Å; Y104-W146 AromaticContact CG-CZ2 3.77Å; Y104-W146 HydrophobicContact CG-CZ2 3.77Å; R105-W146 HydrophobicContact CG-CG 4.27Å; I142-W146 WeakPolarHBondContact O-CB 3.36Å; I142-W146 PolarHBondContact O-N 3.32Å; E143-W146 PolarHBondContact O-N 3.08Å; W146-L148 VanDerWaalsContact C-N 3.33Å; W146-L148 PolarHBondContact O-N 3.17Å; W146-C149 PolarHBondContact O-N 3.18Å; W146-E150 PolarHBondContact O-N 3.16Å; W146-W372 HydrophobicContact CZ3-CH2 4.49Å; W146-W372 HydrophobicContact CZ3-CZ3 4.48Å; W146-F373 HydrophobicContact CB-CE2 4.01Å; W146-F373 HydrophobicContact CD2-CE2 4.45Å; W146-F373 AromaticContact CE3-CD2 3.76Å; W146-F373 HydrophobicContact CE3-CD2 3.76Å; W146-F373 AromaticContact CE3-CE2 3.66Å; W146-F373 HydrophobicContact CE3-CE2 3.66Å; W146-F373 HydrophobicContact CE3-CZ 4.5Å; W146-F373 HydrophobicContact CZ3-CD2 4.34Å; W146-H376 HydrophobicContact CH2-CB 3.81Å; W146-H376 HydrophobicContact CZ3-CB 4.1Å; W146-L377 HydrophobicContact CD2-CD1 4.42Å; W146-L377 HydrophobicContact CE3-CB 4.21Å; W146-L377 HydrophobicContact CE3-CD1 4.38Å; W146-L377 HydrophobicContact CH2-CB 4.12Å; W146-L377 HydrophobicContact CH2-CD1 4.47Å; W146-L377 HydrophobicContact CZ3-CB 3.71Å; W146-L377 HydrophobicContact CZ3-CD1 4.41Å; W146-L380 HydrophobicContact CZ2-CD2 3.87Å
147	N	92.4	Very high	88.1	Confident	5 Å²	5	19.5 Å²	19.5	3%	0.027	12%	0.118	C	C	.	.	H	α-helix	trans	-63.7	-40	178.8	-172.9	10.7	0	0	0	111	R105 E143 I145 C149 E150 V151 H173	R105-N147 VanDerWaalsContact CZ-ND2 3.29Å; R105-N147 PolarHBondContact NH1-ND2 3.31Å; R105-N147 PolarHBondContact NH1-OD1 3.19Å; R105-N147 PolarHBondContact NH2-ND2 3.18Å; E143-N147 VanDerWaalsContact O-CB 3.23Å; E143-N147 WeakPolarHBondContact O-CB 3.5Å; E143-N147 PolarHBondContact O-N 3.14Å; I145-N147 PolarHBondContact O-N 3.27Å; N147-C149 VanDerWaalsContact C-N 3.33Å; N147-C149 PolarHBondContact O-N 3.34Å; N147-E150 WeakPolarHBondContact O-CB 3.41Å; N147-E150 PolarHBondContact O-N 3.02Å; N147-V151 WeakPolarHBondContact O-CG2 3.26Å; N147-V151 PolarHBondContact O-N 3.12Å; N147-H173 PolarHBondContact ND2-CE1 3.13Å
148	L	91.8	Very high	88	Confident	0 Å²	0	20.1 Å²	20.1	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-61.5	-44.1	174.7	-175.2	61.5	0	0	0	111.4	L144 I145 W146 E150 V151 L152 L166 W169 L349 A352 F353	L144-L148 PolarHBondContact O-N 2.87Å; I145-L148 PolarHBondContact O-N 2.95Å; W146-L148 VanDerWaalsContact C-N 3.33Å; W146-L148 PolarHBondContact O-N 3.17Å; L148-E150 VanDerWaalsContact C-N 3.34Å; L148-E150 PolarHBondContact O-N 3.44Å; L148-V151 PolarHBondContact O-N 3.3Å; L148-L152 HydrophobicContact CD1-CD1 3.72Å; L148-L152 HydrophobicContact CD1-CG 3.91Å; L148-L152 HydrophobicContact CD2-CD1 4.33Å; L148-L152 HydrophobicContact CG-CD1 3.76Å; L148-L152 HydrophobicContact CG-CG 4.24Å; L148-L152 WeakPolarHBondContact O-CB 3.27Å; L148-L152 WeakPolarHBondContact O-CG 3.25Å; L148-L152 PolarHBondContact O-N 2.89Å; L148-L166 HydrophobicContact CD1-CD2 3.99Å; L148-W169 HydrophobicContact CB-CZ2 4.12Å; L148-W169 HydrophobicContact CD1-CD2 4.43Å; L148-W169 HydrophobicContact CD1-CH2 4.46Å; L148-W169 HydrophobicContact CD1-CZ2 4.25Å; L148-W169 HydrophobicContact CD2-CH2 4.46Å; L148-W169 HydrophobicContact CD2-CZ2 4.16Å; L148-W169 HydrophobicContact CG-CZ2 4.41Å; L148-L349 HydrophobicContact CD2-CD2 3.61Å; L148-A352 HydrophobicContact CD2-CB 3.74Å; L148-A352 HydrophobicContact CG-CB 4.33Å; L148-F353 HydrophobicContact CD1-CE1 3.8Å; L148-F353 HydrophobicContact CD1-CZ 3.99Å; L148-F353 HydrophobicContact CD2-CE1 4.32Å; L148-F353 HydrophobicContact CD2-CE2 4.21Å; L148-F353 HydrophobicContact CD2-CZ 4.04Å
149	C	91.2	Very high	87.7	Confident	1 Å²	1	18.2 Å²	18.2	1%	0.007	11%	0.114	C	C	.	.	H	α-helix	trans	-64.3	-37.9	176.8	-66.9	0	0	0	0	112.4	I145 W146 N147 F153 I154 L377	I145-C149 WeakPolarHBondContact O-CB 3.47Å; I145-C149 PolarHBondContact O-N 3.12Å; I145-C149 PolarHBondContact O-SG 2.68Å; W146-C149 PolarHBondContact O-N 3.18Å; N147-C149 VanDerWaalsContact C-N 3.33Å; N147-C149 PolarHBondContact O-N 3.34Å; C149-F153 HydrophobicContact CB-CD2 3.87Å; C149-F153 HydrophobicContact CB-CE2 4.32Å; C149-F153 WeakPolarHBondContact O-CB 3.42Å; C149-F153 PolarHBondContact O-N 3.27Å; C149-I154 PolarHBondContact O-N 3.13Å; C149-L377 HydrophobicContact CB-CD1 4.15Å; C149-L377 HydrophobicContact CB-CD2 4.42Å
150	E	91.6	Very high	87.3	Confident	9 Å²	9	18 Å²	18	4%	0.042	11%	0.113	C	C	.	.	I	π-helix	trans	-57.7	-48.3	173.1	-178.2	-177.8	131.4	0	0	110.7	S101 R102 R105 W146 N147 L148 I154 D155	S101-E150 WeakPolarHBondContact CB-OE2 3.08Å; S101-E150 WeakPolarHBondContact OG-CG 3.49Å; S101-E150 PolarHBondContact OG-OE2 3.2Å; R102-E150 IonicContact NE-OE1 3.13Å; R105-E150 WeakPolarHBondContact CD-OE2 3.43Å; R105-E150 IonicContact NH1-OE1 2.78Å; R105-E150 IonicContact NH1-OE2 2.93Å; W146-E150 PolarHBondContact O-N 3.16Å; N147-E150 WeakPolarHBondContact O-CB 3.41Å; N147-E150 PolarHBondContact O-N 3.02Å; L148-E150 VanDerWaalsContact C-N 3.34Å; L148-E150 PolarHBondContact O-N 3.44Å; E150-I154 WeakPolarHBondContact O-CB 3.33Å; E150-I154 PolarHBondContact O-N 3.2Å; E150-D155 WeakPolarHBondContact O-CB 3.43Å; E150-D155 PolarHBondContact O-N 2.9Å
151	V	89.2	Confident	87.2	Confident	8 Å²	8	14.9 Å²	14.9	5%	0.048	10%	0.097	C	C	.	.	I	π-helix	trans	-67.4	-48.1	-178.6	172.3	0	0	0	0	111.9	N147 L148 A156 L162 H165 L166	N147-V151 WeakPolarHBondContact O-CG2 3.26Å; N147-V151 PolarHBondContact O-N 3.12Å; L148-V151 PolarHBondContact O-N 3.3Å; V151-A156 PolarHBondContact O-N 3.19Å; V151-L162 HydrophobicContact CG1-CD1 3.79Å; V151-H165 HydrophobicContact CB-CB 4.43Å; V151-H165 HydrophobicContact CG1-CB 3.58Å; V151-H165 HydrophobicContact CG2-CB 3.95Å; V151-L166 HydrophobicContact CG1-CD2 4.45Å
152	L	88.4	Confident	87.1	Confident	8 Å²	8	14 Å²	14	4%	0.042	9%	0.09	C	C	.	.	I	π-helix	trans	-77.5	-42.4	-173.2	-64.8	-178.5	0	0	0	113.1	L148 L162 L324 A352 F353 F355	L148-L152 HydrophobicContact CD1-CD1 3.72Å; L148-L152 HydrophobicContact CD1-CG 3.91Å; L148-L152 HydrophobicContact CD2-CD1 4.33Å; L148-L152 HydrophobicContact CG-CD1 3.76Å; L148-L152 HydrophobicContact CG-CG 4.24Å; L148-L152 WeakPolarHBondContact O-CB 3.27Å; L148-L152 WeakPolarHBondContact O-CG 3.25Å; L148-L152 PolarHBondContact O-N 2.89Å; L152-L162 HydrophobicContact CD2-CD1 3.9Å; L152-L324 HydrophobicContact CD2-CD2 3.92Å; L152-A352 HydrophobicContact CD1-CB 4.32Å; L152-A352 WeakPolarHBondContact CD1-O 3.39Å; L152-F353 HydrophobicContact CD1-CD1 4.06Å; L152-F353 HydrophobicContact CD1-CE1 4.44Å; L152-F355 HydrophobicContact CB-CE1 4.22Å; L152-F355 HydrophobicContact CD2-CZ 4.18Å
153	F	86.9	Confident	87	Confident	16 Å²	16	14.2 Å²	14.2	7%	0.07	9%	0.091	C	C	.	.	I	π-helix	trans	-105.7	-44.3	-168.7	-56.1	-64.3	0	0	0	113.3	C149 F355 I357 L381 L386	C149-F153 HydrophobicContact CB-CD2 3.87Å; C149-F153 HydrophobicContact CB-CE2 4.32Å; C149-F153 WeakPolarHBondContact O-CB 3.42Å; C149-F153 PolarHBondContact O-N 3.27Å; F153-F355 HydrophobicContact CD1-CD1 4.07Å; F153-F355 HydrophobicContact CE1-CB 4.1Å; F153-F355 AromaticContact CE1-CD1 3.6Å; F153-F355 HydrophobicContact CE1-CD1 3.6Å; F153-F355 HydrophobicContact CE1-CE1 4.36Å; F153-F355 HydrophobicContact CE1-CG 4.18Å; F153-F355 HydrophobicContact CZ-CD1 4.49Å; F153-I357 HydrophobicContact CD1-CD1 3.74Å; F153-I357 HydrophobicContact CD1-CG1 3.83Å; F153-I357 HydrophobicContact CD2-CG1 4.43Å; F153-I357 HydrophobicContact CE1-CD1 3.88Å; F153-I357 HydrophobicContact CE1-CG1 3.47Å; F153-I357 VanDerWaalsContact CE1-CG1 3.47Å; F153-I357 HydrophobicContact CE2-CG1 4.15Å; F153-I357 HydrophobicContact CG-CD1 4.22Å; F153-I357 HydrophobicContact CG-CG1 4.31Å; F153-I357 HydrophobicContact CZ-CD1 4.49Å; F153-I357 HydrophobicContact CZ-CG1 3.67Å; F153-L381 HydrophobicContact CB-CD2 4.05Å; F153-L386 HydrophobicContact CB-CD1 3.98Å; F153-L386 WeakPolarHBondContact O-CD1 3.48Å
154	I	84.6	Confident	86.8	Confident	6 Å²	6	15.9 Å²	15.9	3%	0.031	10%	0.1	C	C	.	.	I	π-helix	trans	-82.8	-55.4	-171.8	-55.5	179.9	0	0	0	111	F97 V98 C149 E150 L380 L381	F97-I154 HydrophobicContact CB-CG2 3.93Å; V98-I154 HydrophobicContact CG2-CG2 3.89Å; C149-I154 PolarHBondContact O-N 3.13Å; E150-I154 WeakPolarHBondContact O-CB 3.33Å; E150-I154 PolarHBondContact O-N 3.2Å; I154-L380 HydrophobicContact CD1-CD2 3.5Å; I154-L380 VanDerWaalsContact CD1-CD2 3.5Å; I154-L380 HydrophobicContact CD1-CG 3.94Å; I154-L381 HydrophobicContact CG1-CD2 4.36Å
155	D	84.4	Confident	86.6	Confident	52 Å²	52	18.2 Å²	18.2	28%	0.278	11%	0.111	S	C	.	.	I	π-helix	trans	-73.3	-36.5	176.3	-169.7	40	0	0	0	110.7	V98 E150 A157 H165	V98-D155 HydrophobicContact CG2-CB 4.03Å; E150-D155 WeakPolarHBondContact O-CB 3.43Å; E150-D155 PolarHBondContact O-N 2.9Å; D155-A157 VanDerWaalsContact C-N 3.26Å; D155-A157 PolarHBondContact O-N 3.23Å; D155-H165 IonicContact OD2-CE1 2.7Å; D155-H165 PolarHBondContact OD2-CE1 2.88Å; D155-H165 IonicContact OD2-ND1 2.68Å; D155-H165 PolarHBondContact OD2-ND1 3.28Å; D155-H165 IonicContact OD2-NE2 3.92Å
156	A	82.6	Confident	86.5	Confident	47 Å²	47	18.2 Å²	18.2	39%	0.388	11%	0.111	S	C	.	.			trans	48.2	50.2	177.3	0	0	0	0	0	111.4	V151	V151-A156 PolarHBondContact O-N 3.19Å
157	A	80.6	Confident	86.3	Confident	6 Å²	6	18.5 Å²	18.5	5%	0.05	11%	0.112	C	C	.	.	P	Polyproline II helix	trans	-60.1	138	-173	0	0	0	0	0	111.5	D155 L162 H165	D155-A157 VanDerWaalsContact C-N 3.26Å; D155-A157 PolarHBondContact O-N 3.23Å; A157-L162 HydrophobicContact CB-CB 4.48Å; A157-H165 WeakPolarHBondContact CB-ND1 3.33Å
158	P	81.5	Confident	86	Confident	85 Å²	85	21.7 Å²	21.7	55%	0.552	13%	0.129	S	C	*	.	P	Polyproline II helix	trans	-67	167.3	177.2	29.4	-34.9	0	0	0	111.6	G160 S161 L162	P158-G160 PolarHBondContact O-N 3.25Å; P158-S161 PolarHBondContact O-N 3.2Å; P158-L162 PolarHBondContact O-N 3.2Å
159	A	77.4	Confident	86	Confident	20 Å²	20	21.8 Å²	21.8	17%	0.165	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.1	141	174.1	0	0	0	0	0	111.3	S161 L251	A159-S161 VanDerWaalsContact C-N 3.33Å; A159-S161 PolarHBondContact O-N 3.23Å; A159-L251 HydrophobicContact CB-CD1 4.32Å; A159-L251 HydrophobicContact CB-CD2 4.23Å; A159-L251 WeakPolarHBondContact O-CD1 3.4Å
160	G	78.8	Confident	85.8	Confident	3 Å²	3	21.9 Å²	21.9	3%	0.031	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	87.6	-58.2	-170.9	0	0	0	0	0	113	P158 L162 L163	P158-G160 PolarHBondContact O-N 3.25Å; G160-L162 VanDerWaalsContact C-N 3.31Å; G160-L162 PolarHBondContact O-N 3.48Å; G160-L163 PolarHBondContact O-N 3.29Å
161	S	84.4	Confident	85.5	Confident	9 Å²	9	24.7 Å²	24.7	6%	0.063	14%	0.141	C	C	.	.	H	α-helix	trans	-64.5	-35.5	175.9	-64.5	0	0	0	0	112.6	P158 A159 L163 L164 H165 P245	P158-S161 PolarHBondContact O-N 3.2Å; A159-S161 VanDerWaalsContact C-N 3.33Å; A159-S161 PolarHBondContact O-N 3.23Å; S161-L163 VanDerWaalsContact C-N 3.31Å; S161-L163 PolarHBondContact O-N 2.78Å; S161-L164 WeakPolarHBondContact O-CB 3.36Å; S161-L164 PolarHBondContact O-N 3.48Å; S161-L164 VanDerWaalsContact O-N 3.16Å; S161-H165 PolarHBondContact O-N 3.29Å; S161-P245 WeakPolarHBondContact OG-CG 3.23Å
162	L	86.6	Confident	85.2	Confident	2 Å²	2	27.9 Å²	27.9	1%	0.01	16%	0.157	C	C	.	.	H	α-helix	trans	-54.5	-44.7	177.1	176.9	62.4	0	0	0	112.5	V151 L152 A157 P158 G160 L164 H165 L166 P321 L324	V151-L162 HydrophobicContact CG1-CD1 3.79Å; L152-L162 HydrophobicContact CD2-CD1 3.9Å; A157-L162 HydrophobicContact CB-CB 4.48Å; P158-L162 PolarHBondContact O-N 3.2Å; G160-L162 VanDerWaalsContact C-N 3.31Å; G160-L162 PolarHBondContact O-N 3.48Å; L162-L164 VanDerWaalsContact C-N 3.31Å; L162-L164 PolarHBondContact O-N 3.44Å; L162-H165 PolarHBondContact O-N 3.01Å; L162-L166 HydrophobicContact CD1-CD1 4.33Å; L162-L166 HydrophobicContact CD1-CG 4.24Å; L162-L166 HydrophobicContact CG-CD1 4.1Å; L162-L166 HydrophobicContact CG-CG 4.41Å; L162-L166 WeakPolarHBondContact O-CG 3.45Å; L162-L166 PolarHBondContact O-N 2.71Å; L162-P321 HydrophobicContact CD2-CB 4.33Å; L162-P321 HydrophobicContact CD2-CG 4.05Å; L162-L324 HydrophobicContact CD2-CD2 4.26Å
163	L	86.9	Confident	84.7	Confident	9 Å²	9	29.4 Å²	29.4	5%	0.047	16%	0.164	C	C	.	.	H	α-helix	trans	-63.4	-37.6	-179.9	176.6	61	0	0	0	111.8	G160 S161 H165 L166 L167 V309 L312 L313 P317	G160-L163 PolarHBondContact O-N 3.29Å; S161-L163 VanDerWaalsContact C-N 3.31Å; S161-L163 PolarHBondContact O-N 2.78Å; L163-H165 VanDerWaalsContact C-N 3.34Å; L163-L166 PolarHBondContact O-N 2.96Å; L163-L167 HydrophobicContact CD1-CG 4.39Å; L163-L167 HydrophobicContact CG-CD1 4.28Å; L163-L167 WeakPolarHBondContact O-CG 3.49Å; L163-L167 PolarHBondContact O-N 3.13Å; L163-V309 HydrophobicContact CD1-CG1 4.36Å; L163-L312 HydrophobicContact CD1-CB 3.85Å; L163-L313 HydrophobicContact CD2-CD1 4.17Å; L163-P317 HydrophobicContact CD2-CB 4.22Å
164	L	87.5	Confident	84	Confident	41 Å²	41	30.2 Å²	30.2	22%	0.215	17%	0.167	C	C	.	.	H	α-helix	trans	-62.6	-44.1	175.9	-58.8	174.2	0	0	0	111	S161 L162 L166 L167 D168 F242 Y243 P245	S161-L164 WeakPolarHBondContact O-CB 3.36Å; S161-L164 PolarHBondContact O-N 3.48Å; S161-L164 VanDerWaalsContact O-N 3.16Å; L162-L164 VanDerWaalsContact C-N 3.31Å; L162-L164 PolarHBondContact O-N 3.44Å; L164-L166 PolarHBondContact O-N 3.3Å; L164-L167 WeakPolarHBondContact O-CB 3.49Å; L164-L167 PolarHBondContact O-N 2.95Å; L164-D168 PolarHBondContact O-N 3.22Å; L164-F242 HydrophobicContact CD2-CD1 4.2Å; L164-Y243 WeakPolarHBondContact CD1-O 3.49Å; L164-P245 HydrophobicContact CD1-CG 4.15Å
165	H	87.6	Confident	83.1	Confident	56 Å²	56	32.6 Å²	32.6	26%	0.259	19%	0.188	S	C	.	.	H	α-helix	trans	-67.3	-34.7	176.7	-64.2	161.4	0	0	0	112.7	V151 D155 A157 S161 L162 L163 D168 W169	V151-H165 HydrophobicContact CB-CB 4.43Å; V151-H165 HydrophobicContact CG1-CB 3.58Å; V151-H165 HydrophobicContact CG2-CB 3.95Å; D155-H165 IonicContact OD2-CE1 2.7Å; D155-H165 PolarHBondContact OD2-CE1 2.88Å; D155-H165 IonicContact OD2-ND1 2.68Å; D155-H165 PolarHBondContact OD2-ND1 3.28Å; D155-H165 IonicContact OD2-NE2 3.92Å; A157-H165 WeakPolarHBondContact CB-ND1 3.33Å; S161-H165 PolarHBondContact O-N 3.29Å; L162-H165 PolarHBondContact O-N 3.01Å; L163-H165 VanDerWaalsContact C-N 3.34Å; H165-D168 PolarHBondContact O-N 3.3Å; H165-W169 VanDerWaalsContact O-CB 3.3Å; H165-W169 WeakPolarHBondContact O-CB 3.46Å; H165-W169 PolarHBondContact O-N 2.71Å
166	L	89.3	Confident	82.7	Confident	0 Å²	0	34 Å²	34	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-68.9	-35.8	173.5	-70	176.2	0	0	0	112.5	L148 V151 L162 L163 L164 W169 V170 V309 L312 L324 F353	L148-L166 HydrophobicContact CD1-CD2 3.99Å; V151-L166 HydrophobicContact CG1-CD2 4.45Å; L162-L166 HydrophobicContact CD1-CD1 4.33Å; L162-L166 HydrophobicContact CD1-CG 4.24Å; L162-L166 HydrophobicContact CG-CD1 4.1Å; L162-L166 HydrophobicContact CG-CG 4.41Å; L162-L166 WeakPolarHBondContact O-CG 3.45Å; L162-L166 PolarHBondContact O-N 2.71Å; L163-L166 PolarHBondContact O-N 2.96Å; L164-L166 PolarHBondContact O-N 3.3Å; L166-W169 HydrophobicContact CD2-CE3 4.23Å; L166-W169 WeakPolarHBondContact O-CB 3.5Å; L166-W169 PolarHBondContact O-N 3.19Å; L166-V170 WeakPolarHBondContact O-CG2 3.41Å; L166-V170 PolarHBondContact O-N 3.45Å; L166-V309 HydrophobicContact CB-CG1 4.34Å; L166-V309 HydrophobicContact CB-CG2 3.89Å; L166-L312 HydrophobicContact CD1-CD1 4.39Å; L166-L324 HydrophobicContact CD1-CD1 4.36Å; L166-L324 HydrophobicContact CD1-CD2 4.24Å; L166-F353 HydrophobicContact CD2-CE1 4.37Å
167	L	88.1	Confident	82.5	Confident	5 Å²	5	32 Å²	32	3%	0.026	18%	0.178	C	C	.	.	H	α-helix	trans	-63.1	-46.6	172.2	-75.5	165.7	0	0	0	111	L163 L164 W169 V170 R171 V309 L313	L163-L167 HydrophobicContact CD1-CG 4.39Å; L163-L167 HydrophobicContact CG-CD1 4.28Å; L163-L167 WeakPolarHBondContact O-CG 3.49Å; L163-L167 PolarHBondContact O-N 3.13Å; L164-L167 WeakPolarHBondContact O-CB 3.49Å; L164-L167 PolarHBondContact O-N 2.95Å; L167-W169 VanDerWaalsContact C-N 3.3Å; L167-W169 PolarHBondContact O-N 2.99Å; L167-V170 PolarHBondContact O-N 3.42Å; L167-R171 WeakPolarHBondContact O-CB 3.37Å; L167-R171 WeakPolarHBondContact O-CD 3.42Å; L167-R171 WeakPolarHBondContact O-CG 3.41Å; L167-R171 PolarHBondContact O-N 3.44Å; L167-V309 HydrophobicContact CB-CG1 4.49Å; L167-V309 HydrophobicContact CD2-CG1 3.53Å; L167-V309 HydrophobicContact CG-CG1 3.85Å; L167-L313 HydrophobicContact CD1-CD1 4.14Å; L167-L313 HydrophobicContact CD2-CD2 4.07Å
168	D	87.6	Confident	82.5	Confident	73 Å²	73	34.4 Å²	34.4	39%	0.39	19%	0.19	S	C	.	.	H	α-helix	trans	-64.5	-37	175.7	-69.1	-19.9	0	0	0	111.5	L164 H165 R171 L172	L164-D168 PolarHBondContact O-N 3.22Å; H165-D168 PolarHBondContact O-N 3.3Å; D168-R171 PolarHBondContact O-N 2.74Å; D168-R171 IonicContact OD1-CZ 3.86Å; D168-R171 IonicContact OD1-NH1 3.84Å; D168-R171 PolarHBondContact OD1-NH1 3.41Å; D168-L172 WeakPolarHBondContact O-CB 3.39Å; D168-L172 WeakPolarHBondContact O-CD1 3.43Å; D168-L172 WeakPolarHBondContact O-CG 3.44Å; D168-L172 PolarHBondContact O-N 3.2Å
169	W	90.6	Very high	82.5	Confident	1 Å²	1	35 Å²	35	0%	0.004	19%	0.186	C	C	.	.	H	α-helix	trans	-58.3	-49.1	172.9	173.7	76.3	0	0	0	112	L144 L148 H165 L166 L167 L172 H173 Y305 L349 F353	L144-W169 HydrophobicContact CD1-CH2 4.38Å; L144-W169 HydrophobicContact CD1-CZ2 3.43Å; L144-W169 VanDerWaalsContact CD1-CZ2 3.43Å; L144-W169 HydrophobicContact CG-CZ2 3.89Å; L144-W169 PolarHBondContact O-NE1 3.38Å; L148-W169 HydrophobicContact CB-CZ2 4.12Å; L148-W169 HydrophobicContact CD1-CD2 4.43Å; L148-W169 HydrophobicContact CD1-CH2 4.46Å; L148-W169 HydrophobicContact CD1-CZ2 4.25Å; L148-W169 HydrophobicContact CD2-CH2 4.46Å; L148-W169 HydrophobicContact CD2-CZ2 4.16Å; L148-W169 HydrophobicContact CG-CZ2 4.41Å; H165-W169 VanDerWaalsContact O-CB 3.3Å; H165-W169 WeakPolarHBondContact O-CB 3.46Å; H165-W169 PolarHBondContact O-N 2.71Å; L166-W169 HydrophobicContact CD2-CE3 4.23Å; L166-W169 WeakPolarHBondContact O-CB 3.5Å; L166-W169 PolarHBondContact O-N 3.19Å; L167-W169 VanDerWaalsContact C-N 3.3Å; L167-W169 PolarHBondContact O-N 2.99Å; W169-L172 PolarHBondContact O-N 3.39Å; W169-H173 AromaticContact CD1-CE1 3.51Å; W169-H173 AromaticContact CD1-ND1 3.75Å; W169-H173 AromaticContact NE1-CE1 3.62Å; W169-H173 AromaticContact NE1-ND1 3.83Å; W169-H173 PolarHBondContact O-N 2.96Å; W169-H173 PolarHBondContact O-ND1 2.79Å; W169-Y305 AromaticContact CH2-CD2 3.71Å; W169-Y305 HydrophobicContact CH2-CD2 3.71Å; W169-Y305 HydrophobicContact CH2-CE2 4.47Å; W169-Y305 AromaticContact CH2-CG 3.77Å; W169-Y305 HydrophobicContact CH2-CG 3.77Å; W169-Y305 AromaticContact CZ3-CD2 3.83Å; W169-Y305 HydrophobicContact CZ3-CD2 3.83Å; W169-Y305 HydrophobicContact CZ3-CG 4.14Å; W169-L349 HydrophobicContact CZ2-CD2 4.16Å; W169-F353 HydrophobicContact CH2-CZ 4.26Å; W169-F353 HydrophobicContact CZ3-CZ 4.26Å
170	V	87.2	Confident	82.8	Confident	4 Å²	4	37.9 Å²	37.9	2%	0.024	19%	0.194	C	C	.	.	H	α-helix	trans	-66.7	-41.7	178.8	173	0	0	0	0	112	L166 L167 L172 H173 K174 Y305 H306 V309	L166-V170 WeakPolarHBondContact O-CG2 3.41Å; L166-V170 PolarHBondContact O-N 3.45Å; L167-V170 PolarHBondContact O-N 3.42Å; V170-L172 VanDerWaalsContact C-N 3.28Å; V170-L172 PolarHBondContact O-N 2.7Å; V170-H173 PolarHBondContact O-N 3.12Å; V170-K174 WeakPolarHBondContact O-CB 3.07Å; V170-K174 PolarHBondContact O-N 2.91Å; V170-K174 VanDerWaalsContact O-N 3.12Å; V170-Y305 HydrophobicContact CG2-CD2 4.37Å; V170-H306 HydrophobicContact CG1-CB 3.88Å; V170-H306 VanDerWaalsContact CG1-CD2 3.46Å; V170-H306 WeakPolarHBondContact CG1-CD2 3.34Å; V170-V309 HydrophobicContact CG2-CB 3.91Å; V170-V309 HydrophobicContact CG2-CG1 4.27Å; V170-V309 HydrophobicContact CG2-CG2 3.6Å
171	R	85.2	Confident	83	Confident	68 Å²	68	37.9 Å²	37.9	26%	0.257	19%	0.194	S	C	.	.	H	α-helix	trans	-57.5	-43.6	178.1	-72.5	165	-173.8	175.5	-5.3	111.6	L167 D168 H173 K174 Q206 G207	L167-R171 WeakPolarHBondContact O-CB 3.37Å; L167-R171 WeakPolarHBondContact O-CD 3.42Å; L167-R171 WeakPolarHBondContact O-CG 3.41Å; L167-R171 PolarHBondContact O-N 3.44Å; D168-R171 PolarHBondContact O-N 2.74Å; D168-R171 IonicContact OD1-CZ 3.86Å; D168-R171 IonicContact OD1-NH1 3.84Å; D168-R171 PolarHBondContact OD1-NH1 3.41Å; R171-H173 VanDerWaalsContact C-N 3.3Å; R171-H173 PolarHBondContact O-N 3.29Å; R171-K174 PolarHBondContact O-N 3.37Å; R171-Q206 PolarHBondContact NE-O 3.19Å; R171-Q206 PolarHBondContact NH2-O 3.44Å; R171-G207 PolarHBondContact NH2-O 2.94Å
172	L	82.7	Confident	83	Confident	75 Å²	75	42.2 Å²	42.2	39%	0.393	21%	0.212	S	C	.	.	H	α-helix	trans	-66.8	-28	-177.3	-75.4	171.5	0	0	0	113.9	D168 W169 V170	D168-L172 WeakPolarHBondContact O-CB 3.39Å; D168-L172 WeakPolarHBondContact O-CD1 3.43Å; D168-L172 WeakPolarHBondContact O-CG 3.44Å; D168-L172 PolarHBondContact O-N 3.2Å; W169-L172 PolarHBondContact O-N 3.39Å; V170-L172 VanDerWaalsContact C-N 3.28Å; V170-L172 PolarHBondContact O-N 2.7Å
173	H	77.5	Confident	82.9	Confident	40 Å²	40	46.3 Å²	46.3	19%	0.185	23%	0.234	C	C	.	.	H	α-helix	trans	-100.8	-0.9	-179.3	-57.6	98.2	0	0	0	113.3	E143 L144 N147 W169 V170 R171	E143-H173 IonicContact OE1-NE2 3.56Å; L144-H173 VanDerWaalsContact CA-NE2 3.29Å; L144-H173 WeakPolarHBondContact CA-NE2 3.49Å; L144-H173 HydrophobicContact CD1-CB 3.81Å; L144-H173 WeakPolarHBondContact CD1-ND1 3.3Å; L144-H173 PolarHBondContact N-NE2 2.76Å; N147-H173 PolarHBondContact ND2-CE1 3.13Å; W169-H173 AromaticContact CD1-CE1 3.51Å; W169-H173 AromaticContact CD1-ND1 3.75Å; W169-H173 AromaticContact NE1-CE1 3.62Å; W169-H173 AromaticContact NE1-ND1 3.83Å; W169-H173 PolarHBondContact O-N 2.96Å; W169-H173 PolarHBondContact O-ND1 2.79Å; V170-H173 PolarHBondContact O-N 3.12Å; R171-H173 VanDerWaalsContact C-N 3.3Å; R171-H173 PolarHBondContact O-N 3.29Å
174	K	72.8	Confident	82.9	Confident	33 Å²	33	45.9 Å²	45.9	14%	0.143	23%	0.232	C	C	.	.			trans	-125.1	60.4	177.6	-159.7	-176.6	178.1	170.4	0	112.7	V170 R171 D176 V177 L300 L301 H306	V170-K174 WeakPolarHBondContact O-CB 3.07Å; V170-K174 PolarHBondContact O-N 2.91Å; V170-K174 VanDerWaalsContact O-N 3.12Å; R171-K174 PolarHBondContact O-N 3.37Å; K174-D176 PolarHBondContact O-N 3.07Å; K174-V177 HydrophobicContact CD-CG2 4.32Å; K174-V177 HydrophobicContact CG-CG2 4.48Å; K174-L300 PolarHBondContact NZ-O 3.15Å; K174-L301 PolarHBondContact NZ-O 2.68Å; K174-H306 PolarHBondContact NZ-ND1 3.26Å
175	A	65.4	Low	82.6	Confident	56 Å²	56	47.7 Å²	47.7	46%	0.463	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70	-13	179.5	0	0	0	0	0	114.7	V177 D178 E179	A175-V177 PolarHBondContact O-N 3.31Å; A175-V177 VanDerWaalsContact O-N 3.17Å; A175-D178 PolarHBondContact O-N 3.07Å; A175-E179 PolarHBondContact O-N 3.36Å
176	D	75.9	Confident	82.5	Confident	82 Å²	82	52.2 Å²	52.2	44%	0.439	26%	0.262	S	S	.	.	H	α-helix	trans	-56.7	-31.6	179.1	179.4	39.7	0	0	0	112.9	K174 D178 E179 K180	K174-D176 PolarHBondContact O-N 3.07Å; D176-D178 VanDerWaalsContact C-N 3.34Å; D176-D178 PolarHBondContact O-N 3.16Å; D176-E179 PolarHBondContact O-N 2.92Å; D176-K180 WeakPolarHBondContact O-CB 3.3Å; D176-K180 WeakPolarHBondContact O-CG 3.44Å; D176-K180 PolarHBondContact O-N 3.19Å; D176-K180 VanDerWaalsContact OD1-CE 3.24Å; D176-K180 WeakPolarHBondContact OD1-CE 3.35Å; D176-K180 IonicContact OD1-NZ 2.64Å; D176-K180 VanDerWaalsContact OD2-CE 3.26Å; D176-K180 WeakPolarHBondContact OD2-CE 3.47Å; D176-K180 IonicContact OD2-NZ 2.71Å; D176-K180 PolarHBondContact OD2-NZ 2.93Å
177	V	78.6	Confident	82.3	Confident	4 Å²	4	54.2 Å²	54.2	2%	0.024	28%	0.276	C	S	.	.	H	α-helix	trans	-67	-37.1	178.1	-178.8	0	0	0	0	111.6	K174 A175 A181 Y203	K174-V177 HydrophobicContact CD-CG2 4.32Å; K174-V177 HydrophobicContact CG-CG2 4.48Å; A175-V177 PolarHBondContact O-N 3.31Å; A175-V177 VanDerWaalsContact O-N 3.17Å; V177-A181 WeakPolarHBondContact O-CB 3.39Å; V177-A181 PolarHBondContact O-N 3.21Å; V177-Y203 HydrophobicContact CG1-CD1 4.21Å; V177-Y203 HydrophobicContact CG1-CE1 4.12Å
178	D	81.1	Confident	81.6	Confident	56 Å²	56	62.2 Å²	62.2	30%	0.299	32%	0.319	S	S	.	.	H	α-helix	trans	-71.6	-38.2	179.1	-74.8	-42.6	0	0	0	111.9	A175 D176 A181 K182 R208	A175-D178 PolarHBondContact O-N 3.07Å; D176-D178 VanDerWaalsContact C-N 3.34Å; D176-D178 PolarHBondContact O-N 3.16Å; D178-A181 PolarHBondContact O-N 3.4Å; D178-K182 VanDerWaalsContact O-CG 3.31Å; D178-K182 WeakPolarHBondContact O-CG 3.33Å; D178-K182 PolarHBondContact O-N 3.32Å; D178-R208 IonicContact OD1-CZ 2.9Å; D178-R208 IonicContact OD1-NH1 3.14Å; D178-R208 PolarHBondContact OD1-NH1 3.04Å; D178-R208 IonicContact OD1-NH2 3.92Å; D178-R208 IonicContact OD2-NH1 2.62Å
179	E	82.2	Confident	81.2	Confident	98 Å²	98	61.3 Å²	61.3	46%	0.458	32%	0.318	S	S	.	.	H	α-helix	trans	-65.6	-49.2	174.5	-66.8	-58.9	121.4	0	0	110.9	A175 D176 A181 K182 D183	A175-E179 PolarHBondContact O-N 3.36Å; D176-E179 PolarHBondContact O-N 2.92Å; E179-A181 PolarHBondContact O-N 3.46Å; E179-K182 WeakPolarHBondContact O-CB 3.43Å; E179-K182 PolarHBondContact O-N 3.46Å; E179-K182 VanDerWaalsContact O-N 3.08Å; E179-K182 IonicContact OE1-NZ 3.45Å; E179-K182 PolarHBondContact OE1-NZ 3.31Å; E179-D183 PolarHBondContact O-N 2.96Å
180	K	81.9	Confident	80.5	Confident	81 Å²	81	62.6 Å²	62.6	35%	0.352	33%	0.327	S	S	.	.	H	α-helix	trans	-58.2	-37.3	174.2	-74.3	172.1	175.2	167.1	0	112.6	D176 D183 V184 V199	D176-K180 WeakPolarHBondContact O-CB 3.3Å; D176-K180 WeakPolarHBondContact O-CG 3.44Å; D176-K180 PolarHBondContact O-N 3.19Å; D176-K180 VanDerWaalsContact OD1-CE 3.24Å; D176-K180 WeakPolarHBondContact OD1-CE 3.35Å; D176-K180 IonicContact OD1-NZ 2.64Å; D176-K180 VanDerWaalsContact OD2-CE 3.26Å; D176-K180 WeakPolarHBondContact OD2-CE 3.47Å; D176-K180 IonicContact OD2-NZ 2.71Å; D176-K180 PolarHBondContact OD2-NZ 2.93Å; K180-D183 PolarHBondContact O-N 2.93Å; K180-V184 VanDerWaalsContact O-CG2 3.22Å; K180-V184 WeakPolarHBondContact O-CG2 3.39Å; K180-V184 PolarHBondContact O-N 3.25Å; K180-V199 HydrophobicContact CB-CG2 4Å
181	A	83.9	Confident	80	Confident	3 Å²	3	63 Å²	63	3%	0.025	33%	0.331	C	S	.	.	H	α-helix	trans	-68.2	-39.4	176.2	0	0	0	0	0	112.7	V177 D178 E179 D183 V184 L185 V199 Y203	V177-A181 WeakPolarHBondContact O-CB 3.39Å; V177-A181 PolarHBondContact O-N 3.21Å; D178-A181 PolarHBondContact O-N 3.4Å; E179-A181 PolarHBondContact O-N 3.46Å; A181-D183 VanDerWaalsContact C-N 3.33Å; A181-V184 PolarHBondContact O-N 3.11Å; A181-L185 WeakPolarHBondContact O-CB 3.4Å; A181-L185 WeakPolarHBondContact O-CG 3.45Å; A181-L185 PolarHBondContact O-N 3.49Å; A181-V199 HydrophobicContact CB-CG1 3.72Å; A181-V199 HydrophobicContact CB-CG2 4.49Å; A181-Y203 HydrophobicContact CB-CE2 4.36Å; A181-Y203 WeakPolarHBondContact CB-OH 3.5Å
182	K	85.3	Confident	79.7	Confident	100 Å²	100	67 Å²	67	44%	0.435	35%	0.352	S	S	.	.	H	α-helix	trans	-60.4	-45.1	173.4	-73.1	169.1	-169.6	168.2	0	110.7	D178 E179 V184 L185 Q186	D178-K182 VanDerWaalsContact O-CG 3.31Å; D178-K182 WeakPolarHBondContact O-CG 3.33Å; D178-K182 PolarHBondContact O-N 3.32Å; E179-K182 WeakPolarHBondContact O-CB 3.43Å; E179-K182 PolarHBondContact O-N 3.46Å; E179-K182 VanDerWaalsContact O-N 3.08Å; E179-K182 IonicContact OE1-NZ 3.45Å; E179-K182 PolarHBondContact OE1-NZ 3.31Å; K182-V184 PolarHBondContact O-N 3.29Å; K182-L185 PolarHBondContact O-N 3.08Å; K182-Q186 WeakPolarHBondContact O-CB 3.48Å; K182-Q186 VanDerWaalsContact O-CG 3.26Å; K182-Q186 WeakPolarHBondContact O-CG 3.47Å; K182-Q186 PolarHBondContact O-N 3.01Å
183	D	84.6	Confident	79.7	Confident	88 Å²	88	65.3 Å²	65.3	47%	0.471	34%	0.342	S	S	.	.	H	α-helix	trans	-60.4	-46.1	178.4	-68.4	-14.9	0	0	0	111.7	E179 K180 A181 L185 Q186 S187	E179-D183 PolarHBondContact O-N 2.96Å; K180-D183 PolarHBondContact O-N 2.93Å; A181-D183 VanDerWaalsContact C-N 3.33Å; D183-L185 VanDerWaalsContact C-N 3.33Å; D183-L185 PolarHBondContact O-N 3.5Å; D183-Q186 PolarHBondContact O-N 3.5Å; D183-S187 PolarHBondContact O-N 2.95Å
184	V	85.1	Confident	80	Confident	0 Å²	0	70.2 Å²	70.2	0%	0	37%	0.365	C	S	.	.	H	α-helix	trans	-60.6	-42.6	175.9	170.6	0	0	0	0	111.4	K180 A181 K182 S187 P190 H193 N195 Y196 V199 M215	K180-V184 VanDerWaalsContact O-CG2 3.22Å; K180-V184 WeakPolarHBondContact O-CG2 3.39Å; K180-V184 PolarHBondContact O-N 3.25Å; A181-V184 PolarHBondContact O-N 3.11Å; K182-V184 PolarHBondContact O-N 3.29Å; V184-S187 WeakPolarHBondContact O-CB 3.36Å; V184-S187 PolarHBondContact O-N 3.27Å; V184-P190 HydrophobicContact CG1-CB 4.29Å; V184-P190 WeakPolarHBondContact O-CA 3.44Å; V184-P190 WeakPolarHBondContact O-CB 3.4Å; V184-H193 HydrophobicContact CG1-CB 4.25Å; V184-H193 HydrophobicContact CG2-CB 4.44Å; V184-H193 WeakPolarHBondContact CG2-ND1 3.49Å; V184-N195 HydrophobicContact CG2-CB 3.96Å; V184-Y196 HydrophobicContact CG1-CD2 3.9Å; V184-V199 HydrophobicContact CG2-CG2 4.08Å; V184-M215 HydrophobicContact CG1-CE 3.84Å
185	L	83	Confident	80.5	Confident	78 Å²	78	70.4 Å²	70.4	41%	0.408	37%	0.367	S	S	.	.	H	α-helix	trans	-74.8	-25.6	-177.4	-72.7	173.1	0	0	0	113.7	A181 K182 D183 S187 M215	A181-L185 WeakPolarHBondContact O-CB 3.4Å; A181-L185 WeakPolarHBondContact O-CG 3.45Å; A181-L185 PolarHBondContact O-N 3.49Å; K182-L185 PolarHBondContact O-N 3.08Å; D183-L185 VanDerWaalsContact C-N 3.33Å; D183-L185 PolarHBondContact O-N 3.5Å; L185-S187 VanDerWaalsContact C-N 3.33Å; L185-M215 HydrophobicContact CD2-CE 4.32Å; L185-M215 HydrophobicContact CD2-SD 3.73Å
186	Q	85.4	Confident	81.6	Confident	152 Å²	152	67.7 Å²	67.7	71%	0.71	35%	0.345	S	S	*	.	H	α-helix	trans	-80.9	-14.4	175.4	-72.9	177.2	20.8	0	0	113	K182 D183	K182-Q186 WeakPolarHBondContact O-CB 3.48Å; K182-Q186 VanDerWaalsContact O-CG 3.26Å; K182-Q186 WeakPolarHBondContact O-CG 3.47Å; K182-Q186 PolarHBondContact O-N 3.01Å; D183-Q186 PolarHBondContact O-N 3.5Å
187	S	84.4	Confident	82.2	Confident	41 Å²	41	65.5 Å²	65.5	29%	0.287	33%	0.331	S	S	.	.	S	Bend	trans	-66.8	147.1	175	-171	0	0	0	0	112	D183 V184 L185 S189 P190	D183-S187 PolarHBondContact O-N 2.95Å; V184-S187 WeakPolarHBondContact O-CB 3.36Å; V184-S187 PolarHBondContact O-N 3.27Å; L185-S187 VanDerWaalsContact C-N 3.33Å; S187-S189 PolarHBondContact O-N 3.37Å; S187-P190 VanDerWaalsContact O-CD 3.31Å; S187-P190 WeakPolarHBondContact O-CD 3.44Å; S187-P190 WeakPolarHBondContact O-CG 3.5Å
188	D	72.6	Confident	82.6	Confident	173 Å²	173	68.6 Å²	68.6	93%	0.925	35%	0.347	S	S	*	.	S	Bend	trans	-60.6	-30.7	178	-66.9	-39.4	0	0	0	112.7
189	S	79.3	Confident	82.9	Confident	54 Å²	54	66 Å²	66	38%	0.378	33%	0.333	S	S	.	.	S	Bend	trans	-129.7	80.2	175	56.8	0	0	0	0	112	S187 A191 E192 H193	S187-S189 PolarHBondContact O-N 3.37Å; S189-A191 VanDerWaalsContact C-N 3.25Å; S189-A191 PolarHBondContact O-N 3.4Å; S189-A191 VanDerWaalsContact O-N 3.1Å; S189-E192 PolarHBondContact O-N 3.3Å; S189-H193 PolarHBondContact O-N 3.42Å
190	P	77.4	Confident	83.2	Confident	29 Å²	29	61.3 Å²	61.3	19%	0.188	31%	0.312	C	S	.	.	G	3₁₀ helix	trans	-55.5	-37.1	-173.7	-29	36.7	0	0	0	114.3	V184 S187 E192 H193 Y196	V184-P190 HydrophobicContact CG1-CB 4.29Å; V184-P190 WeakPolarHBondContact O-CA 3.44Å; V184-P190 WeakPolarHBondContact O-CB 3.4Å; S187-P190 VanDerWaalsContact O-CD 3.31Å; S187-P190 WeakPolarHBondContact O-CD 3.44Å; S187-P190 WeakPolarHBondContact O-CG 3.5Å; P190-E192 VanDerWaalsContact C-N 3.31Å; P190-E192 PolarHBondContact O-N 3.05Å; P190-H193 VanDerWaalsContact O-CB 3.31Å; P190-H193 WeakPolarHBondContact O-CB 3.42Å; P190-H193 PolarHBondContact O-N 3.02Å; P190-Y196 WeakPolarHBondContact O-CD2 3.37Å
191	A	76.3	Confident	83.6	Confident	13 Å²	13	57.6 Å²	57.6	11%	0.107	30%	0.296	C	S	.	.	G	3₁₀ helix	trans	-73.8	-15.8	-177	0	0	0	0	0	115.1	S189 Y196 L222	S189-A191 VanDerWaalsContact C-N 3.25Å; S189-A191 PolarHBondContact O-N 3.4Å; S189-A191 VanDerWaalsContact O-N 3.1Å; A191-Y196 HydrophobicContact CB-CE2 4.44Å; A191-L222 HydrophobicContact CB-CD1 3.24Å
192	E	78.1	Confident	83.8	Confident	151 Å²	151	57.9 Å²	57.9	71%	0.706	30%	0.298	S	S	*	.	G	3₁₀ helix	trans	-103.9	-0.3	176.7	-63.2	-178.6	163	0	0	111.8	S189 P190	S189-E192 PolarHBondContact O-N 3.3Å; P190-E192 VanDerWaalsContact C-N 3.31Å; P190-E192 PolarHBondContact O-N 3.05Å
193	H	82.8	Confident	84	Confident	40 Å²	40	53.8 Å²	53.8	19%	0.185	28%	0.279	C	S	.	.			trans	-67.3	140.6	-179.7	-166.8	-86.9	0	0	0	111.3	V184 S189 P190 N195 Y196	V184-H193 HydrophobicContact CG1-CB 4.25Å; V184-H193 HydrophobicContact CG2-CB 4.44Å; V184-H193 WeakPolarHBondContact CG2-ND1 3.49Å; S189-H193 PolarHBondContact O-N 3.42Å; P190-H193 VanDerWaalsContact O-CB 3.31Å; P190-H193 WeakPolarHBondContact O-CB 3.42Å; P190-H193 PolarHBondContact O-N 3.02Å; H193-N195 VanDerWaalsContact C-N 3.32Å; H193-N195 PolarHBondContact ND1-N 3.33Å; H193-N195 PolarHBondContact O-N 3.33Å; H193-Y196 WeakPolarHBondContact O-CB 3.38Å; H193-Y196 PolarHBondContact O-N 2.94Å
194	H	83.5	Confident	84.3	Confident	143 Å²	143	49.6 Å²	49.6	66%	0.662	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.6	-42.8	-177.3	62.7	-75.5	0	0	0	113.2	Y196	H194-Y196 VanDerWaalsContact C-N 3.3Å; H194-Y196 PolarHBondContact O-N 3.4Å
195	N	84.4	Confident	84.4	Confident	36 Å²	36	49.6 Å²	49.6	19%	0.193	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.5	3.7	178.5	-62.2	-23.9	0	0	0	114.6	V184 H193 W197 D198 V199	V184-N195 HydrophobicContact CG2-CB 3.96Å; H193-N195 VanDerWaalsContact C-N 3.32Å; H193-N195 PolarHBondContact ND1-N 3.33Å; H193-N195 PolarHBondContact O-N 3.33Å; N195-W197 PolarHBondContact O-N 3Å; N195-D198 PolarHBondContact O-N 2.75Å; N195-V199 WeakPolarHBondContact O-CG2 3.21Å; N195-V199 PolarHBondContact O-N 2.72Å
196	Y	87.2	Confident	84.6	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-59.2	-50.5	-172.3	176.1	-96	0	0	0	112.4	V184 P190 A191 H193 H194 V199 V200 M215 Q219	V184-Y196 HydrophobicContact CG1-CD2 3.9Å; P190-Y196 WeakPolarHBondContact O-CD2 3.37Å; A191-Y196 HydrophobicContact CB-CE2 4.44Å; H193-Y196 WeakPolarHBondContact O-CB 3.38Å; H193-Y196 PolarHBondContact O-N 2.94Å; H194-Y196 VanDerWaalsContact C-N 3.3Å; H194-Y196 PolarHBondContact O-N 3.4Å; Y196-V199 PolarHBondContact O-N 3.26Å; Y196-V200 HydrophobicContact CD1-CG2 4.43Å; Y196-V200 HydrophobicContact CE1-CG2 4.03Å; Y196-V200 WeakPolarHBondContact O-CG2 3.39Å; Y196-V200 PolarHBondContact O-N 3.14Å; Y196-V200 VanDerWaalsContact O-N 3.07Å; Y196-M215 HydrophobicContact CD2-CE 3.54Å; Y196-M215 HydrophobicContact CE2-CB 4.34Å; Y196-M215 HydrophobicContact CE2-CE 3.35Å; Y196-M215 HydrophobicContact CE2-SD 4.24Å; Y196-M215 PolarHBondContact OH-O 3.39Å; Y196-Q219 HydrophobicContact CE1-CB 4.34Å
197	W	88.4	Confident	84.6	Confident	36 Å²	36	39 Å²	39	14%	0.136	21%	0.206	C	C	.	.	H	α-helix	trans	-70.9	-32.7	-179.3	-72.7	107.2	0	0	0	112.5	N195 V199 V200 V201 L216 Q219 Y230 H279 I283	N195-W197 PolarHBondContact O-N 3Å; W197-V199 VanDerWaalsContact C-N 3.3Å; W197-V199 PolarHBondContact O-N 2.94Å; W197-V200 HydrophobicContact CE3-CB 4.41Å; W197-V200 HydrophobicContact CE3-CG1 4.46Å; W197-V200 PolarHBondContact O-N 3.08Å; W197-V201 WeakPolarHBondContact O-CB 3.5Å; W197-V201 VanDerWaalsContact O-CG2 3.29Å; W197-V201 WeakPolarHBondContact O-CG2 3.44Å; W197-V201 PolarHBondContact O-N 3.25Å; W197-L216 HydrophobicContact CH2-CD2 4.22Å; W197-L216 HydrophobicContact CZ3-CD2 3.86Å; W197-Q219 HydrophobicContact CH2-CG 4.2Å; W197-Q219 HydrophobicContact CZ2-CG 3.89Å; W197-Y230 HydrophobicContact CH2-CE1 4.37Å; W197-H279 AromaticContact CD1-CE1 3.83Å; W197-H279 AromaticContact CD1-NE2 3.91Å; W197-H279 HydrophobicContact CD2-CB 3.87Å; W197-H279 AromaticContact CD2-CD2 3.99Å; W197-H279 AromaticContact CD2-CG 3.61Å; W197-H279 AromaticContact CD2-ND1 3.73Å; W197-H279 AromaticContact CE2-CD2 3.69Å; W197-H279 AromaticContact CE2-CG 3.76Å; W197-H279 HydrophobicContact CE3-CB 3.54Å; W197-H279 AromaticContact CE3-CG 3.82Å; W197-H279 AromaticContact CG-CE1 3.78Å; W197-H279 AromaticContact CG-ND1 3.68Å; W197-H279 HydrophobicContact CH2-CB 3.72Å; W197-H279 HydrophobicContact CZ2-CB 4.04Å; W197-H279 AromaticContact CZ2-CD2 3.98Å; W197-H279 HydrophobicContact CZ3-CB 3.46Å; W197-H279 VanDerWaalsContact CZ3-CB 3.46Å; W197-H279 AromaticContact NE1-CD2 3.87Å; W197-H279 AromaticContact NE1-NE2 3.88Å; W197-I283 HydrophobicContact CZ3-CD1 4.43Å
198	D	87.5	Confident	84.8	Confident	68 Å²	68	39.5 Å²	39.5	36%	0.364	20%	0.202	S	C	.	.	H	α-helix	trans	-63	-39.5	175.2	-63.3	-10.9	0	0	0	111.1	N195 S202 L300	N195-D198 PolarHBondContact O-N 2.75Å; D198-S202 WeakPolarHBondContact O-CB 3.21Å; D198-S202 PolarHBondContact O-N 3.22Å; D198-S202 PolarHBondContact O-OG 3.32Å; D198-L300 HydrophobicContact CB-CD2 3.79Å
199	V	86.9	Confident	85.6	Confident	2 Å²	2	31.6 Å²	31.6	1%	0.012	16%	0.16	C	C	.	.	H	α-helix	trans	-67.2	-44.5	173.9	169.8	0	0	0	0	111.2	K180 A181 V184 N195 Y196 W197 S202 Y203	K180-V199 HydrophobicContact CB-CG2 4Å; A181-V199 HydrophobicContact CB-CG1 3.72Å; A181-V199 HydrophobicContact CB-CG2 4.49Å; V184-V199 HydrophobicContact CG2-CG2 4.08Å; N195-V199 WeakPolarHBondContact O-CG2 3.21Å; N195-V199 PolarHBondContact O-N 2.72Å; Y196-V199 PolarHBondContact O-N 3.26Å; W197-V199 VanDerWaalsContact C-N 3.3Å; W197-V199 PolarHBondContact O-N 2.94Å; V199-S202 PolarHBondContact O-N 3.34Å; V199-Y203 HydrophobicContact CG1-CD2 3.8Å; V199-Y203 HydrophobicContact CG1-CE2 3.37Å; V199-Y203 WeakPolarHBondContact O-CD2 3.35Å; V199-Y203 PolarHBondContact O-N 2.9Å
200	V	88.9	Confident	86	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-61.1	-47.7	177.5	174.6	0	0	0	0	111.1	Y196 W197 Y203 V204 M215 L216 I283	Y196-V200 HydrophobicContact CD1-CG2 4.43Å; Y196-V200 HydrophobicContact CE1-CG2 4.03Å; Y196-V200 WeakPolarHBondContact O-CG2 3.39Å; Y196-V200 PolarHBondContact O-N 3.14Å; Y196-V200 VanDerWaalsContact O-N 3.07Å; W197-V200 HydrophobicContact CE3-CB 4.41Å; W197-V200 HydrophobicContact CE3-CG1 4.46Å; W197-V200 PolarHBondContact O-N 3.08Å; V200-Y203 PolarHBondContact O-N 3.12Å; V200-V204 WeakPolarHBondContact O-CG2 3.25Å; V200-V204 PolarHBondContact O-N 3.21Å; V200-V204 VanDerWaalsContact O-N 3.12Å; V200-M215 HydrophobicContact CG2-CB 3.73Å; V200-M215 HydrophobicContact CG2-CG 4.46Å; V200-L216 HydrophobicContact CG1-CD2 4.03Å; V200-L216 HydrophobicContact CG1-CG 4.16Å; V200-I283 HydrophobicContact CG1-CD1 3.92Å
201	V	89.8	Confident	86.5	Confident	3 Å²	3	34.7 Å²	34.7	2%	0.018	17%	0.166	C	C	.	.	H	α-helix	trans	-64	-42.4	177.6	172.7	0	0	0	0	110.2	W197 Y203 V204 L205 L282 I286 L300	W197-V201 WeakPolarHBondContact O-CB 3.5Å; W197-V201 VanDerWaalsContact O-CG2 3.29Å; W197-V201 WeakPolarHBondContact O-CG2 3.44Å; W197-V201 PolarHBondContact O-N 3.25Å; V201-Y203 VanDerWaalsContact C-N 3.33Å; V201-Y203 PolarHBondContact O-N 3.39Å; V201-V204 PolarHBondContact O-N 2.73Å; V201-V204 VanDerWaalsContact O-N 3.13Å; V201-L205 HydrophobicContact CG1-CD1 3.82Å; V201-L205 HydrophobicContact CG1-CG 4.17Å; V201-L205 VanDerWaalsContact O-CG 3.27Å; V201-L205 WeakPolarHBondContact O-CG 3.42Å; V201-L205 PolarHBondContact O-N 2.94Å; V201-L282 HydrophobicContact CG2-CD2 4.08Å; V201-I286 HydrophobicContact CG1-CD1 3.84Å; V201-L300 HydrophobicContact CB-CD1 4Å; V201-L300 HydrophobicContact CG1-CD1 3.68Å
202	S	88.4	Confident	87.1	Confident	9 Å²	9	34.1 Å²	34.1	6%	0.063	16%	0.16	C	C	.	.	H	α-helix	trans	-60.2	-40.2	176.1	-64.4	0	0	0	0	112.7	D198 V199 L205 Q206	D198-S202 WeakPolarHBondContact O-CB 3.21Å; D198-S202 PolarHBondContact O-N 3.22Å; D198-S202 PolarHBondContact O-OG 3.32Å; V199-S202 PolarHBondContact O-N 3.34Å; S202-L205 PolarHBondContact O-N 3.22Å; S202-Q206 WeakPolarHBondContact O-CB 3.41Å; S202-Q206 VanDerWaalsContact O-CG 3.32Å; S202-Q206 WeakPolarHBondContact O-CG 3.45Å; S202-Q206 PolarHBondContact O-N 3.07Å
203	Y	89.8	Confident	87.7	Confident	14 Å²	14	28.9 Å²	28.9	6%	0.055	13%	0.134	C	C	.	.	H	α-helix	trans	-63.4	-41.3	174.1	-75.2	-40.2	0	0	0	112.5	V177 A181 V199 V200 V201 Q206 G207 R208 E211 M215	V177-Y203 HydrophobicContact CG1-CD1 4.21Å; V177-Y203 HydrophobicContact CG1-CE1 4.12Å; A181-Y203 HydrophobicContact CB-CE2 4.36Å; A181-Y203 WeakPolarHBondContact CB-OH 3.5Å; V199-Y203 HydrophobicContact CG1-CD2 3.8Å; V199-Y203 HydrophobicContact CG1-CE2 3.37Å; V199-Y203 WeakPolarHBondContact O-CD2 3.35Å; V199-Y203 PolarHBondContact O-N 2.9Å; V200-Y203 PolarHBondContact O-N 3.12Å; V201-Y203 VanDerWaalsContact C-N 3.33Å; V201-Y203 PolarHBondContact O-N 3.39Å; Y203-Q206 PolarHBondContact O-N 2.93Å; Y203-G207 PolarHBondContact O-N 3.3Å; Y203-R208 HydrophobicContact CD1-CB 4Å; Y203-R208 HydrophobicContact CG-CB 4.47Å; Y203-R208 PolarHBondContact O-N 3.14Å; Y203-E211 HydrophobicContact CD1-CB 4.26Å; Y203-E211 HydrophobicContact CD2-CB 4Å; Y203-E211 HydrophobicContact CE1-CB 4.24Å; Y203-E211 HydrophobicContact CE2-CB 3.96Å; Y203-E211 HydrophobicContact CG-CB 4.14Å; Y203-M215 HydrophobicContact CE2-CG 4.46Å
204	V	90.8	Very high	87.9	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-63.4	-45.4	174.3	178.1	0	0	0	0	110.4	V200 V201 Q206 G207 A212 I283 I286 L287 Y314	V200-V204 WeakPolarHBondContact O-CG2 3.25Å; V200-V204 PolarHBondContact O-N 3.21Å; V200-V204 VanDerWaalsContact O-N 3.12Å; V201-V204 PolarHBondContact O-N 2.73Å; V201-V204 VanDerWaalsContact O-N 3.13Å; V204-Q206 VanDerWaalsContact C-N 3.29Å; V204-Q206 PolarHBondContact O-N 3.47Å; V204-G207 PolarHBondContact O-N 2.82Å; V204-A212 HydrophobicContact CG2-CB 3.91Å; V204-I283 HydrophobicContact CG1-CG2 4.41Å; V204-I283 HydrophobicContact CG2-CG2 4.21Å; V204-I286 HydrophobicContact CG1-CG2 3.8Å; V204-L287 HydrophobicContact CG1-CD2 4.09Å; V204-Y314 WeakPolarHBondContact CG1-OH 3.44Å; V204-Y314 PolarHBondContact O-OH 3.42Å
205	L	88.6	Confident	88	Confident	0 Å²	0	25.9 Å²	25.9	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-61.7	-35.1	178.9	-65.8	169.2	0	0	0	112.7	V201 S202 G207 I286 L294 Q297 L300 L301 T310	V201-L205 HydrophobicContact CG1-CD1 3.82Å; V201-L205 HydrophobicContact CG1-CG 4.17Å; V201-L205 VanDerWaalsContact O-CG 3.27Å; V201-L205 WeakPolarHBondContact O-CG 3.42Å; V201-L205 PolarHBondContact O-N 2.94Å; S202-L205 PolarHBondContact O-N 3.22Å; L205-G207 VanDerWaalsContact C-N 3.31Å; L205-G207 PolarHBondContact O-N 3.13Å; L205-I286 HydrophobicContact CD2-CD1 4.23Å; L205-I286 HydrophobicContact CD2-CG2 3.94Å; L205-L294 HydrophobicContact CD2-CD2 3.77Å; L205-Q297 HydrophobicContact CD1-CB 4.37Å; L205-L300 HydrophobicContact CD1-CB 4.19Å; L205-L301 HydrophobicContact CB-CD2 4.16Å; L205-L301 HydrophobicContact CD1-CD2 4.02Å; L205-L301 HydrophobicContact CD1-CG 4.1Å; L205-L301 HydrophobicContact CD2-CD2 4.21Å; L205-L301 HydrophobicContact CG-CD2 4.35Å; L205-T310 HydrophobicContact CB-CG2 4.39Å; L205-T310 HydrophobicContact CD2-CG2 3.75Å; L205-T310 PolarHBondContact O-OG1 3.12Å
206	Q	86.3	Confident	88.1	Confident	5 Å²	5	24.6 Å²	24.6	2%	0.023	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82	-1.7	175.6	-69.3	-179.9	-8.8	0	0	114.5	R171 S202 Y203 V204 R208	R171-Q206 PolarHBondContact NE-O 3.19Å; R171-Q206 PolarHBondContact NH2-O 3.44Å; S202-Q206 WeakPolarHBondContact O-CB 3.41Å; S202-Q206 VanDerWaalsContact O-CG 3.32Å; S202-Q206 WeakPolarHBondContact O-CG 3.45Å; S202-Q206 PolarHBondContact O-N 3.07Å; Y203-Q206 PolarHBondContact O-N 2.93Å; V204-Q206 VanDerWaalsContact C-N 3.29Å; V204-Q206 PolarHBondContact O-N 3.47Å; Q206-R208 VanDerWaalsContact C-N 3.29Å; Q206-R208 HydrophobicContact CB-CG 4.34Å; Q206-R208 PolarHBondContact O-N 3Å
207	G	86.3	Confident	88	Confident	3 Å²	3	28.4 Å²	28.4	3%	0.031	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.5	21.7	-175.2	0	0	0	0	0	114.6	R171 Y203 V204 L205 L209	R171-G207 PolarHBondContact NH2-O 2.94Å; Y203-G207 PolarHBondContact O-N 3.3Å; V204-G207 PolarHBondContact O-N 2.82Å; L205-G207 VanDerWaalsContact C-N 3.31Å; L205-G207 PolarHBondContact O-N 3.13Å; G207-L209 VanDerWaalsContact C-N 3.32Å; G207-L209 PolarHBondContact O-N 3.35Å
208	R	87.9	Confident	87.8	Confident	50 Å²	50	31.1 Å²	31.1	19%	0.189	15%	0.15	C	C	.	.			trans	-89.9	66.7	175.3	-71	-174.1	71.7	-174.4	0.9	110.5	D178 Y203 Q206 E210 E211 A212	D178-R208 IonicContact OD1-CZ 2.9Å; D178-R208 IonicContact OD1-NH1 3.14Å; D178-R208 PolarHBondContact OD1-NH1 3.04Å; D178-R208 IonicContact OD1-NH2 3.92Å; D178-R208 IonicContact OD2-NH1 2.62Å; Y203-R208 HydrophobicContact CD1-CB 4Å; Y203-R208 HydrophobicContact CG-CB 4.47Å; Y203-R208 PolarHBondContact O-N 3.14Å; Q206-R208 VanDerWaalsContact C-N 3.29Å; Q206-R208 HydrophobicContact CB-CG 4.34Å; Q206-R208 PolarHBondContact O-N 3Å; R208-E210 VanDerWaalsContact C-N 3.33Å; R208-E210 PolarHBondContact O-N 3.23Å; R208-E211 WeakPolarHBondContact CB-OE2 3.41Å; R208-E211 IonicContact CZ-OE1 3.21Å; R208-E211 VanDerWaalsContact CZ-OE1 3.22Å; R208-E211 IonicContact NE-OE1 2.71Å; R208-E211 PolarHBondContact NE-OE1 2.82Å; R208-E211 IonicContact NE-OE2 3.63Å; R208-E211 IonicContact NH2-OE1 3.94Å; R208-E211 PolarHBondContact NH2-OE1 3.02Å; R208-A212 PolarHBondContact O-N 3.04Å
209	L	88.2	Confident	87.5	Confident	8 Å²	8	28.6 Å²	28.6	4%	0.042	14%	0.136	C	C	.	.	H	α-helix	trans	-71.2	-29.9	-168.3	-49.4	175.3	0	0	0	112.4	G207 A212 R213 L237 M240 F242	G207-L209 VanDerWaalsContact C-N 3.32Å; G207-L209 PolarHBondContact O-N 3.35Å; L209-A212 PolarHBondContact O-N 3.16Å; L209-R213 WeakPolarHBondContact O-CB 3.38Å; L209-R213 WeakPolarHBondContact O-CG 3.46Å; L209-R213 PolarHBondContact O-N 3.32Å; L209-L237 HydrophobicContact CD2-CD2 4.05Å; L209-M240 HydrophobicContact CD1-CB 3.48Å; L209-M240 VanDerWaalsContact CD1-CB 3.48Å; L209-M240 HydrophobicContact CD1-CE 4.37Å; L209-M240 HydrophobicContact CD1-CG 3.7Å; L209-M240 HydrophobicContact CD1-SD 3.21Å; L209-M240 WeakPolarHBondContact CD1-SD 3.49Å; L209-M240 HydrophobicContact CD2-SD 4.22Å; L209-M240 HydrophobicContact CG-SD 4.27Å; L209-F242 HydrophobicContact CD1-CE2 3.75Å; L209-F242 HydrophobicContact CD1-CZ 3.81Å; L209-F242 HydrophobicContact CG-CE2 4.47Å; L209-F242 HydrophobicContact CG-CZ 4.23Å
210	E	88.4	Confident	87.2	Confident	93 Å²	93	29.2 Å²	29.2	44%	0.435	14%	0.141	S	C	.	.	H	α-helix	trans	-68.4	-41.9	-178.6	-172.7	55.3	-149.5	0	0	111.4	R208 R213 Q214	R208-E210 VanDerWaalsContact C-N 3.33Å; R208-E210 PolarHBondContact O-N 3.23Å; E210-R213 WeakPolarHBondContact O-CB 3.42Å; E210-R213 PolarHBondContact O-N 3.03Å; E210-R213 IonicContact OE1-NH1 2.88Å; E210-R213 IonicContact OE2-CZ 2.69Å; E210-R213 IonicContact OE2-NH1 2.99Å; E210-R213 PolarHBondContact OE2-NH1 3.21Å; E210-Q214 WeakPolarHBondContact O-CG 3.1Å; E210-Q214 PolarHBondContact O-N 3.02Å
211	E	87.3	Confident	86.8	Confident	55 Å²	55	34.4 Å²	34.4	26%	0.257	17%	0.173	S	C	.	.	H	α-helix	trans	-65.7	-41.2	174.3	-62.6	91.3	149.2	0	0	111.2	Y203 R208 R213 Q214 M215	Y203-E211 HydrophobicContact CD1-CB 4.26Å; Y203-E211 HydrophobicContact CD2-CB 4Å; Y203-E211 HydrophobicContact CE1-CB 4.24Å; Y203-E211 HydrophobicContact CE2-CB 3.96Å; Y203-E211 HydrophobicContact CG-CB 4.14Å; R208-E211 WeakPolarHBondContact CB-OE2 3.41Å; R208-E211 IonicContact CZ-OE1 3.21Å; R208-E211 VanDerWaalsContact CZ-OE1 3.22Å; R208-E211 IonicContact NE-OE1 2.71Å; R208-E211 PolarHBondContact NE-OE1 2.82Å; R208-E211 IonicContact NE-OE2 3.63Å; R208-E211 IonicContact NH2-OE1 3.94Å; R208-E211 PolarHBondContact NH2-OE1 3.02Å; E211-R213 VanDerWaalsContact C-N 3.34Å; E211-R213 PolarHBondContact O-N 3.47Å; E211-Q214 PolarHBondContact O-N 2.92Å; E211-M215 WeakPolarHBondContact O-CG 3.48Å; E211-M215 PolarHBondContact O-N 3.47Å; E211-M215 VanDerWaalsContact O-N 3.08Å
212	A	89.2	Confident	86.4	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-59.8	-43.8	173.1	0	0	0	0	0	111.7	V204 R208 L209 M215 L216	V204-A212 HydrophobicContact CG2-CB 3.91Å; R208-A212 PolarHBondContact O-N 3.04Å; L209-A212 PolarHBondContact O-N 3.16Å; A212-M215 PolarHBondContact O-N 3.31Å; A212-L216 VanDerWaalsContact O-CG 3.28Å; A212-L216 WeakPolarHBondContact O-CG 3.32Å; A212-L216 PolarHBondContact O-N 2.85Å
213	R	90.3	Very high	85.9	Confident	41 Å²	41	42.3 Å²	42.3	16%	0.155	21%	0.212	C	C	.	.	H	α-helix	trans	-60.7	-48	176.4	-73.9	173.4	70.6	-139.2	-2.5	111.9	L209 E210 E211 M215 L216 V217 D234 L237	L209-R213 WeakPolarHBondContact O-CB 3.38Å; L209-R213 WeakPolarHBondContact O-CG 3.46Å; L209-R213 PolarHBondContact O-N 3.32Å; E210-R213 WeakPolarHBondContact O-CB 3.42Å; E210-R213 PolarHBondContact O-N 3.03Å; E210-R213 IonicContact OE1-NH1 2.88Å; E210-R213 IonicContact OE2-CZ 2.69Å; E210-R213 IonicContact OE2-NH1 2.99Å; E210-R213 PolarHBondContact OE2-NH1 3.21Å; E211-R213 VanDerWaalsContact C-N 3.34Å; E211-R213 PolarHBondContact O-N 3.47Å; R213-M215 PolarHBondContact O-N 2.94Å; R213-L216 PolarHBondContact O-N 3.17Å; R213-L216 VanDerWaalsContact O-N 3.15Å; R213-V217 WeakPolarHBondContact O-CG2 3.42Å; R213-V217 PolarHBondContact O-N 3.1Å; R213-D234 WeakPolarHBondContact CG-OD1 3.42Å; R213-D234 IonicContact CZ-OD1 3.83Å; R213-D234 VanDerWaalsContact CZ-OD1 3.3Å; R213-D234 IonicContact CZ-OD2 2.76Å; R213-D234 IonicContact NE-OD1 3.81Å; R213-D234 PolarHBondContact NE-OD1 3.02Å; R213-D234 IonicContact NE-OD2 3.23Å; R213-D234 IonicContact NH2-OD1 3.85Å; R213-D234 PolarHBondContact NH2-OD1 2.98Å; R213-D234 IonicContact NH2-OD2 2.99Å; R213-D234 PolarHBondContact NH2-OD2 3.44Å; R213-L237 HydrophobicContact CG-CB 3.66Å; R213-L237 HydrophobicContact CG-CD1 3.82Å; R213-L237 HydrophobicContact CG-CG 4.41Å
214	Q	87.8	Confident	85.1	Confident	113 Å²	113	46.1 Å²	46.1	53%	0.528	24%	0.238	S	C	.	.	H	α-helix	trans	-58.9	-38.2	178.9	-72.3	173.9	21.7	0	0	112.3	E210 E211	E210-Q214 WeakPolarHBondContact O-CG 3.1Å; E210-Q214 PolarHBondContact O-N 3.02Å; E211-Q214 PolarHBondContact O-N 2.92Å
215	M	85.2	Confident	84.4	Confident	8 Å²	8	50.9 Å²	50.9	4%	0.039	28%	0.277	C	S	.	.	H	α-helix	trans	-66.6	-53.1	173.2	-66.8	-65.5	-85.9	0	0	110.4	V184 L185 Y196 V200 Y203 E211 A212 R213 V217 K218 Q219	V184-M215 HydrophobicContact CG1-CE 3.84Å; L185-M215 HydrophobicContact CD2-CE 4.32Å; L185-M215 HydrophobicContact CD2-SD 3.73Å; Y196-M215 HydrophobicContact CD2-CE 3.54Å; Y196-M215 HydrophobicContact CE2-CB 4.34Å; Y196-M215 HydrophobicContact CE2-CE 3.35Å; Y196-M215 HydrophobicContact CE2-SD 4.24Å; Y196-M215 PolarHBondContact OH-O 3.39Å; V200-M215 HydrophobicContact CG2-CB 3.73Å; V200-M215 HydrophobicContact CG2-CG 4.46Å; Y203-M215 HydrophobicContact CE2-CG 4.46Å; E211-M215 WeakPolarHBondContact O-CG 3.48Å; E211-M215 PolarHBondContact O-N 3.47Å; E211-M215 VanDerWaalsContact O-N 3.08Å; A212-M215 PolarHBondContact O-N 3.31Å; R213-M215 PolarHBondContact O-N 2.94Å; M215-V217 PolarHBondContact O-N 3.11Å; M215-V217 VanDerWaalsContact O-N 3.09Å; M215-K218 WeakPolarHBondContact O-CA 3.46Å; M215-K218 VanDerWaalsContact O-CB 3.31Å; M215-K218 WeakPolarHBondContact O-CB 3.4Å; M215-K218 PolarHBondContact O-N 3.35Å; M215-Q219 PolarHBondContact O-N 3.09Å
216	L	86.3	Confident	83.9	Confident	8 Å²	8	52 Å²	52	4%	0.042	29%	0.285	C	S	.	.	H	α-helix	trans	-55.1	-33.4	-179.8	-71.2	172.3	0	0	0	113.9	W197 V200 A212 R213 K218 Q219 A220 Y230 M233 L237 L280 I283	W197-L216 HydrophobicContact CH2-CD2 4.22Å; W197-L216 HydrophobicContact CZ3-CD2 3.86Å; V200-L216 HydrophobicContact CG1-CD2 4.03Å; V200-L216 HydrophobicContact CG1-CG 4.16Å; A212-L216 VanDerWaalsContact O-CG 3.28Å; A212-L216 WeakPolarHBondContact O-CG 3.32Å; A212-L216 PolarHBondContact O-N 2.85Å; R213-L216 PolarHBondContact O-N 3.17Å; R213-L216 VanDerWaalsContact O-N 3.15Å; L216-K218 VanDerWaalsContact C-N 3.32Å; L216-K218 PolarHBondContact O-N 3.02Å; L216-Q219 PolarHBondContact O-N 3.42Å; L216-A220 WeakPolarHBondContact O-CB 3.27Å; L216-A220 PolarHBondContact O-N 3.08Å; L216-Y230 HydrophobicContact CD2-CD1 4.39Å; L216-Y230 HydrophobicContact CD2-CE1 4.22Å; L216-M233 HydrophobicContact CD1-CG 4.21Å; L216-L237 HydrophobicContact CD1-CD1 3.62Å; L216-L280 HydrophobicContact CD2-CD2 4.12Å; L216-I283 HydrophobicContact CD1-CD1 4.45Å; L216-I283 HydrophobicContact CD2-CD1 4.26Å
217	V	86.5	Confident	83.7	Confident	80 Å²	80	58.5 Å²	58.5	49%	0.485	31%	0.309	S	S	.	.	H	α-helix	trans	-62.2	-37.2	174.3	171	0	0	0	0	112.3	R213 M215 A220 T221	R213-V217 WeakPolarHBondContact O-CG2 3.42Å; R213-V217 PolarHBondContact O-N 3.1Å; M215-V217 PolarHBondContact O-N 3.11Å; M215-V217 VanDerWaalsContact O-N 3.09Å; V217-A220 PolarHBondContact O-N 3.28Å; V217-T221 PolarHBondContact O-N 2.72Å; V217-T221 PolarHBondContact O-OG1 2.99Å
218	K	83.1	Confident	83.5	Confident	93 Å²	93	64 Å²	64	40%	0.404	34%	0.338	S	S	.	.	H	α-helix	trans	-64.1	-42.7	175.8	-62.5	177.7	-179	180	0	110.7	M215 L216 T221	M215-K218 WeakPolarHBondContact O-CA 3.46Å; M215-K218 VanDerWaalsContact O-CB 3.31Å; M215-K218 WeakPolarHBondContact O-CB 3.4Å; M215-K218 PolarHBondContact O-N 3.35Å; L216-K218 VanDerWaalsContact C-N 3.32Å; L216-K218 PolarHBondContact O-N 3.02Å; K218-T221 WeakPolarHBondContact O-CB 3.38Å; K218-T221 PolarHBondContact O-N 3.05Å
219	Q	82.1	Confident	83.2	Confident	15 Å²	15	63.4 Å²	63.4	7%	0.07	34%	0.338	C	S	.	.	H	α-helix	trans	-67.6	-38.1	176	-166.8	68.1	-6	0	0	113	Y196 W197 M215 L216 T221 L222 Q223 Y230	Y196-Q219 HydrophobicContact CE1-CB 4.34Å; W197-Q219 HydrophobicContact CH2-CG 4.2Å; W197-Q219 HydrophobicContact CZ2-CG 3.89Å; M215-Q219 PolarHBondContact O-N 3.09Å; L216-Q219 PolarHBondContact O-N 3.42Å; Q219-T221 PolarHBondContact O-N 2.88Å; Q219-L222 PolarHBondContact O-N 2.9Å; Q219-L222 VanDerWaalsContact O-N 3.1Å; Q219-Q223 PolarHBondContact O-N 2.62Å; Q219-Q223 VanDerWaalsContact O-N 3.13Å; Q219-Y230 HydrophobicContact CB-CE1 4.34Å; Q219-Y230 HydrophobicContact CG-CE1 4.2Å; Q219-Y230 WeakPolarHBondContact CG-OH 3.33Å
220	A	80.8	Confident	83.1	Confident	16 Å²	16	63.4 Å²	63.4	13%	0.132	34%	0.337	C	S	.	.	H	α-helix	trans	-62.3	-24.5	176.9	0	0	0	0	0	113	L216 V217 Y230	L216-A220 WeakPolarHBondContact O-CB 3.27Å; L216-A220 PolarHBondContact O-N 3.08Å; V217-A220 PolarHBondContact O-N 3.28Å; A220-Y230 HydrophobicContact CB-CD1 4.31Å; A220-Y230 HydrophobicContact CB-CD2 3.86Å; A220-Y230 HydrophobicContact CB-CG 3.69Å
221	T	80.6	Confident	83	Confident	109 Å²	109	65 Å²	65	67%	0.669	34%	0.343	S	S	*	.	H	α-helix	trans	-75.4	-33.5	176.5	-55	0	0	0	0	111.7	V217 K218 Q219	V217-T221 PolarHBondContact O-N 2.72Å; V217-T221 PolarHBondContact O-OG1 2.99Å; K218-T221 WeakPolarHBondContact O-CB 3.38Å; K218-T221 PolarHBondContact O-N 3.05Å; Q219-T221 PolarHBondContact O-N 2.88Å
222	L	79.8	Confident	83	Confident	101 Å²	101	65.6 Å²	65.6	53%	0.529	35%	0.347	S	S	.	.	H	α-helix	trans	-81.3	-24	178.7	-66.5	168.4	0	0	0	113.2	A191 Q219 P224	A191-L222 HydrophobicContact CB-CD1 3.24Å; Q219-L222 PolarHBondContact O-N 2.9Å; Q219-L222 VanDerWaalsContact O-N 3.1Å; L222-P224 WeakPolarHBondContact O-CD 3.38Å
223	Q	79.1	Confident	82.9	Confident	77 Å²	77	65.6 Å²	65.6	36%	0.36	35%	0.347	S	S	.	.			trans	-120	78.7	179.5	-66.1	-177.1	-9.4	0	0	112.4	Q219 A225 S226 Y230	Q219-Q223 PolarHBondContact O-N 2.62Å; Q219-Q223 VanDerWaalsContact O-N 3.13Å; Q223-A225 PolarHBondContact O-N 3.38Å; Q223-S226 PolarHBondContact O-N 2.86Å; Q223-Y230 HydrophobicContact CB-CE2 4.3Å; Q223-Y230 PolarHBondContact OE1-OH 3.2Å
224	P	73.5	Confident	82.8	Confident	94 Å²	94	65.7 Å²	65.7	61%	0.61	35%	0.351	S	S	*	.	G	3₁₀ helix	trans	-60.8	-30.1	-178.3	-21.9	31.6	0	0	0	113.9	L222 S226 R227	L222-P224 WeakPolarHBondContact O-CD 3.38Å; P224-S226 VanDerWaalsContact C-N 3.29Å; P224-S226 PolarHBondContact O-N 3.25Å; P224-R227 WeakPolarHBondContact O-CB 3.42Å; P224-R227 PolarHBondContact O-N 2.88Å
225	A	74.3	Confident	82.8	Confident	100 Å²	100	61.6 Å²	61.6	83%	0.826	34%	0.339	S	S	*	.	G	3₁₀ helix	trans	-63.4	-33	-179.4	0	0	0	0	0	112.9	Q223	Q223-A225 PolarHBondContact O-N 3.38Å
226	S	79.6	Confident	83	Confident	22 Å²	22	61.3 Å²	61.3	15%	0.154	34%	0.337	C	S	.	.	G	3₁₀ helix	trans	-100.4	9.6	-179.5	-55.1	0	0	0	0	112.6	Q223 P224 N228 M229 Y230	Q223-S226 PolarHBondContact O-N 2.86Å; P224-S226 VanDerWaalsContact C-N 3.29Å; P224-S226 PolarHBondContact O-N 3.25Å; S226-N228 PolarHBondContact O-N 3Å; S226-N228 VanDerWaalsContact O-N 3.16Å; S226-M229 WeakPolarHBondContact O-CB 3.38Å; S226-M229 PolarHBondContact O-N 3.39Å; S226-Y230 WeakPolarHBondContact O-CD2 3.36Å; S226-Y230 PolarHBondContact O-N 2.67Å; S226-Y230 VanDerWaalsContact O-N 3.1Å
227	R	81.1	Confident	83.1	Confident	142 Å²	142	61.1 Å²	61.1	54%	0.536	34%	0.336	S	S	.	.	H	α-helix	trans	-56.3	-35.3	-174.4	-172.8	176.4	-173.8	-178.7	2.8	113.5	P224 K231	P224-R227 WeakPolarHBondContact O-CB 3.42Å; P224-R227 PolarHBondContact O-N 2.88Å; R227-K231 WeakPolarHBondContact O-CG 3.41Å; R227-K231 PolarHBondContact O-N 3.48Å
228	N	82.1	Confident	83.3	Confident	119 Å²	119	60.7 Å²	60.7	64%	0.636	34%	0.337	S	S	*	.	H	α-helix	trans	-67.9	-38.1	176.9	-69.2	-19.4	0	0	0	111.8	S226 K231 L232	S226-N228 PolarHBondContact O-N 3Å; S226-N228 VanDerWaalsContact O-N 3.16Å; N228-K231 PolarHBondContact O-N 3.45Å; N228-L232 WeakPolarHBondContact O-CG 3.46Å; N228-L232 PolarHBondContact O-N 3.05Å
229	M	83	Confident	83.6	Confident	37 Å²	37	62 Å²	62	18%	0.182	34%	0.343	C	S	.	.	H	α-helix	trans	-65.6	-44.4	175.5	-57.7	173.6	-154	0	0	110.9	S226 K231 L232 M233 F274 L280	S226-M229 WeakPolarHBondContact O-CB 3.38Å; S226-M229 PolarHBondContact O-N 3.39Å; M229-K231 VanDerWaalsContact C-N 3.33Å; M229-K231 PolarHBondContact O-N 3.18Å; M229-L232 PolarHBondContact O-N 3.16Å; M229-M233 PolarHBondContact O-N 3.27Å; M229-F274 HydrophobicContact CB-CD1 4.2Å; M229-F274 HydrophobicContact CB-CE1 4.31Å; M229-L280 HydrophobicContact CB-CD1 3.98Å
230	Y	85.6	Confident	83.9	Confident	9 Å²	9	61.9 Å²	61.9	4%	0.035	34%	0.342	C	S	.	.	H	α-helix	trans	-62.6	-37.6	176.1	-72.1	-73.7	0	0	0	112.5	W197 L216 Q219 A220 Q223 S226 M233 D234 N277 L280	W197-Y230 HydrophobicContact CH2-CE1 4.37Å; L216-Y230 HydrophobicContact CD2-CD1 4.39Å; L216-Y230 HydrophobicContact CD2-CE1 4.22Å; Q219-Y230 HydrophobicContact CB-CE1 4.34Å; Q219-Y230 HydrophobicContact CG-CE1 4.2Å; Q219-Y230 WeakPolarHBondContact CG-OH 3.33Å; A220-Y230 HydrophobicContact CB-CD1 4.31Å; A220-Y230 HydrophobicContact CB-CD2 3.86Å; A220-Y230 HydrophobicContact CB-CG 3.69Å; Q223-Y230 HydrophobicContact CB-CE2 4.3Å; Q223-Y230 PolarHBondContact OE1-OH 3.2Å; S226-Y230 WeakPolarHBondContact O-CD2 3.36Å; S226-Y230 PolarHBondContact O-N 2.67Å; S226-Y230 VanDerWaalsContact O-N 3.1Å; Y230-M233 PolarHBondContact O-N 3.31Å; Y230-D234 VanDerWaalsContact O-CB 3.29Å; Y230-D234 WeakPolarHBondContact O-CB 3.28Å; Y230-D234 PolarHBondContact O-N 3.44Å; Y230-N277 PolarHBondContact OH-ND2 3.31Å; Y230-L280 HydrophobicContact CD1-CD1 3.9Å; Y230-L280 HydrophobicContact CD1-CD2 3.91Å; Y230-L280 HydrophobicContact CD1-CG 4.41Å; Y230-L280 HydrophobicContact CE1-CD1 3.83Å; Y230-L280 HydrophobicContact CE1-CD2 3.79Å; Y230-L280 HydrophobicContact CE1-CG 4.07Å; Y230-L280 HydrophobicContact CE2-CD1 4.49Å; Y230-L280 HydrophobicContact CG-CD1 4.26Å
231	K	85.9	Confident	84.1	Confident	126 Å²	126	62.2 Å²	62.2	55%	0.548	34%	0.343	S	S	.	.	H	α-helix	trans	-65.4	-38.8	173.8	-78	-177.7	176.9	-174.7	0	113	R227 N228 M229 G235	R227-K231 WeakPolarHBondContact O-CG 3.41Å; R227-K231 PolarHBondContact O-N 3.48Å; N228-K231 PolarHBondContact O-N 3.45Å; M229-K231 VanDerWaalsContact C-N 3.33Å; M229-K231 PolarHBondContact O-N 3.18Å; K231-G235 PolarHBondContact O-N 3.18Å
232	L	86.4	Confident	84.3	Confident	67 Å²	67	61 Å²	61	35%	0.351	33%	0.329	S	S	.	.	H	α-helix	trans	-65.6	-46.7	176	-72.4	168.8	0	0	0	110.7	N228 M229 D234 G235 L236 T273 F274	N228-L232 WeakPolarHBondContact O-CG 3.46Å; N228-L232 PolarHBondContact O-N 3.05Å; M229-L232 PolarHBondContact O-N 3.16Å; L232-D234 PolarHBondContact O-N 3.32Å; L232-G235 PolarHBondContact O-N 3.42Å; L232-G235 VanDerWaalsContact O-N 3.16Å; L232-L236 WeakPolarHBondContact O-CG 3.34Å; L232-L236 PolarHBondContact O-N 3.4Å; L232-T273 HydrophobicContact CD1-CG2 4.08Å; L232-F274 HydrophobicContact CB-CE1 4.45Å; L232-F274 HydrophobicContact CB-CZ 4.38Å
233	M	87.5	Confident	84.4	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-60.6	-43.5	175.2	-175.4	60	72.2	0	0	111.9	L216 M229 Y230 G235 L236 L237 F274 L280 I283 C284 L287	L216-M233 HydrophobicContact CD1-CG 4.21Å; M229-M233 PolarHBondContact O-N 3.27Å; Y230-M233 PolarHBondContact O-N 3.31Å; M233-G235 VanDerWaalsContact C-N 3.27Å; M233-G235 PolarHBondContact O-N 2.86Å; M233-L236 PolarHBondContact O-N 3.03Å; M233-L236 VanDerWaalsContact O-N 3.14Å; M233-L237 HydrophobicContact CG-CD1 4.04Å; M233-L237 HydrophobicContact CG-CG 4.37Å; M233-L237 WeakPolarHBondContact O-CG 3.44Å; M233-L237 PolarHBondContact O-N 2.94Å; M233-L237 HydrophobicContact SD-CD1 4.48Å; M233-L237 HydrophobicContact SD-CG 4.29Å; M233-F274 HydrophobicContact CB-CE1 4.21Å; M233-F274 HydrophobicContact CB-CZ 4.41Å; M233-F274 HydrophobicContact CE-CD1 4.35Å; M233-F274 HydrophobicContact CE-CD2 4.26Å; M233-F274 HydrophobicContact CE-CE1 4.06Å; M233-F274 HydrophobicContact CE-CE2 3.95Å; M233-F274 HydrophobicContact CE-CG 4.45Å; M233-F274 HydrophobicContact CE-CZ 3.85Å; M233-L280 HydrophobicContact CB-CD2 4.36Å; M233-L280 HydrophobicContact CE-CB 4.36Å; M233-L280 VanDerWaalsContact CE-O 3.24Å; M233-L280 WeakPolarHBondContact CE-O 3.44Å; M233-L280 HydrophobicContact CG-CD2 4.13Å; M233-I283 HydrophobicContact CE-CB 4.24Å; M233-I283 HydrophobicContact CE-CG2 4.02Å; M233-I283 HydrophobicContact SD-CG2 3.76Å; M233-C284 HydrophobicContact CE-CB 4.01Å; M233-L287 HydrophobicContact SD-CD1 3.99Å
234	D	88.9	Confident	84.4	Confident	44 Å²	44	58.9 Å²	58.9	24%	0.235	32%	0.318	C	S	.	.	H	α-helix	trans	-57.7	-41.4	174.5	-174.7	67.4	0	0	0	112	R213 Y230 L232 L237 S238	R213-D234 WeakPolarHBondContact CG-OD1 3.42Å; R213-D234 IonicContact CZ-OD1 3.83Å; R213-D234 VanDerWaalsContact CZ-OD1 3.3Å; R213-D234 IonicContact CZ-OD2 2.76Å; R213-D234 IonicContact NE-OD1 3.81Å; R213-D234 PolarHBondContact NE-OD1 3.02Å; R213-D234 IonicContact NE-OD2 3.23Å; R213-D234 IonicContact NH2-OD1 3.85Å; R213-D234 PolarHBondContact NH2-OD1 2.98Å; R213-D234 IonicContact NH2-OD2 2.99Å; R213-D234 PolarHBondContact NH2-OD2 3.44Å; Y230-D234 VanDerWaalsContact O-CB 3.29Å; Y230-D234 WeakPolarHBondContact O-CB 3.28Å; Y230-D234 PolarHBondContact O-N 3.44Å; L232-D234 PolarHBondContact O-N 3.32Å; D234-L237 PolarHBondContact O-N 3.35Å; D234-S238 VanDerWaalsContact O-CB 3.24Å; D234-S238 WeakPolarHBondContact O-CB 3.4Å; D234-S238 PolarHBondContact O-N 3.05Å
235	G	88	Confident	84.2	Confident	26 Å²	26	58 Å²	58	27%	0.268	31%	0.312	S	S	.	.	H	α-helix	trans	-63.1	-42.1	174.2	0	0	0	0	0	113.2	K231 L232 M233 K239	K231-G235 PolarHBondContact O-N 3.18Å; L232-G235 PolarHBondContact O-N 3.42Å; L232-G235 VanDerWaalsContact O-N 3.16Å; M233-G235 VanDerWaalsContact C-N 3.27Å; M233-G235 PolarHBondContact O-N 2.86Å; G235-K239 WeakPolarHBondContact O-CB 3.39Å; G235-K239 WeakPolarHBondContact O-CG 3.42Å; G235-K239 PolarHBondContact O-N 3.47Å; G235-K239 VanDerWaalsContact O-N 3.11Å
236	L	88.6	Confident	83.7	Confident	2 Å²	2	56.8 Å²	56.8	1%	0.01	31%	0.309	C	S	.	.	H	α-helix	trans	-64.5	-45.9	176.7	-68.5	176.4	0	0	0	111.7	L232 M233 K239 M240 W261 E264 V265 Y268 F274	L232-L236 WeakPolarHBondContact O-CG 3.34Å; L232-L236 PolarHBondContact O-N 3.4Å; M233-L236 PolarHBondContact O-N 3.03Å; M233-L236 VanDerWaalsContact O-N 3.14Å; L236-K239 PolarHBondContact O-N 2.88Å; L236-M240 PolarHBondContact O-N 3.43Å; L236-W261 PolarHBondContact O-NE1 3.44Å; L236-E264 HydrophobicContact CD2-CG 4.01Å; L236-V265 HydrophobicContact CD1-CG2 4.45Å; L236-V265 HydrophobicContact CD2-CG2 4.07Å; L236-Y268 HydrophobicContact CD1-CD2 3.93Å; L236-Y268 HydrophobicContact CD1-CG 4.49Å; L236-Y268 HydrophobicContact CD2-CD2 3.85Å; L236-Y268 HydrophobicContact CD2-CE2 3.91Å; L236-Y268 HydrophobicContact CG-CD2 4.35Å; L236-F274 HydrophobicContact CD1-CE2 4.22Å; L236-F274 HydrophobicContact CD1-CZ 4.16Å
237	L	89.7	Confident	83.3	Confident	4 Å²	4	57.5 Å²	57.5	2%	0.021	32%	0.32	C	S	.	.	H	α-helix	trans	-65.5	-42.2	178.4	-66.8	173.2	0	0	0	111.7	L209 R213 L216 M233 D234 K239 M240 L287	L209-L237 HydrophobicContact CD2-CD2 4.05Å; R213-L237 HydrophobicContact CG-CB 3.66Å; R213-L237 HydrophobicContact CG-CD1 3.82Å; R213-L237 HydrophobicContact CG-CG 4.41Å; L216-L237 HydrophobicContact CD1-CD1 3.62Å; M233-L237 HydrophobicContact CG-CD1 4.04Å; M233-L237 HydrophobicContact CG-CG 4.37Å; M233-L237 WeakPolarHBondContact O-CG 3.44Å; M233-L237 PolarHBondContact O-N 2.94Å; M233-L237 HydrophobicContact SD-CD1 4.48Å; M233-L237 HydrophobicContact SD-CG 4.29Å; D234-L237 PolarHBondContact O-N 3.35Å; L237-K239 VanDerWaalsContact C-N 3.31Å; L237-K239 PolarHBondContact O-N 3.33Å; L237-M240 PolarHBondContact O-N 3.2Å; L237-L287 HydrophobicContact CD2-CD1 3.87Å; L237-L287 HydrophobicContact CD2-CD2 3.98Å; L237-L287 HydrophobicContact CD2-CG 4.47Å
238	S	90.6	Very high	82.7	Confident	72 Å²	72	57.7 Å²	57.7	50%	0.503	34%	0.337	S	S	.	.	H	α-helix	trans	-68.6	-28.4	179.7	-176	0	0	0	0	113.5	D234	D234-S238 VanDerWaalsContact O-CB 3.24Å; D234-S238 WeakPolarHBondContact O-CB 3.4Å; D234-S238 PolarHBondContact O-N 3.05Å
239	K	88.7	Confident	82.6	Confident	121 Å²	121	53.7 Å²	53.7	53%	0.526	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.8	-6.8	-179.9	-73.4	176	-176.1	-179.8	0	113.3	G235 L236 L237 P241 E264	G235-K239 WeakPolarHBondContact O-CB 3.39Å; G235-K239 WeakPolarHBondContact O-CG 3.42Å; G235-K239 PolarHBondContact O-N 3.47Å; G235-K239 VanDerWaalsContact O-N 3.11Å; L236-K239 PolarHBondContact O-N 2.88Å; L237-K239 VanDerWaalsContact C-N 3.31Å; L237-K239 PolarHBondContact O-N 3.33Å; K239-P241 WeakPolarHBondContact O-CD 3.41Å; K239-E264 IonicContact NZ-OE1 3.14Å; K239-E264 PolarHBondContact NZ-OE1 3.02Å; K239-E264 IonicContact NZ-OE2 3.11Å
240	M	87.3	Confident	82.6	Confident	11 Å²	11	54.8 Å²	54.8	5%	0.054	32%	0.323	C	S	.	.			trans	-59.7	123	-176.9	-177.5	164.6	164.6	0	0	110.3	L209 L236 L237 W261 L313 Y314	L209-M240 HydrophobicContact CD1-CB 3.48Å; L209-M240 VanDerWaalsContact CD1-CB 3.48Å; L209-M240 HydrophobicContact CD1-CE 4.37Å; L209-M240 HydrophobicContact CD1-CG 3.7Å; L209-M240 HydrophobicContact CD1-SD 3.21Å; L209-M240 WeakPolarHBondContact CD1-SD 3.49Å; L209-M240 HydrophobicContact CD2-SD 4.22Å; L209-M240 HydrophobicContact CG-SD 4.27Å; L236-M240 PolarHBondContact O-N 3.43Å; L237-M240 PolarHBondContact O-N 3.2Å; M240-W261 HydrophobicContact CB-CZ2 3.81Å; M240-W261 HydrophobicContact CE-CH2 4.22Å; M240-W261 HydrophobicContact CG-CD2 4.38Å; M240-W261 HydrophobicContact CG-CH2 3.86Å; M240-W261 HydrophobicContact CG-CZ2 3.65Å; M240-W261 HydrophobicContact CG-CZ3 4.28Å; M240-W261 HydrophobicContact SD-CH2 3.52Å; M240-W261 VanDerWaalsContact SD-CH2 3.52Å; M240-W261 HydrophobicContact SD-CZ2 3.61Å; M240-W261 HydrophobicContact SD-CZ3 4.3Å; M240-L313 HydrophobicContact CE-CD1 3.55Å; M240-L313 HydrophobicContact CE-CD2 4.08Å; M240-L313 HydrophobicContact CE-CG 3.72Å; M240-Y314 HydrophobicContact CE-CD1 4.17Å; M240-Y314 HydrophobicContact CE-CE1 3.63Å; M240-Y314 HydrophobicContact SD-CE1 3.84Å
241	P	85.6	Confident	82.4	Confident	23 Å²	23	57.1 Å²	57.1	15%	0.149	34%	0.336	C	S	.	.			trans	-79.7	131.7	-175.5	27.4	-28.5	0	0	0	111.2	K239 F254 W258 W261	K239-P241 WeakPolarHBondContact O-CD 3.41Å; P241-F254 HydrophobicContact CB-CD2 4.41Å; P241-F254 HydrophobicContact CB-CE2 4.08Å; P241-F254 WeakPolarHBondContact O-CE2 3.05Å; P241-W258 VanDerWaalsContact CG-CA 3.49Å; P241-W258 HydrophobicContact CG-CB 3.83Å; P241-W258 HydrophobicContact CG-CG 4.25Å; P241-W261 HydrophobicContact CG-CB 4.44Å
242	F	84.6	Confident	82.4	Confident	85 Å²	85	55.9 Å²	55.9	37%	0.373	34%	0.339	S	S	.	.			trans	-108.6	141.8	166.5	-71.5	-86.3	0	0	0	110	L164 L209	L164-F242 HydrophobicContact CD2-CD1 4.2Å; L209-F242 HydrophobicContact CD1-CE2 3.75Å; L209-F242 HydrophobicContact CD1-CZ 3.81Å; L209-F242 HydrophobicContact CG-CE2 4.47Å; L209-F242 HydrophobicContact CG-CZ 4.23Å
243	Y	82.4	Confident	82.3	Confident	41 Å²	41	57.1 Å²	57.1	16%	0.161	34%	0.343	C	S	.	.			trans	-67.5	134.9	176.8	-175.6	-111.7	0	0	0	109.9	L164 P245 L251 F254	L164-Y243 WeakPolarHBondContact CD1-O 3.49Å; Y243-P245 HydrophobicContact CD1-CG 4.07Å; Y243-P245 HydrophobicContact CE1-CB 4.26Å; Y243-P245 HydrophobicContact CE1-CG 4.16Å; Y243-L251 HydrophobicContact CE2-CD1 4.34Å; Y243-F254 HydrophobicContact CD2-CB 3.95Å; Y243-F254 HydrophobicContact CD2-CD1 4.1Å; Y243-F254 HydrophobicContact CD2-CD2 4.33Å; Y243-F254 AromaticContact CD2-CG 3.85Å; Y243-F254 HydrophobicContact CD2-CG 3.85Å
244	N	79.6	Confident	82.3	Confident	92 Å²	92	57.4 Å²	57.4	49%	0.492	35%	0.345	S	S	.	.			trans	-112.7	102.4	175.7	-175.2	-1.1	0	0	0	110.2	G246 G247	N244-G246 PolarHBondContact O-N 3.16Å; N244-G246 PolarHBondContact OD1-N 3.46Å; N244-G246 VanDerWaalsContact OD1-N 3.16Å; N244-G247 PolarHBondContact O-N 2.93Å
245	P	68.6	Low	82.2	Confident	76 Å²	76	56.9 Å²	56.9	49%	0.494	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-24.4	-177.4	-18.5	30.5	0	0	0	113.9	S161 L164 Y243	S161-P245 WeakPolarHBondContact OG-CG 3.23Å; L164-P245 HydrophobicContact CD1-CG 4.15Å; Y243-P245 HydrophobicContact CD1-CG 4.07Å; Y243-P245 HydrophobicContact CE1-CB 4.26Å; Y243-P245 HydrophobicContact CE1-CG 4.16Å
246	G	64.3	Low	82.3	Confident	74 Å²	74	58.7 Å²	58.7	76%	0.763	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.8	-3	-179.7	0	0	0	0	0	114.4	N244	N244-G246 PolarHBondContact O-N 3.16Å; N244-G246 PolarHBondContact OD1-N 3.46Å; N244-G246 VanDerWaalsContact OD1-N 3.16Å
247	G	70	Confident	82.3	Confident	37 Å²	37	64.1 Å²	64.1	38%	0.381	37%	0.371	S	S	.	.	S	Bend	trans	-90.7	170.2	179.1	0	0	0	0	0	113.2	N244 Q249	N244-G247 PolarHBondContact O-N 2.93Å; G247-Q249 PolarHBondContact O-N 3.32Å
248	T	69.9	Low	82.4	Confident	146 Å²	146	64.7 Å²	64.7	90%	0.896	37%	0.373	S	S	*	.	S	Bend	trans	-76.8	6	171.9	56.4	0	0	0	0	113.4	T250	T248-T250 PolarHBondContact O-N 3.48Å
249	Q	78.8	Confident	82.4	Confident	34 Å²	34	67 Å²	67	16%	0.159	37%	0.371	C	S	.	.			trans	-74.9	125.8	-173.7	-175.7	175.5	28.6	0	0	110.5	G247 E253 F254	G247-Q249 PolarHBondContact O-N 3.32Å; Q249-E253 HydrophobicContact CG-CB 4.04Å; Q249-F254 HydrophobicContact CG-CB 4.3Å
250	T	83.2	Confident	82.5	Confident	60 Å²	60	65.7 Å²	65.7	37%	0.368	37%	0.369	S	S	.	.			trans	-76.8	153	173.2	61.3	0	0	0	0	111.2	T248 T252 E253 F254	T248-T250 PolarHBondContact O-N 3.48Å; T250-T252 PolarHBondContact O-N 2.98Å; T250-T252 PolarHBondContact OG1-OG1 2.91Å; T250-E253 PolarHBondContact O-N 3.38Å; T250-E253 VanDerWaalsContact O-N 3.08Å; T250-E253 WeakPolarHBondContact OG1-CB 3.44Å; T250-E253 WeakPolarHBondContact OG1-CG 3.36Å; T250-E253 PolarHBondContact OG1-N 3.43Å; T250-E253 PolarHBondContact OG1-OE1 3.42Å; T250-F254 PolarHBondContact O-N 2.97Å
251	L	82.4	Confident	82.8	Confident	59 Å²	59	65.5 Å²	65.5	31%	0.309	37%	0.368	S	S	.	.	H	α-helix	trans	-54.5	-37.3	175.4	-167.5	84.4	0	0	0	111.6	A159 Y243 F254 D255 T318	A159-L251 HydrophobicContact CB-CD1 4.32Å; A159-L251 HydrophobicContact CB-CD2 4.23Å; A159-L251 WeakPolarHBondContact O-CD1 3.4Å; Y243-L251 HydrophobicContact CE2-CD1 4.34Å; L251-F254 PolarHBondContact O-N 3.12Å; L251-D255 WeakPolarHBondContact O-CB 3.3Å; L251-D255 PolarHBondContact O-N 3.35Å; L251-T318 HydrophobicContact CD1-CG2 4.09Å; L251-T318 HydrophobicContact CD2-CG2 4.36Å; L251-T318 HydrophobicContact CG-CG2 3.95Å
252	T	84.6	Confident	83.2	Confident	99 Å²	99	66.3 Å²	66.3	61%	0.607	37%	0.37	S	S	*	.	H	α-helix	trans	-66.9	-40.7	177.2	42.7	0	0	0	0	113.1	T250 F254 D255 V256	T250-T252 PolarHBondContact O-N 2.98Å; T250-T252 PolarHBondContact OG1-OG1 2.91Å; T252-F254 VanDerWaalsContact C-N 3.32Å; T252-D255 PolarHBondContact O-N 2.95Å; T252-V256 WeakPolarHBondContact O-CG2 3.37Å; T252-V256 PolarHBondContact O-N 3.37Å
253	E	85.6	Confident	83.4	Confident	93 Å²	93	67.4 Å²	67.4	44%	0.435	38%	0.376	S	S	.	.	H	α-helix	trans	-66.5	-37.4	175.3	-78	161	-140.5	0	0	111.9	Q249 T250 K257	Q249-E253 HydrophobicContact CG-CB 4.04Å; T250-E253 PolarHBondContact O-N 3.38Å; T250-E253 VanDerWaalsContact O-N 3.08Å; T250-E253 WeakPolarHBondContact OG1-CB 3.44Å; T250-E253 WeakPolarHBondContact OG1-CG 3.36Å; T250-E253 PolarHBondContact OG1-N 3.43Å; T250-E253 PolarHBondContact OG1-OE1 3.42Å; E253-K257 WeakPolarHBondContact O-CG 3.47Å; E253-K257 PolarHBondContact O-N 3.26Å; E253-K257 VanDerWaalsContact O-N 3.14Å
254	F	87.4	Confident	83.8	Confident	7 Å²	7	67.5 Å²	67.5	3%	0.031	38%	0.378	C	S	.	.	H	α-helix	trans	-62.8	-49.2	172.9	169	-105.5	0	0	0	111.4	P241 Y243 Q249 T250 L251 T252 V256 K257 W258 P317 T318	P241-F254 HydrophobicContact CB-CD2 4.41Å; P241-F254 HydrophobicContact CB-CE2 4.08Å; P241-F254 WeakPolarHBondContact O-CE2 3.05Å; Y243-F254 HydrophobicContact CD2-CB 3.95Å; Y243-F254 HydrophobicContact CD2-CD1 4.1Å; Y243-F254 HydrophobicContact CD2-CD2 4.33Å; Y243-F254 AromaticContact CD2-CG 3.85Å; Y243-F254 HydrophobicContact CD2-CG 3.85Å; Q249-F254 HydrophobicContact CG-CB 4.3Å; T250-F254 PolarHBondContact O-N 2.97Å; L251-F254 PolarHBondContact O-N 3.12Å; T252-F254 VanDerWaalsContact C-N 3.32Å; F254-V256 VanDerWaalsContact C-N 3.32Å; F254-V256 PolarHBondContact O-N 3.08Å; F254-K257 PolarHBondContact O-N 3.25Å; F254-K257 VanDerWaalsContact O-N 3.13Å; F254-W258 WeakPolarHBondContact O-CB 3.42Å; F254-W258 PolarHBondContact O-N 3.06Å; F254-P317 HydrophobicContact CE1-CB 3.88Å; F254-P317 HydrophobicContact CE1-CG 4.25Å; F254-P317 HydrophobicContact CZ-CB 4.06Å; F254-T318 HydrophobicContact CD1-CG2 3.93Å; F254-T318 HydrophobicContact CE1-CG2 4.1Å
255	D	87.4	Confident	84.3	Confident	32 Å²	32	63.1 Å²	63.1	17%	0.171	35%	0.354	C	S	.	.	H	α-helix	trans	-57.9	-41.9	179.6	-168.8	72.7	0	0	0	112.6	L251 T252 W258 R259 T318	L251-D255 WeakPolarHBondContact O-CB 3.3Å; L251-D255 PolarHBondContact O-N 3.35Å; T252-D255 PolarHBondContact O-N 2.95Å; D255-W258 PolarHBondContact O-N 3.29Å; D255-R259 WeakPolarHBondContact O-CB 3.32Å; D255-R259 WeakPolarHBondContact O-CG 3.44Å; D255-R259 PolarHBondContact O-N 3.24Å; D255-R259 IonicContact OD2-CZ 3.28Å; D255-R259 IonicContact OD2-NE 3.1Å; D255-R259 PolarHBondContact OD2-NE 3.23Å; D255-R259 IonicContact OD2-NH2 3.53Å; D255-R259 PolarHBondContact OD2-NH2 3.1Å; D255-T318 HydrophobicContact CB-CG2 3.94Å; D255-T318 WeakPolarHBondContact OD1-CG2 3.18Å; D255-T318 PolarHBondContact OD1-OG1 3.4Å; D255-T318 VanDerWaalsContact OD1-OG1 3.12Å
256	V	89.6	Confident	85.4	Confident	65 Å²	65	61.5 Å²	61.5	39%	0.394	34%	0.341	S	S	.	.	H	α-helix	trans	-65.2	-44.5	175.6	171.8	0	0	0	0	111.5	T252 F254 W258 R259 N260	T252-V256 WeakPolarHBondContact O-CG2 3.37Å; T252-V256 PolarHBondContact O-N 3.37Å; F254-V256 VanDerWaalsContact C-N 3.32Å; F254-V256 PolarHBondContact O-N 3.08Å; V256-W258 VanDerWaalsContact C-N 3.31Å; V256-W258 PolarHBondContact O-N 3.34Å; V256-R259 PolarHBondContact O-N 3.24Å; V256-N260 WeakPolarHBondContact O-CB 3.22Å; V256-N260 PolarHBondContact O-N 3.36Å; V256-N260 PolarHBondContact O-ND2 3.48Å; V256-N260 PolarHBondContact O-OD1 3.29Å
257	K	89.2	Confident	86.6	Confident	115 Å²	115	64.4 Å²	64.4	50%	0.5	33%	0.329	S	S	.	.	H	α-helix	trans	-62.7	-40.8	177	-75.1	-179.3	-171.5	171.9	0	111.7	E253 F254 N260 W261	E253-K257 WeakPolarHBondContact O-CG 3.47Å; E253-K257 PolarHBondContact O-N 3.26Å; E253-K257 VanDerWaalsContact O-N 3.14Å; F254-K257 PolarHBondContact O-N 3.25Å; F254-K257 VanDerWaalsContact O-N 3.13Å; K257-N260 PolarHBondContact O-N 3.02Å; K257-W261 PolarHBondContact O-N 3.38Å
258	W	91.8	Very high	87.5	Confident	16 Å²	16	65.6 Å²	65.6	6%	0.061	32%	0.323	C	S	.	.	H	α-helix	trans	-65	-46	177.2	-174.7	97.4	0	0	0	111.7	P241 F254 D255 V256 N260 W261 H262 L313 Y314 P317	P241-W258 VanDerWaalsContact CG-CA 3.49Å; P241-W258 HydrophobicContact CG-CB 3.83Å; P241-W258 HydrophobicContact CG-CG 4.25Å; F254-W258 WeakPolarHBondContact O-CB 3.42Å; F254-W258 PolarHBondContact O-N 3.06Å; D255-W258 PolarHBondContact O-N 3.29Å; V256-W258 VanDerWaalsContact C-N 3.31Å; V256-W258 PolarHBondContact O-N 3.34Å; W258-N260 PolarHBondContact O-N 2.83Å; W258-W261 AromaticContact NE1-CZ3 3.89Å; W258-W261 PolarHBondContact O-N 3.04Å; W258-H262 HydrophobicContact CE3-CB 4.26Å; W258-H262 HydrophobicContact CH2-CB 4.24Å; W258-H262 AromaticContact CH2-CD2 3.59Å; W258-H262 AromaticContact CH2-CG 3.96Å; W258-H262 AromaticContact CZ2-CD2 3.93Å; W258-H262 HydrophobicContact CZ3-CB 4.07Å; W258-H262 WeakPolarHBondContact O-CB 3.46Å; W258-H262 PolarHBondContact O-N 2.92Å; W258-L313 PolarHBondContact NE1-O 3.06Å; W258-Y314 WeakPolarHBondContact CH2-O 3.32Å; W258-Y314 VanDerWaalsContact CZ2-C 3.49Å; W258-Y314 WeakPolarHBondContact CZ2-O 3.3Å; W258-P317 HydrophobicContact CB-CG 4.41Å; W258-P317 HydrophobicContact CD2-CB 4.45Å; W258-P317 HydrophobicContact CD2-CG 3.51Å; W258-P317 HydrophobicContact CE3-CG 3.91Å; W258-P317 HydrophobicContact CG-CB 4.38Å; W258-P317 HydrophobicContact CG-CG 3.71Å; W258-P317 HydrophobicContact CZ2-CG 4.17Å; W258-P317 HydrophobicContact CZ3-CG 4.41Å
259	R	89.8	Confident	88.3	Confident	122 Å²	122	60.4 Å²	60.4	46%	0.46	29%	0.289	S	S	.	.	H	α-helix	trans	-60.1	-43.3	175.7	-77.6	-172.6	-86.5	145	-8.5	112.5	D255 V256 W261 H262 E263	D255-R259 WeakPolarHBondContact O-CB 3.32Å; D255-R259 WeakPolarHBondContact O-CG 3.44Å; D255-R259 PolarHBondContact O-N 3.24Å; D255-R259 IonicContact OD2-CZ 3.28Å; D255-R259 IonicContact OD2-NE 3.1Å; D255-R259 PolarHBondContact OD2-NE 3.23Å; D255-R259 IonicContact OD2-NH2 3.53Å; D255-R259 PolarHBondContact OD2-NH2 3.1Å; V256-R259 PolarHBondContact O-N 3.24Å; R259-W261 VanDerWaalsContact C-N 3.32Å; R259-W261 PolarHBondContact O-N 2.91Å; R259-H262 PolarHBondContact O-N 3.49Å; R259-E263 WeakPolarHBondContact O-CB 3.29Å; R259-E263 WeakPolarHBondContact O-CG 3.36Å; R259-E263 PolarHBondContact O-N 2.96Å
260	N	91.2	Very high	88.8	Confident	92 Å²	92	65.3 Å²	65.3	49%	0.492	31%	0.31	S	S	.	.	H	α-helix	trans	-62.4	-39.9	176.8	-69.3	-12.7	0	0	0	112.4	V256 K257 W258 E264	V256-N260 WeakPolarHBondContact O-CB 3.22Å; V256-N260 PolarHBondContact O-N 3.36Å; V256-N260 PolarHBondContact O-ND2 3.48Å; V256-N260 PolarHBondContact O-OD1 3.29Å; K257-N260 PolarHBondContact O-N 3.02Å; W258-N260 PolarHBondContact O-N 2.83Å; N260-E264 PolarHBondContact O-N 3.2Å; N260-E264 VanDerWaalsContact O-N 3.15Å
261	W	93.6	Very high	89	Confident	8 Å²	8	67.5 Å²	67.5	3%	0.03	32%	0.32	C	S	.	.	H	α-helix	trans	-66.7	-44.9	174.7	167.1	82.9	0	0	0	111.3	L236 M240 P241 K257 W258 R259 E263 E264 V265 L287 Y314	L236-W261 PolarHBondContact O-NE1 3.44Å; M240-W261 HydrophobicContact CB-CZ2 3.81Å; M240-W261 HydrophobicContact CE-CH2 4.22Å; M240-W261 HydrophobicContact CG-CD2 4.38Å; M240-W261 HydrophobicContact CG-CH2 3.86Å; M240-W261 HydrophobicContact CG-CZ2 3.65Å; M240-W261 HydrophobicContact CG-CZ3 4.28Å; M240-W261 HydrophobicContact SD-CH2 3.52Å; M240-W261 VanDerWaalsContact SD-CH2 3.52Å; M240-W261 HydrophobicContact SD-CZ2 3.61Å; M240-W261 HydrophobicContact SD-CZ3 4.3Å; P241-W261 HydrophobicContact CG-CB 4.44Å; K257-W261 PolarHBondContact O-N 3.38Å; W258-W261 AromaticContact NE1-CZ3 3.89Å; W258-W261 PolarHBondContact O-N 3.04Å; R259-W261 VanDerWaalsContact C-N 3.32Å; R259-W261 PolarHBondContact O-N 2.91Å; W261-E263 PolarHBondContact O-N 2.9Å; W261-E264 WeakPolarHBondContact O-CA 3.48Å; W261-E264 WeakPolarHBondContact O-CB 3.08Å; W261-E264 PolarHBondContact O-N 3.18Å; W261-V265 HydrophobicContact CD2-CG2 4.23Å; W261-V265 HydrophobicContact CH2-CG2 4.43Å; W261-V265 HydrophobicContact CZ2-CG2 3.88Å; W261-V265 WeakPolarHBondContact O-CG2 3.4Å; W261-V265 PolarHBondContact O-N 3.3Å; W261-L287 HydrophobicContact CH2-CB 4.37Å; W261-L287 HydrophobicContact CH2-CD2 4.26Å; W261-L287 HydrophobicContact CZ2-CD2 4.22Å; W261-Y314 HydrophobicContact CH2-CD1 4.23Å; W261-Y314 HydrophobicContact CH2-CE1 4.3Å
262	H	92.4	Very high	89.1	Confident	40 Å²	40	69.9 Å²	69.9	19%	0.185	33%	0.333	C	S	.	.	H	α-helix	trans	-60.6	-43.1	178.4	-174.1	-86	0	0	0	111.8	W258 R259 E264 V265 D266 V288	W258-H262 HydrophobicContact CE3-CB 4.26Å; W258-H262 HydrophobicContact CH2-CB 4.24Å; W258-H262 AromaticContact CH2-CD2 3.59Å; W258-H262 AromaticContact CH2-CG 3.96Å; W258-H262 AromaticContact CZ2-CD2 3.93Å; W258-H262 HydrophobicContact CZ3-CB 4.07Å; W258-H262 WeakPolarHBondContact O-CB 3.46Å; W258-H262 PolarHBondContact O-N 2.92Å; R259-H262 PolarHBondContact O-N 3.49Å; H262-E264 VanDerWaalsContact C-N 3.31Å; H262-E264 PolarHBondContact O-N 2.71Å; H262-V265 PolarHBondContact O-N 3.29Å; H262-D266 WeakPolarHBondContact O-CB 3.31Å; H262-D266 PolarHBondContact O-N 3.37Å; H262-V288 PolarHBondContact NE2-O 2.94Å
263	E	90.7	Very high	89	Confident	108 Å²	108	67.2 Å²	67.2	51%	0.505	32%	0.316	S	S	.	.	H	α-helix	trans	-62.4	-34.4	172.6	-74.2	178.2	-168.1	0	0	113.1	R259 W261 R267	R259-E263 WeakPolarHBondContact O-CB 3.29Å; R259-E263 WeakPolarHBondContact O-CG 3.36Å; R259-E263 PolarHBondContact O-N 2.96Å; W261-E263 PolarHBondContact O-N 2.9Å; E263-R267 WeakPolarHBondContact O-CB 3.49Å; E263-R267 PolarHBondContact O-N 3.44Å
264	E	90.8	Very high	88.9	Confident	42 Å²	42	62.9 Å²	62.9	20%	0.196	30%	0.296	C	S	.	.	H	α-helix	trans	-65.2	-45.8	173.6	-173.9	178.9	174.8	0	0	110.4	L236 K239 N260 W261 H262 R267 Y268	L236-E264 HydrophobicContact CD2-CG 4.01Å; K239-E264 IonicContact NZ-OE1 3.14Å; K239-E264 PolarHBondContact NZ-OE1 3.02Å; K239-E264 IonicContact NZ-OE2 3.11Å; N260-E264 PolarHBondContact O-N 3.2Å; N260-E264 VanDerWaalsContact O-N 3.15Å; W261-E264 WeakPolarHBondContact O-CA 3.48Å; W261-E264 WeakPolarHBondContact O-CB 3.08Å; W261-E264 PolarHBondContact O-N 3.18Å; H262-E264 VanDerWaalsContact C-N 3.31Å; H262-E264 PolarHBondContact O-N 2.71Å; E264-R267 PolarHBondContact O-N 3.33Å; E264-Y268 HydrophobicContact CG-CD2 4.13Å; E264-Y268 HydrophobicContact CG-CE2 3.7Å; E264-Y268 WeakPolarHBondContact O-CD2 3.44Å; E264-Y268 PolarHBondContact O-N 2.89Å
265	V	89.9	Confident	88.6	Confident	0 Å²	0	65.1 Å²	65.1	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-63.2	-47.7	176.9	-178.2	0	0	0	0	111.3	L236 W261 H262 R267 Y268 L269 L287 V288	L236-V265 HydrophobicContact CD1-CG2 4.45Å; L236-V265 HydrophobicContact CD2-CG2 4.07Å; W261-V265 HydrophobicContact CD2-CG2 4.23Å; W261-V265 HydrophobicContact CH2-CG2 4.43Å; W261-V265 HydrophobicContact CZ2-CG2 3.88Å; W261-V265 WeakPolarHBondContact O-CG2 3.4Å; W261-V265 PolarHBondContact O-N 3.3Å; H262-V265 PolarHBondContact O-N 3.29Å; V265-R267 VanDerWaalsContact C-N 3.3Å; V265-R267 PolarHBondContact O-N 3.46Å; V265-Y268 PolarHBondContact O-N 2.87Å; V265-Y268 VanDerWaalsContact O-N 3.16Å; V265-L269 PolarHBondContact O-N 3.38Å; V265-L287 HydrophobicContact CG1-CB 3.71Å; V265-L287 HydrophobicContact CG1-CD1 4.48Å; V265-V288 HydrophobicContact CB-CG2 4.34Å; V265-V288 HydrophobicContact CG1-CG2 3.6Å
266	D	90.3	Very high	88.2	Confident	42 Å²	42	68.5 Å²	68.5	23%	0.225	34%	0.342	C	S	.	.	H	α-helix	trans	-61.3	-37.6	179.1	176.3	56.6	0	0	0	112	H262 L269 K270 V288	H262-D266 WeakPolarHBondContact O-CB 3.31Å; H262-D266 PolarHBondContact O-N 3.37Å; D266-L269 PolarHBondContact O-N 3.04Å; D266-K270 WeakPolarHBondContact O-CG 3.48Å; D266-K270 PolarHBondContact O-N 3.45Å; D266-K270 WeakPolarHBondContact OD1-CE 3.49Å; D266-K270 IonicContact OD1-NZ 2.8Å; D266-K270 WeakPolarHBondContact OD2-CE 3.5Å; D266-K270 IonicContact OD2-NZ 3.94Å; D266-K270 PolarHBondContact OD2-NZ 2.89Å; D266-V288 HydrophobicContact CB-CG2 4.31Å
267	R	90.6	Very high	87.9	Confident	135 Å²	135	66.2 Å²	66.2	51%	0.509	33%	0.327	S	S	.	.	H	α-helix	trans	-61.1	-47.2	173.3	-170.2	-176.1	-55.2	126.6	8.7	111.8	E263 E264 V265 L269 K270 D271	E263-R267 WeakPolarHBondContact O-CB 3.49Å; E263-R267 PolarHBondContact O-N 3.44Å; E264-R267 PolarHBondContact O-N 3.33Å; V265-R267 VanDerWaalsContact C-N 3.3Å; V265-R267 PolarHBondContact O-N 3.46Å; R267-L269 VanDerWaalsContact C-N 3.26Å; R267-L269 PolarHBondContact O-N 3.27Å; R267-K270 PolarHBondContact O-N 3.31Å; R267-D271 WeakPolarHBondContact O-CB 3.35Å; R267-D271 VanDerWaalsContact O-CG 3.22Å; R267-D271 PolarHBondContact O-N 3.47Å
268	Y	87.6	Confident	87.8	Confident	62 Å²	62	70.3 Å²	70.3	24%	0.243	34%	0.34	C	S	.	.	H	α-helix	trans	-63.3	-32.7	178.8	-78.7	-63.2	0	0	0	113.1	L236 E264 V265 T273	L236-Y268 HydrophobicContact CD1-CD2 3.93Å; L236-Y268 HydrophobicContact CD1-CG 4.49Å; L236-Y268 HydrophobicContact CD2-CD2 3.85Å; L236-Y268 HydrophobicContact CD2-CE2 3.91Å; L236-Y268 HydrophobicContact CG-CD2 4.35Å; E264-Y268 HydrophobicContact CG-CD2 4.13Å; E264-Y268 HydrophobicContact CG-CE2 3.7Å; E264-Y268 WeakPolarHBondContact O-CD2 3.44Å; E264-Y268 PolarHBondContact O-N 2.89Å; V265-Y268 PolarHBondContact O-N 2.87Å; V265-Y268 VanDerWaalsContact O-N 3.16Å; Y268-T273 HydrophobicContact CD1-CG2 4.21Å; Y268-T273 WeakPolarHBondContact O-CB 3.39Å; Y268-T273 PolarHBondContact O-N 3.29Å; Y268-T273 PolarHBondContact O-OG1 3Å
269	L	87.7	Confident	87.5	Confident	37 Å²	37	72.8 Å²	72.8	19%	0.194	35%	0.352	C	S	.	.	H	α-helix	trans	-68.1	-47.7	173.7	-174.9	63	0	0	0	111.2	V265 D266 R267 D271 N272 E281 C284 K285 V288	V265-L269 PolarHBondContact O-N 3.38Å; D266-L269 PolarHBondContact O-N 3.04Å; R267-L269 VanDerWaalsContact C-N 3.26Å; R267-L269 PolarHBondContact O-N 3.27Å; L269-D271 VanDerWaalsContact C-N 3.31Å; L269-D271 PolarHBondContact O-N 3.02Å; L269-N272 PolarHBondContact O-N 3.25Å; L269-E281 HydrophobicContact CD1-CG 4.42Å; L269-C284 HydrophobicContact CD1-CB 4.38Å; L269-K285 HydrophobicContact CD1-CG 3.78Å; L269-K285 HydrophobicContact CD2-CG 4.05Å; L269-V288 HydrophobicContact CB-CG2 4.44Å; L269-V288 HydrophobicContact CD2-CB 4.36Å; L269-V288 HydrophobicContact CD2-CG2 3.88Å
270	K	88.6	Confident	87.4	Confident	138 Å²	138	67 Å²	67	60%	0.6	33%	0.33	S	S	*	.	H	α-helix	trans	-62.5	-35.8	177.2	-74.5	171.4	178.1	165.5	0	113.1	D266 R267 N272	D266-K270 WeakPolarHBondContact O-CG 3.48Å; D266-K270 PolarHBondContact O-N 3.45Å; D266-K270 WeakPolarHBondContact OD1-CE 3.49Å; D266-K270 IonicContact OD1-NZ 2.8Å; D266-K270 WeakPolarHBondContact OD2-CE 3.5Å; D266-K270 IonicContact OD2-NZ 3.94Å; D266-K270 PolarHBondContact OD2-NZ 2.89Å; R267-K270 PolarHBondContact O-N 3.31Å; K270-N272 PolarHBondContact O-N 3.3Å; K270-N272 PolarHBondContact O-ND2 3.13Å
271	D	87.6	Confident	87.2	Confident	106 Å²	106	64.7 Å²	64.7	57%	0.567	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-1.3	176.4	-68.9	-15.7	0	0	0	112.8	R267 L269 T273	R267-D271 WeakPolarHBondContact O-CB 3.35Å; R267-D271 VanDerWaalsContact O-CG 3.22Å; R267-D271 PolarHBondContact O-N 3.47Å; L269-D271 VanDerWaalsContact C-N 3.31Å; L269-D271 PolarHBondContact O-N 3.02Å; D271-T273 PolarHBondContact O-N 3.28Å
272	N	84.8	Confident	87	Confident	109 Å²	109	65.7 Å²	65.7	58%	0.583	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.2	31.2	-178.2	-67.6	-67	0	0	0	113.5	L269 K270 F274 A275	L269-N272 PolarHBondContact O-N 3.25Å; K270-N272 PolarHBondContact O-N 3.3Å; K270-N272 PolarHBondContact O-ND2 3.13Å; N272-F274 PolarHBondContact O-N 2.9Å; N272-F274 VanDerWaalsContact O-N 3.15Å; N272-A275 HydrophobicContact CB-CB 4.17Å; N272-A275 WeakPolarHBondContact O-CB 3.11Å; N272-A275 PolarHBondContact O-N 3.44Å
273	T	82.3	Confident	86.9	Confident	43 Å²	43	63.8 Å²	63.8	26%	0.264	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-30.3	-174.1	-52.7	0	0	0	0	112.4	L232 Y268 D271	L232-T273 HydrophobicContact CD1-CG2 4.08Å; Y268-T273 HydrophobicContact CD1-CG2 4.21Å; Y268-T273 WeakPolarHBondContact O-CB 3.39Å; Y268-T273 PolarHBondContact O-N 3.29Å; Y268-T273 PolarHBondContact O-OG1 3Å; D271-T273 PolarHBondContact O-N 3.28Å
274	F	84.1	Confident	86.8	Confident	2 Å²	2	58.7 Å²	58.7	1%	0.009	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.2	3.9	-176.8	-57.4	-67.5	0	0	0	114.5	M229 L232 M233 L236 N272 S276 N277 L280 E281 C284	M229-F274 HydrophobicContact CB-CD1 4.2Å; M229-F274 HydrophobicContact CB-CE1 4.31Å; L232-F274 HydrophobicContact CB-CE1 4.45Å; L232-F274 HydrophobicContact CB-CZ 4.38Å; M233-F274 HydrophobicContact CB-CE1 4.21Å; M233-F274 HydrophobicContact CB-CZ 4.41Å; M233-F274 HydrophobicContact CE-CD1 4.35Å; M233-F274 HydrophobicContact CE-CD2 4.26Å; M233-F274 HydrophobicContact CE-CE1 4.06Å; M233-F274 HydrophobicContact CE-CE2 3.95Å; M233-F274 HydrophobicContact CE-CG 4.45Å; M233-F274 HydrophobicContact CE-CZ 3.85Å; L236-F274 HydrophobicContact CD1-CE2 4.22Å; L236-F274 HydrophobicContact CD1-CZ 4.16Å; N272-F274 PolarHBondContact O-N 2.9Å; N272-F274 VanDerWaalsContact O-N 3.15Å; F274-S276 PolarHBondContact O-N 3.38Å; F274-N277 CarbonylContact O-C 3.53Å; F274-N277 PolarHBondContact O-N 3.22Å; F274-N277 VanDerWaalsContact O-O 3.11Å; F274-L280 HydrophobicContact CB-CB 4.2Å; F274-L280 HydrophobicContact CD1-CB 3.99Å; F274-L280 HydrophobicContact CD1-CD1 4.33Å; F274-L280 HydrophobicContact CG-CB 4.31Å; F274-E281 HydrophobicContact CB-CB 4.21Å; F274-C284 HydrophobicContact CD2-CB 3.86Å; F274-C284 HydrophobicContact CE2-CB 4.23Å
275	A	80.3	Confident	86.8	Confident	54 Å²	54	59.7 Å²	59.7	45%	0.446	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-21.1	-173.5	0	0	0	0	0	114.5	N272 N277	N272-A275 HydrophobicContact CB-CB 4.17Å; N272-A275 WeakPolarHBondContact O-CB 3.11Å; N272-A275 PolarHBondContact O-N 3.44Å; A275-N277 VanDerWaalsContact C-N 3.28Å; A275-N277 PolarHBondContact O-N 3.44Å
276	S	79.8	Confident	86.8	Confident	103 Å²	103	59.7 Å²	59.7	72%	0.72	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.8	-16	175.3	-52.4	0	0	0	0	113.8	F274	F274-S276 PolarHBondContact O-N 3.38Å
277	N	83.8	Confident	86.8	Confident	16 Å²	16	57.7 Å²	57.7	9%	0.086	28%	0.283	C	S	.	.			trans	-133.2	102.4	179.2	-173.8	-22.1	0	0	0	110.5	Y230 F274 A275 H279 L280 E281	Y230-N277 PolarHBondContact OH-ND2 3.31Å; F274-N277 CarbonylContact O-C 3.53Å; F274-N277 PolarHBondContact O-N 3.22Å; F274-N277 VanDerWaalsContact O-O 3.11Å; A275-N277 VanDerWaalsContact C-N 3.28Å; A275-N277 PolarHBondContact O-N 3.44Å; N277-H279 PolarHBondContact O-N 3.24Å; N277-H279 VanDerWaalsContact O-N 3.1Å; N277-H279 PolarHBondContact OD1-N 3.16Å; N277-L280 HydrophobicContact CB-CB 4.22Å; N277-L280 HydrophobicContact CB-CD1 4.16Å; N277-L280 HydrophobicContact CB-CG 4.22Å; N277-L280 PolarHBondContact O-N 3.31Å; N277-E281 PolarHBondContact O-N 3.33Å
278	R	86.9	Confident	86.8	Confident	202 Å²	202	52.4 Å²	52.4	76%	0.762	27%	0.265	S	S	*	.	H	α-helix	trans	-50.5	-36.7	179.7	179.4	-180	157.9	104.3	2.3	113.3	L282	R278-L282 VanDerWaalsContact O-CB 3.3Å; R278-L282 WeakPolarHBondContact O-CB 3.36Å; R278-L282 PolarHBondContact O-N 3.2Å
279	H	85.8	Confident	86.8	Confident	67 Å²	67	49.9 Å²	49.9	31%	0.31	26%	0.258	S	S	.	.	H	α-helix	trans	-74.6	-37.4	-178.5	-61.2	-75.1	0	0	0	112.6	W197 N277 L282 I283	W197-H279 AromaticContact CD1-CE1 3.83Å; W197-H279 AromaticContact CD1-NE2 3.91Å; W197-H279 HydrophobicContact CD2-CB 3.87Å; W197-H279 AromaticContact CD2-CD2 3.99Å; W197-H279 AromaticContact CD2-CG 3.61Å; W197-H279 AromaticContact CD2-ND1 3.73Å; W197-H279 AromaticContact CE2-CD2 3.69Å; W197-H279 AromaticContact CE2-CG 3.76Å; W197-H279 HydrophobicContact CE3-CB 3.54Å; W197-H279 AromaticContact CE3-CG 3.82Å; W197-H279 AromaticContact CG-CE1 3.78Å; W197-H279 AromaticContact CG-ND1 3.68Å; W197-H279 HydrophobicContact CH2-CB 3.72Å; W197-H279 HydrophobicContact CZ2-CB 4.04Å; W197-H279 AromaticContact CZ2-CD2 3.98Å; W197-H279 HydrophobicContact CZ3-CB 3.46Å; W197-H279 VanDerWaalsContact CZ3-CB 3.46Å; W197-H279 AromaticContact NE1-CD2 3.87Å; W197-H279 AromaticContact NE1-NE2 3.88Å; N277-H279 PolarHBondContact O-N 3.24Å; N277-H279 VanDerWaalsContact O-N 3.1Å; N277-H279 PolarHBondContact OD1-N 3.16Å; H279-L282 PolarHBondContact O-N 3.48Å; H279-I283 WeakPolarHBondContact O-CG1 3.1Å; H279-I283 PolarHBondContact O-N 3.16Å
280	L	86	Confident	86.9	Confident	0 Å²	0	51 Å²	51	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-72.2	-36	175	-66.7	-179.3	0	0	0	111.4	L216 M229 Y230 M233 F274 N277 I283 C284	L216-L280 HydrophobicContact CD2-CD2 4.12Å; M229-L280 HydrophobicContact CB-CD1 3.98Å; Y230-L280 HydrophobicContact CD1-CD1 3.9Å; Y230-L280 HydrophobicContact CD1-CD2 3.91Å; Y230-L280 HydrophobicContact CD1-CG 4.41Å; Y230-L280 HydrophobicContact CE1-CD1 3.83Å; Y230-L280 HydrophobicContact CE1-CD2 3.79Å; Y230-L280 HydrophobicContact CE1-CG 4.07Å; Y230-L280 HydrophobicContact CE2-CD1 4.49Å; Y230-L280 HydrophobicContact CG-CD1 4.26Å; M233-L280 HydrophobicContact CB-CD2 4.36Å; M233-L280 HydrophobicContact CE-CB 4.36Å; M233-L280 VanDerWaalsContact CE-O 3.24Å; M233-L280 WeakPolarHBondContact CE-O 3.44Å; M233-L280 HydrophobicContact CG-CD2 4.13Å; F274-L280 HydrophobicContact CB-CB 4.2Å; F274-L280 HydrophobicContact CD1-CB 3.99Å; F274-L280 HydrophobicContact CD1-CD1 4.33Å; F274-L280 HydrophobicContact CG-CB 4.31Å; N277-L280 HydrophobicContact CB-CB 4.22Å; N277-L280 HydrophobicContact CB-CD1 4.16Å; N277-L280 HydrophobicContact CB-CG 4.22Å; N277-L280 PolarHBondContact O-N 3.31Å; L280-I283 HydrophobicContact CD2-CD1 4.47Å; L280-I283 PolarHBondContact O-N 3.08Å; L280-C284 WeakPolarHBondContact O-CB 3.35Å; L280-C284 PolarHBondContact O-N 3.45Å
281	E	88.4	Confident	86.7	Confident	45 Å²	45	47.7 Å²	47.7	21%	0.21	25%	0.251	C	S	.	.	H	α-helix	trans	-62.7	-43.3	172.1	-166.4	-169.4	148.3	0	0	111.1	L269 F274 N277 C284 K285	L269-E281 HydrophobicContact CD1-CG 4.42Å; F274-E281 HydrophobicContact CB-CB 4.21Å; N277-E281 PolarHBondContact O-N 3.33Å; E281-C284 WeakPolarHBondContact O-CB 3.48Å; E281-C284 PolarHBondContact O-N 3.28Å; E281-K285 WeakPolarHBondContact O-CG 3.43Å; E281-K285 PolarHBondContact O-N 3.39Å; E281-K285 VanDerWaalsContact OE1-CE 3.24Å; E281-K285 WeakPolarHBondContact OE1-CE 3.42Å; E281-K285 IonicContact OE1-NZ 2.76Å; E281-K285 PolarHBondContact OE1-NZ 3.32Å
282	L	89.2	Confident	86.7	Confident	29 Å²	29	48.1 Å²	48.1	15%	0.152	25%	0.253	C	S	.	.	H	α-helix	trans	-57.9	-49.4	173.9	176.9	65	0	0	0	111.5	V201 R278 H279 C284 K285 I286 T293	V201-L282 HydrophobicContact CG2-CD2 4.08Å; R278-L282 VanDerWaalsContact O-CB 3.3Å; R278-L282 WeakPolarHBondContact O-CB 3.36Å; R278-L282 PolarHBondContact O-N 3.2Å; H279-L282 PolarHBondContact O-N 3.48Å; L282-C284 VanDerWaalsContact C-N 3.3Å; L282-C284 PolarHBondContact O-N 3.1Å; L282-K285 PolarHBondContact O-N 3.06Å; L282-I286 HydrophobicContact CD1-CD1 4.31Å; L282-I286 HydrophobicContact CG-CD1 4.11Å; L282-I286 WeakPolarHBondContact O-CG1 3.41Å; L282-I286 PolarHBondContact O-N 3.43Å; L282-T293 HydrophobicContact CD1-CG2 3.43Å; L282-T293 VanDerWaalsContact CD1-CG2 3.43Å
283	I	90.1	Very high	86.8	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-59	-43.5	176.1	-68	166.8	0	0	0	110.4	W197 V200 V204 L216 M233 H279 L280 K285 I286 L287	W197-I283 HydrophobicContact CZ3-CD1 4.43Å; V200-I283 HydrophobicContact CG1-CD1 3.92Å; V204-I283 HydrophobicContact CG1-CG2 4.41Å; V204-I283 HydrophobicContact CG2-CG2 4.21Å; L216-I283 HydrophobicContact CD1-CD1 4.45Å; L216-I283 HydrophobicContact CD2-CD1 4.26Å; M233-I283 HydrophobicContact CE-CB 4.24Å; M233-I283 HydrophobicContact CE-CG2 4.02Å; M233-I283 HydrophobicContact SD-CG2 3.76Å; H279-I283 WeakPolarHBondContact O-CG1 3.1Å; H279-I283 PolarHBondContact O-N 3.16Å; L280-I283 HydrophobicContact CD2-CD1 4.47Å; L280-I283 PolarHBondContact O-N 3.08Å; I283-K285 PolarHBondContact O-N 3.26Å; I283-I286 WeakPolarHBondContact O-CB 3.34Å; I283-I286 PolarHBondContact O-N 3.11Å; I283-L287 HydrophobicContact CG2-CD1 4.22Å; I283-L287 HydrophobicContact CG2-CG 4.33Å; I283-L287 VanDerWaalsContact O-CG 3.3Å; I283-L287 WeakPolarHBondContact O-CG 3.47Å; I283-L287 PolarHBondContact O-N 3.13Å
284	C	88.8	Confident	87	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-61.8	-42.5	177.9	-161	0	0	0	0	112.1	M233 L269 F274 L280 E281 L282 I286 L287 V288	M233-C284 HydrophobicContact CE-CB 4.01Å; L269-C284 HydrophobicContact CD1-CB 4.38Å; F274-C284 HydrophobicContact CD2-CB 3.86Å; F274-C284 HydrophobicContact CE2-CB 4.23Å; L280-C284 WeakPolarHBondContact O-CB 3.35Å; L280-C284 PolarHBondContact O-N 3.45Å; E281-C284 WeakPolarHBondContact O-CB 3.48Å; E281-C284 PolarHBondContact O-N 3.28Å; L282-C284 VanDerWaalsContact C-N 3.3Å; L282-C284 PolarHBondContact O-N 3.1Å; C284-I286 VanDerWaalsContact C-N 3.34Å; C284-L287 PolarHBondContact O-N 2.96Å; C284-V288 WeakPolarHBondContact O-CG2 3.28Å; C284-V288 PolarHBondContact O-N 3.23Å
285	K	89.8	Confident	87.1	Confident	64 Å²	64	43 Å²	43	28%	0.278	22%	0.224	S	C	.	.	H	α-helix	trans	-62.4	-40.2	175.5	-74.4	173.4	173.7	169.1	0	112.1	L269 E281 L282 I283 V288 G289 D290 T293	L269-K285 HydrophobicContact CD1-CG 3.78Å; L269-K285 HydrophobicContact CD2-CG 4.05Å; E281-K285 WeakPolarHBondContact O-CG 3.43Å; E281-K285 PolarHBondContact O-N 3.39Å; E281-K285 VanDerWaalsContact OE1-CE 3.24Å; E281-K285 WeakPolarHBondContact OE1-CE 3.42Å; E281-K285 IonicContact OE1-NZ 2.76Å; E281-K285 PolarHBondContact OE1-NZ 3.32Å; L282-K285 PolarHBondContact O-N 3.06Å; I283-K285 PolarHBondContact O-N 3.26Å; K285-V288 PolarHBondContact O-N 3.33Å; K285-G289 PolarHBondContact O-N 2.65Å; K285-D290 HydrophobicContact CB-CB 4.46Å; K285-D290 WeakPolarHBondContact O-CB 3.37Å; K285-D290 PolarHBondContact O-N 3.09Å; K285-D290 VanDerWaalsContact O-N 3.15Å; K285-T293 HydrophobicContact CB-CG2 3.83Å
286	I	90.9	Very high	87.4	Confident	0 Å²	0	47 Å²	47	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-62.1	-45.3	173.3	-68	167.8	0	0	0	111	V201 V204 L205 L282 I283 C284 V288 G289 T293 L294 Y314	V201-I286 HydrophobicContact CG1-CD1 3.84Å; V204-I286 HydrophobicContact CG1-CG2 3.8Å; L205-I286 HydrophobicContact CD2-CD1 4.23Å; L205-I286 HydrophobicContact CD2-CG2 3.94Å; L282-I286 HydrophobicContact CD1-CD1 4.31Å; L282-I286 HydrophobicContact CG-CD1 4.11Å; L282-I286 WeakPolarHBondContact O-CG1 3.41Å; L282-I286 PolarHBondContact O-N 3.43Å; I283-I286 WeakPolarHBondContact O-CB 3.34Å; I283-I286 PolarHBondContact O-N 3.11Å; C284-I286 VanDerWaalsContact C-N 3.34Å; I286-V288 VanDerWaalsContact C-N 3.3Å; I286-V288 PolarHBondContact O-N 2.7Å; I286-G289 WeakPolarHBondContact O-CA 3.16Å; I286-G289 PolarHBondContact O-N 2.82Å; I286-T293 HydrophobicContact CG1-CG2 4.06Å; I286-L294 HydrophobicContact CB-CD2 4.45Å; I286-L294 HydrophobicContact CG1-CD2 4.26Å; I286-L294 HydrophobicContact CG2-CD2 3.98Å; I286-Y314 HydrophobicContact CG2-CD2 4.26Å; I286-Y314 HydrophobicContact CG2-CE2 3.95Å
287	L	89.8	Confident	87.7	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-64.8	-31.4	179.9	-67.9	178.3	0	0	0	113.2	V204 M233 L237 W261 V265 I283 C284 G289 Y314	V204-L287 HydrophobicContact CG1-CD2 4.09Å; M233-L287 HydrophobicContact SD-CD1 3.99Å; L237-L287 HydrophobicContact CD2-CD1 3.87Å; L237-L287 HydrophobicContact CD2-CD2 3.98Å; L237-L287 HydrophobicContact CD2-CG 4.47Å; W261-L287 HydrophobicContact CH2-CB 4.37Å; W261-L287 HydrophobicContact CH2-CD2 4.26Å; W261-L287 HydrophobicContact CZ2-CD2 4.22Å; V265-L287 HydrophobicContact CG1-CB 3.71Å; V265-L287 HydrophobicContact CG1-CD1 4.48Å; I283-L287 HydrophobicContact CG2-CD1 4.22Å; I283-L287 HydrophobicContact CG2-CG 4.33Å; I283-L287 VanDerWaalsContact O-CG 3.3Å; I283-L287 WeakPolarHBondContact O-CG 3.47Å; I283-L287 PolarHBondContact O-N 3.13Å; C284-L287 PolarHBondContact O-N 2.96Å; L287-G289 PolarHBondContact O-N 3.45Å; L287-Y314 HydrophobicContact CD2-CD1 4.29Å; L287-Y314 HydrophobicContact CD2-CE1 3.47Å; L287-Y314 VanDerWaalsContact CD2-CE1 3.47Å
288	V	90.9	Very high	87.7	Confident	23 Å²	23	45.7 Å²	45.7	14%	0.139	22%	0.215	C	C	.	.	H	α-helix	trans	-71.2	-17.7	171.6	175.7	0	0	0	0	111.5	H262 V265 D266 L269 C284 K285 I286	H262-V288 PolarHBondContact NE2-O 2.94Å; V265-V288 HydrophobicContact CB-CG2 4.34Å; V265-V288 HydrophobicContact CG1-CG2 3.6Å; D266-V288 HydrophobicContact CB-CG2 4.31Å; L269-V288 HydrophobicContact CB-CG2 4.44Å; L269-V288 HydrophobicContact CD2-CB 4.36Å; L269-V288 HydrophobicContact CD2-CG2 3.88Å; C284-V288 WeakPolarHBondContact O-CG2 3.28Å; C284-V288 PolarHBondContact O-N 3.23Å; K285-V288 PolarHBondContact O-N 3.33Å; I286-V288 VanDerWaalsContact C-N 3.3Å; I286-V288 PolarHBondContact O-N 2.7Å
289	G	87.7	Confident	87.5	Confident	9 Å²	9	45 Å²	45	9%	0.093	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.9	34.3	-176.1	0	0	0	0	0	112.6	K285 I286 L287 E291	K285-G289 PolarHBondContact O-N 2.65Å; I286-G289 WeakPolarHBondContact O-CA 3.16Å; I286-G289 PolarHBondContact O-N 2.82Å; L287-G289 PolarHBondContact O-N 3.45Å; G289-E291 PolarHBondContact O-N 3.14Å
290	D	88.9	Confident	87.3	Confident	61 Å²	61	43.3 Å²	43.3	33%	0.326	21%	0.213	S	C	.	.			trans	-63.5	113.7	174	-178.7	47.4	0	0	0	110.5	K285 D292 T293 L294	K285-D290 HydrophobicContact CB-CB 4.46Å; K285-D290 WeakPolarHBondContact O-CB 3.37Å; K285-D290 PolarHBondContact O-N 3.09Å; K285-D290 VanDerWaalsContact O-N 3.15Å; D290-D292 PolarHBondContact O-N 3.27Å; D290-T293 PolarHBondContact O-N 3.25Å; D290-T293 VanDerWaalsContact OD2-CB 3.27Å; D290-T293 WeakPolarHBondContact OD2-CB 3.45Å; D290-T293 PolarHBondContact OD2-N 3.35Å; D290-T293 PolarHBondContact OD2-OG1 3.27Å; D290-L294 WeakPolarHBondContact O-CG 3.22Å; D290-L294 PolarHBondContact O-N 3.43Å
291	E	85.4	Confident	87.1	Confident	69 Å²	69	43.3 Å²	43.3	32%	0.322	21%	0.213	S	C	.	.	H	α-helix	trans	-64.4	-39.9	-170.4	-63.4	-168.9	156.7	0	0	111.9	G289 L294 L295 R311	G289-E291 PolarHBondContact O-N 3.14Å; E291-L294 PolarHBondContact O-N 3.08Å; E291-L295 VanDerWaalsContact O-CG 3.32Å; E291-L295 WeakPolarHBondContact O-CG 3.41Å; E291-L295 PolarHBondContact O-N 3.41Å; E291-R311 IonicContact OE1-CZ 2.85Å; E291-R311 IonicContact OE1-NE 3.94Å; E291-R311 PolarHBondContact OE1-NE 3.42Å; E291-R311 IonicContact OE1-NH2 3.05Å; E291-R311 PolarHBondContact OE1-NH2 3.3Å; E291-R311 IonicContact OE2-NH2 3.58Å
292	D	86.6	Confident	86.8	Confident	115 Å²	115	43.4 Å²	43.4	62%	0.615	23%	0.226	S	C	*	.	H	α-helix	trans	-63.3	-47.1	178.4	-68.9	-33.2	0	0	0	110.8	D290 L294 L295 E296	D290-D292 PolarHBondContact O-N 3.27Å; D292-L294 VanDerWaalsContact C-N 3.32Å; D292-L294 PolarHBondContact O-N 2.76Å; D292-L295 PolarHBondContact O-N 2.84Å; D292-E296 WeakPolarHBondContact O-CG 3.49Å; D292-E296 PolarHBondContact O-N 3.46Å
293	T	87.6	Confident	86.6	Confident	7 Å²	7	43.9 Å²	43.9	4%	0.043	23%	0.231	C	C	.	.	H	α-helix	trans	-60.9	-39.3	176	-63.6	0	0	0	0	112.3	L282 K285 I286 D290 E296 Q297	L282-T293 HydrophobicContact CD1-CG2 3.43Å; L282-T293 VanDerWaalsContact CD1-CG2 3.43Å; K285-T293 HydrophobicContact CB-CG2 3.83Å; I286-T293 HydrophobicContact CG1-CG2 4.06Å; D290-T293 PolarHBondContact O-N 3.25Å; D290-T293 VanDerWaalsContact OD2-CB 3.27Å; D290-T293 WeakPolarHBondContact OD2-CB 3.45Å; D290-T293 PolarHBondContact OD2-N 3.35Å; D290-T293 PolarHBondContact OD2-OG1 3.27Å; T293-E296 PolarHBondContact O-N 3.45Å; T293-Q297 PolarHBondContact O-N 3.07Å
294	L	87.2	Confident	86.6	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-65.9	-38.6	176.6	-69.4	173	0	0	0	111.7	L205 I286 D290 E291 D292 Q297 L301 F307 T310	L205-L294 HydrophobicContact CD2-CD2 3.77Å; I286-L294 HydrophobicContact CB-CD2 4.45Å; I286-L294 HydrophobicContact CG1-CD2 4.26Å; I286-L294 HydrophobicContact CG2-CD2 3.98Å; D290-L294 WeakPolarHBondContact O-CG 3.22Å; D290-L294 PolarHBondContact O-N 3.43Å; E291-L294 PolarHBondContact O-N 3.08Å; D292-L294 VanDerWaalsContact C-N 3.32Å; D292-L294 PolarHBondContact O-N 2.76Å; L294-Q297 PolarHBondContact O-N 3.4Å; L294-Q297 VanDerWaalsContact O-N 3.16Å; L294-L301 WeakPolarHBondContact O-CD1 3.41Å; L294-F307 HydrophobicContact CB-CD2 4.2Å; L294-F307 HydrophobicContact CB-CE2 3.67Å; L294-F307 HydrophobicContact CD1-CE2 4.3Å; L294-T310 HydrophobicContact CD2-CG2 3.81Å
295	L	86.3	Confident	86.6	Confident	38 Å²	38	45.7 Å²	45.7	20%	0.199	24%	0.237	C	C	.	.	H	α-helix	trans	-70.2	-29.7	175.8	-69.5	170.2	0	0	0	112.6	E291 D292 Q297 K298 F307 M334	E291-L295 VanDerWaalsContact O-CG 3.32Å; E291-L295 WeakPolarHBondContact O-CG 3.41Å; E291-L295 PolarHBondContact O-N 3.41Å; D292-L295 PolarHBondContact O-N 2.84Å; L295-Q297 PolarHBondContact O-N 2.95Å; L295-K298 WeakPolarHBondContact O-CB 3.27Å; L295-K298 WeakPolarHBondContact O-CG 3.41Å; L295-K298 PolarHBondContact O-N 3.25Å; L295-F307 HydrophobicContact CD2-CE1 4.06Å; L295-F307 HydrophobicContact CD2-CE2 4.07Å; L295-F307 HydrophobicContact CD2-CZ 3.76Å; L295-F307 HydrophobicContact CG-CE2 4.28Å; L295-F307 HydrophobicContact CG-CZ 4.1Å; L295-M334 HydrophobicContact CD1-CB 4.44Å; L295-M334 HydrophobicContact CD2-CB 4.14Å
296	E	86.8	Confident	86.5	Confident	140 Å²	140	42.7 Å²	42.7	65%	0.654	22%	0.224	S	C	*	.	H	α-helix	trans	-61.8	-24.9	170.2	-72.3	-179.6	-179.9	0	0	112.1	D292 T293	D292-E296 WeakPolarHBondContact O-CG 3.49Å; D292-E296 PolarHBondContact O-N 3.46Å; T293-E296 PolarHBondContact O-N 3.45Å
297	Q	85.8	Confident	86.5	Confident	34 Å²	34	42.7 Å²	42.7	16%	0.159	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.3	23.8	178.2	-55.2	-52.8	-53.6	0	0	113.5	L205 T293 L294 L295 E299 L300 L301	L205-Q297 HydrophobicContact CD1-CB 4.37Å; T293-Q297 PolarHBondContact O-N 3.07Å; L294-Q297 PolarHBondContact O-N 3.4Å; L294-Q297 VanDerWaalsContact O-N 3.16Å; L295-Q297 PolarHBondContact O-N 2.95Å; Q297-E299 VanDerWaalsContact C-N 3.27Å; Q297-E299 PolarHBondContact O-N 3.17Å; Q297-L300 HydrophobicContact CB-CB 4.48Å; Q297-L300 PolarHBondContact O-N 3.23Å; Q297-L300 VanDerWaalsContact OE1-CD1 3.27Å; Q297-L301 PolarHBondContact O-N 2.77Å
298	K	83.6	Confident	86.6	Confident	56 Å²	56	42.7 Å²	42.7	24%	0.243	22%	0.224	C	C	.	.	H	α-helix	trans	-49.3	-43.2	177.9	-89.8	173.6	-171.5	-153.1	0	113.2	L295 L301 G302 M334 F335 D337	L295-K298 WeakPolarHBondContact O-CB 3.27Å; L295-K298 WeakPolarHBondContact O-CG 3.41Å; L295-K298 PolarHBondContact O-N 3.25Å; K298-L301 PolarHBondContact O-N 3.49Å; K298-G302 PolarHBondContact O-N 3.08Å; K298-M334 PolarHBondContact NZ-O 3.05Å; K298-F335 HydrophobicContact CB-CE2 4.26Å; K298-F335 HydrophobicContact CB-CZ 4.45Å; K298-F335 HydrophobicContact CG-CD2 3.99Å; K298-F335 HydrophobicContact CG-CE2 3.73Å; K298-F335 HydrophobicContact CG-CZ 4.23Å; K298-F335 PolarHBondContact NZ-O 3.49Å; K298-D337 IonicContact NZ-OD1 2.64Å; K298-D337 PolarHBondContact NZ-OD1 3.34Å
299	E	83	Confident	86.6	Confident	189 Å²	189	41.6 Å²	41.6	88%	0.883	22%	0.218	S	C	*	.	H	α-helix	trans	-63.7	-42.8	178.9	-63.9	-173.2	170.3	0	0	112.2	Q297 L301 G302	Q297-E299 VanDerWaalsContact C-N 3.27Å; Q297-E299 PolarHBondContact O-N 3.17Å; E299-L301 VanDerWaalsContact C-N 3.33Å; E299-G302 PolarHBondContact O-N 3.27Å
300	L	81.8	Confident	86.7	Confident	30 Å²	30	41.2 Å²	41.2	16%	0.157	21%	0.214	C	C	.	.	H	α-helix	trans	-73.8	-23.1	177.6	-64.9	-173.4	0	0	0	112.8	K174 D198 V201 L205 Q297	K174-L300 PolarHBondContact NZ-O 3.15Å; D198-L300 HydrophobicContact CB-CD2 3.79Å; V201-L300 HydrophobicContact CB-CD1 4Å; V201-L300 HydrophobicContact CG1-CD1 3.68Å; L205-L300 HydrophobicContact CD1-CB 4.19Å; Q297-L300 HydrophobicContact CB-CB 4.48Å; Q297-L300 PolarHBondContact O-N 3.23Å; Q297-L300 VanDerWaalsContact OE1-CD1 3.27Å
301	L	81.2	Confident	86.8	Confident	1 Å²	1	39.1 Å²	39.1	1%	0.005	20%	0.201	C	C	.	.	H	α-helix	trans	-80.7	-39.2	173	-74.7	164	0	0	0	111.3	K174 L205 L294 Q297 K298 E299 T303 H306 F307 F335	K174-L301 PolarHBondContact NZ-O 2.68Å; L205-L301 HydrophobicContact CB-CD2 4.16Å; L205-L301 HydrophobicContact CD1-CD2 4.02Å; L205-L301 HydrophobicContact CD1-CG 4.1Å; L205-L301 HydrophobicContact CD2-CD2 4.21Å; L205-L301 HydrophobicContact CG-CD2 4.35Å; L294-L301 WeakPolarHBondContact O-CD1 3.41Å; Q297-L301 PolarHBondContact O-N 2.77Å; K298-L301 PolarHBondContact O-N 3.49Å; E299-L301 VanDerWaalsContact C-N 3.33Å; L301-T303 PolarHBondContact O-N 2.96Å; L301-H306 HydrophobicContact CD2-CB 4.39Å; L301-H306 PolarHBondContact O-ND1 2.92Å; L301-F307 HydrophobicContact CD1-CB 4.01Å; L301-F307 HydrophobicContact CD1-CD2 3.84Å; L301-F307 HydrophobicContact CD1-CG 4.38Å; L301-F335 HydrophobicContact CB-CE2 4.19Å
302	G	81.1	Confident	87	Confident	47 Å²	47	35.9 Å²	35.9	49%	0.485	19%	0.186	S	C	.	.			trans	74.8	-37.7	177	0	0	0	0	0	114.2	K298 E299	K298-G302 PolarHBondContact O-N 3.08Å; E299-G302 PolarHBondContact O-N 3.27Å
303	T	85.4	Confident	87.2	Confident	39 Å²	39	30.7 Å²	30.7	24%	0.239	16%	0.158	C	C	.	.	S	Bend	trans	-137.8	150.1	-175.1	60.8	0	0	0	0	112.6	L301 Y305 H306 F307	L301-T303 PolarHBondContact O-N 2.96Å; T303-Y305 VanDerWaalsContact C-N 3.28Å; T303-Y305 VanDerWaalsContact CB-CE1 3.45Å; T303-Y305 HydrophobicContact CG2-CE1 3.75Å; T303-Y305 HydrophobicContact CG2-CE2 4.36Å; T303-Y305 PolarHBondContact O-N 3.11Å; T303-Y305 WeakPolarHBondContact OG1-CD2 3.35Å; T303-Y305 WeakPolarHBondContact OG1-CE2 3.44Å; T303-Y305 VanDerWaalsContact OG1-CZ 3.23Å; T303-H306 PolarHBondContact O-N 2.97Å; T303-H306 WeakPolarHBondContact OG1-CB 3.18Å; T303-F307 PolarHBondContact O-N 3.15Å
304	W	89.1	Confident	87.3	Confident	6 Å²	6	30.3 Å²	30.3	2%	0.023	16%	0.156	C	C	.	.	H	α-helix	trans	-66.7	-30.1	-178.5	71.3	-94.5	0	0	0	112.7	F307 L308 A328 L332 F335 D346 L349 L350 F353	W304-F307 WeakPolarHBondContact O-CB 3.49Å; W304-F307 PolarHBondContact O-N 3.09Å; W304-L308 HydrophobicContact CZ3-CD2 4.13Å; W304-L308 PolarHBondContact O-N 2.98Å; W304-A328 HydrophobicContact CH2-CB 4.33Å; W304-A328 HydrophobicContact CZ3-CB 3.95Å; W304-L332 HydrophobicContact CB-CD1 4.39Å; W304-L332 HydrophobicContact CD2-CB 4.39Å; W304-L332 HydrophobicContact CD2-CD1 3.7Å; W304-L332 HydrophobicContact CE3-CB 4.28Å; W304-L332 HydrophobicContact CE3-CD1 4.38Å; W304-L332 HydrophobicContact CG-CD1 3.66Å; W304-L332 HydrophobicContact CZ2-CD1 4.34Å; W304-F335 HydrophobicContact CB-CB 3.63Å; W304-F335 HydrophobicContact CB-CD1 3.63Å; W304-F335 HydrophobicContact CB-CD2 4.38Å; W304-F335 HydrophobicContact CB-CE1 4.4Å; W304-F335 HydrophobicContact CB-CG 3.62Å; W304-D346 PolarHBondContact NE1-OD1 3.44Å; W304-L349 HydrophobicContact CH2-CB 4.34Å; W304-L349 HydrophobicContact CZ2-CB 3.86Å; W304-L349 HydrophobicContact CZ2-CD1 4.22Å; W304-L350 HydrophobicContact CH2-CD2 3.9Å; W304-L350 HydrophobicContact CH2-CG 4.31Å; W304-L350 HydrophobicContact CZ2-CD2 4.46Å; W304-L350 HydrophobicContact CZ2-CG 4.46Å; W304-L350 HydrophobicContact CZ3-CD2 4.42Å; W304-F353 AromaticContact CH2-CD2 3.88Å; W304-F353 HydrophobicContact CH2-CD2 3.88Å; W304-F353 AromaticContact CH2-CE2 3.69Å; W304-F353 HydrophobicContact CH2-CE2 3.69Å; W304-F353 HydrophobicContact CZ3-CD2 4.45Å; W304-F353 HydrophobicContact CZ3-CE2 4.16Å
305	Y	88.9	Confident	87.4	Confident	31 Å²	31	31.6 Å²	31.6	12%	0.122	17%	0.165	C	C	.	.	H	α-helix	trans	-75	-27.9	177.9	57.1	-102.9	0	0	0	112.1	L144 W169 V170 T303 L308 V309 L349	L144-Y305 HydrophobicContact CD1-CE2 4.41Å; L144-Y305 HydrophobicContact CD2-CE1 4.27Å; W169-Y305 AromaticContact CH2-CD2 3.71Å; W169-Y305 HydrophobicContact CH2-CD2 3.71Å; W169-Y305 HydrophobicContact CH2-CE2 4.47Å; W169-Y305 AromaticContact CH2-CG 3.77Å; W169-Y305 HydrophobicContact CH2-CG 3.77Å; W169-Y305 AromaticContact CZ3-CD2 3.83Å; W169-Y305 HydrophobicContact CZ3-CD2 3.83Å; W169-Y305 HydrophobicContact CZ3-CG 4.14Å; V170-Y305 HydrophobicContact CG2-CD2 4.37Å; T303-Y305 VanDerWaalsContact C-N 3.28Å; T303-Y305 VanDerWaalsContact CB-CE1 3.45Å; T303-Y305 HydrophobicContact CG2-CE1 3.75Å; T303-Y305 HydrophobicContact CG2-CE2 4.36Å; T303-Y305 PolarHBondContact O-N 3.11Å; T303-Y305 WeakPolarHBondContact OG1-CD2 3.35Å; T303-Y305 WeakPolarHBondContact OG1-CE2 3.44Å; T303-Y305 VanDerWaalsContact OG1-CZ 3.23Å; Y305-L308 WeakPolarHBondContact O-CB 3.4Å; Y305-L308 PolarHBondContact O-N 2.86Å; Y305-V309 WeakPolarHBondContact O-CG2 3.35Å; Y305-V309 PolarHBondContact O-N 3.16Å; Y305-V309 VanDerWaalsContact O-N 3.12Å; Y305-L349 HydrophobicContact CD1-CD1 3.82Å; Y305-L349 HydrophobicContact CE1-CD1 4.2Å
306	H	89	Confident	87.4	Confident	1 Å²	1	33 Å²	33	1%	0.005	17%	0.171	C	C	.	.	H	α-helix	trans	-67.3	-44.4	167.9	-175.5	-172.1	0	0	0	110	V170 K174 L301 T303 L308 V309 T310	V170-H306 HydrophobicContact CG1-CB 3.88Å; V170-H306 VanDerWaalsContact CG1-CD2 3.46Å; V170-H306 WeakPolarHBondContact CG1-CD2 3.34Å; K174-H306 PolarHBondContact NZ-ND1 3.26Å; L301-H306 HydrophobicContact CD2-CB 4.39Å; L301-H306 PolarHBondContact O-ND1 2.92Å; T303-H306 PolarHBondContact O-N 2.97Å; T303-H306 WeakPolarHBondContact OG1-CB 3.18Å; H306-L308 VanDerWaalsContact C-N 3.31Å; H306-L308 PolarHBondContact O-N 3.22Å; H306-V309 PolarHBondContact O-N 3.45Å; H306-T310 PolarHBondContact CD2-OG1 3.4Å; H306-T310 PolarHBondContact O-N 3.43Å; H306-T310 PolarHBondContact O-OG1 3Å; H306-T310 VanDerWaalsContact O-OG1 3.06Å
307	F	90.4	Very high	87.3	Confident	0 Å²	0	26.6 Å²	26.6	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-56.3	-44.1	172.9	173.9	-116.2	0	0	0	112.2	L294 L295 L301 T303 W304 V309 T310 R311 C331 M334 F335	L294-F307 HydrophobicContact CB-CD2 4.2Å; L294-F307 HydrophobicContact CB-CE2 3.67Å; L294-F307 HydrophobicContact CD1-CE2 4.3Å; L295-F307 HydrophobicContact CD2-CE1 4.06Å; L295-F307 HydrophobicContact CD2-CE2 4.07Å; L295-F307 HydrophobicContact CD2-CZ 3.76Å; L295-F307 HydrophobicContact CG-CE2 4.28Å; L295-F307 HydrophobicContact CG-CZ 4.1Å; L301-F307 HydrophobicContact CD1-CB 4.01Å; L301-F307 HydrophobicContact CD1-CD2 3.84Å; L301-F307 HydrophobicContact CD1-CG 4.38Å; T303-F307 PolarHBondContact O-N 3.15Å; W304-F307 WeakPolarHBondContact O-CB 3.49Å; W304-F307 PolarHBondContact O-N 3.09Å; F307-V309 PolarHBondContact O-N 3.28Å; F307-T310 PolarHBondContact O-N 2.92Å; F307-R311 VanDerWaalsContact O-CB 3.32Å; F307-R311 WeakPolarHBondContact O-CB 3.45Å; F307-R311 PolarHBondContact O-N 3.34Å; F307-C331 HydrophobicContact CD1-CB 3.75Å; F307-C331 HydrophobicContact CE1-CB 3.96Å; F307-C331 VanDerWaalsContact CE1-SG 3.59Å; F307-M334 HydrophobicContact CE1-CB 4.37Å; F307-M334 HydrophobicContact CE1-SD 4.48Å; F307-F335 HydrophobicContact CB-CD2 3.79Å; F307-F335 HydrophobicContact CB-CE2 4.09Å; F307-F335 HydrophobicContact CD1-CD2 4.28Å; F307-F335 HydrophobicContact CG-CD2 4.1Å
308	L	91.1	Very high	87.3	Confident	0 Å²	0	26.8 Å²	26.8	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-55.1	-52.8	174.7	173.7	65	0	0	0	111.4	W304 Y305 H306 T310 R311 L312 L324 A328 C331 F353	W304-L308 HydrophobicContact CZ3-CD2 4.13Å; W304-L308 PolarHBondContact O-N 2.98Å; Y305-L308 WeakPolarHBondContact O-CB 3.4Å; Y305-L308 PolarHBondContact O-N 2.86Å; H306-L308 VanDerWaalsContact C-N 3.31Å; H306-L308 PolarHBondContact O-N 3.22Å; L308-T310 VanDerWaalsContact C-N 3.35Å; L308-T310 PolarHBondContact O-N 3.49Å; L308-R311 PolarHBondContact O-N 2.91Å; L308-L312 HydrophobicContact CD1-CD1 4.04Å; L308-L312 HydrophobicContact CD1-CG 4.2Å; L308-L312 HydrophobicContact CG-CD1 4.05Å; L308-L312 VanDerWaalsContact O-CG 3.25Å; L308-L312 WeakPolarHBondContact O-CG 3.49Å; L308-L312 PolarHBondContact O-N 2.83Å; L308-L324 HydrophobicContact CD2-CD1 4.49Å; L308-A328 HydrophobicContact CD2-CB 3.88Å; L308-C331 HydrophobicContact CB-CB 4.11Å; L308-C331 HydrophobicContact CD1-CB 4.24Å; L308-F353 HydrophobicContact CD2-CD2 4.48Å; L308-F353 HydrophobicContact CD2-CE1 4.23Å; L308-F353 HydrophobicContact CD2-CE2 3.94Å; L308-F353 HydrophobicContact CD2-CZ 3.8Å
309	V	91	Very high	87.4	Confident	1 Å²	1	24.6 Å²	24.6	1%	0.006	14%	0.136	C	C	.	.	H	α-helix	trans	-65.3	-39.1	-177.4	175.3	0	0	0	0	111.7	L163 L166 L167 V170 Y305 H306 F307 L312 L313	L163-V309 HydrophobicContact CD1-CG1 4.36Å; L166-V309 HydrophobicContact CB-CG1 4.34Å; L166-V309 HydrophobicContact CB-CG2 3.89Å; L167-V309 HydrophobicContact CB-CG1 4.49Å; L167-V309 HydrophobicContact CD2-CG1 3.53Å; L167-V309 HydrophobicContact CG-CG1 3.85Å; V170-V309 HydrophobicContact CG2-CB 3.91Å; V170-V309 HydrophobicContact CG2-CG1 4.27Å; V170-V309 HydrophobicContact CG2-CG2 3.6Å; Y305-V309 WeakPolarHBondContact O-CG2 3.35Å; Y305-V309 PolarHBondContact O-N 3.16Å; Y305-V309 VanDerWaalsContact O-N 3.12Å; H306-V309 PolarHBondContact O-N 3.45Å; F307-V309 PolarHBondContact O-N 3.28Å; V309-L312 PolarHBondContact O-N 3.19Å; V309-L313 WeakPolarHBondContact O-CB 3.49Å; V309-L313 PolarHBondContact O-N 3.35Å
310	T	90.5	Very high	87.5	Confident	0 Å²	0	21.5 Å²	21.5	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-64.2	-43.1	174.8	-57.6	0	0	0	0	111.8	L205 L294 H306 F307 L308 L312 L313 Y314	L205-T310 HydrophobicContact CB-CG2 4.39Å; L205-T310 HydrophobicContact CD2-CG2 3.75Å; L205-T310 PolarHBondContact O-OG1 3.12Å; L294-T310 HydrophobicContact CD2-CG2 3.81Å; H306-T310 PolarHBondContact CD2-OG1 3.4Å; H306-T310 PolarHBondContact O-N 3.43Å; H306-T310 PolarHBondContact O-OG1 3Å; H306-T310 VanDerWaalsContact O-OG1 3.06Å; F307-T310 PolarHBondContact O-N 2.92Å; L308-T310 VanDerWaalsContact C-N 3.35Å; L308-T310 PolarHBondContact O-N 3.49Å; T310-L312 VanDerWaalsContact C-N 3.34Å; T310-L312 PolarHBondContact O-N 3.09Å; T310-L313 WeakPolarHBondContact O-CB 3.22Å; T310-L313 PolarHBondContact O-N 3.06Å; T310-Y314 HydrophobicContact CG2-CD2 3.77Å; T310-Y314 HydrophobicContact CG2-CE2 3.89Å; T310-Y314 WeakPolarHBondContact O-CD2 3.43Å; T310-Y314 PolarHBondContact O-N 3.13Å; T310-Y314 VanDerWaalsContact O-N 3.12Å
311	R	91.1	Very high	87.7	Confident	18 Å²	18	22 Å²	22	7%	0.068	12%	0.124	C	C	.	.	H	α-helix	trans	-62.5	-42	175.7	-173.6	-176.6	-178.1	-163.8	2.5	111.2	E291 F307 L308 L313 Y314 S315 S330 C331	E291-R311 IonicContact OE1-CZ 2.85Å; E291-R311 IonicContact OE1-NE 3.94Å; E291-R311 PolarHBondContact OE1-NE 3.42Å; E291-R311 IonicContact OE1-NH2 3.05Å; E291-R311 PolarHBondContact OE1-NH2 3.3Å; E291-R311 IonicContact OE2-NH2 3.58Å; F307-R311 VanDerWaalsContact O-CB 3.32Å; F307-R311 WeakPolarHBondContact O-CB 3.45Å; F307-R311 PolarHBondContact O-N 3.34Å; L308-R311 PolarHBondContact O-N 2.91Å; R311-L313 VanDerWaalsContact C-N 3.31Å; R311-L313 PolarHBondContact O-N 3.15Å; R311-Y314 PolarHBondContact O-N 3.43Å; R311-S315 WeakPolarHBondContact O-CA 3.1Å; R311-S315 WeakPolarHBondContact O-CB 3.42Å; R311-S315 PolarHBondContact O-N 3.5Å; R311-S315 PolarHBondContact O-OG 3.05Å; R311-S330 PolarHBondContact NH1-OG 3.37Å; R311-C331 WeakPolarHBondContact CD-SG 3.35Å; R311-C331 PolarHBondContact NH1-SG 3.44Å; R311-C331 VanDerWaalsContact NH1-SG 3.44Å
312	L	90.6	Very high	87.9	Confident	0 Å²	0	27.1 Å²	27.1	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-63.2	-38.7	175.3	-67.4	172.7	0	0	0	111.7	L163 L166 L308 V309 T310 H316 V319 L324 Y327	L163-L312 HydrophobicContact CD1-CB 3.85Å; L166-L312 HydrophobicContact CD1-CD1 4.39Å; L308-L312 HydrophobicContact CD1-CD1 4.04Å; L308-L312 HydrophobicContact CD1-CG 4.2Å; L308-L312 HydrophobicContact CG-CD1 4.05Å; L308-L312 VanDerWaalsContact O-CG 3.25Å; L308-L312 WeakPolarHBondContact O-CG 3.49Å; L308-L312 PolarHBondContact O-N 2.83Å; V309-L312 PolarHBondContact O-N 3.19Å; T310-L312 VanDerWaalsContact C-N 3.34Å; T310-L312 PolarHBondContact O-N 3.09Å; L312-H316 HydrophobicContact CD2-CB 4.28Å; L312-H316 CarbonylContact O-C 3.59Å; L312-H316 WeakPolarHBondContact O-CA 3.23Å; L312-H316 PolarHBondContact O-N 3.41Å; L312-H316 VanDerWaalsContact O-O 3.1Å; L312-V319 HydrophobicContact CD1-CG1 4.33Å; L312-V319 HydrophobicContact CD2-CB 4.02Å; L312-V319 HydrophobicContact CD2-CG1 4.01Å; L312-V319 HydrophobicContact CD2-CG2 4.01Å; L312-L324 HydrophobicContact CD1-CD1 3.6Å; L312-Y327 HydrophobicContact CD2-CD2 4.14Å; L312-Y327 HydrophobicContact CD2-CG 4.1Å
313	L	90.5	Very high	88.2	Confident	6 Å²	6	28.5 Å²	28.5	3%	0.031	15%	0.152	C	C	.	.	H	α-helix	trans	-63.6	-43.4	178.6	-179.6	60.9	0	0	0	113.4	L163 L167 M240 W258 V309 T310 R311	L163-L313 HydrophobicContact CD2-CD1 4.17Å; L167-L313 HydrophobicContact CD1-CD1 4.14Å; L167-L313 HydrophobicContact CD2-CD2 4.07Å; M240-L313 HydrophobicContact CE-CD1 3.55Å; M240-L313 HydrophobicContact CE-CD2 4.08Å; M240-L313 HydrophobicContact CE-CG 3.72Å; W258-L313 PolarHBondContact NE1-O 3.06Å; V309-L313 WeakPolarHBondContact O-CB 3.49Å; V309-L313 PolarHBondContact O-N 3.35Å; T310-L313 WeakPolarHBondContact O-CB 3.22Å; T310-L313 PolarHBondContact O-N 3.06Å; R311-L313 VanDerWaalsContact C-N 3.31Å; R311-L313 PolarHBondContact O-N 3.15Å
314	Y	89.8	Confident	88.3	Confident	0 Å²	0	26.6 Å²	26.6	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-99.8	-11.2	-173.2	-64.2	-60.7	0	0	0	115	V204 M240 W258 W261 I286 L287 T310 R311	V204-Y314 WeakPolarHBondContact CG1-OH 3.44Å; V204-Y314 PolarHBondContact O-OH 3.42Å; M240-Y314 HydrophobicContact CE-CD1 4.17Å; M240-Y314 HydrophobicContact CE-CE1 3.63Å; M240-Y314 HydrophobicContact SD-CE1 3.84Å; W258-Y314 WeakPolarHBondContact CH2-O 3.32Å; W258-Y314 VanDerWaalsContact CZ2-C 3.49Å; W258-Y314 WeakPolarHBondContact CZ2-O 3.3Å; W261-Y314 HydrophobicContact CH2-CD1 4.23Å; W261-Y314 HydrophobicContact CH2-CE1 4.3Å; I286-Y314 HydrophobicContact CG2-CD2 4.26Å; I286-Y314 HydrophobicContact CG2-CE2 3.95Å; L287-Y314 HydrophobicContact CD2-CD1 4.29Å; L287-Y314 HydrophobicContact CD2-CE1 3.47Å; L287-Y314 VanDerWaalsContact CD2-CE1 3.47Å; T310-Y314 HydrophobicContact CG2-CD2 3.77Å; T310-Y314 HydrophobicContact CG2-CE2 3.89Å; T310-Y314 WeakPolarHBondContact O-CD2 3.43Å; T310-Y314 PolarHBondContact O-N 3.13Å; T310-Y314 VanDerWaalsContact O-N 3.12Å; R311-Y314 PolarHBondContact O-N 3.43Å
315	S	87.8	Confident	88.4	Confident	27 Å²	27	28.7 Å²	28.7	19%	0.189	15%	0.15	C	C	.	.	H	α-helix	trans	-120.2	-36.1	179.2	-47.1	0	0	0	0	113.4	R311	R311-S315 WeakPolarHBondContact O-CA 3.1Å; R311-S315 WeakPolarHBondContact O-CB 3.42Å; R311-S315 PolarHBondContact O-N 3.5Å; R311-S315 PolarHBondContact O-OG 3.05Å
316	H	86.6	Confident	88.4	Confident	68 Å²	68	35 Å²	35	32%	0.315	18%	0.175	S	C	.	.			trans	-143.8	68.8	-169.5	-61.6	-51.2	0	0	0	113.6	L312 T318 V319 Y327	L312-H316 HydrophobicContact CD2-CB 4.28Å; L312-H316 CarbonylContact O-C 3.59Å; L312-H316 WeakPolarHBondContact O-CA 3.23Å; L312-H316 PolarHBondContact O-N 3.41Å; L312-H316 VanDerWaalsContact O-O 3.1Å; H316-T318 PolarHBondContact O-N 3.37Å; H316-V319 PolarHBondContact O-N 3.4Å; H316-Y327 AromaticContact CD2-CE1 3.24Å; H316-Y327 WeakPolarHBondContact CD2-CE1 3.32Å; H316-Y327 AromaticContact CD2-CZ 3.55Å; H316-Y327 PolarHBondContact CD2-OH 2.99Å; H316-Y327 AromaticContact NE2-CE1 3.56Å; H316-Y327 AromaticContact NE2-CZ 3.95Å
317	P	84.8	Confident	88.4	Confident	5 Å²	5	37 Å²	37	3%	0.032	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-13.9	-171.7	34.9	-43.3	0	0	0	114.2	L163 F254 W258	L163-P317 HydrophobicContact CD2-CB 4.22Å; F254-P317 HydrophobicContact CE1-CB 3.88Å; F254-P317 HydrophobicContact CE1-CG 4.25Å; F254-P317 HydrophobicContact CZ-CB 4.06Å; W258-P317 HydrophobicContact CB-CG 4.41Å; W258-P317 HydrophobicContact CD2-CB 4.45Å; W258-P317 HydrophobicContact CD2-CG 3.51Å; W258-P317 HydrophobicContact CE3-CG 3.91Å; W258-P317 HydrophobicContact CG-CB 4.38Å; W258-P317 HydrophobicContact CG-CG 3.71Å; W258-P317 HydrophobicContact CZ2-CG 4.17Å; W258-P317 HydrophobicContact CZ3-CG 4.41Å
318	T	85.1	Confident	88.4	Confident	38 Å²	38	37 Å²	37	23%	0.233	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.8	21.5	-178.4	51.3	0	0	0	0	113.1	L251 F254 D255 H316 K320	L251-T318 HydrophobicContact CD1-CG2 4.09Å; L251-T318 HydrophobicContact CD2-CG2 4.36Å; L251-T318 HydrophobicContact CG-CG2 3.95Å; F254-T318 HydrophobicContact CD1-CG2 3.93Å; F254-T318 HydrophobicContact CE1-CG2 4.1Å; D255-T318 HydrophobicContact CB-CG2 3.94Å; D255-T318 WeakPolarHBondContact OD1-CG2 3.18Å; D255-T318 PolarHBondContact OD1-OG1 3.4Å; D255-T318 VanDerWaalsContact OD1-OG1 3.12Å; H316-T318 PolarHBondContact O-N 3.37Å; T318-K320 PolarHBondContact O-N 3.04Å
319	V	86.3	Confident	88.3	Confident	10 Å²	10	41.6 Å²	41.6	6%	0.061	21%	0.205	C	C	.	.			trans	-52	135.3	179.7	68	0	0	0	0	112	L312 H316 Y327	L312-V319 HydrophobicContact CD1-CG1 4.33Å; L312-V319 HydrophobicContact CD2-CB 4.02Å; L312-V319 HydrophobicContact CD2-CG1 4.01Å; L312-V319 HydrophobicContact CD2-CG2 4.01Å; H316-V319 PolarHBondContact O-N 3.4Å; V319-Y327 HydrophobicContact CG2-CD2 3.84Å; V319-Y327 HydrophobicContact CG2-CE2 3.78Å
320	K	86.2	Confident	88.2	Confident	124 Å²	124	42.7 Å²	42.7	54%	0.539	21%	0.212	S	C	.	.			trans	-86.7	148.2	174.2	-66.8	175.7	-176.8	171.1	0	109.8	T318 T322 D323 L324	T318-K320 PolarHBondContact O-N 3.04Å; K320-T322 PolarHBondContact O-N 2.9Å; K320-D323 PolarHBondContact O-N 2.98Å; K320-L324 PolarHBondContact O-N 3.16Å
321	P	85.3	Confident	88.1	Confident	40 Å²	40	42.7 Å²	42.7	26%	0.26	21%	0.212	S	C	.	.	G	3₁₀ helix	trans	-50.6	-41.7	175.4	-25	30.4	0	0	0	113.2	L162 D323 L324 F355	L162-P321 HydrophobicContact CD2-CB 4.33Å; L162-P321 HydrophobicContact CD2-CG 4.05Å; P321-D323 PolarHBondContact O-N 2.78Å; P321-L324 VanDerWaalsContact O-CB 3.23Å; P321-L324 WeakPolarHBondContact O-CB 3.49Å; P321-L324 PolarHBondContact O-N 3.2Å; P321-F355 HydrophobicContact CB-CE1 4.43Å; P321-F355 HydrophobicContact CB-CE2 4.22Å; P321-F355 HydrophobicContact CB-CZ 3.65Å; P321-F355 WeakPolarHBondContact O-CE2 3.36Å
322	T	85.6	Confident	87.9	Confident	109 Å²	109	42.4 Å²	42.4	67%	0.669	21%	0.212	S	C	*	.	G	3₁₀ helix	trans	-61.9	-27.8	-178.5	53.1	0	0	0	0	114.5	K320	K320-T322 PolarHBondContact O-N 2.9Å
323	D	87.1	Confident	87.7	Confident	75 Å²	75	47.3 Å²	47.3	40%	0.401	24%	0.242	S	C	.	.	G	3₁₀ helix	trans	-95.3	-7.6	-173.2	-51.9	-22.7	0	0	0	110.8	K320 P321 H325 Y326 Y327	K320-D323 PolarHBondContact O-N 2.98Å; P321-D323 PolarHBondContact O-N 2.78Å; D323-H325 VanDerWaalsContact C-N 3.32Å; D323-H325 PolarHBondContact O-N 3.48Å; D323-Y326 PolarHBondContact O-N 2.82Å; D323-Y327 HydrophobicContact CB-CE2 4.29Å; D323-Y327 VanDerWaalsContact O-CD2 3.23Å; D323-Y327 WeakPolarHBondContact O-CD2 3.4Å
324	L	87.9	Confident	87.4	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-62.9	-37.2	-173.8	-171.9	57.4	0	0	0	112.6	L152 L162 L166 L308 L312 K320 P321 Y326 Y327 A328 F353	L152-L324 HydrophobicContact CD2-CD2 3.92Å; L162-L324 HydrophobicContact CD2-CD2 4.26Å; L166-L324 HydrophobicContact CD1-CD1 4.36Å; L166-L324 HydrophobicContact CD1-CD2 4.24Å; L308-L324 HydrophobicContact CD2-CD1 4.49Å; L312-L324 HydrophobicContact CD1-CD1 3.6Å; K320-L324 PolarHBondContact O-N 3.16Å; P321-L324 VanDerWaalsContact O-CB 3.23Å; P321-L324 WeakPolarHBondContact O-CB 3.49Å; P321-L324 PolarHBondContact O-N 3.2Å; L324-Y326 VanDerWaalsContact C-N 3.34Å; L324-Y326 PolarHBondContact O-N 2.79Å; L324-Y327 PolarHBondContact O-N 2.96Å; L324-A328 WeakPolarHBondContact O-CB 3.22Å; L324-A328 PolarHBondContact O-N 2.97Å; L324-F353 HydrophobicContact CD1-CD1 4.46Å; L324-F353 HydrophobicContact CD2-CD1 3.37Å; L324-F353 HydrophobicContact CD2-CE1 3.69Å; L324-F353 HydrophobicContact CG-CD1 3.57Å; L324-F353 HydrophobicContact CG-CE1 4.07Å; L324-F353 HydrophobicContact CG-CG 4.37Å
325	H	90.2	Very high	87.1	Confident	49 Å²	49	51.5 Å²	51.5	23%	0.227	26%	0.262	C	S	.	.	H	α-helix	trans	-56.8	-44.9	175.7	166.7	55.3	0	0	0	112.7	D323 Y327 A328 Q329 E354	D323-H325 VanDerWaalsContact C-N 3.32Å; D323-H325 PolarHBondContact O-N 3.48Å; H325-Y327 VanDerWaalsContact C-N 3.32Å; H325-Y327 PolarHBondContact O-N 3.08Å; H325-A328 PolarHBondContact O-N 3.21Å; H325-A328 VanDerWaalsContact O-N 3.15Å; H325-Q329 PolarHBondContact O-N 2.8Å; H325-E354 HydrophobicContact CB-CG 4.02Å; H325-E354 WeakPolarHBondContact CE1-CG 3.44Å; H325-E354 IonicContact CE1-OE1 2.68Å; H325-E354 PolarHBondContact CE1-OE1 3.16Å; H325-E354 WeakPolarHBondContact ND1-CG 3.47Å; H325-E354 IonicContact ND1-OE1 3.96Å; H325-E354 PolarHBondContact ND1-OE1 3.48Å; H325-E354 IonicContact NE2-OE1 3.49Å
326	Y	89.9	Confident	86.7	Confident	163 Å²	163	52.3 Å²	52.3	64%	0.639	26%	0.264	S	S	*	.	H	α-helix	trans	-60.4	-44.2	-179.6	174.6	-97.7	0	0	0	111.4	D323 L324 S330	D323-Y326 PolarHBondContact O-N 2.82Å; L324-Y326 VanDerWaalsContact C-N 3.34Å; L324-Y326 PolarHBondContact O-N 2.79Å; Y326-S330 WeakPolarHBondContact O-CB 3.45Å; Y326-S330 PolarHBondContact O-N 2.89Å
327	Y	89.5	Confident	85.8	Confident	43 Å²	43	54.4 Å²	54.4	17%	0.169	28%	0.277	C	S	.	.	H	α-helix	trans	-66.5	-40.8	175.7	-66.4	-69	0	0	0	111.9	L312 H316 V319 D323 L324 H325 S330 C331	L312-Y327 HydrophobicContact CD2-CD2 4.14Å; L312-Y327 HydrophobicContact CD2-CG 4.1Å; H316-Y327 AromaticContact CD2-CE1 3.24Å; H316-Y327 WeakPolarHBondContact CD2-CE1 3.32Å; H316-Y327 AromaticContact CD2-CZ 3.55Å; H316-Y327 PolarHBondContact CD2-OH 2.99Å; H316-Y327 AromaticContact NE2-CE1 3.56Å; H316-Y327 AromaticContact NE2-CZ 3.95Å; V319-Y327 HydrophobicContact CG2-CD2 3.84Å; V319-Y327 HydrophobicContact CG2-CE2 3.78Å; D323-Y327 HydrophobicContact CB-CE2 4.29Å; D323-Y327 VanDerWaalsContact O-CD2 3.23Å; D323-Y327 WeakPolarHBondContact O-CD2 3.4Å; L324-Y327 PolarHBondContact O-N 2.96Å; H325-Y327 VanDerWaalsContact C-N 3.32Å; H325-Y327 PolarHBondContact O-N 3.08Å; Y327-S330 PolarHBondContact O-N 3.1Å; Y327-C331 VanDerWaalsContact O-CB 3.29Å; Y327-C331 WeakPolarHBondContact O-CB 3.18Å; Y327-C331 PolarHBondContact O-N 3.39Å; Y327-C331 PolarHBondContact O-SG 3.29Å; Y327-C331 VanDerWaalsContact O-SG 3.33Å
328	A	89.9	Confident	84.4	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-60.6	-48.7	178	0	0	0	0	0	111.8	W304 L308 L324 H325 C331 L332 L350 F353	W304-A328 HydrophobicContact CH2-CB 4.33Å; W304-A328 HydrophobicContact CZ3-CB 3.95Å; L308-A328 HydrophobicContact CD2-CB 3.88Å; L324-A328 WeakPolarHBondContact O-CB 3.22Å; L324-A328 PolarHBondContact O-N 2.97Å; H325-A328 PolarHBondContact O-N 3.21Å; H325-A328 VanDerWaalsContact O-N 3.15Å; A328-C331 PolarHBondContact O-N 3.45Å; A328-L332 WeakPolarHBondContact O-CB 3.47Å; A328-L332 PolarHBondContact O-N 3.21Å; A328-L350 HydrophobicContact CB-CD2 4.18Å; A328-F353 HydrophobicContact CB-CB 4.02Å; A328-F353 HydrophobicContact CB-CD2 3.75Å; A328-F353 HydrophobicContact CB-CE2 4.44Å; A328-F353 HydrophobicContact CB-CG 3.97Å
329	Q	89.1	Confident	82.8	Confident	98 Å²	98	69.9 Å²	69.9	46%	0.458	35%	0.351	S	S	.	.	H	α-helix	trans	-64.4	-41.9	178.4	-169.2	179.4	20.6	0	0	112	H325 L332 T333	H325-Q329 PolarHBondContact O-N 2.8Å; Q329-L332 PolarHBondContact O-N 3.12Å; Q329-T333 WeakPolarHBondContact O-CB 3.3Å; Q329-T333 PolarHBondContact O-N 3.29Å; Q329-T333 PolarHBondContact O-OG1 2.9Å
330	S	89.4	Confident	81.6	Confident	23 Å²	23	72 Å²	72	16%	0.161	37%	0.367	C	S	.	.	H	α-helix	trans	-60.5	-47.4	174	172.1	0	0	0	0	111.7	R311 Y326 Y327 T333 M334	R311-S330 PolarHBondContact NH1-OG 3.37Å; Y326-S330 WeakPolarHBondContact O-CB 3.45Å; Y326-S330 PolarHBondContact O-N 2.89Å; Y327-S330 PolarHBondContact O-N 3.1Å; S330-T333 PolarHBondContact O-N 2.86Å; S330-M334 VanDerWaalsContact O-CG 3.27Å; S330-M334 WeakPolarHBondContact O-CG 3.34Å; S330-M334 PolarHBondContact O-N 3.38Å; S330-M334 WeakPolarHBondContact OG-CE 3.49Å
331	C	88.3	Confident	80.6	Confident	0 Å²	0	72.5 Å²	72.5	0%	0	38%	0.379	C	S	.	.	H	α-helix	trans	-64.3	-41.4	179.1	-78.1	0	0	0	0	112.3	F307 L308 R311 Y327 A328 T333 M334 F335	F307-C331 HydrophobicContact CD1-CB 3.75Å; F307-C331 HydrophobicContact CE1-CB 3.96Å; F307-C331 VanDerWaalsContact CE1-SG 3.59Å; L308-C331 HydrophobicContact CB-CB 4.11Å; L308-C331 HydrophobicContact CD1-CB 4.24Å; R311-C331 WeakPolarHBondContact CD-SG 3.35Å; R311-C331 PolarHBondContact NH1-SG 3.44Å; R311-C331 VanDerWaalsContact NH1-SG 3.44Å; Y327-C331 VanDerWaalsContact O-CB 3.29Å; Y327-C331 WeakPolarHBondContact O-CB 3.18Å; Y327-C331 PolarHBondContact O-N 3.39Å; Y327-C331 PolarHBondContact O-SG 3.29Å; Y327-C331 VanDerWaalsContact O-SG 3.33Å; A328-C331 PolarHBondContact O-N 3.45Å; C331-T333 PolarHBondContact O-N 3.43Å; C331-M334 PolarHBondContact O-N 3.12Å; C331-F335 WeakPolarHBondContact O-CB 3.21Å; C331-F335 PolarHBondContact O-N 3.39Å
332	L	86.8	Confident	79.9	Confident	12 Å²	12	74.9 Å²	74.9	6%	0.063	39%	0.387	C	S	.	.	H	α-helix	trans	-58.9	-47.9	174.9	-174.9	77.2	0	0	0	111.2	W304 A328 Q329 M334 F335 L336 D346 L350	W304-L332 HydrophobicContact CB-CD1 4.39Å; W304-L332 HydrophobicContact CD2-CB 4.39Å; W304-L332 HydrophobicContact CD2-CD1 3.7Å; W304-L332 HydrophobicContact CE3-CB 4.28Å; W304-L332 HydrophobicContact CE3-CD1 4.38Å; W304-L332 HydrophobicContact CG-CD1 3.66Å; W304-L332 HydrophobicContact CZ2-CD1 4.34Å; A328-L332 WeakPolarHBondContact O-CB 3.47Å; A328-L332 PolarHBondContact O-N 3.21Å; Q329-L332 PolarHBondContact O-N 3.12Å; L332-M334 VanDerWaalsContact C-N 3.31Å; L332-M334 PolarHBondContact O-N 3.01Å; L332-F335 PolarHBondContact O-N 3.28Å; L332-L336 HydrophobicContact CD1-CD1 3.5Å; L332-L336 HydrophobicContact CD1-CG 3.98Å; L332-L336 HydrophobicContact CD2-CD1 4.44Å; L332-L336 HydrophobicContact CG-CD1 3.75Å; L332-L336 HydrophobicContact CG-CG 4.3Å; L332-L336 VanDerWaalsContact O-CB 3.29Å; L332-L336 WeakPolarHBondContact O-CB 3.35Å; L332-L336 PolarHBondContact O-N 3.49Å; L332-D346 HydrophobicContact CD1-CB 4.32Å; L332-L350 HydrophobicContact CD2-CD1 3.37Å; L332-L350 HydrophobicContact CD2-CD2 4.16Å; L332-L350 HydrophobicContact CD2-CG 4.18Å
333	T	86.4	Confident	79.7	Confident	103 Å²	103	75.6 Å²	75.6	63%	0.632	38%	0.383	S	S	*	.	H	α-helix	trans	-64.8	-33.8	-178.4	-52.9	0	0	0	0	112.6	Q329 S330 C331	Q329-T333 WeakPolarHBondContact O-CB 3.3Å; Q329-T333 PolarHBondContact O-N 3.29Å; Q329-T333 PolarHBondContact O-OG1 2.9Å; S330-T333 PolarHBondContact O-N 2.86Å; C331-T333 PolarHBondContact O-N 3.43Å
334	M	84.3	Confident	79.5	Confident	66 Å²	66	75.7 Å²	75.7	33%	0.325	39%	0.388	S	S	.	.	H	α-helix	trans	-78.4	-35.6	177.1	-68.5	169	173.1	0	0	112.5	L295 K298 F307 S330 C331 L332	L295-M334 HydrophobicContact CD1-CB 4.44Å; L295-M334 HydrophobicContact CD2-CB 4.14Å; K298-M334 PolarHBondContact NZ-O 3.05Å; F307-M334 HydrophobicContact CE1-CB 4.37Å; F307-M334 HydrophobicContact CE1-SD 4.48Å; S330-M334 VanDerWaalsContact O-CG 3.27Å; S330-M334 WeakPolarHBondContact O-CG 3.34Å; S330-M334 PolarHBondContact O-N 3.38Å; S330-M334 WeakPolarHBondContact OG-CE 3.49Å; C331-M334 PolarHBondContact O-N 3.12Å; L332-M334 VanDerWaalsContact C-N 3.31Å; L332-M334 PolarHBondContact O-N 3.01Å
335	F	82.5	Confident	79.4	Confident	29 Å²	29	77.4 Å²	77.4	13%	0.127	40%	0.396	C	S	.	.	H	α-helix	trans	-79.4	-44.5	-175.5	-164	-89.2	0	0	0	111.6	K298 L301 W304 F307 C331 L332 D337	K298-F335 HydrophobicContact CB-CE2 4.26Å; K298-F335 HydrophobicContact CB-CZ 4.45Å; K298-F335 HydrophobicContact CG-CD2 3.99Å; K298-F335 HydrophobicContact CG-CE2 3.73Å; K298-F335 HydrophobicContact CG-CZ 4.23Å; K298-F335 PolarHBondContact NZ-O 3.49Å; L301-F335 HydrophobicContact CB-CE2 4.19Å; W304-F335 HydrophobicContact CB-CB 3.63Å; W304-F335 HydrophobicContact CB-CD1 3.63Å; W304-F335 HydrophobicContact CB-CD2 4.38Å; W304-F335 HydrophobicContact CB-CE1 4.4Å; W304-F335 HydrophobicContact CB-CG 3.62Å; F307-F335 HydrophobicContact CB-CD2 3.79Å; F307-F335 HydrophobicContact CB-CE2 4.09Å; F307-F335 HydrophobicContact CD1-CD2 4.28Å; F307-F335 HydrophobicContact CG-CD2 4.1Å; C331-F335 WeakPolarHBondContact O-CB 3.21Å; C331-F335 PolarHBondContact O-N 3.39Å; L332-F335 PolarHBondContact O-N 3.28Å; F335-D337 PolarHBondContact O-N 3.3Å
336	L	79.4	Confident	79.3	Confident	43 Å²	43	75.6 Å²	75.6	23%	0.225	39%	0.389	C	S	.	.	S	Bend	trans	-76.9	117.9	175	-67.6	-175.5	0	0	0	110	L332 S340	L332-L336 HydrophobicContact CD1-CD1 3.5Å; L332-L336 HydrophobicContact CD1-CG 3.98Å; L332-L336 HydrophobicContact CD2-CD1 4.44Å; L332-L336 HydrophobicContact CG-CD1 3.75Å; L332-L336 HydrophobicContact CG-CG 4.3Å; L332-L336 VanDerWaalsContact O-CB 3.29Å; L332-L336 WeakPolarHBondContact O-CB 3.35Å; L332-L336 PolarHBondContact O-N 3.49Å; L336-S340 VanDerWaalsContact CB-OG 3.31Å; L336-S340 WeakPolarHBondContact CB-OG 3.43Å; L336-S340 WeakPolarHBondContact CD2-OG 3.45Å
337	D	68.3	Low	79.3	Confident	112 Å²	112	69.8 Å²	69.8	60%	0.599	37%	0.372	S	S	*	.			trans	-63.9	148.7	168.3	-70.8	-11.5	0	0	0	108.8	K298 F335 R339 S340	K298-D337 IonicContact NZ-OD1 2.64Å; K298-D337 PolarHBondContact NZ-OD1 3.34Å; F335-D337 PolarHBondContact O-N 3.3Å; D337-R339 PolarHBondContact O-N 3.27Å; D337-S340 PolarHBondContact N-OG 3.42Å; D337-S340 PolarHBondContact O-N 2.86Å; D337-S340 PolarHBondContact O-OG 3.35Å
338	S	54.3	Low	79.3	Confident	132 Å²	132	67.7 Å²	67.7	92%	0.923	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-0.2	-178.2	51	0	0	0	0	116
339	R	51.6	Low	79.3	Confident	236 Å²	236	67.7 Å²	67.7	89%	0.891	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.4	-8.1	176.7	-62.3	-174.5	178.3	-171.1	0.1	114.2	D337	D337-R339 PolarHBondContact O-N 3.27Å
340	S	62.2	Low	79.4	Confident	56 Å²	56	63.9 Å²	63.9	39%	0.392	35%	0.346	S	S	.	.	S	Bend	trans	-82.3	135.2	178.7	56.8	0	0	0	0	110.5	L336 D337	L336-S340 VanDerWaalsContact CB-OG 3.31Å; L336-S340 WeakPolarHBondContact CB-OG 3.43Å; L336-S340 WeakPolarHBondContact CD2-OG 3.45Å; D337-S340 PolarHBondContact N-OG 3.42Å; D337-S340 PolarHBondContact O-N 2.86Å; D337-S340 PolarHBondContact O-OG 3.35Å
341	V	64	Low	79.4	Confident	133 Å²	133	62.9 Å²	62.9	81%	0.806	34%	0.339	S	S	*	.	P	Polyproline II helix	trans	-81.1	126.5	176.6	-178.9	0	0	0	0	107.4	E343	V341-E343 PolarHBondContact O-N 2.89Å
342	Q	71.8	Confident	79.6	Confident	91 Å²	91	62.9 Å²	62.9	43%	0.425	34%	0.339	S	S	.	.	P	Polyproline II helix	trans	-60.8	125.5	174.7	-177	178.7	-11.3	0	0	109.5	D346	Q342-D346 HydrophobicContact CG-CB 3.81Å
343	E	80.5	Confident	79.8	Confident	124 Å²	124	62.4 Å²	62.4	58%	0.579	34%	0.337	S	S	*	.	P	Polyproline II helix	trans	-74.8	150.3	177.3	-65.8	-166	135.2	0	0	110.1	V341 L345 D346 S347	V341-E343 PolarHBondContact O-N 2.89Å; E343-L345 PolarHBondContact O-N 3.49Å; E343-L345 VanDerWaalsContact O-N 3.13Å; E343-D346 PolarHBondContact N-OD2 3.03Å; E343-D346 WeakPolarHBondContact O-CB 3.45Å; E343-D346 PolarHBondContact O-N 3.24Å; E343-S347 PolarHBondContact O-N 3.5Å
344	P	83.5	Confident	79.9	Confident	77 Å²	77	61.8 Å²	61.8	50%	0.5	33%	0.326	S	S	.	.	H	α-helix	trans	-57.7	-30	177.3	-23.5	32.8	0	0	0	113.1	D346 S347 I348 V367	P344-D346 VanDerWaalsContact C-N 3.32Å; P344-D346 PolarHBondContact O-N 3Å; P344-S347 WeakPolarHBondContact O-CB 3.45Å; P344-S347 PolarHBondContact O-N 3.07Å; P344-I348 WeakPolarHBondContact O-CG1 3.42Å; P344-I348 PolarHBondContact O-N 3.46Å; P344-V367 HydrophobicContact CB-CB 4.37Å; P344-V367 HydrophobicContact CB-CG1 3.96Å; P344-V367 HydrophobicContact CB-CG2 3.41Å; P344-V367 VanDerWaalsContact CB-CG2 3.41Å; P344-V367 HydrophobicContact CG-CG2 4.47Å
345	L	86.2	Confident	80.1	Confident	35 Å²	35	62 Å²	62	18%	0.183	33%	0.326	C	S	.	.	H	α-helix	trans	-61.6	-38.4	173.7	-178.5	60.9	0	0	0	112.2	A141 L144 I145 E343 S347 I348 L349	A141-L345 HydrophobicContact CB-CD1 4.21Å; A141-L345 HydrophobicContact CB-CD2 4.45Å; L144-L345 HydrophobicContact CD2-CD1 4.44Å; L144-L345 HydrophobicContact CD2-CD2 4.02Å; I145-L345 HydrophobicContact CD1-CD1 3.61Å; I145-L345 HydrophobicContact CG1-CD1 3.7Å; E343-L345 PolarHBondContact O-N 3.49Å; E343-L345 VanDerWaalsContact O-N 3.13Å; L345-S347 VanDerWaalsContact C-N 3.33Å; L345-S347 PolarHBondContact O-N 3.08Å; L345-I348 PolarHBondContact O-N 2.89Å; L345-L349 HydrophobicContact CD1-CG 4.4Å; L345-L349 HydrophobicContact CG-CD1 4.25Å; L345-L349 HydrophobicContact CG-CG 4.45Å; L345-L349 WeakPolarHBondContact O-CG 3.37Å; L345-L349 PolarHBondContact O-N 2.82Å
346	D	87.9	Confident	80.4	Confident	12 Å²	12	63.8 Å²	63.8	6%	0.064	34%	0.337	C	S	.	.	H	α-helix	trans	-65.7	-39.3	179.8	-62.6	-34.9	0	0	0	111.1	W304 L332 Q342 E343 P344 I348 L349 L350	W304-D346 PolarHBondContact NE1-OD1 3.44Å; L332-D346 HydrophobicContact CD1-CB 4.32Å; Q342-D346 HydrophobicContact CG-CB 3.81Å; E343-D346 PolarHBondContact N-OD2 3.03Å; E343-D346 WeakPolarHBondContact O-CB 3.45Å; E343-D346 PolarHBondContact O-N 3.24Å; P344-D346 VanDerWaalsContact C-N 3.32Å; P344-D346 PolarHBondContact O-N 3Å; D346-I348 VanDerWaalsContact C-N 3.33Å; D346-I348 PolarHBondContact O-N 2.69Å; D346-L349 PolarHBondContact O-N 2.87Å; D346-L350 WeakPolarHBondContact O-CB 3.37Å; D346-L350 VanDerWaalsContact O-CG 3.24Å; D346-L350 WeakPolarHBondContact O-CG 3.31Å; D346-L350 PolarHBondContact O-N 3.19Å
347	S	88.8	Confident	80.8	Confident	40 Å²	40	62.8 Å²	62.8	28%	0.28	33%	0.331	S	S	.	.	H	α-helix	trans	-57.7	-46.3	173.2	-171.7	0	0	0	0	111.4	E343 P344 L345 L349 L350 A351 D363	E343-S347 PolarHBondContact O-N 3.5Å; P344-S347 WeakPolarHBondContact O-CB 3.45Å; P344-S347 PolarHBondContact O-N 3.07Å; L345-S347 VanDerWaalsContact C-N 3.33Å; L345-S347 PolarHBondContact O-N 3.08Å; S347-L349 PolarHBondContact O-N 3.25Å; S347-L350 PolarHBondContact O-N 3.23Å; S347-A351 WeakPolarHBondContact O-CB 3.15Å; S347-A351 PolarHBondContact O-N 3.16Å; S347-D363 PolarHBondContact OG-OD2 3.16Å
348	I	89.8	Confident	81.7	Confident	0 Å²	0	61.8 Å²	61.8	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-63.1	-45	179.3	-64.6	163.6	0	0	0	111.2	I145 P344 L345 D346 A351 A352 V360 D363 V367	I145-I348 HydrophobicContact CD1-CD1 4.17Å; I145-I348 HydrophobicContact CD1-CG2 3.85Å; I145-I348 HydrophobicContact CG1-CG2 3.96Å; I145-I348 HydrophobicContact CG2-CG2 3.76Å; P344-I348 WeakPolarHBondContact O-CG1 3.42Å; P344-I348 PolarHBondContact O-N 3.46Å; L345-I348 PolarHBondContact O-N 2.89Å; D346-I348 VanDerWaalsContact C-N 3.33Å; D346-I348 PolarHBondContact O-N 2.69Å; I348-A351 PolarHBondContact O-N 2.85Å; I348-A352 PolarHBondContact O-N 3.05Å; I348-V360 HydrophobicContact CG2-CG1 4.14Å; I348-D363 HydrophobicContact CD1-CB 4.26Å; I348-D363 HydrophobicContact CG1-CB 3.55Å; I348-V367 HydrophobicContact CD1-CB 4.13Å; I348-V367 HydrophobicContact CD1-CG1 4.38Å; I348-V367 HydrophobicContact CD1-CG2 4.12Å
349	L	90.8	Very high	83.3	Confident	0 Å²	0	58 Å²	58	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-65.5	-39.7	179.7	-66.6	177.6	0	0	0	111.6	L144 I145 L148 W169 W304 Y305 L345 D346 S347 A352 F353	L144-L349 HydrophobicContact CD2-CD1 4.12Å; L144-L349 HydrophobicContact CD2-CD2 4.39Å; L144-L349 HydrophobicContact CG-CD2 4.43Å; I145-L349 HydrophobicContact CG1-CD2 4.34Å; L148-L349 HydrophobicContact CD2-CD2 3.61Å; W169-L349 HydrophobicContact CZ2-CD2 4.16Å; W304-L349 HydrophobicContact CH2-CB 4.34Å; W304-L349 HydrophobicContact CZ2-CB 3.86Å; W304-L349 HydrophobicContact CZ2-CD1 4.22Å; Y305-L349 HydrophobicContact CD1-CD1 3.82Å; Y305-L349 HydrophobicContact CE1-CD1 4.2Å; L345-L349 HydrophobicContact CD1-CG 4.4Å; L345-L349 HydrophobicContact CG-CD1 4.25Å; L345-L349 HydrophobicContact CG-CG 4.45Å; L345-L349 WeakPolarHBondContact O-CG 3.37Å; L345-L349 PolarHBondContact O-N 2.82Å; D346-L349 PolarHBondContact O-N 2.87Å; S347-L349 PolarHBondContact O-N 3.25Å; L349-A352 WeakPolarHBondContact O-CB 3.4Å; L349-A352 PolarHBondContact O-N 2.87Å; L349-F353 WeakPolarHBondContact O-CD2 3.43Å; L349-F353 PolarHBondContact O-N 2.91Å
350	L	90.3	Very high	85.1	Confident	18 Å²	18	46.9 Å²	46.9	9%	0.094	25%	0.247	C	C	.	.	H	α-helix	trans	-62.1	-46.5	173.8	-71.4	168.5	0	0	0	111.7	W304 A328 L332 D346 S347 A352 F353 E354	W304-L350 HydrophobicContact CH2-CD2 3.9Å; W304-L350 HydrophobicContact CH2-CG 4.31Å; W304-L350 HydrophobicContact CZ2-CD2 4.46Å; W304-L350 HydrophobicContact CZ2-CG 4.46Å; W304-L350 HydrophobicContact CZ3-CD2 4.42Å; A328-L350 HydrophobicContact CB-CD2 4.18Å; L332-L350 HydrophobicContact CD2-CD1 3.37Å; L332-L350 HydrophobicContact CD2-CD2 4.16Å; L332-L350 HydrophobicContact CD2-CG 4.18Å; D346-L350 WeakPolarHBondContact O-CB 3.37Å; D346-L350 VanDerWaalsContact O-CG 3.24Å; D346-L350 WeakPolarHBondContact O-CG 3.31Å; D346-L350 PolarHBondContact O-N 3.19Å; S347-L350 PolarHBondContact O-N 3.23Å; L350-A352 VanDerWaalsContact C-N 3.25Å; L350-A352 PolarHBondContact O-N 2.58Å; L350-F353 CarbonylContact O-C 3.52Å; L350-F353 WeakPolarHBondContact O-CA 3.42Å; L350-F353 PolarHBondContact O-N 2.96Å; L350-E354 WeakPolarHBondContact O-CG 3.19Å; L350-E354 PolarHBondContact O-N 3.28Å
351	A	90.6	Very high	86.4	Confident	2 Å²	2	44.5 Å²	44.5	2%	0.017	23%	0.23	C	C	.	.	H	α-helix	trans	-58.3	-39.2	176.3	0	0	0	0	0	111.7	S347 I348 E354 F355 D356 L359 V360	S347-A351 WeakPolarHBondContact O-CB 3.15Å; S347-A351 PolarHBondContact O-N 3.16Å; I348-A351 PolarHBondContact O-N 2.85Å; A351-E354 WeakPolarHBondContact O-CB 3.42Å; A351-E354 PolarHBondContact O-N 2.78Å; A351-F355 PolarHBondContact O-N 3.11Å; A351-D356 PolarHBondContact O-N 3.42Å; A351-L359 HydrophobicContact CB-CB 4.08Å; A351-L359 HydrophobicContact CB-CD2 3.76Å; A351-L359 HydrophobicContact CB-CG 3.85Å; A351-V360 HydrophobicContact CB-CG2 3.79Å
352	A	91.3	Very high	87.5	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-63.7	-42.6	173.8	0	0	0	0	0	112.1	L148 L152 I348 L349 L350 E354 F355 V360	L148-A352 HydrophobicContact CD2-CB 3.74Å; L148-A352 HydrophobicContact CG-CB 4.33Å; L152-A352 HydrophobicContact CD1-CB 4.32Å; L152-A352 WeakPolarHBondContact CD1-O 3.39Å; I348-A352 PolarHBondContact O-N 3.05Å; L349-A352 WeakPolarHBondContact O-CB 3.4Å; L349-A352 PolarHBondContact O-N 2.87Å; L350-A352 VanDerWaalsContact C-N 3.25Å; L350-A352 PolarHBondContact O-N 2.58Å; A352-E354 VanDerWaalsContact C-N 3.31Å; A352-E354 PolarHBondContact O-N 3.49Å; A352-F355 PolarHBondContact O-N 3.3Å; A352-F355 VanDerWaalsContact O-N 3.1Å; A352-V360 HydrophobicContact CB-CG2 3.94Å
353	F	90.9	Very high	88.2	Confident	1 Å²	1	40.1 Å²	40.1	0%	0.004	20%	0.2	C	C	.	.	H	α-helix	trans	-68.7	-25.6	174.8	-69.8	-56.3	0	0	0	113.8	L148 L152 L166 W169 W304 L308 L324 A328 L349 L350 F355	L148-F353 HydrophobicContact CD1-CE1 3.8Å; L148-F353 HydrophobicContact CD1-CZ 3.99Å; L148-F353 HydrophobicContact CD2-CE1 4.32Å; L148-F353 HydrophobicContact CD2-CE2 4.21Å; L148-F353 HydrophobicContact CD2-CZ 4.04Å; L152-F353 HydrophobicContact CD1-CD1 4.06Å; L152-F353 HydrophobicContact CD1-CE1 4.44Å; L166-F353 HydrophobicContact CD2-CE1 4.37Å; W169-F353 HydrophobicContact CH2-CZ 4.26Å; W169-F353 HydrophobicContact CZ3-CZ 4.26Å; W304-F353 AromaticContact CH2-CD2 3.88Å; W304-F353 HydrophobicContact CH2-CD2 3.88Å; W304-F353 AromaticContact CH2-CE2 3.69Å; W304-F353 HydrophobicContact CH2-CE2 3.69Å; W304-F353 HydrophobicContact CZ3-CD2 4.45Å; W304-F353 HydrophobicContact CZ3-CE2 4.16Å; L308-F353 HydrophobicContact CD2-CD2 4.48Å; L308-F353 HydrophobicContact CD2-CE1 4.23Å; L308-F353 HydrophobicContact CD2-CE2 3.94Å; L308-F353 HydrophobicContact CD2-CZ 3.8Å; L324-F353 HydrophobicContact CD1-CD1 4.46Å; L324-F353 HydrophobicContact CD2-CD1 3.37Å; L324-F353 HydrophobicContact CD2-CE1 3.69Å; L324-F353 HydrophobicContact CG-CD1 3.57Å; L324-F353 HydrophobicContact CG-CE1 4.07Å; L324-F353 HydrophobicContact CG-CG 4.37Å; A328-F353 HydrophobicContact CB-CB 4.02Å; A328-F353 HydrophobicContact CB-CD2 3.75Å; A328-F353 HydrophobicContact CB-CE2 4.44Å; A328-F353 HydrophobicContact CB-CG 3.97Å; L349-F353 WeakPolarHBondContact O-CD2 3.43Å; L349-F353 PolarHBondContact O-N 2.91Å; L350-F353 CarbonylContact O-C 3.52Å; L350-F353 WeakPolarHBondContact O-CA 3.42Å; L350-F353 PolarHBondContact O-N 2.96Å; F353-F355 WeakPolarHBondContact O-CD2 3.47Å; F353-F355 WeakPolarHBondContact O-CE2 3.44Å; F353-F355 PolarHBondContact O-N 2.99Å
354	E	90.1	Very high	88.5	Confident	90 Å²	90	34.2 Å²	34.2	42%	0.421	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-9.8	170.1	-75.6	177.1	-152.6	0	0	113.4	H325 L350 A351 A352 D356	H325-E354 HydrophobicContact CB-CG 4.02Å; H325-E354 WeakPolarHBondContact CE1-CG 3.44Å; H325-E354 IonicContact CE1-OE1 2.68Å; H325-E354 PolarHBondContact CE1-OE1 3.16Å; H325-E354 WeakPolarHBondContact ND1-CG 3.47Å; H325-E354 IonicContact ND1-OE1 3.96Å; H325-E354 PolarHBondContact ND1-OE1 3.48Å; H325-E354 IonicContact NE2-OE1 3.49Å; L350-E354 WeakPolarHBondContact O-CG 3.19Å; L350-E354 PolarHBondContact O-N 3.28Å; A351-E354 WeakPolarHBondContact O-CB 3.42Å; A351-E354 PolarHBondContact O-N 2.78Å; A352-E354 VanDerWaalsContact C-N 3.31Å; A352-E354 PolarHBondContact O-N 3.49Å; E354-D356 PolarHBondContact O-N 2.88Å
355	F	87.9	Confident	88.6	Confident	72 Å²	72	31.8 Å²	31.8	32%	0.316	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.5	23.3	-170.7	-63.6	-100.2	0	0	0	113.6	L152 F153 P321 A351 A352 F353 I357	L152-F355 HydrophobicContact CB-CE1 4.22Å; L152-F355 HydrophobicContact CD2-CZ 4.18Å; F153-F355 HydrophobicContact CD1-CD1 4.07Å; F153-F355 HydrophobicContact CE1-CB 4.1Å; F153-F355 AromaticContact CE1-CD1 3.6Å; F153-F355 HydrophobicContact CE1-CD1 3.6Å; F153-F355 HydrophobicContact CE1-CE1 4.36Å; F153-F355 HydrophobicContact CE1-CG 4.18Å; F153-F355 HydrophobicContact CZ-CD1 4.49Å; P321-F355 HydrophobicContact CB-CE1 4.43Å; P321-F355 HydrophobicContact CB-CE2 4.22Å; P321-F355 HydrophobicContact CB-CZ 3.65Å; P321-F355 WeakPolarHBondContact O-CE2 3.36Å; A351-F355 PolarHBondContact O-N 3.11Å; A352-F355 PolarHBondContact O-N 3.3Å; A352-F355 VanDerWaalsContact O-N 3.1Å; F353-F355 WeakPolarHBondContact O-CD2 3.47Å; F353-F355 WeakPolarHBondContact O-CE2 3.44Å; F353-F355 PolarHBondContact O-N 2.99Å; F355-I357 PolarHBondContact O-N 3.37Å
356	D	88.3	Confident	88.4	Confident	66 Å²	66	32.7 Å²	32.7	35%	0.353	16%	0.162	S	C	.	.			trans	-88.7	85.9	172.1	-167.2	-19	0	0	0	111	A351 E354 Y358 L359 V360	A351-D356 PolarHBondContact O-N 3.42Å; E354-D356 PolarHBondContact O-N 2.88Å; D356-Y358 PolarHBondContact O-N 2.93Å; D356-Y358 PolarHBondContact OD1-N 3.2Å; D356-Y358 VanDerWaalsContact OD1-N 3.08Å; D356-L359 HydrophobicContact CB-CB 4.07Å; D356-L359 PolarHBondContact O-N 3.19Å; D356-L359 PolarHBondContact OD1-N 3.28Å; D356-V360 WeakPolarHBondContact O-CG2 3.34Å; D356-V360 PolarHBondContact O-N 2.95Å
357	I	87.5	Confident	88	Confident	21 Å²	21	35 Å²	35	11%	0.108	18%	0.176	C	C	.	.	H	α-helix	trans	-60.9	-34.8	178.8	-61.9	172	0	0	0	111.6	F153 F355 V360 I361 L381 L386 L387	F153-I357 HydrophobicContact CD1-CD1 3.74Å; F153-I357 HydrophobicContact CD1-CG1 3.83Å; F153-I357 HydrophobicContact CD2-CG1 4.43Å; F153-I357 HydrophobicContact CE1-CD1 3.88Å; F153-I357 HydrophobicContact CE1-CG1 3.47Å; F153-I357 VanDerWaalsContact CE1-CG1 3.47Å; F153-I357 HydrophobicContact CE2-CG1 4.15Å; F153-I357 HydrophobicContact CG-CD1 4.22Å; F153-I357 HydrophobicContact CG-CG1 4.31Å; F153-I357 HydrophobicContact CZ-CD1 4.49Å; F153-I357 HydrophobicContact CZ-CG1 3.67Å; F355-I357 PolarHBondContact O-N 3.37Å; I357-V360 PolarHBondContact O-N 2.62Å; I357-I361 HydrophobicContact CG2-CD1 3.82Å; I357-I361 HydrophobicContact CG2-CG1 4.37Å; I357-I361 VanDerWaalsContact O-CG1 3.28Å; I357-I361 WeakPolarHBondContact O-CG1 3.32Å; I357-I361 PolarHBondContact O-N 3.49Å; I357-L381 HydrophobicContact CG2-CD1 3.65Å; I357-L386 HydrophobicContact CD1-CB 4.46Å; I357-L387 HydrophobicContact CG2-CD2 3.79Å
358	Y	87.5	Confident	87.4	Confident	91 Å²	91	33.3 Å²	33.3	36%	0.357	16%	0.164	S	C	.	.	H	α-helix	trans	-71.3	-38.6	-175.9	-64.4	-76.6	0	0	0	111.1	D356 I361 K362 L387 Q388	D356-Y358 PolarHBondContact O-N 2.93Å; D356-Y358 PolarHBondContact OD1-N 3.2Å; D356-Y358 VanDerWaalsContact OD1-N 3.08Å; Y358-I361 PolarHBondContact O-N 3.03Å; Y358-K362 WeakPolarHBondContact O-CB 3.45Å; Y358-K362 PolarHBondContact O-N 2.74Å; Y358-L387 HydrophobicContact CE1-CD2 4.13Å; Y358-Q388 PolarHBondContact OH-N 3.41Å
359	L	88	Confident	86.3	Confident	53 Å²	53	38.5 Å²	38.5	28%	0.277	19%	0.191	S	C	.	.	H	α-helix	trans	-66.2	-41	173.6	-174.2	59.1	0	0	0	111.6	A351 D356 I361 K362 D363	A351-L359 HydrophobicContact CB-CB 4.08Å; A351-L359 HydrophobicContact CB-CD2 3.76Å; A351-L359 HydrophobicContact CB-CG 3.85Å; D356-L359 HydrophobicContact CB-CB 4.07Å; D356-L359 PolarHBondContact O-N 3.19Å; D356-L359 PolarHBondContact OD1-N 3.28Å; L359-I361 PolarHBondContact O-N 3.38Å; L359-K362 HydrophobicContact CD1-CD 4.47Å; L359-K362 PolarHBondContact O-N 3.33Å; L359-D363 WeakPolarHBondContact O-CB 3.37Å; L359-D363 PolarHBondContact O-N 3.36Å
360	V	89.5	Confident	85.6	Confident	2 Å²	2	39.7 Å²	39.7	1%	0.012	20%	0.198	C	C	.	.	H	α-helix	trans	-56.9	-49.8	173.4	172.3	0	0	0	0	111.2	I145 I348 A351 A352 D356 I357 K362 C364	I145-V360 HydrophobicContact CG2-CG1 4.29Å; I348-V360 HydrophobicContact CG2-CG1 4.14Å; A351-V360 HydrophobicContact CB-CG2 3.79Å; A352-V360 HydrophobicContact CB-CG2 3.94Å; D356-V360 WeakPolarHBondContact O-CG2 3.34Å; D356-V360 PolarHBondContact O-N 2.95Å; I357-V360 PolarHBondContact O-N 2.62Å; V360-K362 VanDerWaalsContact C-N 3.34Å; V360-K362 PolarHBondContact O-N 3.41Å; V360-C364 WeakPolarHBondContact O-CB 3.21Å; V360-C364 PolarHBondContact O-N 3.25Å; V360-C364 PolarHBondContact O-SG 3.07Å
361	I	88.8	Confident	85.3	Confident	7 Å²	7	42.4 Å²	42.4	4%	0.036	21%	0.207	C	C	.	.	H	α-helix	trans	-59	-45.4	178.6	-72.6	170.9	0	0	0	110.9	I357 Y358 L359 S365 V374 T378 L387 L402	I357-I361 HydrophobicContact CG2-CD1 3.82Å; I357-I361 HydrophobicContact CG2-CG1 4.37Å; I357-I361 VanDerWaalsContact O-CG1 3.28Å; I357-I361 WeakPolarHBondContact O-CG1 3.32Å; I357-I361 PolarHBondContact O-N 3.49Å; Y358-I361 PolarHBondContact O-N 3.03Å; L359-I361 PolarHBondContact O-N 3.38Å; I361-S365 PolarHBondContact O-N 3.47Å; I361-S365 VanDerWaalsContact O-N 3.08Å; I361-V374 HydrophobicContact CB-CG1 4.35Å; I361-V374 HydrophobicContact CG2-CG1 3.49Å; I361-V374 VanDerWaalsContact CG2-CG1 3.49Å; I361-T378 HydrophobicContact CD1-CG2 4.26Å; I361-T378 WeakPolarHBondContact CD1-OG1 3.44Å; I361-L387 HydrophobicContact CD1-CD2 4.35Å; I361-L402 HydrophobicContact CG2-CD1 3.74Å
362	K	86.9	Confident	85.3	Confident	106 Å²	106	42.4 Å²	42.4	46%	0.461	21%	0.207	S	C	.	.	H	α-helix	trans	-63.1	-54.2	179.6	-179.7	-168.4	170	-166.3	0	111.3	Y358 L359 V360 C364 S365 I366	Y358-K362 WeakPolarHBondContact O-CB 3.45Å; Y358-K362 PolarHBondContact O-N 2.74Å; L359-K362 HydrophobicContact CD1-CD 4.47Å; L359-K362 PolarHBondContact O-N 3.33Å; V360-K362 VanDerWaalsContact C-N 3.34Å; V360-K362 PolarHBondContact O-N 3.41Å; K362-C364 VanDerWaalsContact C-N 3.34Å; K362-C364 PolarHBondContact O-N 2.98Å; K362-S365 WeakPolarHBondContact O-CB 3.34Å; K362-S365 PolarHBondContact O-N 3.44Å; K362-S365 VanDerWaalsContact O-N 3.12Å; K362-S365 PolarHBondContact O-OG 3.17Å; K362-I366 HydrophobicContact CG-CD1 4.43Å; K362-I366 PolarHBondContact O-N 2.66Å
363	D	86.7	Confident	85.2	Confident	25 Å²	25	42.5 Å²	42.5	13%	0.134	21%	0.207	C	C	.	.	H	α-helix	trans	-66.5	-39	-175.5	-73.6	3.1	0	0	0	110.7	S347 I348 L359 S365 I366 V367	S347-D363 PolarHBondContact OG-OD2 3.16Å; I348-D363 HydrophobicContact CD1-CB 4.26Å; I348-D363 HydrophobicContact CG1-CB 3.55Å; L359-D363 WeakPolarHBondContact O-CB 3.37Å; L359-D363 PolarHBondContact O-N 3.36Å; D363-S365 VanDerWaalsContact C-N 3.29Å; D363-S365 PolarHBondContact O-N 3Å; D363-I366 PolarHBondContact O-N 2.86Å; D363-I366 VanDerWaalsContact O-N 3.16Å; D363-V367 WeakPolarHBondContact O-CB 3.5Å; D363-V367 VanDerWaalsContact O-CG2 3.3Å; D363-V367 WeakPolarHBondContact O-CG2 3.19Å; D363-V367 PolarHBondContact O-N 3.39Å
364	C	87.7	Confident	85.2	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-60.9	-35.6	172.7	-74.4	0	0	0	0	113.1	V360 K362 I366 L368 F373 V374	V360-C364 WeakPolarHBondContact O-CB 3.21Å; V360-C364 PolarHBondContact O-N 3.25Å; V360-C364 PolarHBondContact O-SG 3.07Å; K362-C364 VanDerWaalsContact C-N 3.34Å; K362-C364 PolarHBondContact O-N 2.98Å; C364-I366 PolarHBondContact O-N 3.07Å; C364-L368 HydrophobicContact CB-CD1 3.94Å; C364-L368 WeakPolarHBondContact O-CB 3.23Å; C364-L368 PolarHBondContact O-N 3.32Å; C364-L368 VanDerWaalsContact O-N 3.13Å; C364-F373 HydrophobicContact CB-CD1 3.75Å; C364-F373 HydrophobicContact CB-CE1 3.81Å; C364-F373 WeakPolarHBondContact SG-CE1 3.19Å; C364-V374 HydrophobicContact CB-CG2 3.92Å
365	S	84.9	Confident	85.2	Confident	27 Å²	27	38.2 Å²	38.2	19%	0.189	19%	0.187	C	C	.	.	H	α-helix	trans	-65.1	-28.7	178	75.1	0	0	0	0	113	I361 K362 D363	I361-S365 PolarHBondContact O-N 3.47Å; I361-S365 VanDerWaalsContact O-N 3.08Å; K362-S365 WeakPolarHBondContact O-CB 3.34Å; K362-S365 PolarHBondContact O-N 3.44Å; K362-S365 VanDerWaalsContact O-N 3.12Å; K362-S365 PolarHBondContact O-OG 3.17Å; D363-S365 VanDerWaalsContact C-N 3.29Å; D363-S365 PolarHBondContact O-N 3Å
366	I	82.6	Confident	85.4	Confident	54 Å²	54	34.8 Å²	34.8	28%	0.277	17%	0.172	S	C	.	.	H	α-helix	trans	-87.7	-46.6	-179.6	-61.1	163.6	0	0	0	110.4	V4 V6 K362 D363 C364 N369	V4-I366 HydrophobicContact CG1-CD1 3.88Å; V6-I366 HydrophobicContact CG2-CG2 4.49Å; K362-I366 HydrophobicContact CG-CD1 4.43Å; K362-I366 PolarHBondContact O-N 2.66Å; D363-I366 PolarHBondContact O-N 2.86Å; D363-I366 VanDerWaalsContact O-N 3.16Å; C364-I366 PolarHBondContact O-N 3.07Å; I366-N369 PolarHBondContact O-OD1 3.47Å
367	V	79.5	Confident	85.6	Confident	59 Å²	59	31.7 Å²	31.7	36%	0.358	16%	0.156	S	C	.	.	H	α-helix	trans	-77	-39.3	-170.1	175.4	0	0	0	0	112.6	P344 I348 D363 N369	P344-V367 HydrophobicContact CB-CB 4.37Å; P344-V367 HydrophobicContact CB-CG1 3.96Å; P344-V367 HydrophobicContact CB-CG2 3.41Å; P344-V367 VanDerWaalsContact CB-CG2 3.41Å; P344-V367 HydrophobicContact CG-CG2 4.47Å; I348-V367 HydrophobicContact CD1-CB 4.13Å; I348-V367 HydrophobicContact CD1-CG1 4.38Å; I348-V367 HydrophobicContact CD1-CG2 4.12Å; D363-V367 WeakPolarHBondContact O-CB 3.5Å; D363-V367 VanDerWaalsContact O-CG2 3.3Å; D363-V367 WeakPolarHBondContact O-CG2 3.19Å; D363-V367 PolarHBondContact O-N 3.39Å; V367-N369 VanDerWaalsContact C-N 3.34Å
368	L	76.3	Confident	85.7	Confident	6 Å²	6	30.7 Å²	30.7	3%	0.031	15%	0.15	C	C	.	.	S	Bend	trans	-85	-8.6	-171.7	-60.4	174.4	0	0	0	113.2	I138 A141 I142 C364 N370 F373	I138-L368 HydrophobicContact CG2-CD2 4.27Å; A141-L368 HydrophobicContact CB-CD2 4.5Å; I142-L368 HydrophobicContact CD1-CD1 4.46Å; I142-L368 HydrophobicContact CG1-CD1 3.75Å; I142-L368 HydrophobicContact CG1-CD2 3.93Å; I142-L368 HydrophobicContact CG1-CG 4.38Å; C364-L368 HydrophobicContact CB-CD1 3.94Å; C364-L368 WeakPolarHBondContact O-CB 3.23Å; C364-L368 PolarHBondContact O-N 3.32Å; C364-L368 VanDerWaalsContact O-N 3.13Å; L368-N370 PolarHBondContact O-N 3.33Å; L368-F373 HydrophobicContact CD1-CB 3.83Å; L368-F373 HydrophobicContact CD1-CD1 3.8Å; L368-F373 HydrophobicContact CD1-CD2 4.26Å; L368-F373 HydrophobicContact CD1-CE1 4.45Å; L368-F373 HydrophobicContact CD1-CG 3.7Å
369	N	67.5	Low	85.8	Confident	108 Å²	108	26.3 Å²	26.3	58%	0.578	13%	0.133	S	C	*	.			trans	52.5	1.3	-177.4	-76.6	-22.5	0	0	0	116.3	I366 V367	I366-N369 PolarHBondContact O-OD1 3.47Å; V367-N369 VanDerWaalsContact C-N 3.34Å
370	N	74.3	Confident	85.8	Confident	26 Å²	26	23.8 Å²	23.8	14%	0.139	12%	0.12	C	C	.	.			trans	-125.6	121.9	-179.7	-174.6	-8.9	0	0	0	110.1	L368 W372	L368-N370 PolarHBondContact O-N 3.33Å; N370-W372 PolarHBondContact O-N 3.47Å; N370-W372 VanDerWaalsContact O-N 3.1Å; N370-W372 WeakPolarHBondContact OD1-CB 3.17Å; N370-W372 PolarHBondContact OD1-N 2.97Å
371	W	85.6	Confident	85.7	Confident	74 Å²	74	23.8 Å²	23.8	28%	0.28	12%	0.12	S	C	.	.	H	α-helix	trans	-63.6	-13	176.8	-59.6	101.5	0	0	0	113.7	F373 V374 A375 L402 E405 Y406	W371-F373 PolarHBondContact O-N 3.17Å; W371-V374 PolarHBondContact O-N 3.06Å; W371-A375 WeakPolarHBondContact O-CB 3.38Å; W371-A375 PolarHBondContact O-N 3.24Å; W371-L402 HydrophobicContact CE3-CD2 4.16Å; W371-L402 HydrophobicContact CZ3-CD2 3.95Å; W371-E405 HydrophobicContact CD2-CB 4.15Å; W371-E405 HydrophobicContact CE3-CB 4.34Å; W371-E405 HydrophobicContact CG-CB 4.47Å; W371-Y406 HydrophobicContact CB-CD2 4Å; W371-Y406 HydrophobicContact CB-CG 4.35Å
372	W	89.5	Confident	85.6	Confident	2 Å²	2	26.2 Å²	26.2	1%	0.008	13%	0.133	C	C	.	.	H	α-helix	trans	-52.1	-52.9	179.7	178.9	85.2	0	0	0	112.9	L70 F71 S74 Y104 I108 I142 W146 N370 V374 A375 H376 Y406	L70-W372 HydrophobicContact CD1-CH2 4.42Å; L70-W372 HydrophobicContact CD1-CZ2 3.97Å; L70-W372 HydrophobicContact CG-CZ2 4.45Å; F71-W372 AromaticContact CD1-CD1 3.62Å; F71-W372 HydrophobicContact CD1-CG 4.33Å; F71-W372 HydrophobicContact CE1-CB 4.15Å; F71-W372 AromaticContact CE1-CD1 3.81Å; F71-W372 HydrophobicContact CE1-CG 4.07Å; S74-W372 PolarHBondContact OG-NE1 3.14Å; Y104-W372 HydrophobicContact CD1-CZ2 4.17Å; I108-W372 HydrophobicContact CD1-CH2 3.74Å; I108-W372 HydrophobicContact CD1-CZ3 4.09Å; I108-W372 HydrophobicContact CG1-CH2 3.76Å; I108-W372 HydrophobicContact CG1-CZ3 4.27Å; I142-W372 HydrophobicContact CG2-CZ3 3.78Å; W146-W372 HydrophobicContact CZ3-CH2 4.49Å; W146-W372 HydrophobicContact CZ3-CZ3 4.48Å; N370-W372 PolarHBondContact O-N 3.47Å; N370-W372 VanDerWaalsContact O-N 3.1Å; N370-W372 WeakPolarHBondContact OD1-CB 3.17Å; N370-W372 PolarHBondContact OD1-N 2.97Å; W372-V374 PolarHBondContact O-N 3.3Å; W372-A375 PolarHBondContact O-N 2.95Å; W372-H376 AromaticContact CD1-CE1 3.24Å; W372-H376 AromaticContact CD1-ND1 3.46Å; W372-H376 AromaticContact CE2-ND1 3.88Å; W372-H376 AromaticContact CG-ND1 3.83Å; W372-H376 AromaticContact NE1-CE1 3.28Å; W372-H376 PolarHBondContact NE1-CE1 2.95Å; W372-H376 VanDerWaalsContact NE1-CE1 3.28Å; W372-H376 AromaticContact NE1-ND1 3.51Å; W372-H376 AromaticContact NE1-NE2 3.86Å; W372-H376 PolarHBondContact O-N 2.8Å; W372-H376 VanDerWaalsContact O-N 3.11Å; W372-H376 PolarHBondContact O-ND1 2.79Å; W372-Y406 HydrophobicContact CB-CD2 4.37Å; W372-Y406 HydrophobicContact CB-CE2 3.81Å; W372-Y406 AromaticContact CD1-CZ 3.79Å; W372-Y406 HydrophobicContact CG-CE2 4.42Å
373	F	89.8	Confident	85.5	Confident	2 Å²	2	23.1 Å²	23.1	1%	0.009	12%	0.12	C	C	.	.	H	α-helix	trans	-60.7	-50.2	-176.1	175.7	-92	0	0	0	110.4	I142 I145 W146 C364 L368 W371 A375 H376 L377	I142-F373 HydrophobicContact CB-CD2 4.3Å; I142-F373 HydrophobicContact CG1-CB 4.44Å; I142-F373 HydrophobicContact CG1-CD2 4.1Å; I142-F373 HydrophobicContact CG2-CD2 3.88Å; I142-F373 HydrophobicContact CG2-CE2 4.43Å; I145-F373 HydrophobicContact CB-CE2 4.33Å; I145-F373 HydrophobicContact CB-CZ 3.98Å; I145-F373 HydrophobicContact CG2-CE1 4.28Å; I145-F373 HydrophobicContact CG2-CE2 4.42Å; I145-F373 HydrophobicContact CG2-CZ 3.59Å; W146-F373 HydrophobicContact CB-CE2 4.01Å; W146-F373 HydrophobicContact CD2-CE2 4.45Å; W146-F373 AromaticContact CE3-CD2 3.76Å; W146-F373 HydrophobicContact CE3-CD2 3.76Å; W146-F373 AromaticContact CE3-CE2 3.66Å; W146-F373 HydrophobicContact CE3-CE2 3.66Å; W146-F373 HydrophobicContact CE3-CZ 4.5Å; W146-F373 HydrophobicContact CZ3-CD2 4.34Å; C364-F373 HydrophobicContact CB-CD1 3.75Å; C364-F373 HydrophobicContact CB-CE1 3.81Å; C364-F373 WeakPolarHBondContact SG-CE1 3.19Å; L368-F373 HydrophobicContact CD1-CB 3.83Å; L368-F373 HydrophobicContact CD1-CD1 3.8Å; L368-F373 HydrophobicContact CD1-CD2 4.26Å; L368-F373 HydrophobicContact CD1-CE1 4.45Å; L368-F373 HydrophobicContact CD1-CG 3.7Å; W371-F373 PolarHBondContact O-N 3.17Å; F373-A375 PolarHBondContact O-N 2.96Å; F373-H376 PolarHBondContact O-N 2.64Å; F373-L377 HydrophobicContact CD1-CD2 4.47Å; F373-L377 HydrophobicContact CE1-CB 4.48Å; F373-L377 HydrophobicContact CE1-CD2 3.54Å; F373-L377 HydrophobicContact CE2-CD2 4.46Å; F373-L377 HydrophobicContact CZ-CD2 3.54Å; F373-L377 WeakPolarHBondContact O-CB 2.9Å; F373-L377 PolarHBondContact O-N 3.04Å
374	V	90.3	Very high	85.3	Confident	0 Å²	0	22.8 Å²	22.8	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-68.1	-39.6	-173.7	-171.7	0	0	0	0	110.8	I361 C364 W371 W372 T378 L402	I361-V374 HydrophobicContact CB-CG1 4.35Å; I361-V374 HydrophobicContact CG2-CG1 3.49Å; I361-V374 VanDerWaalsContact CG2-CG1 3.49Å; C364-V374 HydrophobicContact CB-CG2 3.92Å; W371-V374 PolarHBondContact O-N 3.06Å; W372-V374 PolarHBondContact O-N 3.3Å; V374-T378 WeakPolarHBondContact O-CB 2.84Å; V374-T378 PolarHBondContact O-N 3.08Å; V374-T378 PolarHBondContact O-OG1 3.29Å; V374-L402 HydrophobicContact CG1-CD1 3.7Å; V374-L402 HydrophobicContact CG1-CD2 3.65Å; V374-L402 HydrophobicContact CG1-CG 4.16Å
375	A	91.1	Very high	84.9	Confident	1 Å²	1	29.3 Å²	29.3	1%	0.008	15%	0.148	C	C	.	.	H	α-helix	trans	-63.5	-50.7	176.8	0	0	0	0	0	112.5	W371 W372 F373 D379 L403 Y406	W371-A375 WeakPolarHBondContact O-CB 3.38Å; W371-A375 PolarHBondContact O-N 3.24Å; W372-A375 PolarHBondContact O-N 2.95Å; F373-A375 PolarHBondContact O-N 2.96Å; A375-D379 VanDerWaalsContact O-CB 3.29Å; A375-D379 WeakPolarHBondContact O-CB 3.42Å; A375-D379 PolarHBondContact O-N 3.5Å; A375-L403 HydrophobicContact CB-CD2 4.09Å; A375-Y406 HydrophobicContact CB-CD1 3.92Å; A375-Y406 HydrophobicContact CB-CG 3.86Å
376	H	92.1	Very high	84.6	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-75.1	-38.2	-176	-66.3	84.3	0	0	0	112.8	Y104 W146 W372 F373 D379 L380 Y406 Y423	Y104-H376 HydrophobicContact CE1-CB 4.27Å; Y104-H376 AromaticContact CE1-CD2 3.57Å; Y104-H376 AromaticContact CZ-CD2 3.83Å; Y104-H376 PolarHBondContact OH-CD2 2.95Å; W146-H376 HydrophobicContact CH2-CB 3.81Å; W146-H376 HydrophobicContact CZ3-CB 4.1Å; W372-H376 AromaticContact CD1-CE1 3.24Å; W372-H376 AromaticContact CD1-ND1 3.46Å; W372-H376 AromaticContact CE2-ND1 3.88Å; W372-H376 AromaticContact CG-ND1 3.83Å; W372-H376 AromaticContact NE1-CE1 3.28Å; W372-H376 PolarHBondContact NE1-CE1 2.95Å; W372-H376 VanDerWaalsContact NE1-CE1 3.28Å; W372-H376 AromaticContact NE1-ND1 3.51Å; W372-H376 AromaticContact NE1-NE2 3.86Å; W372-H376 PolarHBondContact O-N 2.8Å; W372-H376 VanDerWaalsContact O-N 3.11Å; W372-H376 PolarHBondContact O-ND1 2.79Å; F373-H376 PolarHBondContact O-N 2.64Å; H376-D379 PolarHBondContact O-N 3.05Å; H376-L380 WeakPolarHBondContact O-CB 3.41Å; H376-L380 PolarHBondContact O-N 2.91Å; H376-Y406 AromaticContact CE1-CE1 3.45Å; H376-Y406 VanDerWaalsContact CE1-CE1 3.45Å; H376-Y406 WeakPolarHBondContact CE1-CE1 3.23Å; H376-Y406 AromaticContact CE1-CZ 3.77Å; H376-Y423 AromaticContact NE2-CE1 3.93Å; H376-Y423 AromaticContact NE2-CZ 3.83Å; H376-Y423 PolarHBondContact NE2-OH 3.27Å
377	L	91.1	Very high	84.3	Confident	1 Å²	1	30 Å²	30	1%	0.005	15%	0.15	C	C	.	.	H	α-helix	trans	-66.1	-46.1	176.9	-178.3	63.9	0	0	0	110.3	W146 C149 F373 D379 L380 L381	W146-L377 HydrophobicContact CD2-CD1 4.42Å; W146-L377 HydrophobicContact CE3-CB 4.21Å; W146-L377 HydrophobicContact CE3-CD1 4.38Å; W146-L377 HydrophobicContact CH2-CB 4.12Å; W146-L377 HydrophobicContact CH2-CD1 4.47Å; W146-L377 HydrophobicContact CZ3-CB 3.71Å; W146-L377 HydrophobicContact CZ3-CD1 4.41Å; C149-L377 HydrophobicContact CB-CD1 4.15Å; C149-L377 HydrophobicContact CB-CD2 4.42Å; F373-L377 HydrophobicContact CD1-CD2 4.47Å; F373-L377 HydrophobicContact CE1-CB 4.48Å; F373-L377 HydrophobicContact CE1-CD2 3.54Å; F373-L377 HydrophobicContact CE2-CD2 4.46Å; F373-L377 HydrophobicContact CZ-CD2 3.54Å; F373-L377 WeakPolarHBondContact O-CB 2.9Å; F373-L377 PolarHBondContact O-N 3.04Å; L377-D379 VanDerWaalsContact C-N 3.32Å; L377-D379 PolarHBondContact O-N 3.19Å; L377-L380 PolarHBondContact O-N 2.91Å; L377-L381 HydrophobicContact CD1-CD1 4.2Å; L377-L381 HydrophobicContact CD1-CG 4.21Å; L377-L381 HydrophobicContact CD2-CD1 4.41Å; L377-L381 HydrophobicContact CG-CD1 3.85Å; L377-L381 HydrophobicContact CG-CG 4.28Å; L377-L381 WeakPolarHBondContact O-CB 3.34Å; L377-L381 WeakPolarHBondContact O-CG 3.47Å; L377-L381 PolarHBondContact O-N 3.49Å
378	T	89.8	Confident	83.6	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-62.2	-41.8	178.3	-55.5	0	0	0	0	111	I361 V374 L380 L381 D382 L387 R399 L402	I361-T378 HydrophobicContact CD1-CG2 4.26Å; I361-T378 WeakPolarHBondContact CD1-OG1 3.44Å; V374-T378 WeakPolarHBondContact O-CB 2.84Å; V374-T378 PolarHBondContact O-N 3.08Å; V374-T378 PolarHBondContact O-OG1 3.29Å; T378-L380 PolarHBondContact O-N 2.62Å; T378-L381 PolarHBondContact O-N 3.5Å; T378-D382 WeakPolarHBondContact O-CB 3.45Å; T378-D382 PolarHBondContact O-N 2.87Å; T378-L387 HydrophobicContact CG2-CD1 3.53Å; T378-L387 WeakPolarHBondContact O-CD1 3.28Å; T378-R399 HydrophobicContact CG2-CB 4.12Å; T378-L402 HydrophobicContact CG2-CD1 3.95Å
379	D	89.4	Confident	82.7	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-59.4	-46	174.9	-179.5	64.8	0	0	0	112.2	F78 L81 Q82 A375 H376 L377 D382 H383 R399	F78-D379 HydrophobicContact CD2-CB 4.49Å; F78-D379 VanDerWaalsContact CD2-OD2 3.3Å; F78-D379 WeakPolarHBondContact CD2-OD2 3.25Å; F78-D379 HydrophobicContact CE2-CB 4.18Å; F78-D379 VanDerWaalsContact CE2-CG 3.47Å; F78-D379 WeakPolarHBondContact CE2-OD2 3.46Å; L81-D379 WeakPolarHBondContact CD2-OD2 3.38Å; Q82-D379 PolarHBondContact NE2-OD1 3.2Å; Q82-D379 VanDerWaalsContact NE2-OD1 3.08Å; Q82-D379 PolarHBondContact NE2-OD2 3.33Å; A375-D379 VanDerWaalsContact O-CB 3.29Å; A375-D379 WeakPolarHBondContact O-CB 3.42Å; A375-D379 PolarHBondContact O-N 3.5Å; H376-D379 PolarHBondContact O-N 3.05Å; L377-D379 VanDerWaalsContact C-N 3.32Å; L377-D379 PolarHBondContact O-N 3.19Å; D379-D382 PolarHBondContact O-N 3.41Å; D379-H383 PolarHBondContact O-N 2.98Å; D379-H383 VanDerWaalsContact O-N 3.08Å; D379-H383 PolarHBondContact O-ND1 3.16Å; D379-H383 IonicContact OD1-CE1 3.26Å; D379-H383 PolarHBondContact OD1-CE1 3.02Å; D379-H383 VanDerWaalsContact OD1-CE1 3.23Å; D379-H383 IonicContact OD1-ND1 3.79Å; D379-H383 PolarHBondContact OD1-ND1 3.35Å; D379-H383 IonicContact OD2-CE1 2.94Å; D379-H383 IonicContact OD2-ND1 2.75Å; D379-R399 IonicContact OD1-CZ 2.69Å; D379-R399 IonicContact OD1-NE 3.9Å; D379-R399 PolarHBondContact OD1-NE 3.02Å; D379-R399 IonicContact OD1-NH2 2.72Å; D379-R399 PolarHBondContact OD1-NH2 3.09Å
380	L	89.4	Confident	82.1	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-64.9	-40.7	177.7	-177.6	59.1	0	0	0	112.5	L81 F97 I100 W146 I154 H376 L377 T378 H383 C384	L81-L380 HydrophobicContact CD1-CD1 4.33Å; L81-L380 HydrophobicContact CD2-CB 4.4Å; L81-L380 HydrophobicContact CD2-CD1 4.01Å; F97-L380 HydrophobicContact CB-CD1 4.44Å; F97-L380 HydrophobicContact CD1-CD1 4.15Å; I100-L380 HydrophobicContact CG2-CD1 4.2Å; W146-L380 HydrophobicContact CZ2-CD2 3.87Å; I154-L380 HydrophobicContact CD1-CD2 3.5Å; I154-L380 VanDerWaalsContact CD1-CD2 3.5Å; I154-L380 HydrophobicContact CD1-CG 3.94Å; H376-L380 WeakPolarHBondContact O-CB 3.41Å; H376-L380 PolarHBondContact O-N 2.91Å; L377-L380 PolarHBondContact O-N 2.91Å; T378-L380 PolarHBondContact O-N 2.62Å; L380-H383 PolarHBondContact O-N 3.44Å; L380-C384 PolarHBondContact O-N 3.26Å; L380-C384 PolarHBondContact O-SG 3.47Å
381	L	87.4	Confident	81.2	Confident	2 Å²	2	41.5 Å²	41.5	1%	0.01	21%	0.208	C	C	.	.	H	α-helix	trans	-67.7	-35.5	177.7	-69.3	173.6	0	0	0	112.4	F153 I154 I357 L377 T378 C384 K385 L386 L387	F153-L381 HydrophobicContact CB-CD2 4.05Å; I154-L381 HydrophobicContact CG1-CD2 4.36Å; I357-L381 HydrophobicContact CG2-CD1 3.65Å; L377-L381 HydrophobicContact CD1-CD1 4.2Å; L377-L381 HydrophobicContact CD1-CG 4.21Å; L377-L381 HydrophobicContact CD2-CD1 4.41Å; L377-L381 HydrophobicContact CG-CD1 3.85Å; L377-L381 HydrophobicContact CG-CG 4.28Å; L377-L381 WeakPolarHBondContact O-CB 3.34Å; L377-L381 WeakPolarHBondContact O-CG 3.47Å; L377-L381 PolarHBondContact O-N 3.49Å; T378-L381 PolarHBondContact O-N 3.5Å; L381-C384 WeakPolarHBondContact O-CB 3.35Å; L381-C384 PolarHBondContact O-N 3.46Å; L381-K385 PolarHBondContact O-N 3.23Å; L381-L386 HydrophobicContact CD2-CD1 3.78Å; L381-L386 PolarHBondContact O-N 3.37Å; L381-L386 VanDerWaalsContact O-N 3.12Å; L381-L387 HydrophobicContact CB-CD1 3.92Å; L381-L387 HydrophobicContact CB-CG 4.1Å
382	D	86.6	Confident	80.1	Confident	58 Å²	58	40.6 Å²	40.6	31%	0.31	21%	0.208	S	C	.	.	H	α-helix	trans	-65.8	-44.1	174.6	-165	56.7	0	0	0	111.2	T378 D379 C384 K385 L387 R399	T378-D382 WeakPolarHBondContact O-CB 3.45Å; T378-D382 PolarHBondContact O-N 2.87Å; D379-D382 PolarHBondContact O-N 3.41Å; D382-C384 PolarHBondContact O-N 3.28Å; D382-K385 WeakPolarHBondContact O-CA 3.49Å; D382-K385 PolarHBondContact O-N 3.47Å; D382-L387 HydrophobicContact CB-CD1 4.19Å; D382-R399 WeakPolarHBondContact OD2-CD 3.42Å; D382-R399 IonicContact OD2-NE 3.91Å
383	H	84	Confident	78.3	Confident	40 Å²	40	48.5 Å²	48.5	19%	0.185	25%	0.251	C	S	.	.	H	α-helix	trans	-62.1	-29.5	172.8	-76.2	81.5	0	0	0	112.8	L81 Q82 F97 D379 L380 K385	L81-H383 HydrophobicContact CD1-CB 4.14Å; Q82-H383 PolarHBondContact NE2-CE1 3.17Å; Q82-H383 VanDerWaalsContact NE2-CE1 3.34Å; F97-H383 HydrophobicContact CE1-CB 3.93Å; F97-H383 HydrophobicContact CZ-CB 4.24Å; F97-H383 WeakPolarHBondContact CZ-O 3.35Å; D379-H383 PolarHBondContact O-N 2.98Å; D379-H383 VanDerWaalsContact O-N 3.08Å; D379-H383 PolarHBondContact O-ND1 3.16Å; D379-H383 IonicContact OD1-CE1 3.26Å; D379-H383 PolarHBondContact OD1-CE1 3.02Å; D379-H383 VanDerWaalsContact OD1-CE1 3.23Å; D379-H383 IonicContact OD1-ND1 3.79Å; D379-H383 PolarHBondContact OD1-ND1 3.35Å; D379-H383 IonicContact OD2-CE1 2.94Å; D379-H383 IonicContact OD2-ND1 2.75Å; L380-H383 PolarHBondContact O-N 3.44Å; H383-K385 PolarHBondContact O-N 3.46Å
384	C	81.9	Confident	76.7	Confident	18 Å²	18	57.1 Å²	57.1	12%	0.122	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-7.3	171.9	-66	0	0	0	0	113.4	L380 L381 D382 L386	L380-C384 PolarHBondContact O-N 3.26Å; L380-C384 PolarHBondContact O-SG 3.47Å; L381-C384 WeakPolarHBondContact O-CB 3.35Å; L381-C384 PolarHBondContact O-N 3.46Å; D382-C384 PolarHBondContact O-N 3.28Å; C384-L386 VanDerWaalsContact C-N 3.26Å; C384-L386 HydrophobicContact CB-CD1 3.73Å; C384-L386 HydrophobicContact CB-CG 3.8Å; C384-L386 PolarHBondContact O-N 2.85Å
385	K	81	Confident	74.9	Confident	137 Å²	137	58.8 Å²	58.8	60%	0.596	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.1	32.8	-174.9	-52.5	-172.1	179.7	-171.1	0	113.2	D86 L381 D382 H383	D86-K385 IonicContact OD1-NZ 3.74Å; L381-K385 PolarHBondContact O-N 3.23Å; D382-K385 WeakPolarHBondContact O-CA 3.49Å; D382-K385 PolarHBondContact O-N 3.47Å; H383-K385 PolarHBondContact O-N 3.46Å
386	L	77.6	Confident	73.6	Confident	72 Å²	72	59.1 Å²	59.1	38%	0.377	31%	0.308	S	S	.	.			trans	-90.1	-22.8	179.1	-64.6	172.3	0	0	0	112.3	F153 I357 L381 C384	F153-L386 HydrophobicContact CB-CD1 3.98Å; F153-L386 WeakPolarHBondContact O-CD1 3.48Å; I357-L386 HydrophobicContact CD1-CB 4.46Å; L381-L386 HydrophobicContact CD2-CD1 3.78Å; L381-L386 PolarHBondContact O-N 3.37Å; L381-L386 VanDerWaalsContact O-N 3.12Å; C384-L386 VanDerWaalsContact C-N 3.26Å; C384-L386 HydrophobicContact CB-CD1 3.73Å; C384-L386 HydrophobicContact CB-CG 3.8Å; C384-L386 PolarHBondContact O-N 2.85Å
387	L	75.4	Confident	72.9	Confident	24 Å²	24	61.2 Å²	61.2	13%	0.126	32%	0.319	C	S	.	.	S	Bend	trans	-91.1	134.7	176.7	-64.7	170.8	0	0	0	110	I357 Y358 I361 T378 L381 D382	I357-L387 HydrophobicContact CG2-CD2 3.79Å; Y358-L387 HydrophobicContact CE1-CD2 4.13Å; I361-L387 HydrophobicContact CD1-CD2 4.35Å; T378-L387 HydrophobicContact CG2-CD1 3.53Å; T378-L387 WeakPolarHBondContact O-CD1 3.28Å; L381-L387 HydrophobicContact CB-CD1 3.92Å; L381-L387 HydrophobicContact CB-CG 4.1Å; D382-L387 HydrophobicContact CB-CD1 4.19Å
388	Q	65	Low	72.5	Confident	135 Å²	135	64.1 Å²	64.1	63%	0.631	33%	0.333	S	S	*	.			trans	-79.5	132.6	167.4	-65.9	179.8	2	0	0	108.6	Y358 H390	Y358-Q388 PolarHBondContact OH-N 3.41Å; Q388-H390 PolarHBondContact O-N 3.1Å; Q388-H390 PolarHBondContact OE1-NE2 3.23Å
389	S	58.2	Low	72.3	Confident	91 Å²	91	65.3 Å²	65.3	64%	0.636	34%	0.338	S	S	*	.			trans	-70.6	73.9	171.8	59.5	0	0	0	0	109.7	N391	S389-N391 PolarHBondContact O-N 3.39Å
390	H	55.1	Low	72.2	Confident	112 Å²	112	65.4 Å²	65.4	52%	0.519	34%	0.338	S	S	.	.			trans	-82.7	109.2	165.1	-72.4	-67.4	0	0	0	107	Q388 L392	Q388-H390 PolarHBondContact O-N 3.1Å; Q388-H390 PolarHBondContact OE1-NE2 3.23Å; H390-L392 PolarHBondContact O-N 2.87Å; H390-L392 VanDerWaalsContact O-N 3.16Å
391	N	55	Low	72.2	Confident	102 Å²	102	68.9 Å²	68.9	55%	0.545	35%	0.354	S	S	.	.	B	Isolated β-bridge	trans	-59.9	120.3	169.8	-67.1	2.7	0	0	0	107.1	S389 N397	S389-N391 PolarHBondContact O-N 3.39Å; N391-N397 PolarHBondContact OD1-OD1 2.79Å; N391-N397 VanDerWaalsContact OD1-OD1 3.1Å
392	L	61.5	Low	72.2	Confident	55 Å²	55	69 Å²	69	29%	0.288	36%	0.355	S	S	.	.			trans	-62.6	156	171.6	-64.9	169.7	0	0	0	108.1	H390 F394 G395 S396 M398 F401	H390-L392 PolarHBondContact O-N 2.87Å; H390-L392 VanDerWaalsContact O-N 3.16Å; L392-F394 PolarHBondContact O-N 3.36Å; L392-G395 PolarHBondContact O-N 2.85Å; L392-S396 WeakPolarHBondContact CB-O 3.44Å; L392-S396 PolarHBondContact N-O 2.82Å; L392-M398 HydrophobicContact CD1-SD 4.27Å; L392-M398 HydrophobicContact CD2-CE 4.14Å; L392-F401 HydrophobicContact CD1-CB 4.21Å
393	N	51.7	Low	72.4	Confident	168 Å²	168	66.3 Å²	66.3	90%	0.898	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	-11.5	179.9	-64.6	-7.6	0	0	0	114
394	F	57.1	Low	72.6	Confident	184 Å²	184	65 Å²	65	81%	0.807	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.8	10.9	177.5	-56.7	-76	0	0	0	114.1	L392 S396	L392-F394 PolarHBondContact O-N 3.36Å; F394-S396 VanDerWaalsContact C-N 3.35Å; F394-S396 PolarHBondContact O-N 2.96Å
395	G	52.7	Low	72.9	Confident	35 Å²	35	67.9 Å²	67.9	36%	0.361	35%	0.346	S	S	.	.	S	Bend	trans	94.1	-33.5	174.8	0	0	0	0	0	114.3	L392	L392-G395 PolarHBondContact O-N 2.85Å
396	S	64.6	Low	73.3	Confident	7 Å²	7	61.6 Å²	61.6	5%	0.049	32%	0.318	C	S	.	.	S	Bend	trans	-87.5	155	-173.7	-176.3	0	0	0	0	114.4	L392 F394 E400	L392-S396 WeakPolarHBondContact CB-O 3.44Å; L392-S396 PolarHBondContact N-O 2.82Å; F394-S396 VanDerWaalsContact C-N 3.35Å; F394-S396 PolarHBondContact O-N 2.96Å; S396-E400 VanDerWaalsContact OG-CB 3.27Å; S396-E400 WeakPolarHBondContact OG-CB 3.24Å; S396-E400 VanDerWaalsContact OG-CG 3.22Å; S396-E400 WeakPolarHBondContact OG-CG 3.48Å; S396-E400 PolarHBondContact OG-OE2 3.22Å
397	N	77.3	Confident	73.9	Confident	45 Å²	45	58.1 Å²	58.1	24%	0.241	30%	0.3	C	S	.	.	B	Isolated β-bridge	trans	-70.7	147.5	168.7	-74	-36.7	0	0	0	111.2	N391 R399 E400 F401	N391-N397 PolarHBondContact OD1-OD1 2.79Å; N391-N397 VanDerWaalsContact OD1-OD1 3.1Å; N397-R399 PolarHBondContact O-N 3.35Å; N397-E400 HydrophobicContact CB-CB 4.44Å; N397-E400 PolarHBondContact O-N 2.69Å; N397-F401 PolarHBondContact O-N 2.76Å
398	M	82.1	Confident	74.4	Confident	61 Å²	61	58.4 Å²	58.4	30%	0.3	30%	0.304	S	S	.	.	H	α-helix	trans	-51.7	-43.3	176.1	-178.4	66.2	85.5	0	0	112.6	L392 E400 F401 L402	L392-M398 HydrophobicContact CD1-SD 4.27Å; L392-M398 HydrophobicContact CD2-CE 4.14Å; M398-E400 VanDerWaalsContact C-N 3.33Å; M398-E400 PolarHBondContact O-N 2.94Å; M398-F401 PolarHBondContact O-N 3.2Å; M398-L402 HydrophobicContact CG-CD1 3.87Å; M398-L402 WeakPolarHBondContact O-CD1 3.32Å; M398-L402 WeakPolarHBondContact O-CG 3.17Å; M398-L402 PolarHBondContact O-N 3.19Å; M398-L402 VanDerWaalsContact O-N 3.12Å; M398-L402 HydrophobicContact SD-CD1 4.06Å; M398-L402 HydrophobicContact SD-CG 4.35Å
399	R	86.4	Confident	75.3	Confident	25 Å²	25	52.6 Å²	52.6	9%	0.094	28%	0.281	C	S	.	.	H	α-helix	trans	-54.3	-49.7	174.6	172.9	-177.3	173.1	-88.3	1.4	111.7	Q82 T378 D379 D382 N397 L402 L403 H426	Q82-R399 VanDerWaalsContact OE1-NH2 3.16Å; T378-R399 HydrophobicContact CG2-CB 4.12Å; D379-R399 IonicContact OD1-CZ 2.69Å; D379-R399 IonicContact OD1-NE 3.9Å; D379-R399 PolarHBondContact OD1-NE 3.02Å; D379-R399 IonicContact OD1-NH2 2.72Å; D379-R399 PolarHBondContact OD1-NH2 3.09Å; D382-R399 WeakPolarHBondContact OD2-CD 3.42Å; D382-R399 IonicContact OD2-NE 3.91Å; N397-R399 PolarHBondContact O-N 3.35Å; R399-L402 PolarHBondContact O-N 2.88Å; R399-L403 HydrophobicContact CG-CD1 3.78Å; R399-L403 HydrophobicContact CG-CG 4.48Å; R399-L403 WeakPolarHBondContact O-CB 3.28Å; R399-L403 WeakPolarHBondContact O-CG 3.4Å; R399-L403 PolarHBondContact O-N 2.74Å; R399-H426 PolarHBondContact NH1-O 3.13Å; R399-H426 VanDerWaalsContact NH1-O 3.1Å
400	E	86.8	Confident	76.5	Confident	2 Å²	2	48.4 Å²	48.4	1%	0.009	25%	0.251	C	S	.	.	H	α-helix	trans	-67.8	-42.6	-176.4	174.2	179.2	-145.3	0	0	111	S396 N397 M398 L402 L403 L404 C427 E429 L430	S396-E400 VanDerWaalsContact OG-CB 3.27Å; S396-E400 WeakPolarHBondContact OG-CB 3.24Å; S396-E400 VanDerWaalsContact OG-CG 3.22Å; S396-E400 WeakPolarHBondContact OG-CG 3.48Å; S396-E400 PolarHBondContact OG-OE2 3.22Å; N397-E400 HydrophobicContact CB-CB 4.44Å; N397-E400 PolarHBondContact O-N 2.69Å; M398-E400 VanDerWaalsContact C-N 3.33Å; M398-E400 PolarHBondContact O-N 2.94Å; E400-L402 VanDerWaalsContact C-N 3.34Å; E400-L402 PolarHBondContact O-N 3.1Å; E400-L403 PolarHBondContact O-N 3.45Å; E400-L404 HydrophobicContact CG-CD1 3.75Å; E400-L404 HydrophobicContact CG-CG 4.14Å; E400-L404 WeakPolarHBondContact O-CB 3.33Å; E400-L404 WeakPolarHBondContact O-CG 3.38Å; E400-L404 PolarHBondContact O-N 2.89Å; E400-C427 HydrophobicContact CG-CB 3.91Å; E400-E429 WeakPolarHBondContact OE1-CA 3.49Å; E400-E429 PolarHBondContact OE1-N 3.3Å; E400-L430 PolarHBondContact OE1-N 3.35Å
401	F	88.1	Confident	77.9	Confident	73 Å²	73	43.9 Å²	43.9	32%	0.32	23%	0.23	S	C	.	.	H	α-helix	trans	-53.8	-50.3	174.3	173.7	-102.7	0	0	0	112.2	L392 N397 M398 L403 L404 E405	L392-F401 HydrophobicContact CD1-CB 4.21Å; N397-F401 PolarHBondContact O-N 2.76Å; M398-F401 PolarHBondContact O-N 3.2Å; F401-L403 PolarHBondContact O-N 3.1Å; F401-L404 PolarHBondContact O-N 3.35Å; F401-E405 HydrophobicContact CE1-CG 4.28Å; F401-E405 HydrophobicContact CE2-CG 4.02Å; F401-E405 HydrophobicContact CZ-CG 3.89Å; F401-E405 PolarHBondContact O-N 3.07Å
402	L	88.1	Confident	79.1	Confident	6 Å²	6	42.6 Å²	42.6	3%	0.031	23%	0.226	C	C	.	.	H	α-helix	trans	-67.4	-37.7	-178.1	-65.9	164.3	0	0	0	112.5	I361 W371 V374 T378 M398 R399 E400 Y406	I361-L402 HydrophobicContact CG2-CD1 3.74Å; W371-L402 HydrophobicContact CE3-CD2 4.16Å; W371-L402 HydrophobicContact CZ3-CD2 3.95Å; V374-L402 HydrophobicContact CG1-CD1 3.7Å; V374-L402 HydrophobicContact CG1-CD2 3.65Å; V374-L402 HydrophobicContact CG1-CG 4.16Å; T378-L402 HydrophobicContact CG2-CD1 3.95Å; M398-L402 HydrophobicContact CG-CD1 3.87Å; M398-L402 WeakPolarHBondContact O-CD1 3.32Å; M398-L402 WeakPolarHBondContact O-CG 3.17Å; M398-L402 PolarHBondContact O-N 3.19Å; M398-L402 VanDerWaalsContact O-N 3.12Å; M398-L402 HydrophobicContact SD-CD1 4.06Å; M398-L402 HydrophobicContact SD-CG 4.35Å; R399-L402 PolarHBondContact O-N 2.88Å; E400-L402 VanDerWaalsContact C-N 3.34Å; E400-L402 PolarHBondContact O-N 3.1Å; L402-Y406 WeakPolarHBondContact O-CB 3.43Å; L402-Y406 PolarHBondContact O-N 3.3Å; L402-Y406 VanDerWaalsContact O-N 3.08Å
403	L	90.4	Very high	80.1	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-66.1	-39.1	174.1	-75.9	171.3	0	0	0	111.9	F78 A375 R399 E400 F401 Y406 A407 Y423	F78-L403 HydrophobicContact CE2-CD1 4.41Å; F78-L403 HydrophobicContact CE2-CD2 3.83Å; F78-L403 HydrophobicContact CZ-CD1 4.49Å; F78-L403 HydrophobicContact CZ-CD2 4.21Å; A375-L403 HydrophobicContact CB-CD2 4.09Å; R399-L403 HydrophobicContact CG-CD1 3.78Å; R399-L403 HydrophobicContact CG-CG 4.48Å; R399-L403 WeakPolarHBondContact O-CB 3.28Å; R399-L403 WeakPolarHBondContact O-CG 3.4Å; R399-L403 PolarHBondContact O-N 2.74Å; E400-L403 PolarHBondContact O-N 3.45Å; F401-L403 PolarHBondContact O-N 3.1Å; L403-Y406 PolarHBondContact O-N 3.37Å; L403-A407 WeakPolarHBondContact O-CB 3.35Å; L403-A407 PolarHBondContact O-N 2.98Å; L403-Y423 HydrophobicContact CD2-CD1 4.1Å
404	L	89.1	Confident	81.4	Confident	13 Å²	13	38.6 Å²	38.6	7%	0.068	20%	0.2	C	C	.	.	H	α-helix	trans	-66.5	-42.5	178.3	-71.9	171.1	0	0	0	112.2	E400 F401 S408 F424 C427 L430 C434	E400-L404 HydrophobicContact CG-CD1 3.75Å; E400-L404 HydrophobicContact CG-CG 4.14Å; E400-L404 WeakPolarHBondContact O-CB 3.33Å; E400-L404 WeakPolarHBondContact O-CG 3.38Å; E400-L404 PolarHBondContact O-N 2.89Å; F401-L404 PolarHBondContact O-N 3.35Å; L404-S408 VanDerWaalsContact O-CB 3.23Å; L404-S408 WeakPolarHBondContact O-CB 3.37Å; L404-S408 PolarHBondContact O-N 3.49Å; L404-S408 PolarHBondContact O-OG 3.13Å; L404-F424 HydrophobicContact CD2-CD1 3.64Å; L404-F424 HydrophobicContact CD2-CE1 3.78Å; L404-C427 HydrophobicContact CD2-CB 4.1Å; L404-L430 HydrophobicContact CD1-CB 3.77Å; L404-L430 HydrophobicContact CD1-CD1 4.22Å; L404-C434 HydrophobicContact CD2-CB 4.22Å
405	E	87.3	Confident	82.5	Confident	79 Å²	79	31.5 Å²	31.5	37%	0.369	17%	0.173	S	C	.	.	H	α-helix	trans	-63.6	-44.9	175.4	-70	-59	137.7	0	0	110.9	W371 F401 S408 G409	W371-E405 HydrophobicContact CD2-CB 4.15Å; W371-E405 HydrophobicContact CE3-CB 4.34Å; W371-E405 HydrophobicContact CG-CB 4.47Å; F401-E405 HydrophobicContact CE1-CG 4.28Å; F401-E405 HydrophobicContact CE2-CG 4.02Å; F401-E405 HydrophobicContact CZ-CG 3.89Å; F401-E405 PolarHBondContact O-N 3.07Å; E405-S408 PolarHBondContact O-N 3.37Å; E405-G409 PolarHBondContact O-N 3.17Å
406	Y	89.3	Confident	84.1	Confident	4 Å²	4	29.9 Å²	29.9	2%	0.016	16%	0.156	C	C	.	.	H	α-helix	trans	-62.5	-48	175.9	177.2	-119	0	0	0	112.7	F71 W371 W372 A375 H376 L402 L403 S408 G409 L410 Y423	F71-Y406 WeakPolarHBondContact CD1-OH 3.46Å; W371-Y406 HydrophobicContact CB-CD2 4Å; W371-Y406 HydrophobicContact CB-CG 4.35Å; W372-Y406 HydrophobicContact CB-CD2 4.37Å; W372-Y406 HydrophobicContact CB-CE2 3.81Å; W372-Y406 AromaticContact CD1-CZ 3.79Å; W372-Y406 HydrophobicContact CG-CE2 4.42Å; A375-Y406 HydrophobicContact CB-CD1 3.92Å; A375-Y406 HydrophobicContact CB-CG 3.86Å; H376-Y406 AromaticContact CE1-CE1 3.45Å; H376-Y406 VanDerWaalsContact CE1-CE1 3.45Å; H376-Y406 WeakPolarHBondContact CE1-CE1 3.23Å; H376-Y406 AromaticContact CE1-CZ 3.77Å; L402-Y406 WeakPolarHBondContact O-CB 3.43Å; L402-Y406 PolarHBondContact O-N 3.3Å; L402-Y406 VanDerWaalsContact O-N 3.08Å; L403-Y406 PolarHBondContact O-N 3.37Å; Y406-S408 VanDerWaalsContact C-N 3.31Å; Y406-S408 PolarHBondContact O-N 3.39Å; Y406-G409 PolarHBondContact O-N 2.93Å; Y406-L410 HydrophobicContact CD1-CD1 4.12Å; Y406-L410 HydrophobicContact CD2-CG 4.41Å; Y406-L410 HydrophobicContact CE1-CD1 3.45Å; Y406-L410 VanDerWaalsContact CE1-CD1 3.45Å; Y406-L410 HydrophobicContact CE1-CG 4.17Å; Y406-L410 HydrophobicContact CE2-CD1 4.07Å; Y406-L410 HydrophobicContact CE2-CD2 4.1Å; Y406-L410 HydrophobicContact CE2-CG 3.88Å; Y406-L410 VanDerWaalsContact CZ-CD1 3.41Å; Y406-L410 PolarHBondContact O-N 3.08Å; Y406-L410 WeakPolarHBondContact OH-CD1 3.49Å; Y406-Y423 HydrophobicContact CD1-CE1 4.36Å; Y406-Y423 HydrophobicContact CE1-CD2 4.38Å; Y406-Y423 HydrophobicContact CE1-CE1 4.04Å; Y406-Y423 AromaticContact CE1-CE2 3.87Å; Y406-Y423 HydrophobicContact CE1-CE2 3.87Å; Y406-Y423 AromaticContact CE1-CZ 3.68Å
407	A	90	Very high	85.1	Confident	0 Å²	0	30 Å²	30	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-61.5	-40.7	178.4	0	0	0	0	0	111.4	L403 L410 F411 A420 F424	L403-A407 WeakPolarHBondContact O-CB 3.35Å; L403-A407 PolarHBondContact O-N 2.98Å; A407-L410 PolarHBondContact O-N 3.02Å; A407-F411 WeakPolarHBondContact O-CB 3.18Å; A407-F411 PolarHBondContact O-N 2.92Å; A407-A420 WeakPolarHBondContact O-CB 3.48Å; A407-F424 HydrophobicContact CB-CD1 4.12Å; A407-F424 HydrophobicContact CB-CD2 4.22Å; A407-F424 HydrophobicContact CB-CE1 3.74Å; A407-F424 HydrophobicContact CB-CE2 3.87Å; A407-F424 HydrophobicContact CB-CG 4.33Å; A407-F424 HydrophobicContact CB-CZ 3.59Å
408	S	86.8	Confident	85.7	Confident	29 Å²	29	31.5 Å²	31.5	20%	0.203	16%	0.161	C	C	.	.	H	α-helix	trans	-63	-41.7	175.7	-60.1	0	0	0	0	111.8	L404 E405 Y406 F411 T412 Q438	L404-S408 VanDerWaalsContact O-CB 3.23Å; L404-S408 WeakPolarHBondContact O-CB 3.37Å; L404-S408 PolarHBondContact O-N 3.49Å; L404-S408 PolarHBondContact O-OG 3.13Å; E405-S408 PolarHBondContact O-N 3.37Å; Y406-S408 VanDerWaalsContact C-N 3.31Å; Y406-S408 PolarHBondContact O-N 3.39Å; S408-F411 PolarHBondContact O-N 3.18Å; S408-T412 PolarHBondContact O-N 3.01Å; S408-Q438 PolarHBondContact OG-NE2 3.28Å
409	G	83.5	Confident	86	Confident	14 Å²	14	29.2 Å²	29.2	14%	0.144	15%	0.151	C	C	.	.	H	α-helix	trans	-58.7	-48.7	173	0	0	0	0	0	112.2	E405 Y406 F411 T412	E405-G409 PolarHBondContact O-N 3.17Å; Y406-G409 PolarHBondContact O-N 2.93Å; G409-F411 VanDerWaalsContact C-N 3.3Å; G409-F411 PolarHBondContact O-N 3.27Å; G409-T412 PolarHBondContact O-N 3.01Å; G409-T412 PolarHBondContact O-OG1 3.24Å
410	L	84.7	Confident	86.1	Confident	2 Å²	2	28 Å²	28	1%	0.01	15%	0.147	C	C	.	.	H	α-helix	trans	-62.4	-34.6	176.3	-72	178.5	0	0	0	113.4	F71 Y406 A407 T412 H413 L416 A420 Y423	F71-L410 HydrophobicContact CG-CD2 4.38Å; Y406-L410 HydrophobicContact CD1-CD1 4.12Å; Y406-L410 HydrophobicContact CD2-CG 4.41Å; Y406-L410 HydrophobicContact CE1-CD1 3.45Å; Y406-L410 VanDerWaalsContact CE1-CD1 3.45Å; Y406-L410 HydrophobicContact CE1-CG 4.17Å; Y406-L410 HydrophobicContact CE2-CD1 4.07Å; Y406-L410 HydrophobicContact CE2-CD2 4.1Å; Y406-L410 HydrophobicContact CE2-CG 3.88Å; Y406-L410 VanDerWaalsContact CZ-CD1 3.41Å; Y406-L410 PolarHBondContact O-N 3.08Å; Y406-L410 WeakPolarHBondContact OH-CD1 3.49Å; A407-L410 PolarHBondContact O-N 3.02Å; L410-T412 PolarHBondContact O-N 3.41Å; L410-H413 WeakPolarHBondContact O-CB 3.38Å; L410-H413 PolarHBondContact O-N 3.1Å; L410-L416 HydrophobicContact CD2-CB 4.24Å; L410-L416 HydrophobicContact CD2-CD1 3.92Å; L410-A420 HydrophobicContact CB-CB 3.89Å; L410-Y423 HydrophobicContact CD1-CD2 3.94Å; L410-Y423 HydrophobicContact CD1-CE2 3.71Å
411	F	84.8	Confident	86.3	Confident	18 Å²	18	28 Å²	28	8%	0.079	15%	0.147	C	C	.	.	H	α-helix	trans	-65.2	-29.4	-175.9	-157.9	-86.5	0	0	0	112.7	A407 S408 G409 H413 W417 A420 V421 F424 L435 Q438 I439 V442	A407-F411 WeakPolarHBondContact O-CB 3.18Å; A407-F411 PolarHBondContact O-N 2.92Å; S408-F411 PolarHBondContact O-N 3.18Å; G409-F411 VanDerWaalsContact C-N 3.3Å; G409-F411 PolarHBondContact O-N 3.27Å; F411-H413 PolarHBondContact O-N 3.48Å; F411-W417 HydrophobicContact CD2-CB 4.21Å; F411-W417 HydrophobicContact CE2-CB 4.31Å; F411-W417 HydrophobicContact CG-CB 4.43Å; F411-A420 HydrophobicContact CB-CB 4.12Å; F411-A420 HydrophobicContact CD2-CB 3.85Å; F411-A420 HydrophobicContact CG-CB 4.49Å; F411-V421 HydrophobicContact CE2-CG2 4.42Å; F411-F424 AromaticContact CD2-CE2 3.88Å; F411-F424 HydrophobicContact CD2-CE2 3.88Å; F411-F424 HydrophobicContact CG-CE2 4.47Å; F411-L435 HydrophobicContact CE2-CD1 4.44Å; F411-Q438 VanDerWaalsContact CB-OE1 3.23Å; F411-Q438 HydrophobicContact CD1-CB 3.87Å; F411-Q438 HydrophobicContact CE1-CB 3.78Å; F411-Q438 WeakPolarHBondContact CE1-O 3.43Å; F411-Q438 HydrophobicContact CE2-CB 4.43Å; F411-Q438 HydrophobicContact CG-CB 4.25Å; F411-Q438 VanDerWaalsContact CG-OE1 3.28Å; F411-Q438 HydrophobicContact CZ-CB 4.08Å; F411-I439 HydrophobicContact CE2-CD1 4.37Å; F411-I439 HydrophobicContact CZ-CD1 4.03Å; F411-V442 HydrophobicContact CE1-CG2 3.37Å; F411-V442 HydrophobicContact CE2-CG2 4.42Å; F411-V442 HydrophobicContact CZ-CG2 3.26Å
412	T	80.1	Confident	86.4	Confident	74 Å²	74	26.9 Å²	26.9	45%	0.454	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-23.7	174.9	70.3	0	0	0	0	112.7	P28 S408 G409 L410	P28-T412 VanDerWaalsContact O-CG2 3.32Å; P28-T412 WeakPolarHBondContact O-CG2 3.46Å; S408-T412 PolarHBondContact O-N 3.01Å; G409-T412 PolarHBondContact O-N 3.01Å; G409-T412 PolarHBondContact O-OG1 3.24Å; L410-T412 PolarHBondContact O-N 3.41Å
413	H	81.1	Confident	86.6	Confident	13 Å²	13	26.6 Å²	26.6	6%	0.06	14%	0.142	C	C	.	.	S	Bend	trans	-85.4	135	-174.9	-169.7	-104.3	0	0	0	113	I62 N63 L410 F411 S415 L416 W417	I62-H413 HydrophobicContact CG2-CB 4.03Å; N63-H413 PolarHBondContact OD1-CD2 3.4Å; N63-H413 VanDerWaalsContact OD1-CD2 3.24Å; L410-H413 WeakPolarHBondContact O-CB 3.38Å; L410-H413 PolarHBondContact O-N 3.1Å; F411-H413 PolarHBondContact O-N 3.48Å; H413-S415 PolarHBondContact CE1-OG 3Å; H413-S415 PolarHBondContact ND1-OG 3.34Å; H413-S415 PolarHBondContact O-N 3.4Å; H413-L416 HydrophobicContact CB-CB 4.19Å; H413-L416 HydrophobicContact CB-CD1 4.32Å; H413-L416 PolarHBondContact O-N 3.17Å; H413-W417 PolarHBondContact O-N 3.01Å
414	H	79.2	Confident	86.6	Confident	127 Å²	127	26.6 Å²	26.6	59%	0.588	14%	0.143	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-24.1	-169.5	74.3	94.9	0	0	0	115.4	W417	H414-W417 VanDerWaalsContact O-CD1 3.24Å; H414-W417 PolarHBondContact O-NE1 3.26Å
415	S	81	Confident	86.6	Confident	34 Å²	34	29.4 Å²	29.4	24%	0.238	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-113.2	-23.5	-178.4	53.4	0	0	0	0	114.5	H413	H413-S415 PolarHBondContact CE1-OG 3Å; H413-S415 PolarHBondContact ND1-OG 3.34Å; H413-S415 PolarHBondContact O-N 3.4Å
416	L	85	Confident	86.5	Confident	1 Å²	1	28.5 Å²	28.5	1%	0.005	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93	-10.1	-173.9	-65.4	168.8	0	0	0	113.3	I62 R68 F71 L410 H413 Q418 C419 A420	I62-L416 HydrophobicContact CG2-CD1 4.04Å; R68-L416 HydrophobicContact CG-CD1 4.49Å; R68-L416 HydrophobicContact CG-CD2 4Å; R68-L416 HydrophobicContact CG-CG 4.42Å; F71-L416 HydrophobicContact CB-CD1 4.44Å; F71-L416 HydrophobicContact CB-CD2 4.19Å; F71-L416 HydrophobicContact CD2-CD1 3.77Å; F71-L416 HydrophobicContact CG-CD1 4.46Å; L410-L416 HydrophobicContact CD2-CB 4.24Å; L410-L416 HydrophobicContact CD2-CD1 3.92Å; H413-L416 HydrophobicContact CB-CB 4.19Å; H413-L416 HydrophobicContact CB-CD1 4.32Å; H413-L416 PolarHBondContact O-N 3.17Å; L416-Q418 PolarHBondContact O-N 3.43Å; L416-C419 WeakPolarHBondContact O-CB 3.5Å; L416-C419 PolarHBondContact O-N 3.04Å; L416-A420 PolarHBondContact O-N 3.4Å; L416-A420 VanDerWaalsContact O-N 3.13Å
417	W	86.8	Confident	86.4	Confident	9 Å²	9	28.6 Å²	28.6	3%	0.034	15%	0.154	C	C	.	.	H	α-helix	trans	-54.6	-28.1	177.9	71.7	-89.2	0	0	0	113.9	F411 H413 H414 A420 V421 I439 V442 V453 I456	F411-W417 HydrophobicContact CD2-CB 4.21Å; F411-W417 HydrophobicContact CE2-CB 4.31Å; F411-W417 HydrophobicContact CG-CB 4.43Å; H413-W417 PolarHBondContact O-N 3.01Å; H414-W417 VanDerWaalsContact O-CD1 3.24Å; H414-W417 PolarHBondContact O-NE1 3.26Å; W417-A420 WeakPolarHBondContact O-CB 3.38Å; W417-A420 PolarHBondContact O-N 3.21Å; W417-V421 HydrophobicContact CE3-CG2 4.34Å; W417-V421 HydrophobicContact CZ3-CG2 4.49Å; W417-V421 WeakPolarHBondContact O-CG2 3.23Å; W417-V421 PolarHBondContact O-N 3.08Å; W417-I439 HydrophobicContact CZ3-CD1 4.28Å; W417-V442 HydrophobicContact CD2-CG1 4.46Å; W417-V442 HydrophobicContact CE3-CG2 4.38Å; W417-V453 HydrophobicContact CH2-CB 4.44Å; W417-V453 HydrophobicContact CH2-CG2 3.49Å; W417-V453 VanDerWaalsContact CH2-CG2 3.49Å; W417-V453 HydrophobicContact CZ2-CG2 4.06Å; W417-V453 HydrophobicContact CZ3-CG2 3.98Å; W417-I456 HydrophobicContact CH2-CD1 3.74Å; W417-I456 HydrophobicContact CZ3-CD1 3.58Å
418	Q	88.8	Confident	86	Confident	78 Å²	78	33.3 Å²	33.3	36%	0.364	19%	0.185	S	C	.	.	H	α-helix	trans	-65.2	-46.3	174.4	-83	164.5	92.2	0	0	111.3	L416 A420 V421 I456	L416-Q418 PolarHBondContact O-N 3.43Å; Q418-A420 VanDerWaalsContact C-N 3.26Å; Q418-A420 PolarHBondContact O-N 3.46Å; Q418-V421 WeakPolarHBondContact O-CB 3.44Å; Q418-V421 PolarHBondContact O-N 3.35Å; Q418-V421 VanDerWaalsContact O-N 3.16Å; Q418-I456 HydrophobicContact CG-CD1 4.34Å
419	C	88.3	Confident	85.8	Confident	13 Å²	13	36.8 Å²	36.8	9%	0.088	20%	0.198	C	C	.	.	H	α-helix	trans	-62.4	-37.8	176.7	-57.2	0	0	0	0	111.1	N72 H75 L416 V421 D422 Y423	N72-C419 PolarHBondContact OD1-SG 2.92Å; H75-C419 HydrophobicContact CB-CB 4.47Å; H75-C419 PolarHBondContact CE1-O 3.4Å; L416-C419 WeakPolarHBondContact O-CB 3.5Å; L416-C419 PolarHBondContact O-N 3.04Å; C419-V421 PolarHBondContact O-N 3.12Å; C419-D422 PolarHBondContact O-N 2.93Å; C419-Y423 WeakPolarHBondContact O-CD2 3.33Å; C419-Y423 PolarHBondContact O-N 2.87Å
420	A	89.3	Confident	85.9	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-57.6	-35.3	176.1	0	0	0	0	0	112.8	A407 L410 F411 L416 W417 Q418 D422 Y423 F424	A407-A420 WeakPolarHBondContact O-CB 3.48Å; L410-A420 HydrophobicContact CB-CB 3.89Å; F411-A420 HydrophobicContact CB-CB 4.12Å; F411-A420 HydrophobicContact CD2-CB 3.85Å; F411-A420 HydrophobicContact CG-CB 4.49Å; L416-A420 PolarHBondContact O-N 3.4Å; L416-A420 VanDerWaalsContact O-N 3.13Å; W417-A420 WeakPolarHBondContact O-CB 3.38Å; W417-A420 PolarHBondContact O-N 3.21Å; Q418-A420 VanDerWaalsContact C-N 3.26Å; Q418-A420 PolarHBondContact O-N 3.46Å; A420-D422 PolarHBondContact O-N 3.2Å; A420-Y423 PolarHBondContact O-N 3.13Å; A420-F424 HydrophobicContact CB-CE2 4.32Å; A420-F424 WeakPolarHBondContact O-CD2 3.3Å; A420-F424 PolarHBondContact O-N 3.41Å; A420-F424 VanDerWaalsContact O-N 3.09Å
421	V	90.8	Very high	85.9	Confident	1 Å²	1	39.5 Å²	39.5	1%	0.006	21%	0.209	C	C	.	.	H	α-helix	trans	-58.7	-46	177.8	-179.4	0	0	0	0	111.4	F411 W417 Q418 C419 Y423 F424 D425 L435 I456	F411-V421 HydrophobicContact CE2-CG2 4.42Å; W417-V421 HydrophobicContact CE3-CG2 4.34Å; W417-V421 HydrophobicContact CZ3-CG2 4.49Å; W417-V421 WeakPolarHBondContact O-CG2 3.23Å; W417-V421 PolarHBondContact O-N 3.08Å; Q418-V421 WeakPolarHBondContact O-CB 3.44Å; Q418-V421 PolarHBondContact O-N 3.35Å; Q418-V421 VanDerWaalsContact O-N 3.16Å; C419-V421 PolarHBondContact O-N 3.12Å; V421-Y423 VanDerWaalsContact C-N 3.28Å; V421-Y423 PolarHBondContact O-N 3.4Å; V421-F424 WeakPolarHBondContact O-CB 3.43Å; V421-F424 PolarHBondContact O-N 2.9Å; V421-F424 VanDerWaalsContact O-N 3.11Å; V421-D425 PolarHBondContact O-N 3.21Å; V421-L435 HydrophobicContact CB-CD1 4.42Å; V421-L435 HydrophobicContact CG1-CD1 4.11Å; V421-L435 HydrophobicContact CG1-CD2 3.96Å; V421-L435 HydrophobicContact CG2-CD1 4.01Å; V421-I456 HydrophobicContact CG1-CG2 3.79Å; V421-I456 HydrophobicContact CG2-CG2 4.26Å
422	D	90.4	Very high	86.1	Confident	49 Å²	49	45.5 Å²	45.5	26%	0.262	23%	0.231	S	C	.	.	H	α-helix	trans	-69.9	-29.1	-177.9	-49.6	-44.8	0	0	0	111.2	H75 V79 C419 A420 D425 H426 R460	H75-D422 IonicContact CE1-OD2 3.65Å; H75-D422 PolarHBondContact CE1-OD2 2.61Å; H75-D422 IonicContact NE2-OD2 2.66Å; H75-D422 PolarHBondContact NE2-OD2 3.14Å; V79-D422 HydrophobicContact CG2-CB 4.38Å; C419-D422 PolarHBondContact O-N 2.93Å; A420-D422 PolarHBondContact O-N 3.2Å; D422-D425 PolarHBondContact O-N 2.91Å; D422-H426 PolarHBondContact O-N 3.48Å; D422-H426 PolarHBondContact O-ND1 2.78Å; D422-R460 IonicContact OD1-NH2 2.99Å; D422-R460 PolarHBondContact OD1-NH2 3.45Å
423	Y	91.6	Very high	86.5	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-63.8	-40.8	170.5	-69.7	-75.8	0	0	0	111.8	H75 F78 H376 L403 Y406 L410 C419 A420 V421 D425 H426 C427	H75-Y423 VanDerWaalsContact CA-OH 3.28Å; H75-Y423 WeakPolarHBondContact CA-OH 3.33Å; H75-Y423 HydrophobicContact CB-CE2 4.27Å; H75-Y423 WeakPolarHBondContact CB-OH 3.49Å; H75-Y423 AromaticContact ND1-CE2 3.5Å; H75-Y423 WeakPolarHBondContact ND1-CE2 3.49Å; H75-Y423 AromaticContact ND1-CZ 3.87Å; F78-Y423 HydrophobicContact CB-CE1 4.02Å; F78-Y423 AromaticContact CD1-CD1 3.65Å; F78-Y423 HydrophobicContact CD1-CD1 3.65Å; F78-Y423 AromaticContact CD1-CE1 3.4Å; F78-Y423 HydrophobicContact CD1-CE1 3.4Å; F78-Y423 VanDerWaalsContact CD1-CE1 3.4Å; F78-Y423 HydrophobicContact CD2-CD1 4.2Å; F78-Y423 AromaticContact CD2-CE1 3.75Å; F78-Y423 HydrophobicContact CD2-CE1 3.75Å; F78-Y423 AromaticContact CE1-CD1 3.43Å; F78-Y423 HydrophobicContact CE1-CD1 3.43Å; F78-Y423 VanDerWaalsContact CE1-CD1 3.43Å; F78-Y423 AromaticContact CE1-CE1 3.72Å; F78-Y423 HydrophobicContact CE1-CE1 3.72Å; F78-Y423 HydrophobicContact CE1-CG 4.27Å; F78-Y423 AromaticContact CE2-CD1 3.98Å; F78-Y423 HydrophobicContact CE2-CD1 3.98Å; F78-Y423 HydrophobicContact CE2-CE1 4.01Å; F78-Y423 HydrophobicContact CG-CD1 4.04Å; F78-Y423 AromaticContact CG-CE1 3.43Å; F78-Y423 HydrophobicContact CG-CE1 3.43Å; F78-Y423 VanDerWaalsContact CG-CE1 3.43Å; F78-Y423 AromaticContact CZ-CD1 3.6Å; F78-Y423 HydrophobicContact CZ-CD1 3.6Å; F78-Y423 HydrophobicContact CZ-CE1 4.01Å; H376-Y423 AromaticContact NE2-CE1 3.93Å; H376-Y423 AromaticContact NE2-CZ 3.83Å; H376-Y423 PolarHBondContact NE2-OH 3.27Å; L403-Y423 HydrophobicContact CD2-CD1 4.1Å; Y406-Y423 HydrophobicContact CD1-CE1 4.36Å; Y406-Y423 HydrophobicContact CE1-CD2 4.38Å; Y406-Y423 HydrophobicContact CE1-CE1 4.04Å; Y406-Y423 AromaticContact CE1-CE2 3.87Å; Y406-Y423 HydrophobicContact CE1-CE2 3.87Å; Y406-Y423 AromaticContact CE1-CZ 3.68Å; L410-Y423 HydrophobicContact CD1-CD2 3.94Å; L410-Y423 HydrophobicContact CD1-CE2 3.71Å; C419-Y423 WeakPolarHBondContact O-CD2 3.33Å; C419-Y423 PolarHBondContact O-N 2.87Å; A420-Y423 PolarHBondContact O-N 3.13Å; V421-Y423 VanDerWaalsContact C-N 3.28Å; V421-Y423 PolarHBondContact O-N 3.4Å; Y423-D425 VanDerWaalsContact C-N 3.31Å; Y423-D425 PolarHBondContact O-N 3.28Å; Y423-H426 PolarHBondContact O-N 2.9Å; Y423-C427 PolarHBondContact O-SG 2.88Å
424	F	90.4	Very high	86.7	Confident	1 Å²	1	45.4 Å²	45.4	0%	0.004	24%	0.238	C	C	.	.	H	α-helix	trans	-63.4	-35	174.9	-71.5	-60.6	0	0	0	112.7	L404 A407 F411 A420 V421 H426 C427 G431 C434 L435	L404-F424 HydrophobicContact CD2-CD1 3.64Å; L404-F424 HydrophobicContact CD2-CE1 3.78Å; A407-F424 HydrophobicContact CB-CD1 4.12Å; A407-F424 HydrophobicContact CB-CD2 4.22Å; A407-F424 HydrophobicContact CB-CE1 3.74Å; A407-F424 HydrophobicContact CB-CE2 3.87Å; A407-F424 HydrophobicContact CB-CG 4.33Å; A407-F424 HydrophobicContact CB-CZ 3.59Å; F411-F424 AromaticContact CD2-CE2 3.88Å; F411-F424 HydrophobicContact CD2-CE2 3.88Å; F411-F424 HydrophobicContact CG-CE2 4.47Å; A420-F424 HydrophobicContact CB-CE2 4.32Å; A420-F424 WeakPolarHBondContact O-CD2 3.3Å; A420-F424 PolarHBondContact O-N 3.41Å; A420-F424 VanDerWaalsContact O-N 3.09Å; V421-F424 WeakPolarHBondContact O-CB 3.43Å; V421-F424 PolarHBondContact O-N 2.9Å; V421-F424 VanDerWaalsContact O-N 3.11Å; F424-H426 VanDerWaalsContact C-N 3.26Å; F424-H426 PolarHBondContact O-N 3.44Å; F424-C427 WeakPolarHBondContact O-CB 3.42Å; F424-C427 PolarHBondContact O-N 2.9Å; F424-G431 WeakPolarHBondContact O-CA 3.45Å; F424-C434 HydrophobicContact CD1-CB 4.06Å; F424-C434 HydrophobicContact CE1-CB 3.87Å; F424-L435 HydrophobicContact CB-CB 4.08Å; F424-L435 HydrophobicContact CD2-CB 4.43Å; F424-L435 HydrophobicContact CD2-CD1 4.04Å; F424-L435 HydrophobicContact CG-CB 4.25Å
425	D	89	Confident	87.2	Confident	71 Å²	71	39.5 Å²	39.5	38%	0.38	21%	0.21	S	C	.	.	H	α-helix	trans	-66.3	-28.8	178.4	-68	-30	0	0	0	113.2	V421 D422 Y423 C427 R460	V421-D425 PolarHBondContact O-N 3.21Å; D422-D425 PolarHBondContact O-N 2.91Å; Y423-D425 VanDerWaalsContact C-N 3.31Å; Y423-D425 PolarHBondContact O-N 3.28Å; D425-C427 VanDerWaalsContact C-N 3.27Å; D425-C427 PolarHBondContact O-N 2.86Å; D425-R460 VanDerWaalsContact CG-NE 3.29Å; D425-R460 WeakPolarHBondContact OD1-CD 3.29Å; D425-R460 IonicContact OD1-CZ 3.7Å; D425-R460 IonicContact OD1-NE 3.3Å; D425-R460 PolarHBondContact OD1-NE 2.88Å; D425-R460 IonicContact OD2-CZ 2.87Å; D425-R460 IonicContact OD2-NE 3.95Å; D425-R460 PolarHBondContact OD2-NE 3.35Å; D425-R460 IonicContact OD2-NH2 2.75Å; D425-R460 PolarHBondContact OD2-NH2 3.05Å
426	H	86.8	Confident	87.6	Confident	61 Å²	61	40.6 Å²	40.6	28%	0.282	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.8	12.9	178.9	-62.7	92.1	0	0	0	113.2	F78 Q82 R399 D422 Y423 F424	F78-H426 HydrophobicContact CE1-CB 4.24Å; F78-H426 AromaticContact CE1-ND1 3.93Å; F78-H426 HydrophobicContact CZ-CB 4.01Å; Q82-H426 VanDerWaalsContact CB-CD2 3.46Å; Q82-H426 WeakPolarHBondContact CB-CD2 3.37Å; Q82-H426 WeakPolarHBondContact CB-NE2 3.32Å; Q82-H426 HydrophobicContact CG-CB 4.44Å; Q82-H426 WeakPolarHBondContact CG-CD2 3.43Å; R399-H426 PolarHBondContact NH1-O 3.13Å; R399-H426 VanDerWaalsContact NH1-O 3.1Å; D422-H426 PolarHBondContact O-N 3.48Å; D422-H426 PolarHBondContact O-ND1 2.78Å; Y423-H426 PolarHBondContact O-N 2.9Å; F424-H426 VanDerWaalsContact C-N 3.26Å; F424-H426 PolarHBondContact O-N 3.44Å
427	C	86	Confident	87.7	Confident	6 Å²	6	46.3 Å²	46.3	4%	0.041	24%	0.241	C	C	.	.			trans	-103.7	111.3	171.6	-66.6	0	0	0	0	109.7	E400 L404 Y423 F424 D425	E400-C427 HydrophobicContact CG-CB 3.91Å; L404-C427 HydrophobicContact CD2-CB 4.1Å; Y423-C427 PolarHBondContact O-SG 2.88Å; F424-C427 WeakPolarHBondContact O-CB 3.42Å; F424-C427 PolarHBondContact O-N 2.9Å; D425-C427 VanDerWaalsContact C-N 3.27Å; D425-C427 PolarHBondContact O-N 2.86Å
428	P	81.2	Confident	87.6	Confident	99 Å²	99	47.4 Å²	47.4	64%	0.643	25%	0.247	S	C	*	.	S	Bend	trans	-74	-30.9	-165.7	27	-34.4	0	0	0	115.5
429	E	82.9	Confident	87.6	Confident	102 Å²	102	43.8 Å²	43.8	48%	0.477	23%	0.23	S	C	.	.	S	Bend	trans	-102.3	-54.9	-171.8	-57.9	-167.9	166.5	0	0	112.4	E400	E400-E429 WeakPolarHBondContact OE1-CA 3.49Å; E400-E429 PolarHBondContact OE1-N 3.3Å
430	L	85.1	Confident	87.4	Confident	73 Å²	73	47.4 Å²	47.4	38%	0.382	25%	0.246	S	C	.	.	S	Bend	trans	-104.9	-14	-171	-63.5	176.5	0	0	0	113.1	E400 L404 R432 A433 C434	E400-L430 PolarHBondContact OE1-N 3.35Å; L404-L430 HydrophobicContact CD1-CB 3.77Å; L404-L430 HydrophobicContact CD1-CD1 4.22Å; L430-R432 PolarHBondContact O-N 3.46Å; L430-A433 PolarHBondContact O-N 3.01Å; L430-C434 WeakPolarHBondContact O-CB 3.49Å; L430-C434 PolarHBondContact O-N 2.98Å; L430-C434 PolarHBondContact O-SG 3.46Å; L430-C434 VanDerWaalsContact O-SG 3.4Å
431	G	86.3	Confident	87.1	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-49.9	-52.3	-175.9	0	0	0	0	0	114.3	F424 C434 L435	F424-G431 WeakPolarHBondContact O-CA 3.45Å; G431-C434 PolarHBondContact O-N 2.83Å; G431-L435 WeakPolarHBondContact O-CB 3.44Å; G431-L435 PolarHBondContact O-N 3.46Å
432	R	88.2	Confident	86.8	Confident	144 Å²	144	56.2 Å²	56.2	54%	0.543	28%	0.28	S	S	.	.	H	α-helix	trans	-63.4	-46.2	-179.7	-178	175.7	178.7	153.6	7.2	112.6	L430 C434 L435 E436	L430-R432 PolarHBondContact O-N 3.46Å; R432-C434 VanDerWaalsContact C-N 3.34Å; R432-C434 PolarHBondContact O-N 3Å; R432-L435 PolarHBondContact O-N 3.3Å; R432-E436 HydrophobicContact CG-CG 4.44Å; R432-E436 WeakPolarHBondContact CG-OE1 3.38Å; R432-E436 IonicContact CZ-OE1 3.56Å; R432-E436 IonicContact NE-OE1 2.75Å; R432-E436 PolarHBondContact NE-OE1 3.5Å; R432-E436 IonicContact NH2-OE1 3.77Å; R432-E436 WeakPolarHBondContact O-CB 3.41Å; R432-E436 VanDerWaalsContact O-CG 3.32Å; R432-E436 WeakPolarHBondContact O-CG 3.19Å; R432-E436 PolarHBondContact O-N 2.97Å
433	A	88.4	Confident	86.3	Confident	51 Å²	51	57.3 Å²	57.3	42%	0.421	29%	0.29	S	S	.	.	H	α-helix	trans	-64.5	-40.5	-179.1	0	0	0	0	0	111.4	L430 E436 L437	L430-A433 PolarHBondContact O-N 3.01Å; A433-E436 PolarHBondContact O-N 2.99Å; A433-L437 WeakPolarHBondContact O-CG 3.48Å; A433-L437 PolarHBondContact O-N 3.38Å
434	C	86.3	Confident	85.9	Confident	34 Å²	34	58.3 Å²	58.3	23%	0.23	30%	0.295	C	S	.	.	H	α-helix	trans	-62.8	-45.9	174	-71.7	0	0	0	0	111.7	L404 F424 L430 G431 R432 E436 L437 Q438	L404-C434 HydrophobicContact CD2-CB 4.22Å; F424-C434 HydrophobicContact CD1-CB 4.06Å; F424-C434 HydrophobicContact CE1-CB 3.87Å; L430-C434 WeakPolarHBondContact O-CB 3.49Å; L430-C434 PolarHBondContact O-N 2.98Å; L430-C434 PolarHBondContact O-SG 3.46Å; L430-C434 VanDerWaalsContact O-SG 3.4Å; G431-C434 PolarHBondContact O-N 2.83Å; R432-C434 VanDerWaalsContact C-N 3.34Å; R432-C434 PolarHBondContact O-N 3Å; C434-E436 PolarHBondContact O-N 3.35Å; C434-L437 PolarHBondContact O-N 3.4Å; C434-Q438 WeakPolarHBondContact O-CB 3.15Å; C434-Q438 WeakPolarHBondContact O-CG 3.36Å; C434-Q438 PolarHBondContact O-N 2.92Å
435	L	89.3	Confident	85.5	Confident	3 Å²	3	63 Å²	63	2%	0.016	32%	0.32	C	S	.	.	H	α-helix	trans	-60.9	-43.6	177.2	-180	62	0	0	0	111.8	F411 V421 F424 G431 R432 L437 Q438 I439 M462	F411-L435 HydrophobicContact CE2-CD1 4.44Å; V421-L435 HydrophobicContact CB-CD1 4.42Å; V421-L435 HydrophobicContact CG1-CD1 4.11Å; V421-L435 HydrophobicContact CG1-CD2 3.96Å; V421-L435 HydrophobicContact CG2-CD1 4.01Å; F424-L435 HydrophobicContact CB-CB 4.08Å; F424-L435 HydrophobicContact CD2-CB 4.43Å; F424-L435 HydrophobicContact CD2-CD1 4.04Å; F424-L435 HydrophobicContact CG-CB 4.25Å; G431-L435 WeakPolarHBondContact O-CB 3.44Å; G431-L435 PolarHBondContact O-N 3.46Å; R432-L435 PolarHBondContact O-N 3.3Å; L435-L437 VanDerWaalsContact C-N 3.26Å; L435-L437 PolarHBondContact O-N 3.32Å; L435-Q438 PolarHBondContact O-N 3.35Å; L435-I439 HydrophobicContact CD1-CD1 4.43Å; L435-I439 VanDerWaalsContact O-CB 3.28Å; L435-I439 WeakPolarHBondContact O-CB 3.15Å; L435-I439 WeakPolarHBondContact O-CG2 3.47Å; L435-I439 PolarHBondContact O-N 2.85Å; L435-M462 HydrophobicContact CD2-CE 4.38Å; L435-M462 HydrophobicContact CD2-SD 4.13Å; L435-M462 HydrophobicContact CG-CE 4.03Å; L435-M462 HydrophobicContact CG-SD 4.42Å
436	E	89.1	Confident	85.3	Confident	57 Å²	57	63.2 Å²	63.2	27%	0.266	32%	0.324	S	S	.	.	H	α-helix	trans	-57.7	-36.8	177.6	-78	-179.8	-169	0	0	112.7	R432 A433 C434 M462	R432-E436 HydrophobicContact CG-CG 4.44Å; R432-E436 WeakPolarHBondContact CG-OE1 3.38Å; R432-E436 IonicContact CZ-OE1 3.56Å; R432-E436 IonicContact NE-OE1 2.75Å; R432-E436 PolarHBondContact NE-OE1 3.5Å; R432-E436 IonicContact NH2-OE1 3.77Å; R432-E436 WeakPolarHBondContact O-CB 3.41Å; R432-E436 VanDerWaalsContact O-CG 3.32Å; R432-E436 WeakPolarHBondContact O-CG 3.19Å; R432-E436 PolarHBondContact O-N 2.97Å; A433-E436 PolarHBondContact O-N 2.99Å; C434-E436 PolarHBondContact O-N 3.35Å; E436-M462 HydrophobicContact CB-CE 4.06Å; E436-M462 HydrophobicContact CG-CE 3.39Å; E436-M462 HydrophobicContact CG-CG 4.42Å
437	L	87.1	Confident	85.2	Confident	120 Å²	120	64.6 Å²	64.6	63%	0.628	33%	0.331	S	S	*	.	H	α-helix	trans	-80.7	-35.6	177.9	-68.7	171.5	0	0	0	113.3	A433 C434 L435	A433-L437 WeakPolarHBondContact O-CG 3.48Å; A433-L437 PolarHBondContact O-N 3.38Å; C434-L437 PolarHBondContact O-N 3.4Å; L435-L437 VanDerWaalsContact C-N 3.26Å; L435-L437 PolarHBondContact O-N 3.32Å
438	Q	85.7	Confident	85.2	Confident	33 Å²	33	74.4 Å²	74.4	15%	0.154	37%	0.367	C	S	.	.	H	α-helix	trans	-80.9	-34.8	-176.4	-69.1	-168.3	27.1	0	0	112.4	S408 F411 C434 L435 E440 R441	S408-Q438 PolarHBondContact OG-NE2 3.28Å; F411-Q438 VanDerWaalsContact CB-OE1 3.23Å; F411-Q438 HydrophobicContact CD1-CB 3.87Å; F411-Q438 HydrophobicContact CE1-CB 3.78Å; F411-Q438 WeakPolarHBondContact CE1-O 3.43Å; F411-Q438 HydrophobicContact CE2-CB 4.43Å; F411-Q438 HydrophobicContact CG-CB 4.25Å; F411-Q438 VanDerWaalsContact CG-OE1 3.28Å; F411-Q438 HydrophobicContact CZ-CB 4.08Å; C434-Q438 WeakPolarHBondContact O-CB 3.15Å; C434-Q438 WeakPolarHBondContact O-CG 3.36Å; C434-Q438 PolarHBondContact O-N 2.92Å; L435-Q438 PolarHBondContact O-N 3.35Å; Q438-E440 PolarHBondContact O-N 2.81Å; Q438-R441 WeakPolarHBondContact O-CB 3.32Å; Q438-R441 PolarHBondContact O-N 2.89Å
439	I	87.6	Confident	85.5	Confident	2 Å²	2	71.1 Å²	71.1	1%	0.01	34%	0.342	C	S	.	.	H	α-helix	trans	-60.1	-33.4	-176.2	-157.1	65.9	0	0	0	113.4	F411 W417 L435 R441 V442 V453 M462 Q465	F411-I439 HydrophobicContact CE2-CD1 4.37Å; F411-I439 HydrophobicContact CZ-CD1 4.03Å; W417-I439 HydrophobicContact CZ3-CD1 4.28Å; L435-I439 HydrophobicContact CD1-CD1 4.43Å; L435-I439 VanDerWaalsContact O-CB 3.28Å; L435-I439 WeakPolarHBondContact O-CB 3.15Å; L435-I439 WeakPolarHBondContact O-CG2 3.47Å; L435-I439 PolarHBondContact O-N 2.85Å; I439-R441 PolarHBondContact O-N 3.49Å; I439-V442 HydrophobicContact CD1-CG2 4.26Å; I439-V442 WeakPolarHBondContact O-CG2 3.31Å; I439-V442 PolarHBondContact O-N 2.79Å; I439-V453 HydrophobicContact CD1-CG1 3.85Å; I439-V453 HydrophobicContact CG1-CG1 3.69Å; I439-M462 HydrophobicContact CG2-CE 3.92Å; I439-Q465 HydrophobicContact CG2-CB 4.09Å; I439-Q465 HydrophobicContact CG2-CG 3.83Å
440	E	83.8	Confident	85.8	Confident	88 Å²	88	66.3 Å²	66.3	41%	0.411	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-20.4	177.2	-62.1	-162.8	141.6	0	0	113	Q438 Q465 S468	Q438-E440 PolarHBondContact O-N 2.81Å; E440-Q465 HydrophobicContact CG-CG 4.32Å; E440-S468 WeakPolarHBondContact OE1-CB 3.47Å; E440-S468 PolarHBondContact OE1-OG 2.98Å
441	R	82.6	Confident	86	Confident	178 Å²	178	66.1 Å²	66.1	67%	0.672	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.8	-7.8	-179.8	-57.9	-177.3	178.7	-172.7	-0.8	113.1	Q438 I439 P443	Q438-R441 WeakPolarHBondContact O-CB 3.32Å; Q438-R441 PolarHBondContact O-N 2.89Å; I439-R441 PolarHBondContact O-N 3.49Å; R441-P443 WeakPolarHBondContact O-CD 3.33Å
442	V	84.6	Confident	86.1	Confident	9 Å²	9	71.5 Å²	71.5	6%	0.055	34%	0.342	C	S	.	.	S	Bend	trans	-63.3	125.3	178.8	178.7	0	0	0	0	109.5	F411 W417 I439 L444 V453	F411-V442 HydrophobicContact CE1-CG2 3.37Å; F411-V442 HydrophobicContact CE2-CG2 4.42Å; F411-V442 HydrophobicContact CZ-CG2 3.26Å; W417-V442 HydrophobicContact CD2-CG1 4.46Å; W417-V442 HydrophobicContact CE3-CG2 4.38Å; I439-V442 HydrophobicContact CD1-CG2 4.26Å; I439-V442 WeakPolarHBondContact O-CG2 3.31Å; I439-V442 PolarHBondContact O-N 2.79Å; V442-L444 WeakPolarHBondContact O-CG 3.23Å; V442-L444 PolarHBondContact O-N 3.26Å; V442-L444 VanDerWaalsContact O-N 3.11Å; V442-V453 HydrophobicContact CG1-CG2 4.1Å
443	P	81.1	Confident	86.2	Confident	72 Å²	72	64.7 Å²	64.7	47%	0.468	32%	0.316	S	S	.	.			trans	-67.3	116.9	179.5	21.3	-27.4	0	0	0	110.3	R441 D445 K449	R441-P443 WeakPolarHBondContact O-CD 3.33Å; P443-D445 PolarHBondContact O-N 3.01Å; P443-K449 VanDerWaalsContact O-CD 3.3Å; P443-K449 WeakPolarHBondContact O-CD 3.33Å; P443-K449 VanDerWaalsContact O-CE 3.23Å; P443-K449 WeakPolarHBondContact O-CE 3.26Å; P443-K449 PolarHBondContact O-NZ 3.44Å
444	L	83.1	Confident	86.3	Confident	20 Å²	20	62.4 Å²	62.4	11%	0.105	30%	0.297	C	S	.	.			trans	-90.7	59.3	-176	-59.8	177.8	0	0	0	111.9	V442 T446 A450 V453 I469 I472 M473 R476	V442-L444 WeakPolarHBondContact O-CG 3.23Å; V442-L444 PolarHBondContact O-N 3.26Å; V442-L444 VanDerWaalsContact O-N 3.11Å; L444-T446 PolarHBondContact O-N 3.17Å; L444-A450 HydrophobicContact CD2-CB 4.27Å; L444-V453 HydrophobicContact CD2-CB 4.47Å; L444-V453 HydrophobicContact CD2-CG2 4.12Å; L444-I469 HydrophobicContact CD1-CG2 3.91Å; L444-I472 HydrophobicContact CD1-CG2 4.33Å; L444-M473 HydrophobicContact CB-SD 3.92Å; L444-M473 HydrophobicContact CD1-CG 4.24Å; L444-M473 HydrophobicContact CD1-SD 4.21Å; L444-R476 PolarHBondContact O-NH1 2.98Å
445	D	81.7	Confident	86.5	Confident	99 Å²	99	68.6 Å²	68.6	53%	0.529	32%	0.316	S	S	.	.			trans	-68	-34.5	-172.1	-57	-46.8	0	0	0	114.1	P443 R476	P443-D445 PolarHBondContact O-N 3.01Å; D445-R476 PolarHBondContact O-NH2 3.48Å
446	T	84.8	Confident	86.5	Confident	77 Å²	77	69.5 Å²	69.5	47%	0.472	32%	0.32	S	S	.	.	S	Bend	trans	-126.4	150.1	-175.4	65.8	0	0	0	0	111	L444 R448 K449 A450	L444-T446 PolarHBondContact O-N 3.17Å; T446-R448 VanDerWaalsContact C-N 3.26Å; T446-R448 PolarHBondContact O-N 2.99Å; T446-K449 PolarHBondContact O-N 3.45Å; T446-K449 VanDerWaalsContact O-N 3.12Å; T446-K449 WeakPolarHBondContact OG1-CB 2.99Å; T446-K449 PolarHBondContact OG1-N 3.25Å; T446-A450 PolarHBondContact O-N 3.03Å
447	E	84.3	Confident	86.6	Confident	90 Å²	90	66.8 Å²	66.8	42%	0.421	31%	0.308	S	S	.	.	H	α-helix	trans	-60.5	-37.5	176.9	-165.1	170.2	-160.7	0	0	112.1	K449 A450 L451 W489	E447-K449 VanDerWaalsContact C-N 3.33Å; E447-K449 PolarHBondContact O-N 3.36Å; E447-A450 PolarHBondContact O-N 3.35Å; E447-L451 WeakPolarHBondContact O-CG 3.23Å; E447-L451 PolarHBondContact O-N 2.72Å; E447-W489 HydrophobicContact CG-CZ2 3.64Å; E447-W489 PolarHBondContact OE1-NE1 3.5Å; E447-W489 VanDerWaalsContact OE1-NE1 3.1Å
448	R	87.3	Confident	86.7	Confident	212 Å²	212	66.6 Å²	66.6	80%	0.8	30%	0.304	S	S	*	.	H	α-helix	trans	-59.9	-42.3	174.8	-66.9	-177.7	-177.2	168.4	0.5	112	T446 K452	T446-R448 VanDerWaalsContact C-N 3.26Å; T446-R448 PolarHBondContact O-N 2.99Å; R448-K452 WeakPolarHBondContact O-CG 3.46Å; R448-K452 PolarHBondContact O-N 3.41Å; R448-K452 VanDerWaalsContact O-N 3.16Å
449	K	86.8	Confident	86.9	Confident	30 Å²	30	70.3 Å²	70.3	13%	0.13	32%	0.321	C	S	.	.	H	α-helix	trans	-67.2	-42.3	177.8	-169	175.4	178.7	-167.8	0	110.7	P443 T446 E447 L451 K452 V453	P443-K449 VanDerWaalsContact O-CD 3.3Å; P443-K449 WeakPolarHBondContact O-CD 3.33Å; P443-K449 VanDerWaalsContact O-CE 3.23Å; P443-K449 WeakPolarHBondContact O-CE 3.26Å; P443-K449 PolarHBondContact O-NZ 3.44Å; T446-K449 PolarHBondContact O-N 3.45Å; T446-K449 VanDerWaalsContact O-N 3.12Å; T446-K449 WeakPolarHBondContact OG1-CB 2.99Å; T446-K449 PolarHBondContact OG1-N 3.25Å; E447-K449 VanDerWaalsContact C-N 3.33Å; E447-K449 PolarHBondContact O-N 3.36Å; K449-L451 PolarHBondContact O-N 3.43Å; K449-K452 WeakPolarHBondContact O-CB 3.25Å; K449-K452 PolarHBondContact O-N 2.87Å; K449-V453 WeakPolarHBondContact O-CG2 3.4Å; K449-V453 PolarHBondContact O-N 3.36Å
450	A	88.4	Confident	87	Confident	0 Å²	0	72.8 Å²	72.8	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-60.7	-42.8	175.9	0	0	0	0	0	112.9	L444 T446 E447 K452 V453 L454 M473 W489	L444-A450 HydrophobicContact CD2-CB 4.27Å; T446-A450 PolarHBondContact O-N 3.03Å; E447-A450 PolarHBondContact O-N 3.35Å; A450-K452 VanDerWaalsContact C-N 3.32Å; A450-K452 PolarHBondContact O-N 2.97Å; A450-V453 PolarHBondContact O-N 2.83Å; A450-L454 WeakPolarHBondContact O-CB 3.33Å; A450-L454 WeakPolarHBondContact O-CG 2.98Å; A450-L454 PolarHBondContact O-N 2.7Å; A450-M473 HydrophobicContact CB-CE 3.7Å; A450-M473 HydrophobicContact CB-CG 3.86Å; A450-M473 HydrophobicContact CB-SD 3.73Å; A450-W489 HydrophobicContact CB-CH2 4.09Å
451	L	89.2	Confident	87.3	Confident	70 Å²	70	76 Å²	76	37%	0.366	35%	0.345	S	S	.	.	H	α-helix	trans	-63.5	-35.8	175.6	-71.1	171.7	0	0	0	112.8	E447 K449 R455 W489	E447-L451 WeakPolarHBondContact O-CG 3.23Å; E447-L451 PolarHBondContact O-N 2.72Å; K449-L451 PolarHBondContact O-N 3.43Å; L451-R455 WeakPolarHBondContact O-CB 3.48Å; L451-R455 PolarHBondContact O-N 2.66Å; L451-W489 HydrophobicContact CD2-CH2 3.65Å; L451-W489 HydrophobicContact CD2-CZ2 4.08Å; L451-W489 HydrophobicContact CG-CH2 4Å; L451-W489 HydrophobicContact CG-CZ2 4.26Å
452	K	89.6	Confident	87.6	Confident	113 Å²	113	67.7 Å²	67.7	49%	0.491	31%	0.314	S	S	.	.	H	α-helix	trans	-65.2	-47.4	174	-73	-178.3	177.3	-164.2	0	111.9	R448 K449 A450 L454 R455 I456	R448-K452 WeakPolarHBondContact O-CG 3.46Å; R448-K452 PolarHBondContact O-N 3.41Å; R448-K452 VanDerWaalsContact O-N 3.16Å; K449-K452 WeakPolarHBondContact O-CB 3.25Å; K449-K452 PolarHBondContact O-N 2.87Å; A450-K452 VanDerWaalsContact C-N 3.32Å; A450-K452 PolarHBondContact O-N 2.97Å; K452-L454 VanDerWaalsContact C-N 3.31Å; K452-L454 PolarHBondContact O-N 3.23Å; K452-R455 PolarHBondContact O-N 3.29Å; K452-I456 WeakPolarHBondContact O-CG1 3.46Å; K452-I456 PolarHBondContact O-N 3.22Å; K452-I456 VanDerWaalsContact O-N 3.16Å
453	V	89.7	Confident	87.8	Confident	0 Å²	0	71 Å²	71	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-60.7	-44.1	177.1	-179.9	0	0	0	0	110.1	W417 I439 V442 L444 K449 A450 R455 I456 C457 I469	W417-V453 HydrophobicContact CH2-CB 4.44Å; W417-V453 HydrophobicContact CH2-CG2 3.49Å; W417-V453 VanDerWaalsContact CH2-CG2 3.49Å; W417-V453 HydrophobicContact CZ2-CG2 4.06Å; W417-V453 HydrophobicContact CZ3-CG2 3.98Å; I439-V453 HydrophobicContact CD1-CG1 3.85Å; I439-V453 HydrophobicContact CG1-CG1 3.69Å; V442-V453 HydrophobicContact CG1-CG2 4.1Å; L444-V453 HydrophobicContact CD2-CB 4.47Å; L444-V453 HydrophobicContact CD2-CG2 4.12Å; K449-V453 WeakPolarHBondContact O-CG2 3.4Å; K449-V453 PolarHBondContact O-N 3.36Å; A450-V453 PolarHBondContact O-N 2.83Å; V453-R455 PolarHBondContact O-N 3.41Å; V453-I456 WeakPolarHBondContact O-CB 3.46Å; V453-I456 PolarHBondContact O-N 3.45Å; V453-C457 PolarHBondContact O-N 3.43Å; V453-C457 PolarHBondContact O-SG 2.84Å; V453-I469 HydrophobicContact CG1-CD1 3.57Å
454	L	90	Very high	88.2	Confident	4 Å²	4	72.8 Å²	72.8	2%	0.021	34%	0.34	C	S	.	.	H	α-helix	trans	-56.9	-48.7	175.8	-85	-171.6	0	0	0	112.7	A450 K452 I456 C457 E458 V466 I469 W489	A450-L454 WeakPolarHBondContact O-CB 3.33Å; A450-L454 WeakPolarHBondContact O-CG 2.98Å; A450-L454 PolarHBondContact O-N 2.7Å; K452-L454 VanDerWaalsContact C-N 3.31Å; K452-L454 PolarHBondContact O-N 3.23Å; L454-I456 VanDerWaalsContact C-N 3.28Å; L454-I456 PolarHBondContact O-N 2.87Å; L454-C457 PolarHBondContact O-N 2.75Å; L454-C457 VanDerWaalsContact O-N 3.13Å; L454-E458 WeakPolarHBondContact O-CB 3.39Å; L454-E458 WeakPolarHBondContact O-CG 3.44Å; L454-E458 PolarHBondContact O-N 3.44Å; L454-V466 HydrophobicContact CD2-CB 4.18Å; L454-V466 HydrophobicContact CD2-CG1 3.89Å; L454-V466 HydrophobicContact CD2-CG2 4.14Å; L454-I469 HydrophobicContact CD2-CB 4.14Å; L454-I469 HydrophobicContact CD2-CG2 3.89Å; L454-I469 HydrophobicContact CG-CG2 4.11Å; L454-W489 HydrophobicContact CD1-CE3 4.37Å; L454-W489 HydrophobicContact CD1-CH2 3.89Å; L454-W489 HydrophobicContact CD1-CZ3 3.35Å; L454-W489 HydrophobicContact CG-CZ3 4.28Å
455	R	90.9	Very high	88.6	Confident	163 Å²	163	72.9 Å²	72.9	62%	0.615	34%	0.34	S	S	*	.	H	α-helix	trans	-57.7	-43.5	179.8	-179.6	177.3	173.3	171.6	1.1	111.6	L451 K452 V453 C457 E458 E459	L451-R455 WeakPolarHBondContact O-CB 3.48Å; L451-R455 PolarHBondContact O-N 2.66Å; K452-R455 PolarHBondContact O-N 3.29Å; V453-R455 PolarHBondContact O-N 3.41Å; R455-C457 VanDerWaalsContact C-N 3.34Å; R455-C457 PolarHBondContact O-N 2.91Å; R455-E458 PolarHBondContact O-N 2.86Å; R455-E459 HydrophobicContact CG-CG 4.43Å; R455-E459 WeakPolarHBondContact CG-OE1 3.47Å; R455-E459 IonicContact CZ-OE1 3.89Å; R455-E459 IonicContact NE-OE1 3.22Å; R455-E459 PolarHBondContact NE-OE1 3.1Å; R455-E459 IonicContact NH2-OE1 3.75Å; R455-E459 PolarHBondContact NH2-OE1 3.19Å; R455-E459 WeakPolarHBondContact O-CB 3.02Å; R455-E459 VanDerWaalsContact O-CG 3.3Å; R455-E459 WeakPolarHBondContact O-CG 3.49Å; R455-E459 PolarHBondContact O-N 2.7Å
456	I	89.6	Confident	89	Confident	22 Å²	22	69.1 Å²	69.1	11%	0.113	32%	0.32	C	S	.	.	H	α-helix	trans	-59.9	-44.8	176.8	-72.4	168.1	0	0	0	111.1	W417 Q418 V421 K452 V453 L454 R460	W417-I456 HydrophobicContact CH2-CD1 3.74Å; W417-I456 HydrophobicContact CZ3-CD1 3.58Å; Q418-I456 HydrophobicContact CG-CD1 4.34Å; V421-I456 HydrophobicContact CG1-CG2 3.79Å; V421-I456 HydrophobicContact CG2-CG2 4.26Å; K452-I456 WeakPolarHBondContact O-CG1 3.46Å; K452-I456 PolarHBondContact O-N 3.22Å; K452-I456 VanDerWaalsContact O-N 3.16Å; V453-I456 WeakPolarHBondContact O-CB 3.46Å; V453-I456 PolarHBondContact O-N 3.45Å; L454-I456 VanDerWaalsContact C-N 3.28Å; L454-I456 PolarHBondContact O-N 2.87Å; I456-R460 PolarHBondContact O-N 3.3Å; I456-R460 PolarHBondContact O-NH1 2.68Å
457	C	90.8	Very high	89.3	Confident	0 Å²	0	69.7 Å²	69.7	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-67.4	-38.5	177.3	-64.4	0	0	0	0	112.7	V453 L454 R455 R460 Q461 M462 V466	V453-C457 PolarHBondContact O-N 3.43Å; V453-C457 PolarHBondContact O-SG 2.84Å; L454-C457 PolarHBondContact O-N 2.75Å; L454-C457 VanDerWaalsContact O-N 3.13Å; R455-C457 VanDerWaalsContact C-N 3.34Å; R455-C457 PolarHBondContact O-N 2.91Å; C457-R460 CarbonylContact O-C 3.53Å; C457-R460 PolarHBondContact O-N 2.94Å; C457-Q461 PolarHBondContact O-N 3.21Å; C457-Q461 VanDerWaalsContact O-N 3.08Å; C457-M462 HydrophobicContact CB-CB 4.04Å; C457-M462 PolarHBondContact O-N 3.06Å; C457-V466 HydrophobicContact CB-CG2 3.57Å
458	E	89.4	Confident	89.6	Confident	117 Å²	117	67.1 Å²	67.1	55%	0.547	31%	0.306	S	S	.	.	H	α-helix	trans	-66.4	-44.7	178.1	-75.5	174.6	174.2	0	0	111.5	L454 R455 R460 Q461 V466	L454-E458 WeakPolarHBondContact O-CB 3.39Å; L454-E458 WeakPolarHBondContact O-CG 3.44Å; L454-E458 PolarHBondContact O-N 3.44Å; R455-E458 PolarHBondContact O-N 2.86Å; E458-R460 PolarHBondContact O-N 3.39Å; E458-Q461 PolarHBondContact O-N 3.48Å; E458-Q461 VanDerWaalsContact O-N 3.14Å; E458-V466 HydrophobicContact CG-CG2 3.97Å
459	E	91	Very high	89.7	Confident	111 Å²	111	57.1 Å²	57.1	52%	0.519	27%	0.268	S	S	.	.	H	α-helix	trans	-58.2	-30.5	175.1	-74.2	170.2	-177.9	0	0	111.8	R455	R455-E459 HydrophobicContact CG-CG 4.43Å; R455-E459 WeakPolarHBondContact CG-OE1 3.47Å; R455-E459 IonicContact CZ-OE1 3.89Å; R455-E459 IonicContact NE-OE1 3.22Å; R455-E459 PolarHBondContact NE-OE1 3.1Å; R455-E459 IonicContact NH2-OE1 3.75Å; R455-E459 PolarHBondContact NH2-OE1 3.19Å; R455-E459 WeakPolarHBondContact O-CB 3.02Å; R455-E459 VanDerWaalsContact O-CG 3.3Å; R455-E459 WeakPolarHBondContact O-CG 3.49Å; R455-E459 PolarHBondContact O-N 2.7Å
460	R	88.9	Confident	89.9	Confident	53 Å²	53	55.7 Å²	55.7	20%	0.2	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.3	8.4	-179.6	-69	168.5	-174.8	68.3	-1.4	114.6	D422 D425 I456 C457 E458 M462	D422-R460 IonicContact OD1-NH2 2.99Å; D422-R460 PolarHBondContact OD1-NH2 3.45Å; D425-R460 VanDerWaalsContact CG-NE 3.29Å; D425-R460 WeakPolarHBondContact OD1-CD 3.29Å; D425-R460 IonicContact OD1-CZ 3.7Å; D425-R460 IonicContact OD1-NE 3.3Å; D425-R460 PolarHBondContact OD1-NE 2.88Å; D425-R460 IonicContact OD2-CZ 2.87Å; D425-R460 IonicContact OD2-NE 3.95Å; D425-R460 PolarHBondContact OD2-NE 3.35Å; D425-R460 IonicContact OD2-NH2 2.75Å; D425-R460 PolarHBondContact OD2-NH2 3.05Å; I456-R460 PolarHBondContact O-N 3.3Å; I456-R460 PolarHBondContact O-NH1 2.68Å; C457-R460 CarbonylContact O-C 3.53Å; C457-R460 PolarHBondContact O-N 2.94Å; E458-R460 PolarHBondContact O-N 3.39Å; R460-M462 VanDerWaalsContact C-N 3.25Å; R460-M462 HydrophobicContact CB-CG 4.11Å; R460-M462 HydrophobicContact CB-SD 3.97Å; R460-M462 PolarHBondContact O-N 3.14Å
461	Q	89.9	Confident	90	Very high	155 Å²	155	59.4 Å²	59.4	72%	0.724	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.5	28.9	179	-53.7	179.2	0.3	0	0	114.9	C457 E458 S463	C457-Q461 PolarHBondContact O-N 3.21Å; C457-Q461 VanDerWaalsContact O-N 3.08Å; E458-Q461 PolarHBondContact O-N 3.48Å; E458-Q461 VanDerWaalsContact O-N 3.14Å; Q461-S463 VanDerWaalsContact C-N 3.31Å; Q461-S463 PolarHBondContact O-N 3.2Å
462	M	88.9	Confident	90	Very high	4 Å²	4	59.7 Å²	59.7	2%	0.02	28%	0.279	C	S	.	.			trans	-82.3	69.3	179.5	-66	166.7	79.2	0	0	111.4	L435 E436 I439 C457 R460 E464 Q465 V466	L435-M462 HydrophobicContact CD2-CE 4.38Å; L435-M462 HydrophobicContact CD2-SD 4.13Å; L435-M462 HydrophobicContact CG-CE 4.03Å; L435-M462 HydrophobicContact CG-SD 4.42Å; E436-M462 HydrophobicContact CB-CE 4.06Å; E436-M462 HydrophobicContact CG-CE 3.39Å; E436-M462 HydrophobicContact CG-CG 4.42Å; I439-M462 HydrophobicContact CG2-CE 3.92Å; C457-M462 HydrophobicContact CB-CB 4.04Å; C457-M462 PolarHBondContact O-N 3.06Å; R460-M462 VanDerWaalsContact C-N 3.25Å; R460-M462 HydrophobicContact CB-CG 4.11Å; R460-M462 HydrophobicContact CB-SD 3.97Å; R460-M462 PolarHBondContact O-N 3.14Å; M462-E464 VanDerWaalsContact C-N 3.34Å; M462-E464 PolarHBondContact O-N 3.28Å; M462-Q465 HydrophobicContact CB-CB 4.3Å; M462-Q465 HydrophobicContact CE-CG 4.08Å; M462-Q465 PolarHBondContact O-N 2.85Å; M462-V466 WeakPolarHBondContact O-CG2 3.3Å; M462-V466 PolarHBondContact O-N 3.47Å
463	S	89.4	Confident	90	Very high	78 Å²	78	55 Å²	55	55%	0.545	26%	0.259	S	S	.	.	H	α-helix	trans	-64.5	-33.6	-169.4	-63.5	0	0	0	0	114.2	Q461 R467	Q461-S463 VanDerWaalsContact C-N 3.31Å; Q461-S463 PolarHBondContact O-N 3.2Å; S463-R467 PolarHBondContact O-N 3.12Å; S463-R467 VanDerWaalsContact O-N 3.12Å
464	E	89.7	Confident	90	Very high	111 Å²	111	55 Å²	55	52%	0.519	26%	0.259	S	S	.	.	H	α-helix	trans	-70.9	-42.7	-180	-65.6	-56.3	117.5	0	0	111.2	M462 R467 S468	M462-E464 VanDerWaalsContact C-N 3.34Å; M462-E464 PolarHBondContact O-N 3.28Å; E464-R467 WeakPolarHBondContact O-CB 3.48Å; E464-R467 PolarHBondContact O-N 2.89Å; E464-R467 IonicContact OE1-CZ 3.01Å; E464-R467 VanDerWaalsContact OE1-CZ 3.26Å; E464-R467 IonicContact OE1-NH1 2.7Å; E464-R467 PolarHBondContact OE1-NH1 2.87Å; E464-R467 IonicContact OE1-NH2 3.72Å; E464-R467 PolarHBondContact OE1-NH2 3Å; E464-R467 IonicContact OE2-CZ 3.67Å; E464-R467 IonicContact OE2-NH1 3.79Å; E464-R467 PolarHBondContact OE2-NH1 3.04Å; E464-S468 WeakPolarHBondContact O-CB 3.48Å; E464-S468 PolarHBondContact O-N 3.36Å
465	Q	91	Very high	89.9	Confident	21 Å²	21	59.2 Å²	59.2	10%	0.098	28%	0.28	C	S	.	.	H	α-helix	trans	-66.9	-40.3	177	-65.7	74.6	14.1	0	0	110.8	I439 E440 M462 R467 S468 I469	I439-Q465 HydrophobicContact CG2-CB 4.09Å; I439-Q465 HydrophobicContact CG2-CG 3.83Å; E440-Q465 HydrophobicContact CG-CG 4.32Å; M462-Q465 HydrophobicContact CB-CB 4.3Å; M462-Q465 HydrophobicContact CE-CG 4.08Å; M462-Q465 PolarHBondContact O-N 2.85Å; Q465-R467 VanDerWaalsContact C-N 3.3Å; Q465-R467 PolarHBondContact O-N 3.42Å; Q465-S468 WeakPolarHBondContact O-CB 3.49Å; Q465-S468 PolarHBondContact O-N 3.46Å; Q465-I469 WeakPolarHBondContact O-CB 3.39Å; Q465-I469 WeakPolarHBondContact O-CD1 3.38Å; Q465-I469 WeakPolarHBondContact O-CG1 3.35Å; Q465-I469 PolarHBondContact O-N 2.78Å
466	V	90.1	Very high	89.8	Confident	21 Å²	21	56.6 Å²	56.6	13%	0.127	27%	0.27	C	S	.	.	H	α-helix	trans	-55.3	-47.2	171.7	166	0	0	0	0	110.7	L454 C457 E458 M462 C470	L454-V466 HydrophobicContact CD2-CB 4.18Å; L454-V466 HydrophobicContact CD2-CG1 3.89Å; L454-V466 HydrophobicContact CD2-CG2 4.14Å; C457-V466 HydrophobicContact CB-CG2 3.57Å; E458-V466 HydrophobicContact CG-CG2 3.97Å; M462-V466 WeakPolarHBondContact O-CG2 3.3Å; M462-V466 PolarHBondContact O-N 3.47Å; V466-C470 WeakPolarHBondContact O-CB 3.25Å; V466-C470 PolarHBondContact O-N 3.34Å; V466-C470 PolarHBondContact O-SG 3.36Å
467	R	89.9	Confident	89.8	Confident	88 Å²	88	56 Å²	56	33%	0.332	27%	0.269	S	S	.	.	H	α-helix	trans	-62.5	-46.8	177.9	-170.1	-178.7	-51.5	121.6	11.1	111.6	S463 E464 Q465 C470 K471 A493	S463-R467 PolarHBondContact O-N 3.12Å; S463-R467 VanDerWaalsContact O-N 3.12Å; E464-R467 WeakPolarHBondContact O-CB 3.48Å; E464-R467 PolarHBondContact O-N 2.89Å; E464-R467 IonicContact OE1-CZ 3.01Å; E464-R467 VanDerWaalsContact OE1-CZ 3.26Å; E464-R467 IonicContact OE1-NH1 2.7Å; E464-R467 PolarHBondContact OE1-NH1 2.87Å; E464-R467 IonicContact OE1-NH2 3.72Å; E464-R467 PolarHBondContact OE1-NH2 3Å; E464-R467 IonicContact OE2-CZ 3.67Å; E464-R467 IonicContact OE2-NH1 3.79Å; E464-R467 PolarHBondContact OE2-NH1 3.04Å; Q465-R467 VanDerWaalsContact C-N 3.3Å; Q465-R467 PolarHBondContact O-N 3.42Å; R467-C470 PolarHBondContact O-N 3.19Å; R467-K471 WeakPolarHBondContact O-CG 3.43Å; R467-K471 PolarHBondContact O-N 3.37Å; R467-A493 HydrophobicContact CG-CB 4.44Å; R467-A493 WeakPolarHBondContact CG-O 3.24Å
468	S	90.4	Very high	89.6	Confident	36 Å²	36	57.5 Å²	57.5	25%	0.252	28%	0.277	S	S	.	.	H	α-helix	trans	-57.2	-52.3	178.3	-174.2	0	0	0	0	111.6	E440 E464 Q465 C470 K471 I472	E440-S468 WeakPolarHBondContact OE1-CB 3.47Å; E440-S468 PolarHBondContact OE1-OG 2.98Å; E464-S468 WeakPolarHBondContact O-CB 3.48Å; E464-S468 PolarHBondContact O-N 3.36Å; Q465-S468 WeakPolarHBondContact O-CB 3.49Å; Q465-S468 PolarHBondContact O-N 3.46Å; S468-C470 PolarHBondContact O-N 3.32Å; S468-K471 PolarHBondContact O-N 3.36Å; S468-I472 WeakPolarHBondContact O-CG1 3.48Å; S468-I472 PolarHBondContact O-N 3.29Å
469	I	90	Very high	89.5	Confident	2 Å²	2	62.3 Å²	62.3	1%	0.01	29%	0.29	C	S	.	.	H	α-helix	trans	-59.2	-45.9	178.2	-68.4	161.1	0	0	0	111.2	L444 V453 L454 Q465 K471 I472 M473	L444-I469 HydrophobicContact CD1-CG2 3.91Å; V453-I469 HydrophobicContact CG1-CD1 3.57Å; L454-I469 HydrophobicContact CD2-CB 4.14Å; L454-I469 HydrophobicContact CD2-CG2 3.89Å; L454-I469 HydrophobicContact CG-CG2 4.11Å; Q465-I469 WeakPolarHBondContact O-CB 3.39Å; Q465-I469 WeakPolarHBondContact O-CD1 3.38Å; Q465-I469 WeakPolarHBondContact O-CG1 3.35Å; Q465-I469 PolarHBondContact O-N 2.78Å; I469-K471 VanDerWaalsContact C-N 3.33Å; I469-K471 PolarHBondContact O-N 3.49Å; I469-I472 PolarHBondContact O-N 3.47Å; I469-M473 WeakPolarHBondContact O-CG 3.4Å; I469-M473 PolarHBondContact O-N 3.33Å
470	C	90.9	Very high	89.4	Confident	0 Å²	0	61 Å²	61	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-62.7	-40	179	-69.7	0	0	0	0	111.9	V466 R467 S468 M473 A474 W489 A493	V466-C470 WeakPolarHBondContact O-CB 3.25Å; V466-C470 PolarHBondContact O-N 3.34Å; V466-C470 PolarHBondContact O-SG 3.36Å; R467-C470 PolarHBondContact O-N 3.19Å; S468-C470 PolarHBondContact O-N 3.32Å; C470-M473 PolarHBondContact O-N 2.97Å; C470-A474 VanDerWaalsContact O-CB 3.25Å; C470-A474 WeakPolarHBondContact O-CB 3.14Å; C470-A474 PolarHBondContact O-N 2.95Å; C470-W489 HydrophobicContact CB-CE3 4.41Å; C470-A493 HydrophobicContact CB-CB 3.56Å
471	K	89.8	Confident	89.2	Confident	79 Å²	79	63.1 Å²	63.1	34%	0.343	30%	0.302	S	S	.	.	H	α-helix	trans	-63.5	-43.4	176	-73.5	-177.1	-174.5	-142.3	0	112.5	R467 S468 I469 A474 M475 A493 D495	R467-K471 WeakPolarHBondContact O-CG 3.43Å; R467-K471 PolarHBondContact O-N 3.37Å; S468-K471 PolarHBondContact O-N 3.36Å; I469-K471 VanDerWaalsContact C-N 3.33Å; I469-K471 PolarHBondContact O-N 3.49Å; K471-A474 PolarHBondContact O-N 2.98Å; K471-M475 PolarHBondContact O-N 3.23Å; K471-A493 HydrophobicContact CG-CB 4.09Å; K471-D495 WeakPolarHBondContact CE-OD2 3.16Å; K471-D495 IonicContact NZ-OD2 3.58Å; K471-D495 PolarHBondContact NZ-OD2 2.86Å
472	I	89.2	Confident	88.9	Confident	75 Å²	75	62.6 Å²	62.6	39%	0.385	29%	0.293	S	S	.	.	H	α-helix	trans	-60.7	-47	177.2	-65.6	166.1	0	0	0	110.3	L444 S468 I469 M475 R476	L444-I472 HydrophobicContact CD1-CG2 4.33Å; S468-I472 WeakPolarHBondContact O-CG1 3.48Å; S468-I472 PolarHBondContact O-N 3.29Å; I469-I472 PolarHBondContact O-N 3.47Å; I472-M475 PolarHBondContact O-N 3.16Å; I472-R476 WeakPolarHBondContact O-CB 3.48Å; I472-R476 PolarHBondContact O-N 3.47Å
473	M	90.3	Very high	88.7	Confident	14 Å²	14	62.6 Å²	62.6	7%	0.069	29%	0.293	C	S	.	.	H	α-helix	trans	-65.2	-39.9	178.3	-70.5	-60.2	-66.3	0	0	112.4	L444 A450 I469 C470 R476 A477 W489	L444-M473 HydrophobicContact CB-SD 3.92Å; L444-M473 HydrophobicContact CD1-CG 4.24Å; L444-M473 HydrophobicContact CD1-SD 4.21Å; A450-M473 HydrophobicContact CB-CE 3.7Å; A450-M473 HydrophobicContact CB-CG 3.86Å; A450-M473 HydrophobicContact CB-SD 3.73Å; I469-M473 WeakPolarHBondContact O-CG 3.4Å; I469-M473 PolarHBondContact O-N 3.33Å; C470-M473 PolarHBondContact O-N 2.97Å; M473-R476 PolarHBondContact O-N 3.45Å; M473-A477 WeakPolarHBondContact O-CB 3.44Å; M473-A477 PolarHBondContact O-N 3.45Å; M473-W489 HydrophobicContact CB-CB 4.45Å; M473-W489 HydrophobicContact CB-CD2 3.72Å; M473-W489 HydrophobicContact CB-CE3 3.8Å; M473-W489 HydrophobicContact CB-CG 3.96Å; M473-W489 HydrophobicContact CB-CZ3 4.28Å; M473-W489 HydrophobicContact CE-CZ2 4.43Å; M473-W489 HydrophobicContact CG-CD2 4.5Å; M473-W489 HydrophobicContact CG-CE3 4.31Å; M473-W489 HydrophobicContact CG-CZ3 4.29Å
474	A	89.8	Confident	88.5	Confident	0 Å²	0	59 Å²	59	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-63.6	-45.1	177	0	0	0	0	0	111.5	C470 K471 R476 A477 L478 W489 F498	C470-A474 VanDerWaalsContact O-CB 3.25Å; C470-A474 WeakPolarHBondContact O-CB 3.14Å; C470-A474 PolarHBondContact O-N 2.95Å; K471-A474 PolarHBondContact O-N 2.98Å; A474-R476 PolarHBondContact O-N 3.4Å; A474-A477 PolarHBondContact O-N 3.18Å; A474-L478 WeakPolarHBondContact O-CB 3.28Å; A474-L478 PolarHBondContact O-N 2.93Å; A474-W489 HydrophobicContact CB-CB 3.68Å; A474-F498 HydrophobicContact CB-CD1 3.9Å; A474-F498 HydrophobicContact CB-CE1 3.47Å; A474-F498 VanDerWaalsContact CB-CE1 3.47Å
475	M	88.8	Confident	88.3	Confident	94 Å²	94	55.1 Å²	55.1	46%	0.463	25%	0.253	S	S	.	.	H	α-helix	trans	-62.3	-40.6	174.1	-81.5	-159.9	-80.3	0	0	112.7	K471 I472 L478 R479 F498	K471-M475 PolarHBondContact O-N 3.23Å; I472-M475 PolarHBondContact O-N 3.16Å; M475-L478 PolarHBondContact O-N 3.4Å; M475-R479 WeakPolarHBondContact O-CG 3.19Å; M475-R479 PolarHBondContact O-N 3.36Å; M475-F498 HydrophobicContact CG-CE2 4.06Å; M475-F498 HydrophobicContact CG-CZ 3.78Å
476	R	88.9	Confident	88.2	Confident	107 Å²	107	54.1 Å²	54.1	40%	0.404	25%	0.249	S	C	.	.	H	α-helix	trans	-64.1	-44.2	176.8	-175.6	178.4	-179.6	155.6	4.8	111.8	L444 D445 I472 M473 A474 L478 R479 N480	L444-R476 PolarHBondContact O-NH1 2.98Å; D445-R476 PolarHBondContact O-NH2 3.48Å; I472-R476 WeakPolarHBondContact O-CB 3.48Å; I472-R476 PolarHBondContact O-N 3.47Å; M473-R476 PolarHBondContact O-N 3.45Å; A474-R476 PolarHBondContact O-N 3.4Å; R476-L478 VanDerWaalsContact C-N 3.32Å; R476-R479 PolarHBondContact O-N 3.46Å; R476-N480 PolarHBondContact O-N 3.07Å; R476-N480 VanDerWaalsContact O-N 3.08Å; R476-N480 PolarHBondContact O-ND2 3.5Å
477	A	88.3	Confident	88	Confident	11 Å²	11	53.3 Å²	53.3	9%	0.091	24%	0.243	C	C	.	.	H	α-helix	trans	-62.7	-40.4	176.4	0	0	0	0	0	111.7	M473 A474 N480 N481 R482 A486	M473-A477 WeakPolarHBondContact O-CB 3.44Å; M473-A477 PolarHBondContact O-N 3.45Å; A474-A477 PolarHBondContact O-N 3.18Å; A477-N480 CarbonylContact O-C 3.49Å; A477-N480 PolarHBondContact O-N 3.2Å; A477-N481 PolarHBondContact O-N 3.43Å; A477-R482 PolarHBondContact O-N 2.94Å; A477-A486 HydrophobicContact CB-CB 3.79Å
478	L	87.3	Confident	87.9	Confident	31 Å²	31	51 Å²	51	16%	0.162	24%	0.241	C	C	.	.	H	α-helix	trans	-61.7	-45.8	175.1	-176.8	64.3	0	0	0	111.8	A474 M475 R476 N480 N481 L483 A486 F498 L501	A474-L478 WeakPolarHBondContact O-CB 3.28Å; A474-L478 PolarHBondContact O-N 2.93Å; M475-L478 PolarHBondContact O-N 3.4Å; R476-L478 VanDerWaalsContact C-N 3.32Å; L478-N480 VanDerWaalsContact C-N 3.25Å; L478-N480 PolarHBondContact O-N 2.83Å; L478-N481 PolarHBondContact O-N 3.06Å; L478-L483 HydrophobicContact CD1-CD2 3.79Å; L478-A486 HydrophobicContact CB-CB 4.2Å; L478-F498 HydrophobicContact CB-CZ 4.39Å; L478-F498 HydrophobicContact CD2-CE2 4.03Å; L478-F498 HydrophobicContact CD2-CZ 3.66Å; L478-L501 HydrophobicContact CD2-CD2 4.37Å
479	R	87.9	Confident	87.9	Confident	217 Å²	217	49.4 Å²	49.4	82%	0.819	23%	0.229	S	C	*	.	H	α-helix	trans	-61.4	-33.3	175.9	-74.2	179.5	-179.9	-175.2	0.9	113	M475 R476 N481	M475-R479 WeakPolarHBondContact O-CG 3.19Å; M475-R479 PolarHBondContact O-N 3.36Å; R476-R479 PolarHBondContact O-N 3.46Å; R479-N481 PolarHBondContact O-N 3.33Å
480	N	87.4	Confident	87.8	Confident	83 Å²	83	49.4 Å²	49.4	44%	0.444	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.4	9.3	176.3	-68.1	-21.6	0	0	0	113.4	R476 A477 L478 R482	R476-N480 PolarHBondContact O-N 3.07Å; R476-N480 VanDerWaalsContact O-N 3.08Å; R476-N480 PolarHBondContact O-ND2 3.5Å; A477-N480 CarbonylContact O-C 3.49Å; A477-N480 PolarHBondContact O-N 3.2Å; L478-N480 VanDerWaalsContact C-N 3.25Å; L478-N480 PolarHBondContact O-N 2.83Å; N480-R482 HydrophobicContact CB-CG 4.44Å; N480-R482 PolarHBondContact O-N 3.33Å
481	N	84.4	Confident	87.7	Confident	99 Å²	99	50.9 Å²	50.9	53%	0.529	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.1	26.4	-179.3	-130.8	17.7	0	0	0	114.5	A477 L478 R479	A477-N481 PolarHBondContact O-N 3.43Å; L478-N481 PolarHBondContact O-N 3.06Å; R479-N481 PolarHBondContact O-N 3.33Å
482	R	85	Confident	87.5	Confident	144 Å²	144	53.2 Å²	53.2	54%	0.543	24%	0.243	S	C	.	.			trans	-98.9	81.8	174.8	-58.9	-174.6	-151.2	166.5	3.6	109.5	A477 N480 A486	A477-R482 PolarHBondContact O-N 2.94Å; N480-R482 HydrophobicContact CB-CG 4.44Å; N480-R482 PolarHBondContact O-N 3.33Å; R482-A486 WeakPolarHBondContact O-CB 3.34Å; R482-A486 PolarHBondContact O-N 2.79Å
483	L	84.9	Confident	87.4	Confident	4 Å²	4	49.7 Å²	49.7	2%	0.021	23%	0.226	C	C	.	.	H	α-helix	trans	-64.9	-40	-172.9	-61.2	176	0	0	0	112.5	L478 A486 L487 R505 F506	L478-L483 HydrophobicContact CD1-CD2 3.79Å; L483-A486 PolarHBondContact O-N 3.03Å; L483-L487 WeakPolarHBondContact O-CB 3.32Å; L483-L487 PolarHBondContact O-N 2.93Å; L483-R505 HydrophobicContact CD1-CG 4.34Å; L483-R505 HydrophobicContact CD2-CB 4.35Å; L483-R505 HydrophobicContact CD2-CG 3.97Å; L483-F506 VanDerWaalsContact C-CZ 3.47Å; L483-F506 HydrophobicContact CB-CD1 4.2Å; L483-F506 HydrophobicContact CB-CD2 4.24Å; L483-F506 HydrophobicContact CB-CE1 3.59Å; L483-F506 HydrophobicContact CB-CE2 3.63Å; L483-F506 HydrophobicContact CB-CZ 3.29Å; L483-F506 HydrophobicContact CD1-CD1 4Å; L483-F506 HydrophobicContact CD1-CE1 4.13Å; L483-F506 HydrophobicContact CD1-CG 4.31Å
484	G	84.1	Confident	87.2	Confident	1 Å²	1	57.1 Å²	57.1	1%	0.01	26%	0.258	C	S	.	.	H	α-helix	trans	-62.4	-46.7	179	0	0	0	0	0	112.7	L487 S488 D518	G484-L487 PolarHBondContact O-N 3.11Å; G484-S488 PolarHBondContact O-N 3.37Å; G484-S488 VanDerWaalsContact O-N 3.07Å; G484-D518 PolarHBondContact N-OD2 2.82Å
485	S	86.2	Confident	87	Confident	31 Å²	31	58.5 Å²	58.5	22%	0.217	27%	0.265	C	S	.	.	H	α-helix	trans	-61.5	-46	173.7	-55.9	0	0	0	0	111.3	L487 S488 W489	S485-L487 VanDerWaalsContact C-N 3.27Å; S485-L487 PolarHBondContact O-N 3.43Å; S485-S488 PolarHBondContact O-N 3.26Å; S485-W489 PolarHBondContact O-N 3.4Å
486	A	88.3	Confident	86.9	Confident	0 Å²	0	56 Å²	56	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-57.4	-41.6	179	0	0	0	0	0	112	A477 L478 R482 L483 W489 S490 I502	A477-A486 HydrophobicContact CB-CB 3.79Å; L478-A486 HydrophobicContact CB-CB 4.2Å; R482-A486 WeakPolarHBondContact O-CB 3.34Å; R482-A486 PolarHBondContact O-N 2.79Å; L483-A486 PolarHBondContact O-N 3.03Å; A486-W489 PolarHBondContact O-N 2.81Å; A486-S490 WeakPolarHBondContact O-CB 3.46Å; A486-S490 PolarHBondContact O-N 3.04Å; A486-I502 HydrophobicContact CB-CD1 3.9Å; A486-I502 HydrophobicContact CB-CG1 4.43Å; A486-I502 WeakPolarHBondContact O-CD1 3.21Å
487	L	87	Confident	86.9	Confident	3 Å²	3	54.3 Å²	54.3	2%	0.016	27%	0.269	C	S	.	.	H	α-helix	trans	-64.6	-46.5	177.6	-177.4	60	0	0	0	111.7	L483 G484 S485 W489 S490 I491 I502 F506 L525 L535	L483-L487 WeakPolarHBondContact O-CB 3.32Å; L483-L487 PolarHBondContact O-N 2.93Å; G484-L487 PolarHBondContact O-N 3.11Å; S485-L487 VanDerWaalsContact C-N 3.27Å; S485-L487 PolarHBondContact O-N 3.43Å; L487-W489 VanDerWaalsContact C-N 3.33Å; L487-W489 PolarHBondContact O-N 3.44Å; L487-S490 WeakPolarHBondContact O-CB 3.46Å; L487-S490 PolarHBondContact O-N 3.38Å; L487-S490 VanDerWaalsContact O-N 3.16Å; L487-I491 HydrophobicContact CD1-CD1 4.13Å; L487-I491 HydrophobicContact CD1-CG1 4.39Å; L487-I491 HydrophobicContact CG-CD1 3.92Å; L487-I491 WeakPolarHBondContact O-CD1 3.49Å; L487-I491 WeakPolarHBondContact O-CG1 3.33Å; L487-I491 PolarHBondContact O-N 3.12Å; L487-I502 HydrophobicContact CB-CG2 3.98Å; L487-I502 HydrophobicContact CD1-CG2 4.36Å; L487-F506 HydrophobicContact CB-CE2 4.27Å; L487-F506 HydrophobicContact CD2-CE2 4Å; L487-L525 HydrophobicContact CD2-CD1 4.13Å; L487-L535 HydrophobicContact CD1-CD1 3.85Å; L487-L535 HydrophobicContact CD1-CD2 4.15Å; L487-L535 HydrophobicContact CD2-CD1 3.87Å; L487-L535 HydrophobicContact CG-CD1 4.43Å
488	S	87.3	Confident	86.8	Confident	39 Å²	39	55.3 Å²	55.3	27%	0.273	27%	0.271	S	S	.	.	H	α-helix	trans	-57	-45.3	176.8	-177.4	0	0	0	0	112	G484 S485 I491 R492	G484-S488 PolarHBondContact O-N 3.37Å; G484-S488 VanDerWaalsContact O-N 3.07Å; S485-S488 PolarHBondContact O-N 3.26Å; S488-I491 PolarHBondContact O-N 3.36Å; S488-R492 WeakPolarHBondContact O-CG 3.34Å; S488-R492 PolarHBondContact O-N 3Å
489	W	89.6	Confident	86.8	Confident	4 Å²	4	53.9 Å²	53.9	2%	0.015	26%	0.263	C	S	.	.	H	α-helix	trans	-66.9	-37.6	176.5	-73	108.3	0	0	0	112.7	E447 A450 L451 L454 C470 M473 A474 S485 A486 L487 R492 A493	E447-W489 HydrophobicContact CG-CZ2 3.64Å; E447-W489 PolarHBondContact OE1-NE1 3.5Å; E447-W489 VanDerWaalsContact OE1-NE1 3.1Å; A450-W489 HydrophobicContact CB-CH2 4.09Å; L451-W489 HydrophobicContact CD2-CH2 3.65Å; L451-W489 HydrophobicContact CD2-CZ2 4.08Å; L451-W489 HydrophobicContact CG-CH2 4Å; L451-W489 HydrophobicContact CG-CZ2 4.26Å; L454-W489 HydrophobicContact CD1-CE3 4.37Å; L454-W489 HydrophobicContact CD1-CH2 3.89Å; L454-W489 HydrophobicContact CD1-CZ3 3.35Å; L454-W489 HydrophobicContact CG-CZ3 4.28Å; C470-W489 HydrophobicContact CB-CE3 4.41Å; M473-W489 HydrophobicContact CB-CB 4.45Å; M473-W489 HydrophobicContact CB-CD2 3.72Å; M473-W489 HydrophobicContact CB-CE3 3.8Å; M473-W489 HydrophobicContact CB-CG 3.96Å; M473-W489 HydrophobicContact CB-CZ3 4.28Å; M473-W489 HydrophobicContact CE-CZ2 4.43Å; M473-W489 HydrophobicContact CG-CD2 4.5Å; M473-W489 HydrophobicContact CG-CE3 4.31Å; M473-W489 HydrophobicContact CG-CZ3 4.29Å; A474-W489 HydrophobicContact CB-CB 3.68Å; S485-W489 PolarHBondContact O-N 3.4Å; A486-W489 PolarHBondContact O-N 2.81Å; L487-W489 VanDerWaalsContact C-N 3.33Å; L487-W489 PolarHBondContact O-N 3.44Å; W489-R492 PolarHBondContact O-N 3.17Å; W489-A493 PolarHBondContact O-N 3Å
490	S	88.9	Confident	86.7	Confident	1 Å²	1	45.2 Å²	45.2	1%	0.007	24%	0.235	C	C	.	.	H	α-helix	trans	-63.7	-41	175.6	-168.1	0	0	0	0	112.9	A486 L487 A493 K494 D495 A499	A486-S490 WeakPolarHBondContact O-CB 3.46Å; A486-S490 PolarHBondContact O-N 3.04Å; L487-S490 WeakPolarHBondContact O-CB 3.46Å; L487-S490 PolarHBondContact O-N 3.38Å; L487-S490 VanDerWaalsContact O-N 3.16Å; S490-A493 CarbonylContact O-C 2.92Å; S490-A493 WeakPolarHBondContact O-CB 3.44Å; S490-A493 PolarHBondContact O-N 3.18Å; S490-K494 PolarHBondContact O-N 3.29Å; S490-K494 VanDerWaalsContact O-N 3.13Å; S490-D495 PolarHBondContact O-N 3.47Å; S490-D495 PolarHBondContact OG-O 3.31Å; S490-A499 PolarHBondContact OG-N 3.34Å; S490-A499 VanDerWaalsContact OG-N 3.12Å
491	I	87.4	Confident	86.7	Confident	32 Å²	32	45.5 Å²	45.5	16%	0.164	24%	0.236	C	C	.	.	H	α-helix	trans	-63.8	-44	177.9	-72.3	162.3	0	0	0	111	L487 S488 A493 K494 L525 A528 L531 L535	L487-I491 HydrophobicContact CD1-CD1 4.13Å; L487-I491 HydrophobicContact CD1-CG1 4.39Å; L487-I491 HydrophobicContact CG-CD1 3.92Å; L487-I491 WeakPolarHBondContact O-CD1 3.49Å; L487-I491 WeakPolarHBondContact O-CG1 3.33Å; L487-I491 PolarHBondContact O-N 3.12Å; S488-I491 PolarHBondContact O-N 3.36Å; I491-A493 VanDerWaalsContact C-N 3.27Å; I491-A493 PolarHBondContact O-N 3.41Å; I491-K494 PolarHBondContact O-N 3.28Å; I491-L525 HydrophobicContact CD1-CD2 3.19Å; I491-A528 HydrophobicContact CD1-CB 4.26Å; I491-A528 HydrophobicContact CG2-CB 3.55Å; I491-L531 HydrophobicContact CB-CD2 4.4Å; I491-L531 HydrophobicContact CG1-CD2 4Å; I491-L535 HydrophobicContact CD1-CD2 4.27Å; I491-L535 HydrophobicContact CG1-CD2 4.37Å
492	R	85.7	Confident	86.8	Confident	127 Å²	127	40.8 Å²	40.8	48%	0.479	21%	0.211	S	C	.	.	H	α-helix	trans	-61.9	-36.6	174.8	-68.8	176.6	-176.5	-144.1	1	112	S488 W489 K494	S488-R492 WeakPolarHBondContact O-CG 3.34Å; S488-R492 PolarHBondContact O-N 3Å; W489-R492 PolarHBondContact O-N 3.17Å; R492-K494 PolarHBondContact O-N 3.04Å
493	A	87	Confident	86.8	Confident	2 Å²	2	34 Å²	34	2%	0.017	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-14	172.8	0	0	0	0	0	113.8	R467 C470 K471 W489 S490 I491 D495	R467-A493 HydrophobicContact CG-CB 4.44Å; R467-A493 WeakPolarHBondContact CG-O 3.24Å; C470-A493 HydrophobicContact CB-CB 3.56Å; K471-A493 HydrophobicContact CG-CB 4.09Å; W489-A493 PolarHBondContact O-N 3Å; S490-A493 CarbonylContact O-C 2.92Å; S490-A493 WeakPolarHBondContact O-CB 3.44Å; S490-A493 PolarHBondContact O-N 3.18Å; I491-A493 VanDerWaalsContact C-N 3.27Å; I491-A493 PolarHBondContact O-N 3.41Å; A493-D495 HydrophobicContact CB-CB 4.22Å; A493-D495 PolarHBondContact O-N 3.5Å
494	K	86.1	Confident	86.9	Confident	169 Å²	169	37.4 Å²	37.4	74%	0.735	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.6	34.6	-168.8	-56.2	-179.7	-180	178.3	0	112.5	S490 I491 R492 A496	S490-K494 PolarHBondContact O-N 3.29Å; S490-K494 VanDerWaalsContact O-N 3.13Å; I491-K494 PolarHBondContact O-N 3.28Å; R492-K494 PolarHBondContact O-N 3.04Å; K494-A496 PolarHBondContact O-N 3.39Å
495	D	86.8	Confident	86.9	Confident	29 Å²	29	42.7 Å²	42.7	16%	0.155	22%	0.22	C	C	.	.			trans	-92.6	95.3	179.3	-165.8	-33.9	0	0	0	110.6	K471 S490 A493 A497 F498 A499	K471-D495 WeakPolarHBondContact CE-OD2 3.16Å; K471-D495 IonicContact NZ-OD2 3.58Å; K471-D495 PolarHBondContact NZ-OD2 2.86Å; S490-D495 PolarHBondContact O-N 3.47Å; S490-D495 PolarHBondContact OG-O 3.31Å; A493-D495 HydrophobicContact CB-CB 4.22Å; A493-D495 PolarHBondContact O-N 3.5Å; D495-A497 VanDerWaalsContact C-N 3.32Å; D495-A497 PolarHBondContact O-N 3.21Å; D495-A497 PolarHBondContact OD1-N 3.3Å; D495-F498 HydrophobicContact CB-CB 4.01Å; D495-F498 PolarHBondContact O-N 2.89Å; D495-F498 PolarHBondContact OD1-N 3.43Å; D495-A499 WeakPolarHBondContact O-CB 3.47Å; D495-A499 PolarHBondContact O-N 2.72Å
496	A	87.4	Confident	86.8	Confident	43 Å²	43	41.3 Å²	41.3	36%	0.355	21%	0.21	S	C	.	.	H	α-helix	trans	-64.5	-34.6	-179	0	0	0	0	0	113.1	K494 T500 L531	K494-A496 PolarHBondContact O-N 3.39Å; A496-T500 WeakPolarHBondContact O-CB 3.44Å; A496-T500 PolarHBondContact O-N 3.22Å; A496-T500 PolarHBondContact O-OG1 2.96Å; A496-L531 HydrophobicContact CB-CG 4.43Å; A496-L531 VanDerWaalsContact CB-O 3.27Å; A496-L531 WeakPolarHBondContact CB-O 3.19Å
497	A	87.1	Confident	86.5	Confident	71 Å²	71	41.7 Å²	41.7	59%	0.587	21%	0.213	S	C	*	.	H	α-helix	trans	-69.4	-44.9	179.3	0	0	0	0	0	110.5	D495 T500 L501	D495-A497 VanDerWaalsContact C-N 3.32Å; D495-A497 PolarHBondContact O-N 3.21Å; D495-A497 PolarHBondContact OD1-N 3.3Å; A497-T500 WeakPolarHBondContact O-CB 3.36Å; A497-T500 PolarHBondContact O-N 3.33Å; A497-L501 PolarHBondContact O-N 3Å
498	F	86.4	Confident	86.4	Confident	32 Å²	32	47.4 Å²	47.4	14%	0.14	24%	0.239	C	C	.	.	H	α-helix	trans	-69.2	-37.3	177.9	-158.3	-112.2	0	0	0	112.2	A474 M475 L478 D495 T500 L501 I502	A474-F498 HydrophobicContact CB-CD1 3.9Å; A474-F498 HydrophobicContact CB-CE1 3.47Å; A474-F498 VanDerWaalsContact CB-CE1 3.47Å; M475-F498 HydrophobicContact CG-CE2 4.06Å; M475-F498 HydrophobicContact CG-CZ 3.78Å; L478-F498 HydrophobicContact CB-CZ 4.39Å; L478-F498 HydrophobicContact CD2-CE2 4.03Å; L478-F498 HydrophobicContact CD2-CZ 3.66Å; D495-F498 HydrophobicContact CB-CB 4.01Å; D495-F498 PolarHBondContact O-N 2.89Å; D495-F498 PolarHBondContact OD1-N 3.43Å; F498-T500 VanDerWaalsContact C-N 3.27Å; F498-T500 PolarHBondContact O-N 3.31Å; F498-L501 HydrophobicContact CD2-CD2 4.14Å; F498-L501 HydrophobicContact CE2-CD2 3.99Å; F498-L501 PolarHBondContact O-N 3.3Å; F498-I502 HydrophobicContact CD1-CD1 3.6Å; F498-I502 HydrophobicContact CD1-CG1 4.36Å; F498-I502 HydrophobicContact CE1-CD1 3.59Å; F498-I502 HydrophobicContact CE1-CG1 4.23Å; F498-I502 HydrophobicContact CG-CD1 4.47Å; F498-I502 HydrophobicContact CZ-CD1 4.47Å; F498-I502 WeakPolarHBondContact O-CG1 3.46Å; F498-I502 PolarHBondContact O-N 3.49Å
499	A	87.1	Confident	86.1	Confident	0 Å²	0	47 Å²	47	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-60.3	-37.1	171.4	0	0	0	0	0	112.3	S490 D495 S503 L531	S490-A499 PolarHBondContact OG-N 3.34Å; S490-A499 VanDerWaalsContact OG-N 3.12Å; D495-A499 WeakPolarHBondContact O-CB 3.47Å; D495-A499 PolarHBondContact O-N 2.72Å; A499-S503 WeakPolarHBondContact O-CB 3.35Å; A499-S503 PolarHBondContact O-N 2.96Å; A499-S503 PolarHBondContact O-OG 3.02Å; A499-L531 HydrophobicContact CB-CD2 3.91Å
500	T	86.9	Confident	85.7	Confident	36 Å²	36	47.5 Å²	47.5	22%	0.221	24%	0.236	C	C	.	.	H	α-helix	trans	-63.2	-49.2	174.6	-60.5	0	0	0	0	111.6	A496 A497 F498 I502 S503 E504 S532 R534	A496-T500 WeakPolarHBondContact O-CB 3.44Å; A496-T500 PolarHBondContact O-N 3.22Å; A496-T500 PolarHBondContact O-OG1 2.96Å; A497-T500 WeakPolarHBondContact O-CB 3.36Å; A497-T500 PolarHBondContact O-N 3.33Å; F498-T500 VanDerWaalsContact C-N 3.27Å; F498-T500 PolarHBondContact O-N 3.31Å; T500-I502 VanDerWaalsContact C-N 3.32Å; T500-I502 PolarHBondContact O-N 3.06Å; T500-S503 WeakPolarHBondContact O-CB 3Å; T500-S503 PolarHBondContact O-N 2.94Å; T500-S503 VanDerWaalsContact O-N 3.15Å; T500-E504 WeakPolarHBondContact O-CG 3.31Å; T500-E504 PolarHBondContact O-N 3.07Å; T500-S532 WeakPolarHBondContact OG1-CB 3.33Å; T500-S532 PolarHBondContact OG1-OG 3.15Å; T500-R534 HydrophobicContact CG2-CB 4.09Å; T500-R534 HydrophobicContact CG2-CG 3.72Å
501	L	87.4	Confident	85.2	Confident	89 Å²	89	50.1 Å²	50.1	47%	0.466	25%	0.254	S	S	.	.	H	α-helix	trans	-57.7	-43.9	177.7	-178.5	71.1	0	0	0	112.2	L478 A497 F498 E504 R505	L478-L501 HydrophobicContact CD2-CD2 4.37Å; A497-L501 PolarHBondContact O-N 3Å; F498-L501 HydrophobicContact CD2-CD2 4.14Å; F498-L501 HydrophobicContact CE2-CD2 3.99Å; F498-L501 PolarHBondContact O-N 3.3Å; L501-E504 PolarHBondContact O-N 3.3Å; L501-R505 PolarHBondContact O-N 3.47Å; L501-R505 VanDerWaalsContact O-N 3.11Å
502	I	86.1	Confident	84.7	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-66.9	-40.8	178.2	-63.8	162.5	0	0	0	110.6	A486 L487 F498 T500 E504 R505 F506	A486-I502 HydrophobicContact CB-CD1 3.9Å; A486-I502 HydrophobicContact CB-CG1 4.43Å; A486-I502 WeakPolarHBondContact O-CD1 3.21Å; L487-I502 HydrophobicContact CB-CG2 3.98Å; L487-I502 HydrophobicContact CD1-CG2 4.36Å; F498-I502 HydrophobicContact CD1-CD1 3.6Å; F498-I502 HydrophobicContact CD1-CG1 4.36Å; F498-I502 HydrophobicContact CE1-CD1 3.59Å; F498-I502 HydrophobicContact CE1-CG1 4.23Å; F498-I502 HydrophobicContact CG-CD1 4.47Å; F498-I502 HydrophobicContact CZ-CD1 4.47Å; F498-I502 WeakPolarHBondContact O-CG1 3.46Å; F498-I502 PolarHBondContact O-N 3.49Å; T500-I502 VanDerWaalsContact C-N 3.32Å; T500-I502 PolarHBondContact O-N 3.06Å; I502-E504 PolarHBondContact O-N 3.08Å; I502-R505 PolarHBondContact O-N 3.05Å; I502-F506 HydrophobicContact CG2-CD2 3.81Å; I502-F506 HydrophobicContact CG2-CE2 3.68Å; I502-F506 WeakPolarHBondContact O-CD2 3.33Å; I502-F506 PolarHBondContact O-N 3.36Å
503	S	86.1	Confident	84.3	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-62.4	-41.5	177.4	-57.6	0	0	0	0	111.8	A499 T500 R505 F506 L507	A499-S503 WeakPolarHBondContact O-CB 3.35Å; A499-S503 PolarHBondContact O-N 2.96Å; A499-S503 PolarHBondContact O-OG 3.02Å; T500-S503 WeakPolarHBondContact O-CB 3Å; T500-S503 PolarHBondContact O-N 2.94Å; T500-S503 VanDerWaalsContact O-N 3.15Å; S503-R505 VanDerWaalsContact C-N 3.3Å; S503-R505 PolarHBondContact O-N 2.92Å; S503-F506 WeakPolarHBondContact O-CB 3.22Å; S503-F506 PolarHBondContact O-N 2.97Å; S503-L507 WeakPolarHBondContact O-CG 3.43Å; S503-L507 PolarHBondContact O-N 3.46Å; S503-L507 VanDerWaalsContact O-N 3.08Å
504	E	85.7	Confident	83.4	Confident	77 Å²	77	54.9 Å²	54.9	36%	0.36	31%	0.305	S	S	.	.	H	α-helix	trans	-63	-38.3	174.6	-73	-179	170	0	0	111.9	T500 L501 I502 L507 Q508 R534	T500-E504 WeakPolarHBondContact O-CG 3.31Å; T500-E504 PolarHBondContact O-N 3.07Å; L501-E504 PolarHBondContact O-N 3.3Å; I502-E504 PolarHBondContact O-N 3.08Å; E504-L507 PolarHBondContact O-N 3.42Å; E504-Q508 WeakPolarHBondContact O-CG 3.34Å; E504-Q508 PolarHBondContact O-N 2.96Å; E504-R534 IonicContact OE1-NE 2.65Å
505	R	84.4	Confident	82.7	Confident	112 Å²	112	51.1 Å²	51.1	42%	0.423	30%	0.296	S	S	.	.	H	α-helix	trans	-67.6	-37.2	175.9	-165.3	142.1	176.8	151.6	-3.8	113	L483 L501 I502 S503 L507 Q508 D509	L483-R505 HydrophobicContact CD1-CG 4.34Å; L483-R505 HydrophobicContact CD2-CB 4.35Å; L483-R505 HydrophobicContact CD2-CG 3.97Å; L501-R505 PolarHBondContact O-N 3.47Å; L501-R505 VanDerWaalsContact O-N 3.11Å; I502-R505 PolarHBondContact O-N 3.05Å; S503-R505 VanDerWaalsContact C-N 3.3Å; S503-R505 PolarHBondContact O-N 2.92Å; R505-L507 VanDerWaalsContact C-N 3.32Å; R505-L507 PolarHBondContact O-N 3.43Å; R505-Q508 PolarHBondContact O-N 3.32Å; R505-D509 PolarHBondContact O-N 3.47Å
506	F	84.1	Confident	82	Confident	1 Å²	1	50.7 Å²	50.7	0%	0.004	29%	0.293	C	S	.	.	H	α-helix	trans	-60.5	-41.4	170.6	-88.1	-68.2	0	0	0	112.4	L483 L487 I502 S503 D509 Y510 S517 I522 L538	L483-F506 VanDerWaalsContact C-CZ 3.47Å; L483-F506 HydrophobicContact CB-CD1 4.2Å; L483-F506 HydrophobicContact CB-CD2 4.24Å; L483-F506 HydrophobicContact CB-CE1 3.59Å; L483-F506 HydrophobicContact CB-CE2 3.63Å; L483-F506 HydrophobicContact CB-CZ 3.29Å; L483-F506 HydrophobicContact CD1-CD1 4Å; L483-F506 HydrophobicContact CD1-CE1 4.13Å; L483-F506 HydrophobicContact CD1-CG 4.31Å; L487-F506 HydrophobicContact CB-CE2 4.27Å; L487-F506 HydrophobicContact CD2-CE2 4Å; I502-F506 HydrophobicContact CG2-CD2 3.81Å; I502-F506 HydrophobicContact CG2-CE2 3.68Å; I502-F506 WeakPolarHBondContact O-CD2 3.33Å; I502-F506 PolarHBondContact O-N 3.36Å; S503-F506 WeakPolarHBondContact O-CB 3.22Å; S503-F506 PolarHBondContact O-N 2.97Å; F506-D509 PolarHBondContact O-N 3.17Å; F506-Y510 WeakPolarHBondContact O-CB 3.26Å; F506-Y510 PolarHBondContact O-N 3.14Å; F506-S517 WeakPolarHBondContact CE1-O 3.2Å; F506-I522 HydrophobicContact CD1-CD1 4.22Å; F506-I522 HydrophobicContact CE1-CD1 4.04Å; F506-I522 HydrophobicContact CZ-CD1 4.29Å; F506-L538 HydrophobicContact CB-CD2 3.69Å; F506-L538 HydrophobicContact CD2-CD2 4.17Å; F506-L538 HydrophobicContact CG-CD2 4.13Å
507	L	83.1	Confident	80.9	Confident	9 Å²	9	50.7 Å²	50.7	5%	0.047	29%	0.291	C	S	.	.	H	α-helix	trans	-66.8	-41.1	177.2	-68	172.2	0	0	0	111.6	S503 E504 R505 Y510 C511 F537 L538 P571 F574	S503-L507 WeakPolarHBondContact O-CG 3.43Å; S503-L507 PolarHBondContact O-N 3.46Å; S503-L507 VanDerWaalsContact O-N 3.08Å; E504-L507 PolarHBondContact O-N 3.42Å; R505-L507 VanDerWaalsContact C-N 3.32Å; R505-L507 PolarHBondContact O-N 3.43Å; L507-Y510 PolarHBondContact O-N 3.27Å; L507-C511 PolarHBondContact O-N 3.42Å; L507-C511 PolarHBondContact O-SG 3.26Å; L507-F537 HydrophobicContact CD1-CD1 4.14Å; L507-F537 HydrophobicContact CD1-CE1 4.08Å; L507-F537 HydrophobicContact CD2-CD1 4.39Å; L507-F537 HydrophobicContact CD2-CE1 3.86Å; L507-L538 HydrophobicContact CD2-CD1 3.65Å; L507-L538 HydrophobicContact CG-CD1 4.22Å; L507-P571 HydrophobicContact CD1-CG 3.92Å; L507-F574 HydrophobicContact CB-CD2 4.03Å; L507-F574 HydrophobicContact CB-CE2 4.25Å; L507-F574 HydrophobicContact CD2-CD1 4.37Å; L507-F574 HydrophobicContact CD2-CD2 3.86Å; L507-F574 HydrophobicContact CD2-CE1 4.23Å; L507-F574 HydrophobicContact CD2-CE2 3.69Å; L507-F574 HydrophobicContact CD2-CG 4.21Å; L507-F574 HydrophobicContact CD2-CZ 3.9Å; L507-F574 HydrophobicContact CG-CD2 4.43Å
508	Q	83.4	Confident	79.9	Confident	122 Å²	122	51 Å²	51	57%	0.57	28%	0.283	S	S	*	.	H	α-helix	trans	-62	-45.7	174.7	-73.1	173.6	-1.6	0	0	112.1	E504 R505 Y510 C511 A512	E504-Q508 WeakPolarHBondContact O-CG 3.34Å; E504-Q508 PolarHBondContact O-N 2.96Å; R505-Q508 PolarHBondContact O-N 3.32Å; Q508-Y510 VanDerWaalsContact C-N 3.28Å; Q508-Y510 PolarHBondContact O-N 3.47Å; Q508-C511 PolarHBondContact O-N 2.94Å; Q508-A512 PolarHBondContact O-N 3.31Å
509	D	81.1	Confident	79.1	Confident	30 Å²	30	52.8 Å²	52.8	16%	0.16	29%	0.293	C	S	.	.	H	α-helix	trans	-61.3	-38	176.2	-98.2	49.1	0	0	0	111.7	R505 F506 A512 K513	R505-D509 PolarHBondContact O-N 3.47Å; F506-D509 PolarHBondContact O-N 3.17Å; D509-A512 PolarHBondContact O-N 3.19Å; D509-K513 WeakPolarHBondContact O-CB 3.42Å; D509-K513 PolarHBondContact O-N 3.29Å; D509-K513 IonicContact OD2-NZ 2.72Å; D509-K513 PolarHBondContact OD2-NZ 2.75Å
510	Y	81.6	Confident	78.4	Confident	15 Å²	15	58.7 Å²	58.7	6%	0.059	33%	0.325	C	S	.	.	H	α-helix	trans	-65.8	-44.2	173.7	-175.1	-88.4	0	0	0	112	F506 L507 Q508 A512 K513 G514 F516 Y542 H546 F574 T577 D581	F506-Y510 WeakPolarHBondContact O-CB 3.26Å; F506-Y510 PolarHBondContact O-N 3.14Å; L507-Y510 PolarHBondContact O-N 3.27Å; Q508-Y510 VanDerWaalsContact C-N 3.28Å; Q508-Y510 PolarHBondContact O-N 3.47Å; Y510-A512 PolarHBondContact O-N 3.01Å; Y510-K513 PolarHBondContact O-N 3.08Å; Y510-G514 VanDerWaalsContact O-CA 3.25Å; Y510-G514 WeakPolarHBondContact O-CA 3.37Å; Y510-G514 PolarHBondContact O-N 2.91Å; Y510-F516 AromaticContact CD2-CD1 3.97Å; Y510-F516 HydrophobicContact CD2-CD1 3.97Å; Y510-F516 AromaticContact CD2-CD2 3.64Å; Y510-F516 HydrophobicContact CD2-CD2 3.64Å; Y510-F516 AromaticContact CD2-CE1 3.78Å; Y510-F516 HydrophobicContact CD2-CE1 3.78Å; Y510-F516 AromaticContact CD2-CE2 3.46Å; Y510-F516 HydrophobicContact CD2-CE2 3.46Å; Y510-F516 VanDerWaalsContact CD2-CE2 3.46Å; Y510-F516 AromaticContact CD2-CG 3.9Å; Y510-F516 HydrophobicContact CD2-CG 3.9Å; Y510-F516 AromaticContact CD2-CZ 3.53Å; Y510-F516 HydrophobicContact CD2-CZ 3.53Å; Y510-F516 AromaticContact CE2-CD2 3.85Å; Y510-F516 HydrophobicContact CE2-CD2 3.85Å; Y510-F516 AromaticContact CE2-CE2 3.61Å; Y510-F516 HydrophobicContact CE2-CE2 3.61Å; Y510-F516 HydrophobicContact CE2-CZ 4.08Å; Y510-F516 HydrophobicContact CG-CD1 4.47Å; Y510-F516 AromaticContact CG-CE1 3.96Å; Y510-F516 HydrophobicContact CG-CE1 3.96Å; Y510-F516 HydrophobicContact CG-CE2 4.22Å; Y510-F516 AromaticContact CG-CZ 3.84Å; Y510-F516 HydrophobicContact CG-CZ 3.84Å; Y510-Y542 HydrophobicContact CD1-CE1 4.47Å; Y510-Y542 HydrophobicContact CE1-CE1 4.18Å; Y510-Y542 WeakPolarHBondContact CE1-OH 3.46Å; Y510-Y542 HydrophobicContact CE2-CE1 4.45Å; Y510-Y542 PolarHBondContact OH-OH 3.32Å; Y510-H546 PolarHBondContact OH-CE1 2.99Å; Y510-H546 VanDerWaalsContact OH-CE1 3.32Å; Y510-H546 PolarHBondContact OH-NE2 3.46Å; Y510-F574 AromaticContact CD1-CE2 3.74Å; Y510-F574 HydrophobicContact CD1-CE2 3.74Å; Y510-F574 AromaticContact CD1-CZ 3.66Å; Y510-F574 HydrophobicContact CD1-CZ 3.66Å; Y510-F574 HydrophobicContact CE1-CE2 4.46Å; Y510-F574 HydrophobicContact CE1-CZ 4Å; Y510-T577 HydrophobicContact CD1-CG2 3.87Å; Y510-T577 HydrophobicContact CE1-CG2 3.59Å; Y510-D581 PolarHBondContact OH-OD2 3.29Å
511	C	78.5	Confident	77.7	Confident	57 Å²	57	60.7 Å²	60.7	39%	0.385	33%	0.334	S	S	.	.	H	α-helix	trans	-58.8	-36.1	175.9	-69.6	0	0	0	0	112.5	L507 Q508 F574 T577	L507-C511 PolarHBondContact O-N 3.42Å; L507-C511 PolarHBondContact O-SG 3.26Å; Q508-C511 PolarHBondContact O-N 2.94Å; C511-F574 WeakPolarHBondContact SG-CD2 3.26Å; C511-T577 PolarHBondContact SG-OG1 3.45Å
512	A	77.8	Confident	77.3	Confident	85 Å²	85	56.5 Å²	56.5	70%	0.702	31%	0.312	S	S	*	.	H	α-helix	trans	-80.7	-40	-178.6	0	0	0	0	0	113.6	Q508 D509 Y510	Q508-A512 PolarHBondContact O-N 3.31Å; D509-A512 PolarHBondContact O-N 3.19Å; Y510-A512 PolarHBondContact O-N 3.01Å
513	K	75.9	Confident	76.7	Confident	129 Å²	129	60.3 Å²	60.3	56%	0.561	33%	0.332	S	S	*	.	H	α-helix	trans	-109.2	-14.2	-170.6	-61.9	172.5	-173.7	158.1	0	114.4	D509 Y510 T515	D509-K513 WeakPolarHBondContact O-CB 3.42Å; D509-K513 PolarHBondContact O-N 3.29Å; D509-K513 IonicContact OD2-NZ 2.72Å; D509-K513 PolarHBondContact OD2-NZ 2.75Å; Y510-K513 PolarHBondContact O-N 3.08Å; K513-T515 PolarHBondContact O-N 3.38Å
514	G	69.2	Low	76.3	Confident	46 Å²	46	66.7 Å²	66.7	47%	0.474	37%	0.366	S	S	.	.	S	Bend	trans	68.1	9.2	-175.2	0	0	0	0	0	115.1	Y510	Y510-G514 VanDerWaalsContact O-CA 3.25Å; Y510-G514 WeakPolarHBondContact O-CA 3.37Å; Y510-G514 PolarHBondContact O-N 2.91Å
515	T	71.5	Confident	75.9	Confident	90 Å²	90	64.2 Å²	64.2	55%	0.552	36%	0.355	S	S	*	.	S	Bend	trans	-138.7	146.6	-178.6	51	0	0	0	0	110.8	K513	K513-T515 PolarHBondContact O-N 3.38Å
516	F	71.1	Confident	75.7	Confident	20 Å²	20	60.6 Å²	60.6	9%	0.088	35%	0.353	C	S	.	.			trans	-83.7	139	173.8	-75.7	-65.6	0	0	0	111.1	Y510 L519 L538 Y542	Y510-F516 AromaticContact CD2-CD1 3.97Å; Y510-F516 HydrophobicContact CD2-CD1 3.97Å; Y510-F516 AromaticContact CD2-CD2 3.64Å; Y510-F516 HydrophobicContact CD2-CD2 3.64Å; Y510-F516 AromaticContact CD2-CE1 3.78Å; Y510-F516 HydrophobicContact CD2-CE1 3.78Å; Y510-F516 AromaticContact CD2-CE2 3.46Å; Y510-F516 HydrophobicContact CD2-CE2 3.46Å; Y510-F516 VanDerWaalsContact CD2-CE2 3.46Å; Y510-F516 AromaticContact CD2-CG 3.9Å; Y510-F516 HydrophobicContact CD2-CG 3.9Å; Y510-F516 AromaticContact CD2-CZ 3.53Å; Y510-F516 HydrophobicContact CD2-CZ 3.53Å; Y510-F516 AromaticContact CE2-CD2 3.85Å; Y510-F516 HydrophobicContact CE2-CD2 3.85Å; Y510-F516 AromaticContact CE2-CE2 3.61Å; Y510-F516 HydrophobicContact CE2-CE2 3.61Å; Y510-F516 HydrophobicContact CE2-CZ 4.08Å; Y510-F516 HydrophobicContact CG-CD1 4.47Å; Y510-F516 AromaticContact CG-CE1 3.96Å; Y510-F516 HydrophobicContact CG-CE1 3.96Å; Y510-F516 HydrophobicContact CG-CE2 4.22Å; Y510-F516 AromaticContact CG-CZ 3.84Å; Y510-F516 HydrophobicContact CG-CZ 3.84Å; F516-L519 HydrophobicContact CB-CD1 3.56Å; F516-L519 HydrophobicContact CB-CG 4.19Å; F516-L519 VanDerWaalsContact O-CD1 3.27Å; F516-L519 WeakPolarHBondContact O-CD1 3.23Å; F516-L538 HydrophobicContact CD1-CD1 4.47Å; F516-L538 HydrophobicContact CE1-CD1 3.49Å; F516-L538 VanDerWaalsContact CE1-CD1 3.49Å; F516-L538 HydrophobicContact CZ-CD1 3.7Å; F516-Y542 AromaticContact CE2-CD1 3.8Å; F516-Y542 HydrophobicContact CE2-CD1 3.8Å; F516-Y542 AromaticContact CE2-CE1 3.5Å; F516-Y542 HydrophobicContact CE2-CE1 3.5Å; F516-Y542 AromaticContact CZ-CD1 3.55Å; F516-Y542 HydrophobicContact CZ-CD1 3.55Å; F516-Y542 AromaticContact CZ-CE1 3.38Å; F516-Y542 HydrophobicContact CZ-CE1 3.38Å
517	S	64.4	Low	75.4	Confident	44 Å²	44	66 Å²	66	31%	0.308	39%	0.388	S	S	.	.	S	Bend	trans	-80	140.1	163.4	-49.8	0	0	0	0	108.2	F506	F506-S517 WeakPolarHBondContact CE1-O 3.2Å
518	D	66.3	Low	75.2	Confident	77 Å²	77	67 Å²	67	41%	0.412	40%	0.397	S	S	.	.			trans	56.1	50.2	172.9	-53.7	-35.1	0	0	0	116.2	G484 D520 L521	G484-D518 PolarHBondContact N-OD2 2.82Å; D518-D520 VanDerWaalsContact C-N 3.25Å; D518-D520 PolarHBondContact O-N 3.21Å; D518-L521 HydrophobicContact CB-CD1 4.17Å; D518-L521 PolarHBondContact O-N 3.45Å
519	L	70.4	Confident	75	Confident	69 Å²	69	63.5 Å²	63.5	36%	0.361	38%	0.382	S	S	.	.	H	α-helix	trans	-49.1	-43.5	177.9	-90.1	81.6	0	0	0	113.3	F516 L521 I522 D523	F516-L519 HydrophobicContact CB-CD1 3.56Å; F516-L519 HydrophobicContact CB-CG 4.19Å; F516-L519 VanDerWaalsContact O-CD1 3.27Å; F516-L519 WeakPolarHBondContact O-CD1 3.23Å; L519-L521 PolarHBondContact O-N 3.43Å; L519-I522 PolarHBondContact O-N 3.22Å; L519-I522 VanDerWaalsContact O-N 3.13Å; L519-D523 PolarHBondContact O-N 3.42Å
520	D	71.6	Confident	75.1	Confident	124 Å²	124	68.2 Å²	68.2	66%	0.663	41%	0.406	S	S	*	.	H	α-helix	trans	-61.1	-34	-174	-63.4	-24.4	0	0	0	112.4	D518 N524	D518-D520 VanDerWaalsContact C-N 3.25Å; D518-D520 PolarHBondContact O-N 3.21Å; D520-N524 WeakPolarHBondContact O-CB 3.47Å; D520-N524 PolarHBondContact O-N 2.89Å; D520-N524 PolarHBondContact O-ND2 3.38Å
521	L	73.1	Confident	75.2	Confident	79 Å²	79	69.9 Å²	69.9	41%	0.414	42%	0.416	S	S	.	.	H	α-helix	trans	-74	-36.2	179.5	-76.9	169.9	0	0	0	111.5	D518 L519 L525	D518-L521 HydrophobicContact CB-CD1 4.17Å; D518-L521 PolarHBondContact O-N 3.45Å; L519-L521 PolarHBondContact O-N 3.43Å; L521-L525 WeakPolarHBondContact O-CG 3.24Å
522	I	78.3	Confident	75.5	Confident	1 Å²	1	67.6 Å²	67.6	1%	0.005	40%	0.401	C	S	.	.	H	α-helix	trans	-70.9	-41.2	-179.8	-59.2	175.5	0	0	0	110.2	F506 L519 N524 L525 A539 R543	F506-I522 HydrophobicContact CD1-CD1 4.22Å; F506-I522 HydrophobicContact CE1-CD1 4.04Å; F506-I522 HydrophobicContact CZ-CD1 4.29Å; L519-I522 PolarHBondContact O-N 3.22Å; L519-I522 VanDerWaalsContact O-N 3.13Å; I522-N524 VanDerWaalsContact C-N 3.28Å; I522-N524 PolarHBondContact O-N 3.15Å; I522-L525 HydrophobicContact CG2-CD1 4.33Å; I522-L525 WeakPolarHBondContact O-CD1 3.41Å; I522-L525 WeakPolarHBondContact O-CG 3.29Å; I522-L525 PolarHBondContact O-N 2.85Å; I522-A539 HydrophobicContact CG2-CB 3.64Å; I522-R543 HydrophobicContact CG2-CG 3.91Å
523	D	72.9	Confident	75.7	Confident	80 Å²	80	70 Å²	70	43%	0.428	40%	0.402	S	S	.	.	H	α-helix	trans	-69.2	-27.3	-179.2	-69	-13.8	0	0	0	112.7	L519 R543	L519-D523 PolarHBondContact O-N 3.42Å; D523-R543 IonicContact OD1-CZ 3.86Å; D523-R543 VanDerWaalsContact OD1-CZ 3.3Å; D523-R543 IonicContact OD1-NE 3.1Å; D523-R543 PolarHBondContact OD1-NE 3.38Å; D523-R543 IonicContact OD1-NH2 3.74Å; D523-R543 PolarHBondContact OD1-NH2 2.83Å; D523-R543 IonicContact OD2-CZ 3.09Å; D523-R543 IonicContact OD2-NE 3.18Å; D523-R543 IonicContact OD2-NH2 3.97Å; D523-R543 PolarHBondContact OD2-NH2 3.28Å
524	N	78.1	Confident	76	Confident	134 Å²	134	67.5 Å²	67.5	72%	0.717	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.3	17.2	-177.2	-69.5	-53.2	0	0	0	114.3	D520 I522 G526	D520-N524 WeakPolarHBondContact O-CB 3.47Å; D520-N524 PolarHBondContact O-N 2.89Å; D520-N524 PolarHBondContact O-ND2 3.38Å; I522-N524 VanDerWaalsContact C-N 3.28Å; I522-N524 PolarHBondContact O-N 3.15Å; N524-G526 VanDerWaalsContact C-N 3.32Å; N524-G526 PolarHBondContact O-N 2.88Å
525	L	76.8	Confident	76.7	Confident	24 Å²	24	65.3 Å²	65.3	13%	0.126	37%	0.366	C	S	.	.			trans	-69.7	-25.4	-179.2	-74.9	170	0	0	0	114.1	L487 I491 L521 I522 A528 L535 A539	L487-L525 HydrophobicContact CD2-CD1 4.13Å; I491-L525 HydrophobicContact CD1-CD2 3.19Å; L521-L525 WeakPolarHBondContact O-CG 3.24Å; I522-L525 HydrophobicContact CG2-CD1 4.33Å; I522-L525 WeakPolarHBondContact O-CD1 3.41Å; I522-L525 WeakPolarHBondContact O-CG 3.29Å; I522-L525 PolarHBondContact O-N 2.85Å; L525-A528 VanDerWaalsContact O-CB 3.24Å; L525-A528 WeakPolarHBondContact O-CB 3.24Å; L525-A528 PolarHBondContact O-N 3.41Å; L525-A528 VanDerWaalsContact O-N 3.11Å; L525-L535 HydrophobicContact CD1-CD1 3.98Å; L525-A539 HydrophobicContact CD1-CB 3.49Å; L525-A539 VanDerWaalsContact CD1-CB 3.49Å
526	G	80	Confident	77.3	Confident	36 Å²	36	62.7 Å²	62.7	37%	0.371	35%	0.35	S	S	.	.	G	3₁₀ helix	trans	52.9	-136.9	-178.6	0	0	0	0	0	112.3	N524 A528 M529	N524-G526 VanDerWaalsContact C-N 3.32Å; N524-G526 PolarHBondContact O-N 2.88Å; G526-A528 PolarHBondContact O-N 3.3Å; G526-A528 VanDerWaalsContact O-N 3.09Å; G526-M529 VanDerWaalsContact O-CE 3.27Å; G526-M529 WeakPolarHBondContact O-CE 3.47Å; G526-M529 WeakPolarHBondContact O-CG 3.48Å; G526-M529 PolarHBondContact O-N 2.94Å
527	P	79.3	Confident	77.9	Confident	115 Å²	115	61.8 Å²	61.8	75%	0.747	35%	0.346	S	S	*	.	G	3₁₀ helix	trans	-60.7	-18.8	179.3	-23.1	33.7	0	0	0	115	M529 L530	P527-M529 PolarHBondContact O-N 2.85Å; P527-L530 WeakPolarHBondContact O-CB 3.37Å; P527-L530 PolarHBondContact O-N 3.33Å
528	A	78.8	Confident	78.7	Confident	29 Å²	29	59.7 Å²	59.7	24%	0.24	33%	0.331	C	S	.	.	G	3₁₀ helix	trans	-67	-15.7	-178.2	0	0	0	0	0	113.6	I491 L525 G526 L530 L531	I491-A528 HydrophobicContact CD1-CB 4.26Å; I491-A528 HydrophobicContact CG2-CB 3.55Å; L525-A528 VanDerWaalsContact O-CB 3.24Å; L525-A528 WeakPolarHBondContact O-CB 3.24Å; L525-A528 PolarHBondContact O-N 3.41Å; L525-A528 VanDerWaalsContact O-N 3.11Å; G526-A528 PolarHBondContact O-N 3.3Å; G526-A528 VanDerWaalsContact O-N 3.09Å; A528-L530 PolarHBondContact O-N 3.37Å; A528-L531 VanDerWaalsContact O-CB 3.27Å; A528-L531 WeakPolarHBondContact O-CB 3.48Å; A528-L531 PolarHBondContact O-N 2.88Å
529	M	79.4	Confident	79.1	Confident	49 Å²	49	56.3 Å²	56.3	24%	0.241	32%	0.315	C	S	.	.	G	3₁₀ helix	trans	-59.2	-28.8	174.1	68.5	179.9	64.6	0	0	112.6	G526 P527 L531 T536 A539	G526-M529 VanDerWaalsContact O-CE 3.27Å; G526-M529 WeakPolarHBondContact O-CE 3.47Å; G526-M529 WeakPolarHBondContact O-CG 3.48Å; G526-M529 PolarHBondContact O-N 2.94Å; P527-M529 PolarHBondContact O-N 2.85Å; M529-L531 PolarHBondContact O-N 3.44Å; M529-T536 PolarHBondContact O-N 3.36Å; M529-T536 PolarHBondContact O-OG1 3.48Å; M529-A539 HydrophobicContact CB-CB 4.22Å
530	L	82.2	Confident	79.4	Confident	130 Å²	130	53.8 Å²	53.8	68%	0.681	31%	0.305	S	S	*	.	G	3₁₀ helix	trans	-74.6	0.4	-179	-59.8	174.9	0	0	0	113.7	P527 A528 S532 T536	P527-L530 WeakPolarHBondContact O-CB 3.37Å; P527-L530 PolarHBondContact O-N 3.33Å; A528-L530 PolarHBondContact O-N 3.37Å; L530-S532 PolarHBondContact O-N 3.47Å; L530-T536 HydrophobicContact CD2-CG2 4.34Å
531	L	83	Confident	79.7	Confident	49 Å²	49	51.5 Å²	51.5	26%	0.257	29%	0.289	S	S	.	.	G	3₁₀ helix	trans	-64.8	-29.7	178.7	-175.8	66.3	0	0	0	112.5	I491 A496 A499 A528 M529 L535	I491-L531 HydrophobicContact CB-CD2 4.4Å; I491-L531 HydrophobicContact CG1-CD2 4Å; A496-L531 HydrophobicContact CB-CG 4.43Å; A496-L531 VanDerWaalsContact CB-O 3.27Å; A496-L531 WeakPolarHBondContact CB-O 3.19Å; A499-L531 HydrophobicContact CB-CD2 3.91Å; A528-L531 VanDerWaalsContact O-CB 3.27Å; A528-L531 WeakPolarHBondContact O-CB 3.48Å; A528-L531 PolarHBondContact O-N 2.88Å; M529-L531 PolarHBondContact O-N 3.44Å; L531-L535 HydrophobicContact CB-CD2 4.44Å
532	S	84.6	Confident	80.1	Confident	10 Å²	10	47.8 Å²	47.8	7%	0.07	27%	0.269	C	S	.	.			trans	-147	146.6	177.7	160.6	0	0	0	0	110	T500 L530 R534 L535 T536	T500-S532 WeakPolarHBondContact OG1-CB 3.33Å; T500-S532 PolarHBondContact OG1-OG 3.15Å; L530-S532 PolarHBondContact O-N 3.47Å; S532-R534 PolarHBondContact O-N 3.42Å; S532-R534 PolarHBondContact OG-N 3.15Å; S532-R534 VanDerWaalsContact OG-N 3.14Å; S532-L535 PolarHBondContact O-N 2.87Å; S532-T536 WeakPolarHBondContact O-CB 3.48Å; S532-T536 PolarHBondContact O-N 3.2Å; S532-T536 PolarHBondContact O-OG1 2.9Å
533	D	82.8	Confident	80.3	Confident	136 Å²	136	49.3 Å²	49.3	73%	0.727	28%	0.275	S	S	*	.	H	α-helix	trans	-59.2	-37.6	174.6	-58.8	-23.7	0	0	0	111.6	T536 F537	D533-T536 PolarHBondContact O-N 2.96Å; D533-F537 WeakPolarHBondContact O-CB 3.32Å; D533-F537 PolarHBondContact O-N 3.28Å
534	R	83.3	Confident	80.7	Confident	76 Å²	76	49.5 Å²	49.5	29%	0.287	27%	0.273	S	S	.	.	H	α-helix	trans	-69.5	-38.1	178.3	-68.2	-67	-172.4	-115.1	-3.1	111.9	T500 E504 S532 F537 L538	T500-R534 HydrophobicContact CG2-CB 4.09Å; T500-R534 HydrophobicContact CG2-CG 3.72Å; E504-R534 IonicContact OE1-NE 2.65Å; S532-R534 PolarHBondContact O-N 3.42Å; S532-R534 PolarHBondContact OG-N 3.15Å; S532-R534 VanDerWaalsContact OG-N 3.14Å; R534-F537 PolarHBondContact O-N 3.47Å; R534-L538 WeakPolarHBondContact O-CB 3.19Å; R534-L538 PolarHBondContact O-N 3.26Å
535	L	82.1	Confident	81	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-70.1	-37.6	175	-174.8	60.7	0	0	0	111.2	L487 I491 L525 L531 S532 L538 A539	L487-L535 HydrophobicContact CD1-CD1 3.85Å; L487-L535 HydrophobicContact CD1-CD2 4.15Å; L487-L535 HydrophobicContact CD2-CD1 3.87Å; L487-L535 HydrophobicContact CG-CD1 4.43Å; I491-L535 HydrophobicContact CD1-CD2 4.27Å; I491-L535 HydrophobicContact CG1-CD2 4.37Å; L525-L535 HydrophobicContact CD1-CD1 3.98Å; L531-L535 HydrophobicContact CB-CD2 4.44Å; S532-L535 PolarHBondContact O-N 2.87Å; L535-L538 PolarHBondContact O-N 3.44Å; L535-A539 HydrophobicContact CD1-CB 4.29Å; L535-A539 VanDerWaalsContact O-CB 3.28Å; L535-A539 WeakPolarHBondContact O-CB 3.37Å; L535-A539 PolarHBondContact O-N 3.21Å
536	T	84.1	Confident	81.2	Confident	35 Å²	35	44.6 Å²	44.6	22%	0.215	25%	0.245	C	C	.	.	I	π-helix	trans	-63.1	-42.8	174.7	-58.9	0	0	0	0	111.1	M529 L530 S532 D533 G540 K541	M529-T536 PolarHBondContact O-N 3.36Å; M529-T536 PolarHBondContact O-OG1 3.48Å; L530-T536 HydrophobicContact CD2-CG2 4.34Å; S532-T536 WeakPolarHBondContact O-CB 3.48Å; S532-T536 PolarHBondContact O-N 3.2Å; S532-T536 PolarHBondContact O-OG1 2.9Å; D533-T536 PolarHBondContact O-N 2.96Å; T536-G540 VanDerWaalsContact O-CA 3.27Å; T536-G540 WeakPolarHBondContact O-CA 3.25Å; T536-G540 PolarHBondContact O-N 3.49Å; T536-K541 PolarHBondContact O-N 3.38Å
537	F	85.1	Confident	81.4	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	26%	0.257	C	S	.	.	I	π-helix	trans	-58.9	-53.9	173.4	169.5	-104.5	0	0	0	111.3	L507 D533 R534 K541 Y542 L564 I569 A570 F574 L578	L507-F537 HydrophobicContact CD1-CD1 4.14Å; L507-F537 HydrophobicContact CD1-CE1 4.08Å; L507-F537 HydrophobicContact CD2-CD1 4.39Å; L507-F537 HydrophobicContact CD2-CE1 3.86Å; D533-F537 WeakPolarHBondContact O-CB 3.32Å; D533-F537 PolarHBondContact O-N 3.28Å; R534-F537 PolarHBondContact O-N 3.47Å; F537-K541 PolarHBondContact O-N 3.45Å; F537-Y542 HydrophobicContact CZ-CG 4.49Å; F537-Y542 WeakPolarHBondContact O-CB 3.37Å; F537-Y542 PolarHBondContact O-N 3.48Å; F537-L564 HydrophobicContact CD2-CD2 3.68Å; F537-L564 HydrophobicContact CE2-CB 4.32Å; F537-L564 HydrophobicContact CE2-CD1 4.22Å; F537-L564 HydrophobicContact CE2-CD2 3.77Å; F537-L564 HydrophobicContact CE2-CG 4.33Å; F537-I569 HydrophobicContact CB-CG2 4.16Å; F537-I569 HydrophobicContact CD2-CG2 4.05Å; F537-A570 HydrophobicContact CD2-CB 4.14Å; F537-A570 HydrophobicContact CE2-CB 3.43Å; F537-A570 VanDerWaalsContact CE2-CB 3.43Å; F537-A570 HydrophobicContact CZ-CB 3.66Å; F537-F574 AromaticContact CE1-CD1 3.92Å; F537-F574 HydrophobicContact CE1-CD1 3.92Å; F537-F574 HydrophobicContact CE1-CE1 4.31Å; F537-F574 AromaticContact CZ-CD1 3.75Å; F537-F574 HydrophobicContact CZ-CD1 3.75Å; F537-F574 HydrophobicContact CZ-CE1 4.12Å; F537-L578 HydrophobicContact CE2-CD1 4.5Å; F537-L578 HydrophobicContact CZ-CD1 4.22Å
538	L	81.6	Confident	81.6	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	23%	0.225	C	C	.	.	I	π-helix	trans	-63.7	-60.4	-176.8	176.5	68.8	0	0	0	111.8	F506 L507 F516 R534 L535 R543	F506-L538 HydrophobicContact CB-CD2 3.69Å; F506-L538 HydrophobicContact CD2-CD2 4.17Å; F506-L538 HydrophobicContact CG-CD2 4.13Å; L507-L538 HydrophobicContact CD2-CD1 3.65Å; L507-L538 HydrophobicContact CG-CD1 4.22Å; F516-L538 HydrophobicContact CD1-CD1 4.47Å; F516-L538 HydrophobicContact CE1-CD1 3.49Å; F516-L538 VanDerWaalsContact CE1-CD1 3.49Å; F516-L538 HydrophobicContact CZ-CD1 3.7Å; R534-L538 WeakPolarHBondContact O-CB 3.19Å; R534-L538 PolarHBondContact O-N 3.26Å; L535-L538 PolarHBondContact O-N 3.44Å; L538-R543 WeakPolarHBondContact O-CG 3.49Å; L538-R543 PolarHBondContact O-N 3.48Å
539	A	74.1	Confident	81.8	Confident	7 Å²	7	47 Å²	47	6%	0.058	23%	0.228	C	C	.	.	I	π-helix	trans	-82.1	-31.6	-169.7	0	0	0	0	0	114.1	I522 L525 M529 L535	I522-A539 HydrophobicContact CG2-CB 3.64Å; L525-A539 HydrophobicContact CD1-CB 3.49Å; L525-A539 VanDerWaalsContact CD1-CB 3.49Å; M529-A539 HydrophobicContact CB-CB 4.22Å; L535-A539 HydrophobicContact CD1-CB 4.29Å; L535-A539 VanDerWaalsContact O-CB 3.28Å; L535-A539 WeakPolarHBondContact O-CB 3.37Å; L535-A539 PolarHBondContact O-N 3.21Å
540	G	76.8	Confident	81.9	Confident	15 Å²	15	47.5 Å²	47.5	16%	0.155	25%	0.246	C	C	.	.	I	π-helix	trans	-86.7	-70	178.6	0	0	0	0	0	110.8	T536 E544	T536-G540 VanDerWaalsContact O-CA 3.27Å; T536-G540 WeakPolarHBondContact O-CA 3.25Å; T536-G540 PolarHBondContact O-N 3.49Å; G540-E544 WeakPolarHBondContact O-CB 3.48Å; G540-E544 PolarHBondContact O-N 3.12Å
541	K	78.4	Confident	82.1	Confident	77 Å²	77	45.9 Å²	45.9	34%	0.335	23%	0.234	S	C	.	.	I	π-helix	trans	-81.1	-43.1	-164.3	-64.5	-71.4	170.5	-163.7	0	114.3	T536 F537 E544 F545 L560 L564	T536-K541 PolarHBondContact O-N 3.38Å; F537-K541 PolarHBondContact O-N 3.45Å; K541-E544 IonicContact NZ-OE2 2.78Å; K541-E544 PolarHBondContact O-N 3.27Å; K541-F545 PolarHBondContact O-N 3.38Å; K541-F545 VanDerWaalsContact O-N 3.09Å; K541-L560 HydrophobicContact CD-CD1 3.94Å; K541-L564 HydrophobicContact CB-CD1 4.11Å; K541-L564 HydrophobicContact CB-CD2 3.29Å; K541-L564 HydrophobicContact CB-CG 4.18Å; K541-L564 HydrophobicContact CD-CD2 4.45Å; K541-L564 HydrophobicContact CG-CD2 3.85Å
542	Y	81.3	Confident	82.1	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	26%	0.255	C	S	.	.	I	π-helix	trans	-75.2	-36.3	-176.4	-172.4	-116.9	0	0	0	112.5	Y510 F516 F537 F545 H546 F574 L578 D581	Y510-Y542 HydrophobicContact CD1-CE1 4.47Å; Y510-Y542 HydrophobicContact CE1-CE1 4.18Å; Y510-Y542 WeakPolarHBondContact CE1-OH 3.46Å; Y510-Y542 HydrophobicContact CE2-CE1 4.45Å; Y510-Y542 PolarHBondContact OH-OH 3.32Å; F516-Y542 AromaticContact CE2-CD1 3.8Å; F516-Y542 HydrophobicContact CE2-CD1 3.8Å; F516-Y542 AromaticContact CE2-CE1 3.5Å; F516-Y542 HydrophobicContact CE2-CE1 3.5Å; F516-Y542 AromaticContact CZ-CD1 3.55Å; F516-Y542 HydrophobicContact CZ-CD1 3.55Å; F516-Y542 AromaticContact CZ-CE1 3.38Å; F516-Y542 HydrophobicContact CZ-CE1 3.38Å; F537-Y542 HydrophobicContact CZ-CG 4.49Å; F537-Y542 WeakPolarHBondContact O-CB 3.37Å; F537-Y542 PolarHBondContact O-N 3.48Å; Y542-F545 HydrophobicContact CD2-CD1 4.5Å; Y542-F545 HydrophobicContact CE2-CD1 4.23Å; Y542-F545 WeakPolarHBondContact O-CB 3.42Å; Y542-F545 PolarHBondContact O-N 3.19Å; Y542-H546 AromaticContact CE1-CD2 3.85Å; Y542-H546 AromaticContact CE1-NE2 3.67Å; Y542-H546 AromaticContact CE2-NE2 3.88Å; Y542-H546 AromaticContact CZ-CD2 3.79Å; Y542-H546 AromaticContact CZ-NE2 3.31Å; Y542-H546 VanDerWaalsContact CZ-NE2 3.31Å; Y542-H546 PolarHBondContact O-CD2 2.85Å; Y542-H546 PolarHBondContact O-N 3.4Å; Y542-H546 PolarHBondContact OH-NE2 2.72Å; Y542-H546 VanDerWaalsContact OH-NE2 3.16Å; Y542-F574 HydrophobicContact CD1-CE1 4.34Å; Y542-F574 HydrophobicContact CD1-CZ 4.35Å; Y542-F574 HydrophobicContact CD2-CE1 4.12Å; Y542-F574 AromaticContact CE1-CE1 3.94Å; Y542-F574 HydrophobicContact CE1-CE1 3.94Å; Y542-F574 AromaticContact CE1-CZ 3.68Å; Y542-F574 HydrophobicContact CE1-CZ 3.68Å; Y542-F574 AromaticContact CE2-CE1 3.75Å; Y542-F574 HydrophobicContact CE2-CE1 3.75Å; Y542-F574 HydrophobicContact CE2-CZ 4.23Å; Y542-F574 HydrophobicContact CG-CE1 4.4Å; Y542-F574 AromaticContact CZ-CE1 3.62Å; Y542-F574 AromaticContact CZ-CZ 3.61Å; Y542-L578 HydrophobicContact CD2-CD2 3.62Å; Y542-L578 HydrophobicContact CE2-CD2 3.42Å; Y542-L578 VanDerWaalsContact CE2-CD2 3.42Å; Y542-D581 PolarHBondContact OH-OD2 3.43Å
543	R	81.5	Confident	82.1	Confident	33 Å²	33	56 Å²	56	13%	0.125	27%	0.272	C	S	.	.	H	α-helix	trans	-67.8	-38.5	170.3	-67.8	-67	-64.9	155.7	3.7	112.7	I522 D523 L538 F545 H546 K547	I522-R543 HydrophobicContact CG2-CG 3.91Å; D523-R543 IonicContact OD1-CZ 3.86Å; D523-R543 VanDerWaalsContact OD1-CZ 3.3Å; D523-R543 IonicContact OD1-NE 3.1Å; D523-R543 PolarHBondContact OD1-NE 3.38Å; D523-R543 IonicContact OD1-NH2 3.74Å; D523-R543 PolarHBondContact OD1-NH2 2.83Å; D523-R543 IonicContact OD2-CZ 3.09Å; D523-R543 IonicContact OD2-NE 3.18Å; D523-R543 IonicContact OD2-NH2 3.97Å; D523-R543 PolarHBondContact OD2-NH2 3.28Å; L538-R543 WeakPolarHBondContact O-CG 3.49Å; L538-R543 PolarHBondContact O-N 3.48Å; R543-F545 VanDerWaalsContact C-N 3.27Å; R543-F545 PolarHBondContact O-N 3.47Å; R543-H546 PolarHBondContact O-N 2.92Å; R543-K547 PolarHBondContact O-N 3.13Å
544	E	82	Confident	82.1	Confident	84 Å²	84	52.2 Å²	52.2	39%	0.393	25%	0.249	S	C	.	.	H	α-helix	trans	-58.4	-39.9	172.9	-179.2	179.5	-160.1	0	0	111.5	G540 K541 K547 L548 L560	G540-E544 WeakPolarHBondContact O-CB 3.48Å; G540-E544 PolarHBondContact O-N 3.12Å; K541-E544 IonicContact NZ-OE2 2.78Å; K541-E544 PolarHBondContact O-N 3.27Å; E544-K547 PolarHBondContact O-N 3.32Å; E544-L548 HydrophobicContact CG-CD1 4.22Å; E544-L548 WeakPolarHBondContact O-CG 3.37Å; E544-L548 PolarHBondContact O-N 2.85Å; E544-L560 HydrophobicContact CB-CD2 3.96Å; E544-L560 HydrophobicContact CG-CD2 3.7Å
545	F	83.6	Confident	82	Confident	4 Å²	4	55.2 Å²	55.2	2%	0.018	26%	0.264	C	S	.	.	H	α-helix	trans	-57.8	-51.6	172.1	165.7	-99.4	0	0	0	112.3	K541 Y542 R543 K547 L548 Y549 A557 L560 L561 D581 L585	K541-F545 PolarHBondContact O-N 3.38Å; K541-F545 VanDerWaalsContact O-N 3.09Å; Y542-F545 HydrophobicContact CD2-CD1 4.5Å; Y542-F545 HydrophobicContact CE2-CD1 4.23Å; Y542-F545 WeakPolarHBondContact O-CB 3.42Å; Y542-F545 PolarHBondContact O-N 3.19Å; R543-F545 VanDerWaalsContact C-N 3.27Å; R543-F545 PolarHBondContact O-N 3.47Å; F545-K547 VanDerWaalsContact C-N 3.28Å; F545-K547 PolarHBondContact O-N 3.39Å; F545-L548 PolarHBondContact O-N 2.81Å; F545-Y549 HydrophobicContact CZ-CD2 4.43Å; F545-Y549 WeakPolarHBondContact O-CB 3.34Å; F545-Y549 PolarHBondContact O-N 3.06Å; F545-A557 HydrophobicContact CD2-CB 3.9Å; F545-A557 WeakPolarHBondContact CD2-O 3.3Å; F545-A557 HydrophobicContact CE2-CB 3.98Å; F545-L560 HydrophobicContact CB-CD2 4.11Å; F545-L561 HydrophobicContact CD2-CB 3.95Å; F545-L561 HydrophobicContact CD2-CD1 4.05Å; F545-L561 HydrophobicContact CE1-CD1 4.08Å; F545-L561 HydrophobicContact CE2-CB 3.92Å; F545-L561 HydrophobicContact CE2-CD1 3.43Å; F545-L561 VanDerWaalsContact CE2-CD1 3.43Å; F545-L561 HydrophobicContact CE2-CG 4.32Å; F545-L561 HydrophobicContact CZ-CD1 3.46Å; F545-L561 VanDerWaalsContact CZ-CD1 3.46Å; F545-D581 HydrophobicContact CE1-CB 4.28Å; F545-L585 HydrophobicContact CE2-CD1 3.9Å; F545-L585 HydrophobicContact CZ-CD1 4.18Å
546	H	81.4	Confident	82	Confident	51 Å²	51	59.7 Å²	59.7	24%	0.236	29%	0.285	C	S	.	.	H	α-helix	trans	-61.4	-35.8	178.2	-84.3	-77.1	0	0	0	112.6	Y510 Y542 R543 G550	Y510-H546 PolarHBondContact OH-CE1 2.99Å; Y510-H546 VanDerWaalsContact OH-CE1 3.32Å; Y510-H546 PolarHBondContact OH-NE2 3.46Å; Y542-H546 AromaticContact CE1-CD2 3.85Å; Y542-H546 AromaticContact CE1-NE2 3.67Å; Y542-H546 AromaticContact CE2-NE2 3.88Å; Y542-H546 AromaticContact CZ-CD2 3.79Å; Y542-H546 AromaticContact CZ-NE2 3.31Å; Y542-H546 VanDerWaalsContact CZ-NE2 3.31Å; Y542-H546 PolarHBondContact O-CD2 2.85Å; Y542-H546 PolarHBondContact O-N 3.4Å; Y542-H546 PolarHBondContact OH-NE2 2.72Å; Y542-H546 VanDerWaalsContact OH-NE2 3.16Å; R543-H546 PolarHBondContact O-N 2.92Å; H546-G550 PolarHBondContact O-N 3.48Å
547	K	83.4	Confident	82	Confident	140 Å²	140	58 Å²	58	61%	0.609	28%	0.275	S	S	*	.	H	α-helix	trans	-66.1	-49.7	175.1	-174.2	179.8	176.3	-178.6	0	111.9	R543 E544 F545 Y549 G550 E551	R543-K547 PolarHBondContact O-N 3.13Å; E544-K547 PolarHBondContact O-N 3.32Å; F545-K547 VanDerWaalsContact C-N 3.28Å; F545-K547 PolarHBondContact O-N 3.39Å; K547-Y549 VanDerWaalsContact C-N 3.26Å; K547-Y549 PolarHBondContact O-N 2.89Å; K547-G550 PolarHBondContact O-N 3.12Å; K547-E551 WeakPolarHBondContact CE-OE1 3.48Å; K547-E551 WeakPolarHBondContact O-CG 3.47Å; K547-E551 PolarHBondContact O-N 2.8Å
548	L	84.1	Confident	81.8	Confident	14 Å²	14	58 Å²	58	7%	0.073	28%	0.275	C	S	.	.	H	α-helix	trans	-61.7	-36.8	176.9	-71.7	172	0	0	0	111.9	E544 F545 E551 K552 R553 E556 A557 L560	E544-L548 HydrophobicContact CG-CD1 4.22Å; E544-L548 WeakPolarHBondContact O-CG 3.37Å; E544-L548 PolarHBondContact O-N 2.85Å; F545-L548 PolarHBondContact O-N 2.81Å; L548-E551 PolarHBondContact O-N 3.37Å; L548-K552 PolarHBondContact O-N 2.85Å; L548-R553 HydrophobicContact CD2-CB 4.18Å; L548-R553 PolarHBondContact O-N 3.38Å; L548-E556 HydrophobicContact CD1-CB 4.28Å; L548-A557 HydrophobicContact CB-CB 3.92Å; L548-L560 HydrophobicContact CD1-CD2 4.08Å
549	Y	82.6	Confident	82	Confident	77 Å²	77	65 Å²	65	30%	0.302	31%	0.305	S	S	.	.	H	α-helix	trans	-63.6	-45.7	174.2	-170.3	-89.3	0	0	0	111.5	F545 K547 E551 K552 F554 P584 L585	F545-Y549 HydrophobicContact CZ-CD2 4.43Å; F545-Y549 WeakPolarHBondContact O-CB 3.34Å; F545-Y549 PolarHBondContact O-N 3.06Å; K547-Y549 VanDerWaalsContact C-N 3.26Å; K547-Y549 PolarHBondContact O-N 2.89Å; Y549-E551 PolarHBondContact O-N 2.94Å; Y549-K552 PolarHBondContact O-N 3.06Å; Y549-K552 VanDerWaalsContact O-N 3.1Å; Y549-F554 HydrophobicContact CD2-CD1 4.15Å; Y549-F554 HydrophobicContact CD2-CE1 4.22Å; Y549-F554 HydrophobicContact CE2-CD1 4.23Å; Y549-F554 HydrophobicContact CE2-CE1 4.12Å; Y549-P584 WeakPolarHBondContact OH-CB 3.44Å; Y549-L585 HydrophobicContact CD2-CD1 4.4Å; Y549-L585 HydrophobicContact CD2-CD2 3.85Å; Y549-L585 HydrophobicContact CD2-CG 4.23Å; Y549-L585 HydrophobicContact CE2-CD1 4.48Å; Y549-L585 HydrophobicContact CE2-CD2 3.6Å; Y549-L585 HydrophobicContact CE2-CG 3.88Å
550	G	82.3	Confident	82.4	Confident	60 Å²	60	65.6 Å²	65.6	62%	0.619	31%	0.307	S	S	*	.	H	α-helix	trans	-63.6	-35.5	174.9	0	0	0	0	0	114	H546 K547 K552	H546-G550 PolarHBondContact O-N 3.48Å; K547-G550 PolarHBondContact O-N 3.12Å; G550-K552 PolarHBondContact O-N 3.18Å
551	E	87	Confident	82.7	Confident	95 Å²	95	64.9 Å²	64.9	44%	0.444	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.8	0.4	174	-70.2	176	-173	0	0	113.5	K547 L548 Y549 R553	K547-E551 WeakPolarHBondContact CE-OE1 3.48Å; K547-E551 WeakPolarHBondContact O-CG 3.47Å; K547-E551 PolarHBondContact O-N 2.8Å; L548-E551 PolarHBondContact O-N 3.37Å; Y549-E551 PolarHBondContact O-N 2.94Å; E551-R553 HydrophobicContact CB-CG 4.35Å; E551-R553 PolarHBondContact O-N 3.41Å; E551-R553 IonicContact OE2-NH1 3.33Å
552	K	81.5	Confident	82.9	Confident	160 Å²	160	62 Å²	62	70%	0.696	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.9	21.5	-175.9	-54.5	-178.9	179.4	179.2	0	114.6	L548 Y549 G550 F554	L548-K552 PolarHBondContact O-N 2.85Å; Y549-K552 PolarHBondContact O-N 3.06Å; Y549-K552 VanDerWaalsContact O-N 3.1Å; G550-K552 PolarHBondContact O-N 3.18Å; K552-F554 HydrophobicContact CB-CE2 3.85Å; K552-F554 HydrophobicContact CB-CZ 3.86Å; K552-F554 HydrophobicContact CG-CE2 4.36Å; K552-F554 HydrophobicContact CG-CZ 4.01Å; K552-F554 WeakPolarHBondContact O-CD2 3.12Å; K552-F554 PolarHBondContact O-N 3.24Å
553	R	85.6	Confident	83	Confident	112 Å²	112	64.1 Å²	64.1	42%	0.423	30%	0.303	S	S	.	.			trans	-85.3	60.8	175.2	-68	173.7	69.9	-175.1	7.5	110.6	L548 E551 K555 E556 A557	L548-R553 HydrophobicContact CD2-CB 4.18Å; L548-R553 PolarHBondContact O-N 3.38Å; E551-R553 HydrophobicContact CB-CG 4.35Å; E551-R553 PolarHBondContact O-N 3.41Å; E551-R553 IonicContact OE2-NH1 3.33Å; R553-K555 PolarHBondContact O-N 3.48Å; R553-E556 IonicContact CZ-OE1 3.74Å; R553-E556 IonicContact CZ-OE2 3.35Å; R553-E556 IonicContact NE-OE1 2.96Å; R553-E556 PolarHBondContact NE-OE1 3.33Å; R553-E556 VanDerWaalsContact NE-OE1 3.1Å; R553-E556 IonicContact NE-OE2 3.17Å; R553-E556 PolarHBondContact NE-OE2 2.9Å; R553-E556 IonicContact NH2-OE1 3.51Å; R553-E556 PolarHBondContact NH2-OE1 2.86Å; R553-E556 IonicContact NH2-OE2 2.69Å; R553-E556 PolarHBondContact NH2-OE2 3.42Å; R553-E556 PolarHBondContact O-N 3.49Å; R553-A557 PolarHBondContact O-N 2.76Å
554	F	82.9	Confident	83	Confident	57 Å²	57	62.6 Å²	62.6	25%	0.25	30%	0.297	C	S	.	.	H	α-helix	trans	-61.9	-37.1	-167.4	-58.2	-57.7	0	0	0	114.7	Y549 K552 E556 A557 A558 L585 I592	Y549-F554 HydrophobicContact CD2-CD1 4.15Å; Y549-F554 HydrophobicContact CD2-CE1 4.22Å; Y549-F554 HydrophobicContact CE2-CD1 4.23Å; Y549-F554 HydrophobicContact CE2-CE1 4.12Å; K552-F554 HydrophobicContact CB-CE2 3.85Å; K552-F554 HydrophobicContact CB-CZ 3.86Å; K552-F554 HydrophobicContact CG-CE2 4.36Å; K552-F554 HydrophobicContact CG-CZ 4.01Å; K552-F554 WeakPolarHBondContact O-CD2 3.12Å; K552-F554 PolarHBondContact O-N 3.24Å; F554-E556 PolarHBondContact O-N 2.61Å; F554-A557 PolarHBondContact O-N 2.99Å; F554-A558 VanDerWaalsContact O-CB 3.26Å; F554-A558 WeakPolarHBondContact O-CB 3.44Å; F554-A558 PolarHBondContact O-N 2.92Å; F554-L585 HydrophobicContact CB-CD2 3.89Å; F554-L585 HydrophobicContact CD1-CD2 3.61Å; F554-L585 HydrophobicContact CG-CD2 4.09Å; F554-I592 HydrophobicContact CB-CD1 3.66Å; F554-I592 HydrophobicContact CB-CG1 4.21Å; F554-I592 HydrophobicContact CB-CG2 4.47Å; F554-I592 HydrophobicContact CG-CD1 4.27Å
555	K	81.3	Confident	82.8	Confident	138 Å²	138	58.7 Å²	58.7	60%	0.6	28%	0.279	S	S	*	.	H	α-helix	trans	-64.1	-38.7	177.8	-69.1	-174.7	179.2	-179.5	0	112.9	R553 K559	R553-K555 PolarHBondContact O-N 3.48Å; K555-K559 PolarHBondContact O-N 2.54Å; K555-K559 VanDerWaalsContact O-N 3.15Å
556	E	82.1	Confident	82.4	Confident	94 Å²	94	61.4 Å²	61.4	44%	0.439	30%	0.296	S	S	.	.	H	α-helix	trans	-75.4	-40.4	178.9	-65	-177.1	-139.4	0	0	111.4	L548 R553 F554 A558 K559 L560	L548-E556 HydrophobicContact CD1-CB 4.28Å; R553-E556 IonicContact CZ-OE1 3.74Å; R553-E556 IonicContact CZ-OE2 3.35Å; R553-E556 IonicContact NE-OE1 2.96Å; R553-E556 PolarHBondContact NE-OE1 3.33Å; R553-E556 VanDerWaalsContact NE-OE1 3.1Å; R553-E556 IonicContact NE-OE2 3.17Å; R553-E556 PolarHBondContact NE-OE2 2.9Å; R553-E556 IonicContact NH2-OE1 3.51Å; R553-E556 PolarHBondContact NH2-OE1 2.86Å; R553-E556 IonicContact NH2-OE2 2.69Å; R553-E556 PolarHBondContact NH2-OE2 3.42Å; R553-E556 PolarHBondContact O-N 3.49Å; F554-E556 PolarHBondContact O-N 2.61Å; E556-A558 VanDerWaalsContact C-N 3.33Å; E556-A558 PolarHBondContact O-N 3.33Å; E556-K559 PolarHBondContact O-N 2.99Å; E556-L560 WeakPolarHBondContact O-CB 3.49Å; E556-L560 PolarHBondContact O-N 3.41Å
557	A	83.5	Confident	82.1	Confident	0 Å²	0	61.9 Å²	61.9	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-58.7	-44.6	172.9	0	0	0	0	0	111.6	F545 L548 R553 F554 L560 L561	F545-A557 HydrophobicContact CD2-CB 3.9Å; F545-A557 WeakPolarHBondContact CD2-O 3.3Å; F545-A557 HydrophobicContact CE2-CB 3.98Å; L548-A557 HydrophobicContact CB-CB 3.92Å; R553-A557 PolarHBondContact O-N 2.76Å; F554-A557 PolarHBondContact O-N 2.99Å; A557-L560 PolarHBondContact O-N 2.89Å; A557-L561 WeakPolarHBondContact O-CB 3.4Å; A557-L561 PolarHBondContact O-N 3.25Å
558	A	81.6	Confident	81.5	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-61.1	-44.3	176.3	0	0	0	0	0	112.8	F554 E556 L560 L561 L562 L585 I592 F593	F554-A558 VanDerWaalsContact O-CB 3.26Å; F554-A558 WeakPolarHBondContact O-CB 3.44Å; F554-A558 PolarHBondContact O-N 2.92Å; E556-A558 VanDerWaalsContact C-N 3.33Å; E556-A558 PolarHBondContact O-N 3.33Å; A558-L560 VanDerWaalsContact C-N 3.35Å; A558-L560 PolarHBondContact O-N 3.08Å; A558-L561 PolarHBondContact O-N 3.14Å; A558-L562 WeakPolarHBondContact O-CB 3.37Å; A558-L562 PolarHBondContact O-N 2.98Å; A558-L585 HydrophobicContact CB-CD1 4.49Å; A558-I592 HydrophobicContact CB-CG2 3.42Å; A558-I592 VanDerWaalsContact CB-CG2 3.42Å; A558-F593 HydrophobicContact CB-CD1 3.99Å; A558-F593 HydrophobicContact CB-CE1 3.49Å; A558-F593 VanDerWaalsContact CB-CE1 3.49Å; A558-F593 HydrophobicContact CB-CE2 4.09Å; A558-F593 HydrophobicContact CB-CG 4.48Å; A558-F593 HydrophobicContact CB-CZ 3.55Å
559	K	84.3	Confident	81	Confident	148 Å²	148	64.1 Å²	64.1	64%	0.643	32%	0.321	S	S	*	.	H	α-helix	trans	-63.3	-40.6	175.8	-171.2	177	-179.1	177.9	0	111.9	K555 E556 S563	K555-K559 PolarHBondContact O-N 2.54Å; K555-K559 VanDerWaalsContact O-N 3.15Å; E556-K559 PolarHBondContact O-N 2.99Å; K559-S563 WeakPolarHBondContact O-CB 3.17Å; K559-S563 PolarHBondContact O-N 2.86Å
560	L	83.8	Confident	80.7	Confident	19 Å²	19	60.6 Å²	60.6	10%	0.099	31%	0.308	C	S	.	.	H	α-helix	trans	-65.8	-46.3	177.7	-174.8	64.5	0	0	0	111.4	K541 E544 F545 L548 E556 A557 A558 L562 S563 L564	K541-L560 HydrophobicContact CD-CD1 3.94Å; E544-L560 HydrophobicContact CB-CD2 3.96Å; E544-L560 HydrophobicContact CG-CD2 3.7Å; F545-L560 HydrophobicContact CB-CD2 4.11Å; L548-L560 HydrophobicContact CD1-CD2 4.08Å; E556-L560 WeakPolarHBondContact O-CB 3.49Å; E556-L560 PolarHBondContact O-N 3.41Å; A557-L560 PolarHBondContact O-N 2.89Å; A558-L560 VanDerWaalsContact C-N 3.35Å; A558-L560 PolarHBondContact O-N 3.08Å; L560-L562 PolarHBondContact O-N 3.36Å; L560-S563 PolarHBondContact O-N 2.93Å; L560-S563 PolarHBondContact O-OG 3.21Å; L560-L564 HydrophobicContact CG-CD1 4.47Å; L560-L564 WeakPolarHBondContact O-CG 3.34Å; L560-L564 PolarHBondContact O-N 3.03Å
561	L	83.1	Confident	80.4	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-59.7	-45.3	177.2	-173.2	144.4	0	0	0	111.7	F545 A557 A558 S563 L564 M565 A582 L601	F545-L561 HydrophobicContact CD2-CB 3.95Å; F545-L561 HydrophobicContact CD2-CD1 4.05Å; F545-L561 HydrophobicContact CE1-CD1 4.08Å; F545-L561 HydrophobicContact CE2-CB 3.92Å; F545-L561 HydrophobicContact CE2-CD1 3.43Å; F545-L561 VanDerWaalsContact CE2-CD1 3.43Å; F545-L561 HydrophobicContact CE2-CG 4.32Å; F545-L561 HydrophobicContact CZ-CD1 3.46Å; F545-L561 VanDerWaalsContact CZ-CD1 3.46Å; A557-L561 WeakPolarHBondContact O-CB 3.4Å; A557-L561 PolarHBondContact O-N 3.25Å; A558-L561 PolarHBondContact O-N 3.14Å; L561-S563 VanDerWaalsContact C-N 3.32Å; L561-S563 PolarHBondContact O-N 3.49Å; L561-L564 WeakPolarHBondContact O-CB 3.41Å; L561-L564 PolarHBondContact O-N 3.13Å; L561-M565 HydrophobicContact CD2-SD 4.18Å; L561-M565 PolarHBondContact O-N 3.38Å; L561-A582 HydrophobicContact CD1-CB 4.22Å; L561-A582 HydrophobicContact CD2-CB 3.87Å; L561-L601 HydrophobicContact CD2-CD2 4.37Å
562	L	83.1	Confident	79.8	Confident	17 Å²	17	60.9 Å²	60.9	9%	0.089	29%	0.287	C	S	.	.	H	α-helix	trans	-62	-41.5	175.8	-174.1	68.7	0	0	0	111.9	A558 L560 L564 M565 T566 Q597 E600 L601	A558-L562 WeakPolarHBondContact O-CB 3.37Å; A558-L562 PolarHBondContact O-N 2.98Å; L560-L562 PolarHBondContact O-N 3.36Å; L562-L564 VanDerWaalsContact C-N 3.28Å; L562-L564 PolarHBondContact O-N 3.16Å; L562-M565 PolarHBondContact O-N 3.01Å; L562-T566 HydrophobicContact CD1-CG2 4.03Å; L562-T566 HydrophobicContact CG-CG2 4.15Å; L562-T566 WeakPolarHBondContact O-CG2 3.29Å; L562-T566 PolarHBondContact O-N 3.47Å; L562-T566 PolarHBondContact O-OG1 2.9Å; L562-Q597 HydrophobicContact CD2-CB 3.75Å; L562-Q597 HydrophobicContact CD2-CG 3.53Å; L562-E600 HydrophobicContact CD1-CB 3.88Å; L562-L601 HydrophobicContact CD1-CD2 3.72Å; L562-L601 HydrophobicContact CD1-CG 3.85Å
563	S	83.3	Confident	79.4	Confident	44 Å²	44	58.5 Å²	58.5	31%	0.308	29%	0.29	S	S	.	.	H	α-helix	trans	-63.9	-33.5	177.4	78.5	0	0	0	0	112.6	K559 L560 L561 M565 A567	K559-S563 WeakPolarHBondContact O-CB 3.17Å; K559-S563 PolarHBondContact O-N 2.86Å; L560-S563 PolarHBondContact O-N 2.93Å; L560-S563 PolarHBondContact O-OG 3.21Å; L561-S563 VanDerWaalsContact C-N 3.32Å; L561-S563 PolarHBondContact O-N 3.49Å; S563-M565 VanDerWaalsContact C-N 3.28Å; S563-M565 PolarHBondContact O-N 3.33Å; S563-A567 WeakPolarHBondContact O-CB 3.28Å; S563-A567 PolarHBondContact O-N 3.32Å
564	L	80.9	Confident	79.2	Confident	1 Å²	1	53.2 Å²	53.2	1%	0.005	27%	0.271	C	S	.	.	H	α-helix	trans	-66	-33.3	178.8	-76.2	169.4	0	0	0	112.5	F537 K541 L560 L561 L562 I569 A570	F537-L564 HydrophobicContact CD2-CD2 3.68Å; F537-L564 HydrophobicContact CE2-CB 4.32Å; F537-L564 HydrophobicContact CE2-CD1 4.22Å; F537-L564 HydrophobicContact CE2-CD2 3.77Å; F537-L564 HydrophobicContact CE2-CG 4.33Å; K541-L564 HydrophobicContact CB-CD1 4.11Å; K541-L564 HydrophobicContact CB-CD2 3.29Å; K541-L564 HydrophobicContact CB-CG 4.18Å; K541-L564 HydrophobicContact CD-CD2 4.45Å; K541-L564 HydrophobicContact CG-CD2 3.85Å; L560-L564 HydrophobicContact CG-CD1 4.47Å; L560-L564 WeakPolarHBondContact O-CG 3.34Å; L560-L564 PolarHBondContact O-N 3.03Å; L561-L564 WeakPolarHBondContact O-CB 3.41Å; L561-L564 PolarHBondContact O-N 3.13Å; L562-L564 VanDerWaalsContact C-N 3.28Å; L562-L564 PolarHBondContact O-N 3.16Å; L564-I569 HydrophobicContact CD2-CB 4.33Å; L564-I569 HydrophobicContact CD2-CG2 4.21Å; L564-I569 PolarHBondContact O-N 3.38Å; L564-A570 PolarHBondContact O-N 3.12Å; L564-A570 VanDerWaalsContact O-N 3.12Å
565	M	76.9	Confident	79.2	Confident	1 Å²	1	50.7 Å²	50.7	1%	0.005	26%	0.26	C	S	.	.	H	α-helix	trans	-84.1	-52.7	179.2	-64.7	-176.4	68.4	0	0	111.9	L561 L562 S563 A567 K568 W575 L578 L579 L601 C604	L561-M565 HydrophobicContact CD2-SD 4.18Å; L561-M565 PolarHBondContact O-N 3.38Å; L562-M565 PolarHBondContact O-N 3.01Å; S563-M565 VanDerWaalsContact C-N 3.28Å; S563-M565 PolarHBondContact O-N 3.33Å; M565-A567 PolarHBondContact O-N 2.85Å; M565-K568 PolarHBondContact O-N 3.41Å; M565-W575 HydrophobicContact CE-CB 4.28Å; M565-W575 HydrophobicContact CE-CD2 4.41Å; M565-W575 HydrophobicContact CE-CE3 4.39Å; M565-W575 HydrophobicContact CE-CG 4.39Å; M565-L578 HydrophobicContact CG-CB 4.48Å; M565-L578 HydrophobicContact CG-CD1 4.01Å; M565-L578 HydrophobicContact SD-CB 4.17Å; M565-L579 HydrophobicContact CE-CD1 4.03Å; M565-L579 HydrophobicContact CE-CD2 3.72Å; M565-L579 HydrophobicContact CE-CG 3.62Å; M565-L579 HydrophobicContact SD-CD2 4.09Å; M565-L579 HydrophobicContact SD-CG 4.21Å; M565-L601 HydrophobicContact SD-CD2 4.11Å; M565-C604 HydrophobicContact CE-CB 3.48Å; M565-C604 VanDerWaalsContact CE-CB 3.48Å
566	T	76.1	Confident	79.2	Confident	61 Å²	61	45.2 Å²	45.2	37%	0.374	24%	0.236	S	C	.	.	H	α-helix	trans	-66.6	-35.4	-176	52	0	0	0	0	112.5	L562 K568 E600	L562-T566 HydrophobicContact CD1-CG2 4.03Å; L562-T566 HydrophobicContact CG-CG2 4.15Å; L562-T566 WeakPolarHBondContact O-CG2 3.29Å; L562-T566 PolarHBondContact O-N 3.47Å; L562-T566 PolarHBondContact O-OG1 2.9Å; T566-K568 PolarHBondContact O-N 3.02Å; T566-E600 HydrophobicContact CG2-CB 4.3Å
567	A	74.8	Confident	79.2	Confident	62 Å²	62	42 Å²	42	51%	0.512	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.3	4.3	175	0	0	0	0	0	113.9	S563 M565 I569	S563-A567 WeakPolarHBondContact O-CB 3.28Å; S563-A567 PolarHBondContact O-N 3.32Å; M565-A567 PolarHBondContact O-N 2.85Å; A567-I569 HydrophobicContact CB-CD1 3.84Å; A567-I569 HydrophobicContact CB-CG1 3.89Å; A567-I569 PolarHBondContact O-N 2.67Å; A567-I569 VanDerWaalsContact O-N 3.09Å
568	K	71.2	Confident	79.1	Confident	131 Å²	131	42 Å²	42	57%	0.57	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.5	26.8	-179.3	-60.5	-172.6	175.8	-175.8	0	114.8	M565 T566 W575	M565-K568 PolarHBondContact O-N 3.41Å; T566-K568 PolarHBondContact O-N 3.02Å; K568-W575 HydrophobicContact CG-CZ2 4.39Å
569	I	74.3	Confident	79.2	Confident	69 Å²	69	42.1 Å²	42.1	35%	0.354	22%	0.224	S	C	.	.			trans	-73.5	-36.7	177.2	-58.8	170.7	0	0	0	109.6	F537 L564 A567	F537-I569 HydrophobicContact CB-CG2 4.16Å; F537-I569 HydrophobicContact CD2-CG2 4.05Å; L564-I569 HydrophobicContact CD2-CB 4.33Å; L564-I569 HydrophobicContact CD2-CG2 4.21Å; L564-I569 PolarHBondContact O-N 3.38Å; A567-I569 HydrophobicContact CB-CD1 3.84Å; A567-I569 HydrophobicContact CB-CG1 3.89Å; A567-I569 PolarHBondContact O-N 2.67Å; A567-I569 VanDerWaalsContact O-N 3.09Å
570	A	75.4	Confident	79.1	Confident	4 Å²	4	36.9 Å²	36.9	3%	0.033	20%	0.204	C	C	.	.	S	Bend	trans	-73.5	136.5	175.6	0	0	0	0	0	112.3	F537 L564 W575 L578	F537-A570 HydrophobicContact CD2-CB 4.14Å; F537-A570 HydrophobicContact CE2-CB 3.43Å; F537-A570 VanDerWaalsContact CE2-CB 3.43Å; F537-A570 HydrophobicContact CZ-CB 3.66Å; L564-A570 PolarHBondContact O-N 3.12Å; L564-A570 VanDerWaalsContact O-N 3.12Å; A570-W575 PolarHBondContact O-NE1 2.92Å; A570-L578 HydrophobicContact CB-CD1 3.47Å; A570-L578 VanDerWaalsContact CB-CD1 3.47Å
571	P	76.6	Confident	79	Confident	9 Å²	9	37.7 Å²	37.7	6%	0.058	21%	0.209	C	C	.	.			trans	-59.7	138.1	170.3	-17.4	29.3	0	0	0	110.9	L507 S573 F574	L507-P571 HydrophobicContact CD1-CG 3.92Å; P571-S573 PolarHBondContact O-N 2.99Å; P571-F574 WeakPolarHBondContact O-CA 3.38Å; P571-F574 WeakPolarHBondContact O-CB 3.37Å; P571-F574 PolarHBondContact O-N 3.33Å
572	R	74.4	Confident	79	Confident	152 Å²	152	37.7 Å²	37.7	57%	0.574	21%	0.209	S	C	*	.	G	3₁₀ helix	trans	-55	-36.3	179.5	-77.8	-177.7	166.9	174.5	-7.2	113.3	F574 W575 E607	R572-F574 PolarHBondContact O-N 3.25Å; R572-F574 VanDerWaalsContact O-N 3.13Å; R572-W575 HydrophobicContact CG-CZ2 4.26Å; R572-W575 PolarHBondContact O-N 3.07Å; R572-E607 IonicContact CZ-OE1 3.02Å; R572-E607 IonicContact NE-OE1 3.96Å; R572-E607 IonicContact NH2-OE1 2.74Å; R572-E607 PolarHBondContact NH2-OE1 3.39Å
573	S	72.9	Confident	79	Confident	109 Å²	109	38.2 Å²	38.2	76%	0.762	21%	0.211	S	C	*	.	G	3₁₀ helix	trans	-61.1	-18.5	175.3	53.1	0	0	0	0	114.1	P571	P571-S573 PolarHBondContact O-N 2.99Å
574	F	81.4	Confident	79	Confident	2 Å²	2	38.7 Å²	38.7	1%	0.009	21%	0.214	C	C	.	.	G	3₁₀ helix	trans	-102.3	-7.1	-178.5	-160.5	-104	0	0	0	113.2	L507 Y510 C511 F537 Y542 P571 R572 M576 T577 L578	L507-F574 HydrophobicContact CB-CD2 4.03Å; L507-F574 HydrophobicContact CB-CE2 4.25Å; L507-F574 HydrophobicContact CD2-CD1 4.37Å; L507-F574 HydrophobicContact CD2-CD2 3.86Å; L507-F574 HydrophobicContact CD2-CE1 4.23Å; L507-F574 HydrophobicContact CD2-CE2 3.69Å; L507-F574 HydrophobicContact CD2-CG 4.21Å; L507-F574 HydrophobicContact CD2-CZ 3.9Å; L507-F574 HydrophobicContact CG-CD2 4.43Å; Y510-F574 AromaticContact CD1-CE2 3.74Å; Y510-F574 HydrophobicContact CD1-CE2 3.74Å; Y510-F574 AromaticContact CD1-CZ 3.66Å; Y510-F574 HydrophobicContact CD1-CZ 3.66Å; Y510-F574 HydrophobicContact CE1-CE2 4.46Å; Y510-F574 HydrophobicContact CE1-CZ 4Å; C511-F574 WeakPolarHBondContact SG-CD2 3.26Å; F537-F574 AromaticContact CE1-CD1 3.92Å; F537-F574 HydrophobicContact CE1-CD1 3.92Å; F537-F574 HydrophobicContact CE1-CE1 4.31Å; F537-F574 AromaticContact CZ-CD1 3.75Å; F537-F574 HydrophobicContact CZ-CD1 3.75Å; F537-F574 HydrophobicContact CZ-CE1 4.12Å; Y542-F574 HydrophobicContact CD1-CE1 4.34Å; Y542-F574 HydrophobicContact CD1-CZ 4.35Å; Y542-F574 HydrophobicContact CD2-CE1 4.12Å; Y542-F574 AromaticContact CE1-CE1 3.94Å; Y542-F574 HydrophobicContact CE1-CE1 3.94Å; Y542-F574 AromaticContact CE1-CZ 3.68Å; Y542-F574 HydrophobicContact CE1-CZ 3.68Å; Y542-F574 AromaticContact CE2-CE1 3.75Å; Y542-F574 HydrophobicContact CE2-CE1 3.75Å; Y542-F574 HydrophobicContact CE2-CZ 4.23Å; Y542-F574 HydrophobicContact CG-CE1 4.4Å; Y542-F574 AromaticContact CZ-CE1 3.62Å; Y542-F574 AromaticContact CZ-CZ 3.61Å; P571-F574 WeakPolarHBondContact O-CA 3.38Å; P571-F574 WeakPolarHBondContact O-CB 3.37Å; P571-F574 PolarHBondContact O-N 3.33Å; R572-F574 PolarHBondContact O-N 3.25Å; R572-F574 VanDerWaalsContact O-N 3.13Å; F574-M576 VanDerWaalsContact C-N 3.33Å; F574-M576 PolarHBondContact O-N 3.38Å; F574-T577 HydrophobicContact CE2-CG2 4.07Å; F574-T577 HydrophobicContact CZ-CG2 4.01Å; F574-T577 PolarHBondContact O-N 2.69Å; F574-L578 HydrophobicContact CD1-CD1 4Å; F574-L578 HydrophobicContact CD1-CD2 4.12Å; F574-L578 HydrophobicContact CD1-CG 3.65Å; F574-L578 HydrophobicContact CE1-CD2 3.87Å; F574-L578 HydrophobicContact CE1-CG 3.85Å; F574-L578 PolarHBondContact O-N 2.81Å
575	W	81.9	Confident	79.1	Confident	4 Å²	4	38.7 Å²	38.7	2%	0.015	21%	0.213	C	C	.	.	H	α-helix	trans	-64.2	-36.1	-176.4	-72.3	15.4	0	0	0	112.8	M565 K568 A570 R572 T577 L578 L579 C604 L608	M565-W575 HydrophobicContact CE-CB 4.28Å; M565-W575 HydrophobicContact CE-CD2 4.41Å; M565-W575 HydrophobicContact CE-CE3 4.39Å; M565-W575 HydrophobicContact CE-CG 4.39Å; K568-W575 HydrophobicContact CG-CZ2 4.39Å; A570-W575 PolarHBondContact O-NE1 2.92Å; R572-W575 HydrophobicContact CG-CZ2 4.26Å; R572-W575 PolarHBondContact O-N 3.07Å; W575-T577 VanDerWaalsContact C-N 3.28Å; W575-T577 PolarHBondContact O-N 3.13Å; W575-L578 PolarHBondContact O-N 3.31Å; W575-L579 WeakPolarHBondContact O-CB 3.24Å; W575-L579 WeakPolarHBondContact O-CG 3.43Å; W575-L579 PolarHBondContact O-N 3.26Å; W575-C604 HydrophobicContact CE3-CB 4.41Å; W575-C604 HydrophobicContact CZ3-CB 4.32Å; W575-L608 HydrophobicContact CB-CD1 3.42Å; W575-L608 VanDerWaalsContact CB-CD1 3.42Å; W575-L608 HydrophobicContact CB-CD2 3.87Å; W575-L608 HydrophobicContact CB-CG 4.11Å; W575-L608 HydrophobicContact CD2-CD2 4.45Å; W575-L608 HydrophobicContact CE3-CD1 4.05Å; W575-L608 HydrophobicContact CE3-CD2 4.06Å; W575-L608 HydrophobicContact CE3-CG 3.85Å; W575-L608 HydrophobicContact CG-CD1 4.42Å; W575-L608 HydrophobicContact CG-CD2 4.43Å
576	M	81.6	Confident	79.3	Confident	23 Å²	23	38.8 Å²	38.8	11%	0.113	21%	0.214	C	C	.	.	H	α-helix	trans	-60.2	-40.8	175.9	-175.7	63	113.5	0	0	111.5	F574 L579 T580 E629 V633 L636	F574-M576 VanDerWaalsContact C-N 3.33Å; F574-M576 PolarHBondContact O-N 3.38Å; M576-L579 PolarHBondContact O-N 2.87Å; M576-T580 WeakPolarHBondContact O-CB 3.35Å; M576-T580 PolarHBondContact O-N 3.25Å; M576-T580 PolarHBondContact O-OG1 2.89Å; M576-E629 HydrophobicContact CE-CB 4.43Å; M576-V633 HydrophobicContact CE-CG2 3.55Å; M576-L636 HydrophobicContact SD-CD1 4.02Å
577	T	82	Confident	79.5	Confident	26 Å²	26	40.9 Å²	40.9	16%	0.16	22%	0.219	C	C	.	.	H	α-helix	trans	-67.3	-44.1	177	-47.8	0	0	0	0	111.2	Y510 C511 F574 W575 L579 T580 D581	Y510-T577 HydrophobicContact CD1-CG2 3.87Å; Y510-T577 HydrophobicContact CE1-CG2 3.59Å; C511-T577 PolarHBondContact SG-OG1 3.45Å; F574-T577 HydrophobicContact CE2-CG2 4.07Å; F574-T577 HydrophobicContact CZ-CG2 4.01Å; F574-T577 PolarHBondContact O-N 2.69Å; W575-T577 VanDerWaalsContact C-N 3.28Å; W575-T577 PolarHBondContact O-N 3.13Å; T577-L579 VanDerWaalsContact C-N 3.34Å; T577-L579 PolarHBondContact O-N 3.38Å; T577-T580 WeakPolarHBondContact O-CB 3.42Å; T577-T580 PolarHBondContact O-N 3.09Å; T577-T580 VanDerWaalsContact O-N 3.17Å; T577-D581 PolarHBondContact O-N 2.68Å
578	L	82.3	Confident	79.7	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-59.9	-42.3	174.9	-72	171	0	0	0	112.8	F537 Y542 M565 A570 F574 W575 T580 D581 A582	F537-L578 HydrophobicContact CE2-CD1 4.5Å; F537-L578 HydrophobicContact CZ-CD1 4.22Å; Y542-L578 HydrophobicContact CD2-CD2 3.62Å; Y542-L578 HydrophobicContact CE2-CD2 3.42Å; Y542-L578 VanDerWaalsContact CE2-CD2 3.42Å; M565-L578 HydrophobicContact CG-CB 4.48Å; M565-L578 HydrophobicContact CG-CD1 4.01Å; M565-L578 HydrophobicContact SD-CB 4.17Å; A570-L578 HydrophobicContact CB-CD1 3.47Å; A570-L578 VanDerWaalsContact CB-CD1 3.47Å; F574-L578 HydrophobicContact CD1-CD1 4Å; F574-L578 HydrophobicContact CD1-CD2 4.12Å; F574-L578 HydrophobicContact CD1-CG 3.65Å; F574-L578 HydrophobicContact CE1-CD2 3.87Å; F574-L578 HydrophobicContact CE1-CG 3.85Å; F574-L578 PolarHBondContact O-N 2.81Å; W575-L578 PolarHBondContact O-N 3.31Å; L578-T580 VanDerWaalsContact C-N 3.34Å; L578-D581 PolarHBondContact O-N 3.05Å; L578-A582 PolarHBondContact O-N 3.29Å
579	L	82.3	Confident	79.8	Confident	2 Å²	2	44.9 Å²	44.9	1%	0.01	23%	0.226	C	C	.	.	H	α-helix	trans	-63.7	-42.5	175.6	-76.5	169.8	0	0	0	111	M565 W575 M576 T577 D581 A582 L583 L601 L605 L608 L636	M565-L579 HydrophobicContact CE-CD1 4.03Å; M565-L579 HydrophobicContact CE-CD2 3.72Å; M565-L579 HydrophobicContact CE-CG 3.62Å; M565-L579 HydrophobicContact SD-CD2 4.09Å; M565-L579 HydrophobicContact SD-CG 4.21Å; W575-L579 WeakPolarHBondContact O-CB 3.24Å; W575-L579 WeakPolarHBondContact O-CG 3.43Å; W575-L579 PolarHBondContact O-N 3.26Å; M576-L579 PolarHBondContact O-N 2.87Å; T577-L579 VanDerWaalsContact C-N 3.34Å; T577-L579 PolarHBondContact O-N 3.38Å; L579-D581 VanDerWaalsContact C-N 3.32Å; L579-D581 PolarHBondContact O-N 3.48Å; L579-A582 WeakPolarHBondContact O-CA 2.99Å; L579-A582 WeakPolarHBondContact O-CB 3.22Å; L579-A582 PolarHBondContact O-N 3.43Å; L579-L583 PolarHBondContact O-N 2.99Å; L579-L601 HydrophobicContact CD2-CD2 4.14Å; L579-L605 HydrophobicContact CD1-CB 4.19Å; L579-L605 HydrophobicContact CD1-CD1 3.92Å; L579-L608 HydrophobicContact CD1-CD1 3.52Å; L579-L636 HydrophobicContact CB-CD1 3.87Å; L579-L636 HydrophobicContact CB-CD2 3.88Å; L579-L636 VanDerWaalsContact O-CD2 3.22Å; L579-L636 WeakPolarHBondContact O-CD2 3.41Å
580	T	83.3	Confident	79.8	Confident	38 Å²	38	48 Å²	48	23%	0.233	24%	0.239	C	C	.	.	H	α-helix	trans	-61.5	-41.1	175.4	-52.9	0	0	0	0	111.1	M576 T577 L578 A582 L583	M576-T580 WeakPolarHBondContact O-CB 3.35Å; M576-T580 PolarHBondContact O-N 3.25Å; M576-T580 PolarHBondContact O-OG1 2.89Å; T577-T580 WeakPolarHBondContact O-CB 3.42Å; T577-T580 PolarHBondContact O-N 3.09Å; T577-T580 VanDerWaalsContact O-N 3.17Å; L578-T580 VanDerWaalsContact C-N 3.34Å; T580-A582 PolarHBondContact O-N 3.27Å; T580-L583 HydrophobicContact CG2-CD1 3.96Å; T580-L583 VanDerWaalsContact O-CB 3.24Å; T580-L583 WeakPolarHBondContact O-CB 3.49Å; T580-L583 WeakPolarHBondContact O-CG 3.31Å; T580-L583 PolarHBondContact O-N 3.05Å; T580-L583 VanDerWaalsContact O-N 3.08Å
581	D	81.7	Confident	80	Confident	37 Å²	37	48.8 Å²	48.8	20%	0.198	24%	0.244	C	C	.	.	H	α-helix	trans	-70.9	-16	176.1	-70.2	-28.2	0	0	0	113.2	Y510 Y542 F545 T577 L578 L579 P584	Y510-D581 PolarHBondContact OH-OD2 3.29Å; Y542-D581 PolarHBondContact OH-OD2 3.43Å; F545-D581 HydrophobicContact CE1-CB 4.28Å; T577-D581 PolarHBondContact O-N 2.68Å; L578-D581 PolarHBondContact O-N 3.05Å; L579-D581 VanDerWaalsContact C-N 3.32Å; L579-D581 PolarHBondContact O-N 3.48Å; D581-P584 WeakPolarHBondContact O-CD 3.31Å
582	A	83.5	Confident	80.2	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-81.6	-19.1	169.8	0	0	0	0	0	113.1	L561 L578 L579 T580 L585 L586 F593	L561-A582 HydrophobicContact CD1-CB 4.22Å; L561-A582 HydrophobicContact CD2-CB 3.87Å; L578-A582 PolarHBondContact O-N 3.29Å; L579-A582 WeakPolarHBondContact O-CA 2.99Å; L579-A582 WeakPolarHBondContact O-CB 3.22Å; L579-A582 PolarHBondContact O-N 3.43Å; T580-A582 PolarHBondContact O-N 3.27Å; A582-L585 WeakPolarHBondContact O-CB 3.44Å; A582-L585 PolarHBondContact O-N 2.99Å; A582-L586 HydrophobicContact CB-CD1 4.43Å; A582-L586 WeakPolarHBondContact O-CG 3.33Å; A582-L586 PolarHBondContact O-N 2.94Å; A582-F593 HydrophobicContact CB-CZ 4.38Å
583	L	83.1	Confident	80.6	Confident	27 Å²	27	42 Å²	42	14%	0.141	22%	0.218	C	C	.	.	H	α-helix	trans	-52.7	-49.2	179.3	-72	167.3	0	0	0	112.9	L579 T580 L585 L586 E587 L636 S639	L579-L583 PolarHBondContact O-N 2.99Å; T580-L583 HydrophobicContact CG2-CD1 3.96Å; T580-L583 VanDerWaalsContact O-CB 3.24Å; T580-L583 WeakPolarHBondContact O-CB 3.49Å; T580-L583 WeakPolarHBondContact O-CG 3.31Å; T580-L583 PolarHBondContact O-N 3.05Å; T580-L583 VanDerWaalsContact O-N 3.08Å; L583-L585 PolarHBondContact O-N 3.31Å; L583-L586 PolarHBondContact O-N 3.44Å; L583-L586 VanDerWaalsContact O-N 3.11Å; L583-E587 PolarHBondContact O-N 3.33Å; L583-L636 HydrophobicContact CD1-CD2 4.16Å; L583-L636 HydrophobicContact CD1-CG 4.42Å; L583-L636 HydrophobicContact CD2-CD2 3.48Å; L583-L636 VanDerWaalsContact CD2-CD2 3.48Å; L583-L636 HydrophobicContact CD2-CG 4.01Å; L583-L636 HydrophobicContact CG-CD2 3.59Å; L583-L636 HydrophobicContact CG-CG 4.3Å; L583-S639 WeakPolarHBondContact CD2-OG 3.35Å
584	P	83.1	Confident	81.2	Confident	55 Å²	55	38.3 Å²	38.3	36%	0.357	19%	0.192	S	C	.	.	H	α-helix	trans	-64.8	-22.9	-179.5	-20.8	34.7	0	0	0	113.6	Y549 D581 Q588	Y549-P584 WeakPolarHBondContact OH-CB 3.44Å; D581-P584 WeakPolarHBondContact O-CD 3.31Å; P584-Q588 WeakPolarHBondContact O-CG 3.43Å; P584-Q588 PolarHBondContact O-NE2 2.71Å; P584-Q588 VanDerWaalsContact O-NE2 3.11Å
585	L	82.5	Confident	81.2	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-82.6	-33.7	175.9	-66	172.2	0	0	0	111.7	F545 Y549 F554 A558 A582 L583 I592 F593	F545-L585 HydrophobicContact CE2-CD1 3.9Å; F545-L585 HydrophobicContact CZ-CD1 4.18Å; Y549-L585 HydrophobicContact CD2-CD1 4.4Å; Y549-L585 HydrophobicContact CD2-CD2 3.85Å; Y549-L585 HydrophobicContact CD2-CG 4.23Å; Y549-L585 HydrophobicContact CE2-CD1 4.48Å; Y549-L585 HydrophobicContact CE2-CD2 3.6Å; Y549-L585 HydrophobicContact CE2-CG 3.88Å; F554-L585 HydrophobicContact CB-CD2 3.89Å; F554-L585 HydrophobicContact CD1-CD2 3.61Å; F554-L585 HydrophobicContact CG-CD2 4.09Å; A558-L585 HydrophobicContact CB-CD1 4.49Å; A582-L585 WeakPolarHBondContact O-CB 3.44Å; A582-L585 PolarHBondContact O-N 2.99Å; L583-L585 PolarHBondContact O-N 3.31Å; L585-I592 HydrophobicContact CD2-CD1 4.17Å; L585-F593 HydrophobicContact CB-CE2 3.67Å; L585-F593 HydrophobicContact CB-CZ 4.4Å; L585-F593 HydrophobicContact CD1-CE2 4.46Å; L585-F593 HydrophobicContact CD1-CZ 4.4Å
586	L	80.9	Confident	81.3	Confident	3 Å²	3	44.2 Å²	44.2	2%	0.016	23%	0.226	C	C	.	.	H	α-helix	trans	-72.6	-28.1	176.4	-71.2	165.8	0	0	0	112.7	A582 L583 F593 L601 L640 N643	A582-L586 HydrophobicContact CB-CD1 4.43Å; A582-L586 WeakPolarHBondContact O-CG 3.33Å; A582-L586 PolarHBondContact O-N 2.94Å; L583-L586 PolarHBondContact O-N 3.44Å; L583-L586 VanDerWaalsContact O-N 3.11Å; L586-F593 HydrophobicContact CD2-CB 4.4Å; L586-F593 HydrophobicContact CD2-CD2 3.47Å; L586-F593 VanDerWaalsContact CD2-CD2 3.47Å; L586-F593 HydrophobicContact CD2-CE2 3.94Å; L586-F593 HydrophobicContact CD2-CG 4.15Å; L586-F593 HydrophobicContact CG-CD2 3.99Å; L586-F593 HydrophobicContact CG-CE2 3.98Å; L586-L601 HydrophobicContact CD2-CD1 4.31Å; L586-L640 HydrophobicContact CD1-CD2 3.67Å; L586-L640 HydrophobicContact CD1-CG 4.06Å; L586-L640 HydrophobicContact CD2-CD2 3.97Å; L586-N643 HydrophobicContact CB-CB 4.41Å; L586-N643 HydrophobicContact CD2-CB 3.76Å
587	E	80.7	Confident	81.4	Confident	105 Å²	105	45.4 Å²	45.4	49%	0.491	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.7	6.8	-178.6	-63.4	-166.3	157.3	0	0	114.4	L583 S639	L583-E587 PolarHBondContact O-N 3.33Å; E587-S639 PolarHBondContact OE1-OG 3.3Å
588	Q	79.4	Confident	81.4	Confident	72 Å²	72	44.1 Å²	44.1	34%	0.336	22%	0.223	S	C	.	.	S	Bend	trans	-66.3	150.3	174.1	-69	-63	-30	0	0	111.7	P584 E590 I592	P584-Q588 WeakPolarHBondContact O-CG 3.43Å; P584-Q588 PolarHBondContact O-NE2 2.71Å; P584-Q588 VanDerWaalsContact O-NE2 3.11Å; Q588-E590 PolarHBondContact O-N 3.05Å; Q588-I592 HydrophobicContact CB-CD1 3.7Å; Q588-I592 HydrophobicContact CG-CD1 3.5Å; Q588-I592 VanDerWaalsContact CG-CD1 3.5Å
589	K	71.4	Confident	81.4	Confident	205 Å²	205	50 Å²	50	89%	0.891	25%	0.246	S	C	*	.	S	Bend	trans	-65	-26.9	175.4	-68.3	-175.9	178.9	-179.3	0	112.8
590	E	75.9	Confident	81.5	Confident	135 Å²	135	54.4 Å²	54.4	63%	0.631	27%	0.266	S	S	*	.	S	Bend	trans	-95.6	130.8	172.9	-68.2	-171.7	178.2	0	0	109.8	Q588 I592	Q588-E590 PolarHBondContact O-N 3.05Å; E590-I592 PolarHBondContact O-N 3.49Å
591	V	79.6	Confident	81.5	Confident	21 Å²	21	52.6 Å²	52.6	13%	0.127	26%	0.255	C	S	.	.			trans	-59.6	111.2	171.2	-178.2	0	0	0	0	109.5	F593 M646 A647 K650	V591-F593 WeakPolarHBondContact CG1-O 3.43Å; V591-M646 HydrophobicContact CG2-CB 3.81Å; V591-A647 HydrophobicContact CG1-CB 3.66Å; V591-K650 HydrophobicContact CB-CD 3.8Å; V591-K650 HydrophobicContact CG2-CB 4.15Å; V591-K650 HydrophobicContact CG2-CD 3.65Å
592	I	80.8	Confident	81.6	Confident	18 Å²	18	54.5 Å²	54.5	9%	0.092	26%	0.264	C	S	.	.			trans	-96.8	-41.1	176.8	-71	161.6	0	0	0	110.9	F554 A558 L585 Q588 E590	F554-I592 HydrophobicContact CB-CD1 3.66Å; F554-I592 HydrophobicContact CB-CG1 4.21Å; F554-I592 HydrophobicContact CB-CG2 4.47Å; F554-I592 HydrophobicContact CG-CD1 4.27Å; A558-I592 HydrophobicContact CB-CG2 3.42Å; A558-I592 VanDerWaalsContact CB-CG2 3.42Å; L585-I592 HydrophobicContact CD2-CD1 4.17Å; Q588-I592 HydrophobicContact CB-CD1 3.7Å; Q588-I592 HydrophobicContact CG-CD1 3.5Å; Q588-I592 VanDerWaalsContact CG-CD1 3.5Å; E590-I592 PolarHBondContact O-N 3.49Å
593	F	82.9	Confident	81.6	Confident	0 Å²	0	61.8 Å²	61.8	0%	0	29%	0.293	C	S	.	.	S	Bend	trans	-96.8	128.5	174.2	-65.5	-84.1	0	0	0	110.2	A558 A582 L585 L586 V591 Q597 L601 N643	A558-F593 HydrophobicContact CB-CD1 3.99Å; A558-F593 HydrophobicContact CB-CE1 3.49Å; A558-F593 VanDerWaalsContact CB-CE1 3.49Å; A558-F593 HydrophobicContact CB-CE2 4.09Å; A558-F593 HydrophobicContact CB-CG 4.48Å; A558-F593 HydrophobicContact CB-CZ 3.55Å; A582-F593 HydrophobicContact CB-CZ 4.38Å; L585-F593 HydrophobicContact CB-CE2 3.67Å; L585-F593 HydrophobicContact CB-CZ 4.4Å; L585-F593 HydrophobicContact CD1-CE2 4.46Å; L585-F593 HydrophobicContact CD1-CZ 4.4Å; L586-F593 HydrophobicContact CD2-CB 4.4Å; L586-F593 HydrophobicContact CD2-CD2 3.47Å; L586-F593 VanDerWaalsContact CD2-CD2 3.47Å; L586-F593 HydrophobicContact CD2-CE2 3.94Å; L586-F593 HydrophobicContact CD2-CG 4.15Å; L586-F593 HydrophobicContact CG-CD2 3.99Å; L586-F593 HydrophobicContact CG-CE2 3.98Å; V591-F593 WeakPolarHBondContact CG1-O 3.43Å; F593-Q597 HydrophobicContact CB-CB 4.33Å; F593-Q597 HydrophobicContact CD1-CB 4.21Å; F593-L601 HydrophobicContact CD1-CD1 3.88Å; F593-L601 HydrophobicContact CD2-CD1 4.5Å; F593-L601 HydrophobicContact CE1-CD1 3.79Å; F593-L601 HydrophobicContact CE2-CD1 4.4Å; F593-L601 HydrophobicContact CG-CD1 4.23Å; F593-L601 HydrophobicContact CZ-CD1 4.07Å; F593-N643 PolarHBondContact O-ND2 3.16Å
594	S	84	Confident	81.5	Confident	31 Å²	31	60.7 Å²	60.7	22%	0.217	29%	0.287	C	S	.	.			trans	-66.9	169	172.5	51.8	0	0	0	0	112.6	D596 Q597 T598 E651	S594-D596 VanDerWaalsContact C-N 3.34Å; S594-D596 PolarHBondContact O-N 3.49Å; S594-Q597 PolarHBondContact O-N 2.75Å; S594-Q597 WeakPolarHBondContact OG-CB 3.33Å; S594-Q597 VanDerWaalsContact OG-CD 3.22Å; S594-Q597 WeakPolarHBondContact OG-CG 3.48Å; S594-Q597 PolarHBondContact OG-N 3.06Å; S594-Q597 PolarHBondContact OG-OE1 2.8Å; S594-T598 WeakPolarHBondContact O-CB 3.42Å; S594-T598 PolarHBondContact O-N 2.89Å; S594-T598 PolarHBondContact O-OG1 3.21Å; S594-E651 WeakPolarHBondContact CA-OE1 3.14Å; S594-E651 WeakPolarHBondContact CB-OE1 3.39Å
595	A	82.6	Confident	81.5	Confident	8 Å²	8	58.3 Å²	58.3	7%	0.066	27%	0.271	C	S	.	.	H	α-helix	trans	-56.3	-48.4	175.8	0	0	0	0	0	111.4	Q597 T598 Y599 L644 I648 E651	A595-Q597 PolarHBondContact O-N 3.2Å; A595-T598 WeakPolarHBondContact O-CB 3.27Å; A595-T598 PolarHBondContact O-N 3.37Å; A595-T598 VanDerWaalsContact O-N 3.12Å; A595-Y599 HydrophobicContact CB-CE2 4.4Å; A595-Y599 WeakPolarHBondContact O-CD2 3.49Å; A595-Y599 PolarHBondContact O-N 3.13Å; A595-L644 HydrophobicContact CB-CD1 4.05Å; A595-I648 HydrophobicContact CB-CG1 4.23Å; A595-E651 VanDerWaalsContact CB-OE2 3.3Å; A595-E651 WeakPolarHBondContact CB-OE2 3.5Å; A595-E651 PolarHBondContact N-OE1 3.03Å; A595-E651 VanDerWaalsContact N-OE1 3.1Å
596	D	82.6	Confident	81.5	Confident	123 Å²	123	63.2 Å²	63.2	66%	0.658	29%	0.294	S	S	*	.	H	α-helix	trans	-59.1	-45.4	177.8	-67	-16.5	0	0	0	112.5	S594 T598 Y599 E600	S594-D596 VanDerWaalsContact C-N 3.34Å; S594-D596 PolarHBondContact O-N 3.49Å; D596-T598 VanDerWaalsContact C-N 3.28Å; D596-T598 PolarHBondContact O-N 2.89Å; D596-Y599 PolarHBondContact O-N 3.08Å; D596-E600 PolarHBondContact O-N 3.3Å; D596-E600 VanDerWaalsContact O-N 3.12Å
597	Q	83.6	Confident	81.6	Confident	47 Å²	47	65 Å²	65	22%	0.22	30%	0.303	C	S	.	.	H	α-helix	trans	-66.4	-32.1	177.9	-68.9	174.4	-40.3	0	0	112.4	L562 F593 S594 A595 L601	L562-Q597 HydrophobicContact CD2-CB 3.75Å; L562-Q597 HydrophobicContact CD2-CG 3.53Å; F593-Q597 HydrophobicContact CB-CB 4.33Å; F593-Q597 HydrophobicContact CD1-CB 4.21Å; S594-Q597 PolarHBondContact O-N 2.75Å; S594-Q597 WeakPolarHBondContact OG-CB 3.33Å; S594-Q597 VanDerWaalsContact OG-CD 3.22Å; S594-Q597 WeakPolarHBondContact OG-CG 3.48Å; S594-Q597 PolarHBondContact OG-N 3.06Å; S594-Q597 PolarHBondContact OG-OE1 2.8Å; A595-Q597 PolarHBondContact O-N 3.2Å; Q597-L601 WeakPolarHBondContact O-CG 3.32Å; Q597-L601 PolarHBondContact O-N 2.87Å
598	T	83	Confident	81.5	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-71.5	-38.3	176.3	-52.1	0	0	0	0	110.8	S594 A595 D596 E600 L601 M602 L640 N643 L644	S594-T598 WeakPolarHBondContact O-CB 3.42Å; S594-T598 PolarHBondContact O-N 2.89Å; S594-T598 PolarHBondContact O-OG1 3.21Å; A595-T598 WeakPolarHBondContact O-CB 3.27Å; A595-T598 PolarHBondContact O-N 3.37Å; A595-T598 VanDerWaalsContact O-N 3.12Å; D596-T598 VanDerWaalsContact C-N 3.28Å; D596-T598 PolarHBondContact O-N 2.89Å; T598-E600 VanDerWaalsContact C-N 3.35Å; T598-E600 PolarHBondContact O-N 3.19Å; T598-L601 PolarHBondContact O-N 3.06Å; T598-M602 VanDerWaalsContact O-CG 3.31Å; T598-M602 WeakPolarHBondContact O-CG 3.49Å; T598-M602 PolarHBondContact O-N 3.21Å; T598-L640 HydrophobicContact CG2-CB 4.41Å; T598-L640 HydrophobicContact CG2-CD2 3.91Å; T598-N643 PolarHBondContact OG1-ND2 3.34Å; T598-L644 HydrophobicContact CG2-CB 3.97Å; T598-L644 HydrophobicContact CG2-CD1 4.38Å
599	Y	83.2	Confident	81.4	Confident	123 Å²	123	57.9 Å²	57.9	48%	0.482	27%	0.271	S	S	.	.	H	α-helix	trans	-60.9	-41.9	173	-75.6	-60.2	0	0	0	112.4	A595 D596 M602 Y603 L644	A595-Y599 HydrophobicContact CB-CE2 4.4Å; A595-Y599 WeakPolarHBondContact O-CD2 3.49Å; A595-Y599 PolarHBondContact O-N 3.13Å; D596-Y599 PolarHBondContact O-N 3.08Å; Y599-M602 HydrophobicContact CD1-SD 4.47Å; Y599-M602 WeakPolarHBondContact O-CB 3.44Å; Y599-M602 PolarHBondContact O-N 3.16Å; Y599-Y603 PolarHBondContact O-N 3.39Å; Y599-L644 HydrophobicContact CD2-CD1 4.41Å; Y599-L644 HydrophobicContact CE1-CD1 4.34Å; Y599-L644 HydrophobicContact CE1-CD2 4.02Å; Y599-L644 HydrophobicContact CE2-CD1 3.95Å
600	E	83.8	Confident	81.5	Confident	94 Å²	94	50.9 Å²	50.9	44%	0.439	25%	0.248	S	C	.	.	H	α-helix	trans	-62.9	-41.2	175.3	-70.5	-65.8	147.4	0	0	112.3	L562 T566 D596 T598 Y603 C604	L562-E600 HydrophobicContact CD1-CB 3.88Å; T566-E600 HydrophobicContact CG2-CB 4.3Å; D596-E600 PolarHBondContact O-N 3.3Å; D596-E600 VanDerWaalsContact O-N 3.12Å; T598-E600 VanDerWaalsContact C-N 3.35Å; T598-E600 PolarHBondContact O-N 3.19Å; E600-Y603 WeakPolarHBondContact O-CB 3.16Å; E600-Y603 PolarHBondContact O-N 3.38Å; E600-C604 PolarHBondContact O-N 3.43Å; E600-C604 PolarHBondContact O-SG 3.04Å
601	L	83.3	Confident	81	Confident	0 Å²	0	47 Å²	47	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-64.9	-38.9	174.3	-69.3	173.3	0	0	0	112.3	L561 L562 M565 L579 L586 F593 Q597 T598 Y603 C604 L605 L640	L561-L601 HydrophobicContact CD2-CD2 4.37Å; L562-L601 HydrophobicContact CD1-CD2 3.72Å; L562-L601 HydrophobicContact CD1-CG 3.85Å; M565-L601 HydrophobicContact SD-CD2 4.11Å; L579-L601 HydrophobicContact CD2-CD2 4.14Å; L586-L601 HydrophobicContact CD2-CD1 4.31Å; F593-L601 HydrophobicContact CD1-CD1 3.88Å; F593-L601 HydrophobicContact CD2-CD1 4.5Å; F593-L601 HydrophobicContact CE1-CD1 3.79Å; F593-L601 HydrophobicContact CE2-CD1 4.4Å; F593-L601 HydrophobicContact CG-CD1 4.23Å; F593-L601 HydrophobicContact CZ-CD1 4.07Å; Q597-L601 WeakPolarHBondContact O-CG 3.32Å; Q597-L601 PolarHBondContact O-N 2.87Å; T598-L601 PolarHBondContact O-N 3.06Å; L601-Y603 VanDerWaalsContact C-N 3.33Å; L601-C604 PolarHBondContact O-N 2.92Å; L601-L605 PolarHBondContact O-N 3.38Å; L601-L640 HydrophobicContact CB-CD2 3.71Å; L601-L640 HydrophobicContact CD1-CD2 4.11Å
602	M	83.2	Confident	80.3	Confident	77 Å²	77	48.2 Å²	48.2	38%	0.379	24%	0.241	S	C	.	.	H	α-helix	trans	-62.8	-40.8	174	-71.2	175.8	71.9	0	0	111.3	T598 Y599 L605 E606 L640 L644	T598-M602 VanDerWaalsContact O-CG 3.31Å; T598-M602 WeakPolarHBondContact O-CG 3.49Å; T598-M602 PolarHBondContact O-N 3.21Å; Y599-M602 HydrophobicContact CD1-SD 4.47Å; Y599-M602 WeakPolarHBondContact O-CB 3.44Å; Y599-M602 PolarHBondContact O-N 3.16Å; M602-L605 PolarHBondContact O-N 3.06Å; M602-E606 PolarHBondContact O-N 3.31Å; M602-L640 HydrophobicContact CG-CB 4.11Å; M602-L640 HydrophobicContact CG-CD1 3.94Å; M602-L640 HydrophobicContact CG-CD2 4.44Å; M602-L640 HydrophobicContact CG-CG 4.4Å; M602-L644 HydrophobicContact SD-CD2 4.27Å
603	Y	84.1	Confident	79.4	Confident	153 Å²	153	52.8 Å²	52.8	60%	0.6	27%	0.265	S	S	*	.	H	α-helix	trans	-62	-45.8	175	-179.1	-97	0	0	0	111.8	Y599 E600 L601 L605 E606 E607	Y599-Y603 PolarHBondContact O-N 3.39Å; E600-Y603 WeakPolarHBondContact O-CB 3.16Å; E600-Y603 PolarHBondContact O-N 3.38Å; L601-Y603 VanDerWaalsContact C-N 3.33Å; Y603-L605 VanDerWaalsContact C-N 3.33Å; Y603-L605 PolarHBondContact O-N 3.4Å; Y603-E606 PolarHBondContact O-N 3.25Å; Y603-E607 PolarHBondContact O-N 3.15Å
604	C	81.5	Confident	78.2	Confident	4 Å²	4	57.9 Å²	57.9	3%	0.027	30%	0.297	C	S	.	.	H	α-helix	trans	-63.6	-36.6	176.4	-68.1	0	0	0	0	113.2	M565 W575 E600 L601 L608	M565-C604 HydrophobicContact CE-CB 3.48Å; M565-C604 VanDerWaalsContact CE-CB 3.48Å; W575-C604 HydrophobicContact CE3-CB 4.41Å; W575-C604 HydrophobicContact CZ3-CB 4.32Å; E600-C604 PolarHBondContact O-N 3.43Å; E600-C604 PolarHBondContact O-SG 3.04Å; L601-C604 PolarHBondContact O-N 2.92Å; C604-L608 WeakPolarHBondContact O-CG 3.43Å; C604-L608 PolarHBondContact O-N 3.29Å
605	L	82.5	Confident	76.7	Confident	5 Å²	5	58.7 Å²	58.7	3%	0.026	31%	0.305	C	S	.	.	H	α-helix	trans	-64.5	-42.2	174.8	-180	65.6	0	0	0	111	L579 L601 M602 Y603 L608 T609 L636 R637 L640	L579-L605 HydrophobicContact CD1-CB 4.19Å; L579-L605 HydrophobicContact CD1-CD1 3.92Å; L601-L605 PolarHBondContact O-N 3.38Å; M602-L605 PolarHBondContact O-N 3.06Å; Y603-L605 VanDerWaalsContact C-N 3.33Å; Y603-L605 PolarHBondContact O-N 3.4Å; L605-L608 WeakPolarHBondContact O-CB 3.49Å; L605-L608 PolarHBondContact O-N 2.92Å; L605-T609 PolarHBondContact O-N 2.96Å; L605-T609 PolarHBondContact O-OG1 2.94Å; L605-T609 VanDerWaalsContact O-OG1 3.05Å; L605-L636 HydrophobicContact CD1-CB 4.34Å; L605-L636 HydrophobicContact CD1-CD1 4.02Å; L605-L636 HydrophobicContact CD2-CB 4.02Å; L605-R637 HydrophobicContact CD2-CG 3.82Å; L605-L640 HydrophobicContact CD2-CD1 3.82Å
606	E	82.6	Confident	75.2	Confident	103 Å²	103	60.7 Å²	60.7	48%	0.481	32%	0.322	S	S	.	.	H	α-helix	trans	-69.5	-36.6	179.6	-162.3	61.6	-150.6	0	0	112.5	M602 Y603 L608 T609 S610 R637	M602-E606 PolarHBondContact O-N 3.31Å; Y603-E606 PolarHBondContact O-N 3.25Å; E606-L608 VanDerWaalsContact C-N 3.26Å; E606-L608 PolarHBondContact O-N 3.25Å; E606-T609 WeakPolarHBondContact CA-OG1 3.09Å; E606-T609 PolarHBondContact O-N 3.45Å; E606-T609 PolarHBondContact O-OG1 3.2Å; E606-S610 WeakPolarHBondContact O-CB 3.4Å; E606-S610 PolarHBondContact O-N 3.28Å; E606-S610 PolarHBondContact O-OG 2.85Å; E606-R637 IonicContact OE2-NH2 2.76Å
607	E	81.8	Confident	73.7	Confident	41 Å²	41	59.3 Å²	59.3	19%	0.192	33%	0.327	C	S	.	.	H	α-helix	trans	-61.3	-35.7	171.6	-168.7	-177.6	167.6	0	0	111.3	R572 Y603 S610 S611	R572-E607 IonicContact CZ-OE1 3.02Å; R572-E607 IonicContact NE-OE1 3.96Å; R572-E607 IonicContact NH2-OE1 2.74Å; R572-E607 PolarHBondContact NH2-OE1 3.39Å; Y603-E607 PolarHBondContact O-N 3.15Å; E607-S610 PolarHBondContact O-OG 3.48Å; E607-S610 VanDerWaalsContact O-OG 3.05Å; E607-S611 WeakPolarHBondContact O-CB 3.44Å; E607-S611 PolarHBondContact O-N 2.91Å
608	L	79.3	Confident	71.9	Confident	16 Å²	16	60.5 Å²	60.5	8%	0.084	35%	0.352	C	S	.	.	H	α-helix	trans	-71.7	-49.9	175.9	-74.9	164.7	0	0	0	112.4	W575 L579 C604 L605 E606 S610 S611 I612	W575-L608 HydrophobicContact CB-CD1 3.42Å; W575-L608 VanDerWaalsContact CB-CD1 3.42Å; W575-L608 HydrophobicContact CB-CD2 3.87Å; W575-L608 HydrophobicContact CB-CG 4.11Å; W575-L608 HydrophobicContact CD2-CD2 4.45Å; W575-L608 HydrophobicContact CE3-CD1 4.05Å; W575-L608 HydrophobicContact CE3-CD2 4.06Å; W575-L608 HydrophobicContact CE3-CG 3.85Å; W575-L608 HydrophobicContact CG-CD1 4.42Å; W575-L608 HydrophobicContact CG-CD2 4.43Å; L579-L608 HydrophobicContact CD1-CD1 3.52Å; C604-L608 WeakPolarHBondContact O-CG 3.43Å; C604-L608 PolarHBondContact O-N 3.29Å; L605-L608 WeakPolarHBondContact O-CB 3.49Å; L605-L608 PolarHBondContact O-N 2.92Å; E606-L608 VanDerWaalsContact C-N 3.26Å; E606-L608 PolarHBondContact O-N 3.25Å; L608-S610 PolarHBondContact O-N 3.21Å; L608-S611 PolarHBondContact O-N 3.16Å; L608-S611 VanDerWaalsContact O-N 3.12Å; L608-S611 PolarHBondContact O-OG 3.42Å; L608-I612 VanDerWaalsContact O-CG1 3.3Å; L608-I612 WeakPolarHBondContact O-CG1 3.37Å; L608-I612 PolarHBondContact O-N 2.84Å
609	T	77.6	Confident	70.1	Confident	12 Å²	12	62.7 Å²	62.7	7%	0.074	38%	0.375	C	S	.	.	H	α-helix	trans	-62.3	-42.2	-179.1	35.7	0	0	0	0	111.9	L605 E606 S611 I612 D613 V633	L605-T609 PolarHBondContact O-N 2.96Å; L605-T609 PolarHBondContact O-OG1 2.94Å; L605-T609 VanDerWaalsContact O-OG1 3.05Å; E606-T609 WeakPolarHBondContact CA-OG1 3.09Å; E606-T609 PolarHBondContact O-N 3.45Å; E606-T609 PolarHBondContact O-OG1 3.2Å; T609-S611 VanDerWaalsContact C-N 3.26Å; T609-S611 PolarHBondContact O-N 3.11Å; T609-I612 PolarHBondContact O-N 3.16Å; T609-I612 VanDerWaalsContact O-N 3.12Å; T609-D613 PolarHBondContact O-N 3.34Å; T609-V633 HydrophobicContact CG2-CG1 3.79Å; T609-V633 HydrophobicContact CG2-CG2 4.02Å
610	S	73.9	Confident	68.2	Low	58 Å²	58	66.6 Å²	66.6	41%	0.406	40%	0.397	S	S	.	.	H	α-helix	trans	-60.5	-35.9	174.8	56.4	0	0	0	0	112.7	E606 E607 L608 T614	E606-S610 WeakPolarHBondContact O-CB 3.4Å; E606-S610 PolarHBondContact O-N 3.28Å; E606-S610 PolarHBondContact O-OG 2.85Å; E607-S610 PolarHBondContact O-OG 3.48Å; E607-S610 VanDerWaalsContact O-OG 3.05Å; L608-S610 PolarHBondContact O-N 3.21Å; S610-T614 WeakPolarHBondContact O-CG2 3.19Å; S610-T614 PolarHBondContact O-N 3.06Å; S610-T614 PolarHBondContact O-OG1 3.45Å
611	S	65.4	Low	66.5	Low	54 Å²	54	67.9 Å²	67.9	38%	0.378	40%	0.398	S	S	.	.	H	α-helix	trans	-71	-36.4	174.9	78.2	0	0	0	0	113.2	E607 L608 T609 T614 A615	E607-S611 WeakPolarHBondContact O-CB 3.44Å; E607-S611 PolarHBondContact O-N 2.91Å; L608-S611 PolarHBondContact O-N 3.16Å; L608-S611 VanDerWaalsContact O-N 3.12Å; L608-S611 PolarHBondContact O-OG 3.42Å; T609-S611 VanDerWaalsContact C-N 3.26Å; T609-S611 PolarHBondContact O-N 3.11Å; S611-T614 PolarHBondContact O-N 2.71Å; S611-T614 PolarHBondContact O-OG1 3.44Å; S611-A615 PolarHBondContact O-N 3.02Å; S611-A615 VanDerWaalsContact O-N 3.16Å
612	I	64.8	Low	65	Low	46 Å²	46	71.8 Å²	71.8	24%	0.236	42%	0.423	C	S	.	.	H	α-helix	trans	-68	-43.8	177.4	-67.6	163.4	0	0	0	110.1	L608 T609 T614 A615 A616	L608-I612 VanDerWaalsContact O-CG1 3.3Å; L608-I612 WeakPolarHBondContact O-CG1 3.37Å; L608-I612 PolarHBondContact O-N 2.84Å; T609-I612 PolarHBondContact O-N 3.16Å; T609-I612 VanDerWaalsContact O-N 3.12Å; I612-T614 VanDerWaalsContact C-N 3.26Å; I612-T614 PolarHBondContact O-N 3.1Å; I612-A615 PolarHBondContact O-N 3.37Å; I612-A616 WeakPolarHBondContact O-CB 3.37Å; I612-A616 PolarHBondContact O-N 2.96Å
613	D	61.1	Low	63.6	Low	114 Å²	114	75 Å²	75	61%	0.61	44%	0.44	S	S	*	.	H	α-helix	trans	-60.9	-35.3	177.5	-66.9	-24	0	0	0	111.9	T609	T609-D613 PolarHBondContact O-N 3.34Å
614	T	58.3	Low	62.1	Low	107 Å²	107	75.5 Å²	75.5	66%	0.656	45%	0.447	S	S	*	.	H	α-helix	trans	-74.9	-28.7	174.5	57.9	0	0	0	0	114.2	S610 S611 I612	S610-T614 WeakPolarHBondContact O-CG2 3.19Å; S610-T614 PolarHBondContact O-N 3.06Å; S610-T614 PolarHBondContact O-OG1 3.45Å; S611-T614 PolarHBondContact O-N 2.71Å; S611-T614 PolarHBondContact O-OG1 3.44Å; I612-T614 VanDerWaalsContact C-N 3.26Å; I612-T614 PolarHBondContact O-N 3.1Å
615	A	53	Low	60.9	Low	48 Å²	48	81.1 Å²	81.1	40%	0.397	47%	0.473	S	S	.	.	H	α-helix	trans	-82.4	-33.5	179.6	0	0	0	0	0	112.7	S611 I612 A617 G618	S611-A615 PolarHBondContact O-N 3.02Å; S611-A615 VanDerWaalsContact O-N 3.16Å; I612-A615 PolarHBondContact O-N 3.37Å; A615-A617 PolarHBondContact O-N 3.01Å; A615-G618 PolarHBondContact O-N 3.39Å; A615-G618 VanDerWaalsContact O-N 3.16Å
616	A	50.7	Low	59.9	Low	50 Å²	50	84.4 Å²	84.4	41%	0.413	49%	0.488	S	S	.	.	H	α-helix	trans	-63.9	-24.2	174.6	0	0	0	0	0	112.8	I612 G618	I612-A616 WeakPolarHBondContact O-CB 3.37Å; I612-A616 PolarHBondContact O-N 2.96Å; A616-G618 PolarHBondContact O-N 3.26Å
617	A	50.1	Low	58.9	Low	93 Å²	93	84.3 Å²	84.3	77%	0.769	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.4	-7.5	174.5	0	0	0	0	0	114.4	A615	A615-A617 PolarHBondContact O-N 3.01Å
618	G	47.2	Very low	58.2	Low	73 Å²	73	86.2 Å²	86.2	75%	0.753	51%	0.505	S	S	*	.	S	Bend	trans	-127.7	-1.9	-171.2	0	0	0	0	0	117.5	A615 A616	A615-G618 PolarHBondContact O-N 3.39Å; A615-G618 VanDerWaalsContact O-N 3.16Å; A616-G618 PolarHBondContact O-N 3.26Å
619	G	45.7	Very low	57.9	Low	46 Å²	46	88.7 Å²	88.7	47%	0.474	52%	0.517	S	S	.	.	S	Bend	trans	-165.5	139.6	179.1	0	0	0	0	0	114.8	R621	G619-R621 PolarHBondContact O-N 3.22Å; G619-R621 VanDerWaalsContact O-N 3.17Å
620	E	41.8	Very low	57.8	Low	204 Å²	204	93.8 Å²	93.8	95%	0.953	54%	0.539	S	S	*	.			trans	-66.2	104.3	176.7	-66.9	-179.6	163.7	0	0	110.8
621	R	49.3	Very low	57.9	Low	122 Å²	122	94.7 Å²	94.7	46%	0.46	54%	0.543	S	S	.	.			trans	-92.1	148.8	162.7	-73.1	-174.9	-177.7	177.2	2	109.7	G619 M623 E626 E629	G619-R621 PolarHBondContact O-N 3.22Å; G619-R621 VanDerWaalsContact O-N 3.17Å; R621-M623 PolarHBondContact O-N 3.13Å; R621-E626 HydrophobicContact CB-CG 4.41Å; R621-E629 IonicContact NH1-OE2 3.45Å
622	P	51.9	Low	58.6	Low	81 Å²	81	96 Å²	96	53%	0.526	54%	0.541	S	S	.	.			trans	-66.4	126.5	178.4	24.6	-30.9	0	0	0	111.4	Q624 E625	P622-Q624 PolarHBondContact O-N 3.2Å; P622-E625 HydrophobicContact CG-CG 4.42Å; P622-E625 PolarHBondContact O-N 2.99Å
623	M	52.1	Low	59.5	Low	146 Å²	146	94.3 Å²	94.3	72%	0.719	53%	0.534	S	S	*	.	H	α-helix	trans	-44.4	-32.8	-176.7	-89.7	175.9	71.4	0	0	115.7	R621 D627	R621-M623 PolarHBondContact O-N 3.13Å; M623-D627 PolarHBondContact O-N 3.27Å
624	Q	54.1	Low	60.5	Low	162 Å²	162	94.4 Å²	94.4	76%	0.757	53%	0.53	S	S	*	.	H	α-helix	trans	-71.3	-29.8	-177.6	-75.4	178.7	-6.5	0	0	113.9	P622 V628	P622-Q624 PolarHBondContact O-N 3.2Å; Q624-V628 WeakPolarHBondContact O-CG2 3.46Å
625	E	56.3	Low	61.7	Low	122 Å²	122	93.2 Å²	93.2	57%	0.57	52%	0.52	S	S	*	.	H	α-helix	trans	-77.3	-33.4	177	-74.5	-177.9	160.4	0	0	111.3	P622 V628 E629	P622-E625 HydrophobicContact CG-CG 4.42Å; P622-E625 PolarHBondContact O-N 2.99Å; E625-V628 PolarHBondContact O-N 3.1Å; E625-E629 PolarHBondContact O-N 3.2Å
626	E	60.4	Low	63.3	Low	74 Å²	74	91 Å²	91	35%	0.346	50%	0.501	S	S	.	.	H	α-helix	trans	-63.9	-45.3	175.3	-69.3	-177.3	161.1	0	0	111.7	R621 V628 E629 Q630	R621-E626 HydrophobicContact CB-CG 4.41Å; E626-V628 VanDerWaalsContact C-N 3.3Å; E626-V628 PolarHBondContact O-N 2.99Å; E626-E629 PolarHBondContact O-N 3.39Å; E626-Q630 VanDerWaalsContact O-CB 3.26Å; E626-Q630 WeakPolarHBondContact O-CB 3.33Å; E626-Q630 PolarHBondContact O-N 3.34Å
627	D	62.1	Low	64.9	Low	101 Å²	101	94.3 Å²	94.3	54%	0.54	50%	0.503	S	S	.	.	H	α-helix	trans	-60.1	-38.8	177.6	-78.9	-19.7	0	0	0	112.4	M623 T631	M623-D627 PolarHBondContact O-N 3.27Å; D627-T631 WeakPolarHBondContact O-CB 3.27Å; D627-T631 PolarHBondContact O-N 3.42Å; D627-T631 PolarHBondContact O-OG1 3.1Å
628	V	67.9	Low	66.7	Low	81 Å²	81	93.9 Å²	93.9	49%	0.491	49%	0.487	S	S	.	.	H	α-helix	trans	-73	-42.5	179.7	174.6	0	0	0	0	111.4	Q624 E625 E626 Q630 T631 K632	Q624-V628 WeakPolarHBondContact O-CG2 3.46Å; E625-V628 PolarHBondContact O-N 3.1Å; E626-V628 VanDerWaalsContact C-N 3.3Å; E626-V628 PolarHBondContact O-N 2.99Å; V628-Q630 VanDerWaalsContact C-N 3.34Å; V628-T631 PolarHBondContact O-N 3.07Å; V628-K632 WeakPolarHBondContact O-CG 3.45Å; V628-K632 PolarHBondContact O-N 2.64Å; V628-K632 VanDerWaalsContact O-N 3.08Å
629	E	71.5	Confident	68.4	Low	69 Å²	69	90.4 Å²	90.4	32%	0.322	45%	0.451	S	S	.	.	H	α-helix	trans	-64.1	-41.1	175.3	-76.2	-167.7	154.7	0	0	111.4	M576 R621 E625 E626 K632 V633	M576-E629 HydrophobicContact CE-CB 4.43Å; R621-E629 IonicContact NH1-OE2 3.45Å; E625-E629 PolarHBondContact O-N 3.2Å; E626-E629 PolarHBondContact O-N 3.39Å; E629-K632 WeakPolarHBondContact O-CB 3.42Å; E629-K632 PolarHBondContact O-N 3.21Å; E629-V633 WeakPolarHBondContact O-CG2 3.36Å; E629-V633 PolarHBondContact O-N 3.06Å
630	Q	76.1	Confident	70.3	Confident	118 Å²	118	88.4 Å²	88.4	55%	0.551	43%	0.43	S	S	*	.	H	α-helix	trans	-65.2	-41.3	178.2	-167.5	150.4	-7.9	0	0	112	E626 V628 K632 V633 E634	E626-Q630 VanDerWaalsContact O-CB 3.26Å; E626-Q630 WeakPolarHBondContact O-CB 3.33Å; E626-Q630 PolarHBondContact O-N 3.34Å; V628-Q630 VanDerWaalsContact C-N 3.34Å; Q630-K632 VanDerWaalsContact C-N 3.31Å; Q630-K632 PolarHBondContact O-N 3.43Å; Q630-V633 PolarHBondContact O-N 3.38Å; Q630-E634 WeakPolarHBondContact O-CG 3.49Å; Q630-E634 PolarHBondContact O-N 2.76Å
631	T	77.3	Confident	72.3	Confident	78 Å²	78	81.2 Å²	81.2	48%	0.479	41%	0.405	S	S	.	.	H	α-helix	trans	-59.9	-40.7	172.8	-55.1	0	0	0	0	111.7	D627 V628 E634 L635	D627-T631 WeakPolarHBondContact O-CB 3.27Å; D627-T631 PolarHBondContact O-N 3.42Å; D627-T631 PolarHBondContact O-OG1 3.1Å; V628-T631 PolarHBondContact O-N 3.07Å; T631-E634 PolarHBondContact O-N 3.48Å; T631-L635 HydrophobicContact CG2-CD1 4.16Å; T631-L635 PolarHBondContact O-N 2.9Å
632	K	80.1	Confident	74	Confident	80 Å²	80	81.9 Å²	81.9	35%	0.348	41%	0.408	S	S	.	.	H	α-helix	trans	-63.8	-41.6	175.6	-72.4	174.8	-177.6	176.7	0	112.1	V628 E629 Q630 L635 L636	V628-K632 WeakPolarHBondContact O-CG 3.45Å; V628-K632 PolarHBondContact O-N 2.64Å; V628-K632 VanDerWaalsContact O-N 3.08Å; E629-K632 WeakPolarHBondContact O-CB 3.42Å; E629-K632 PolarHBondContact O-N 3.21Å; Q630-K632 VanDerWaalsContact C-N 3.31Å; Q630-K632 PolarHBondContact O-N 3.43Å; K632-L635 PolarHBondContact O-N 2.89Å; K632-L636 WeakPolarHBondContact O-CB 3.24Å; K632-L636 WeakPolarHBondContact O-CD1 3.29Å; K632-L636 VanDerWaalsContact O-CG 3.28Å; K632-L636 WeakPolarHBondContact O-CG 3.32Å; K632-L636 PolarHBondContact O-N 3.29Å
633	V	82.8	Confident	75.6	Confident	12 Å²	12	78 Å²	78	7%	0.073	38%	0.383	C	S	.	.	H	α-helix	trans	-62.3	-43.6	176.8	173.4	0	0	0	0	111.2	M576 T609 E629 Q630 L636 R637	M576-V633 HydrophobicContact CE-CG2 3.55Å; T609-V633 HydrophobicContact CG2-CG1 3.79Å; T609-V633 HydrophobicContact CG2-CG2 4.02Å; E629-V633 WeakPolarHBondContact O-CG2 3.36Å; E629-V633 PolarHBondContact O-N 3.06Å; Q630-V633 PolarHBondContact O-N 3.38Å; V633-L636 PolarHBondContact O-N 3.42Å; V633-R637 HydrophobicContact CG1-CG 4.5Å; V633-R637 WeakPolarHBondContact O-CG 3.2Å; V633-R637 PolarHBondContact O-N 3.34Å
634	E	82.6	Confident	77.2	Confident	116 Å²	116	72.1 Å²	72.1	54%	0.542	35%	0.354	S	S	.	.	H	α-helix	trans	-63.2	-44.2	178	-72	-178.5	179.9	0	0	112.2	Q630 T631 R637 L638	Q630-E634 WeakPolarHBondContact O-CG 3.49Å; Q630-E634 PolarHBondContact O-N 2.76Å; T631-E634 PolarHBondContact O-N 3.48Å; E634-R637 PolarHBondContact O-N 3.24Å; E634-L638 WeakPolarHBondContact O-CB 3.19Å; E634-L638 PolarHBondContact O-N 3.32Å
635	L	83.4	Confident	78.6	Confident	82 Å²	82	67.2 Å²	67.2	43%	0.429	34%	0.341	S	S	.	.	H	α-helix	trans	-57.9	-48.2	173.1	-83.5	157.1	0	0	0	111.3	T631 K632 R637 L638 S639	T631-L635 HydrophobicContact CG2-CD1 4.16Å; T631-L635 PolarHBondContact O-N 2.9Å; K632-L635 PolarHBondContact O-N 2.89Å; L635-R637 PolarHBondContact O-N 2.95Å; L635-L638 PolarHBondContact O-N 2.56Å; L635-S639 PolarHBondContact O-N 3.39Å; L635-S639 PolarHBondContact O-OG 3.03Å
636	L	85.4	Confident	79.8	Confident	1 Å²	1	64.8 Å²	64.8	1%	0.005	33%	0.331	C	S	.	.	H	α-helix	trans	-59.3	-46	177.8	-75.4	164.5	0	0	0	112.5	M576 L579 L583 L605 K632 V633 L638 S639 L640	M576-L636 HydrophobicContact SD-CD1 4.02Å; L579-L636 HydrophobicContact CB-CD1 3.87Å; L579-L636 HydrophobicContact CB-CD2 3.88Å; L579-L636 VanDerWaalsContact O-CD2 3.22Å; L579-L636 WeakPolarHBondContact O-CD2 3.41Å; L583-L636 HydrophobicContact CD1-CD2 4.16Å; L583-L636 HydrophobicContact CD1-CG 4.42Å; L583-L636 HydrophobicContact CD2-CD2 3.48Å; L583-L636 VanDerWaalsContact CD2-CD2 3.48Å; L583-L636 HydrophobicContact CD2-CG 4.01Å; L583-L636 HydrophobicContact CG-CD2 3.59Å; L583-L636 HydrophobicContact CG-CG 4.3Å; L605-L636 HydrophobicContact CD1-CB 4.34Å; L605-L636 HydrophobicContact CD1-CD1 4.02Å; L605-L636 HydrophobicContact CD2-CB 4.02Å; K632-L636 WeakPolarHBondContact O-CB 3.24Å; K632-L636 WeakPolarHBondContact O-CD1 3.29Å; K632-L636 VanDerWaalsContact O-CG 3.28Å; K632-L636 WeakPolarHBondContact O-CG 3.32Å; K632-L636 PolarHBondContact O-N 3.29Å; V633-L636 PolarHBondContact O-N 3.42Å; L636-L638 VanDerWaalsContact C-N 3.3Å; L636-L638 PolarHBondContact O-N 3.26Å; L636-S639 PolarHBondContact O-N 3.4Å; L636-L640 VanDerWaalsContact O-CB 3.29Å; L636-L640 WeakPolarHBondContact O-CB 3.13Å; L636-L640 WeakPolarHBondContact O-CD1 3.31Å; L636-L640 WeakPolarHBondContact O-CG 3.34Å; L636-L640 PolarHBondContact O-N 3.33Å
637	R	85.9	Confident	80.9	Confident	120 Å²	120	61.3 Å²	61.3	45%	0.453	31%	0.314	S	S	.	.	H	α-helix	trans	-59.6	-42	176.6	-74.8	177.6	172.6	158.2	-2.5	111.6	L605 E606 V633 E634 L635 A641	L605-R637 HydrophobicContact CD2-CG 3.82Å; E606-R637 IonicContact OE2-NH2 2.76Å; V633-R637 HydrophobicContact CG1-CG 4.5Å; V633-R637 WeakPolarHBondContact O-CG 3.2Å; V633-R637 PolarHBondContact O-N 3.34Å; E634-R637 PolarHBondContact O-N 3.24Å; L635-R637 PolarHBondContact O-N 2.95Å; R637-A641 WeakPolarHBondContact O-CB 3.39Å; R637-A641 PolarHBondContact O-N 3.42Å
638	L	86.1	Confident	82	Confident	83 Å²	83	60.5 Å²	60.5	44%	0.435	31%	0.31	S	S	.	.	H	α-helix	trans	-66.3	-47.9	179.2	-176	66.5	0	0	0	112	E634 L635 L636 A641 R642	E634-L638 WeakPolarHBondContact O-CB 3.19Å; E634-L638 PolarHBondContact O-N 3.32Å; L635-L638 PolarHBondContact O-N 2.56Å; L636-L638 VanDerWaalsContact C-N 3.3Å; L636-L638 PolarHBondContact O-N 3.26Å; L638-A641 PolarHBondContact O-N 2.98Å; L638-R642 WeakPolarHBondContact O-CG 3.22Å; L638-R642 PolarHBondContact O-N 3.37Å
639	S	83.6	Confident	82.7	Confident	1 Å²	1	61.4 Å²	61.4	1%	0.007	32%	0.315	C	S	.	.	H	α-helix	trans	-68.3	-37.7	-178.7	-48.8	0	0	0	0	111.5	L583 E587 L635 L636 R642 N643	L583-S639 WeakPolarHBondContact CD2-OG 3.35Å; E587-S639 PolarHBondContact OE1-OG 3.3Å; L635-S639 PolarHBondContact O-N 3.39Å; L635-S639 PolarHBondContact O-OG 3.03Å; L636-S639 PolarHBondContact O-N 3.4Å; S639-R642 PolarHBondContact O-N 3.23Å; S639-N643 PolarHBondContact O-N 3.26Å
640	L	85.5	Confident	83.1	Confident	3 Å²	3	62.4 Å²	62.4	2%	0.016	32%	0.318	C	S	.	.	H	α-helix	trans	-62.8	-45.9	172.9	-73.1	166.9	0	0	0	111.8	L586 T598 L601 M602 L605 L636 R642 N643 L644	L586-L640 HydrophobicContact CD1-CD2 3.67Å; L586-L640 HydrophobicContact CD1-CG 4.06Å; L586-L640 HydrophobicContact CD2-CD2 3.97Å; T598-L640 HydrophobicContact CG2-CB 4.41Å; T598-L640 HydrophobicContact CG2-CD2 3.91Å; L601-L640 HydrophobicContact CB-CD2 3.71Å; L601-L640 HydrophobicContact CD1-CD2 4.11Å; M602-L640 HydrophobicContact CG-CB 4.11Å; M602-L640 HydrophobicContact CG-CD1 3.94Å; M602-L640 HydrophobicContact CG-CD2 4.44Å; M602-L640 HydrophobicContact CG-CG 4.4Å; L605-L640 HydrophobicContact CD2-CD1 3.82Å; L636-L640 VanDerWaalsContact O-CB 3.29Å; L636-L640 WeakPolarHBondContact O-CB 3.13Å; L636-L640 WeakPolarHBondContact O-CD1 3.31Å; L636-L640 WeakPolarHBondContact O-CG 3.34Å; L636-L640 PolarHBondContact O-N 3.33Å; L640-R642 VanDerWaalsContact C-N 3.34Å; L640-R642 PolarHBondContact O-N 2.92Å; L640-N643 PolarHBondContact O-N 3.18Å; L640-L644 WeakPolarHBondContact O-CB 3.34Å; L640-L644 PolarHBondContact O-N 2.88Å
641	A	84.9	Confident	83.3	Confident	54 Å²	54	60.6 Å²	60.6	45%	0.446	31%	0.31	S	S	.	.	H	α-helix	trans	-63	-39.4	178	0	0	0	0	0	112.5	R637 L638 A645	R637-A641 WeakPolarHBondContact O-CB 3.39Å; R637-A641 PolarHBondContact O-N 3.42Å; L638-A641 PolarHBondContact O-N 2.98Å; A641-A645 WeakPolarHBondContact O-CB 3.29Å; A641-A645 PolarHBondContact O-N 3.18Å
642	R	84.1	Confident	82.7	Confident	135 Å²	135	59.3 Å²	59.3	51%	0.509	31%	0.312	S	S	.	.	H	α-helix	trans	-65.4	-47.4	175.3	-75.2	174	175.7	168.6	-0.6	111.9	L638 S639 L640 L644 A645 M646	L638-R642 WeakPolarHBondContact O-CG 3.22Å; L638-R642 PolarHBondContact O-N 3.37Å; S639-R642 PolarHBondContact O-N 3.23Å; L640-R642 VanDerWaalsContact C-N 3.34Å; L640-R642 PolarHBondContact O-N 2.92Å; R642-L644 VanDerWaalsContact C-N 3.33Å; R642-L644 PolarHBondContact O-N 3.33Å; R642-A645 PolarHBondContact O-N 3.24Å; R642-M646 WeakPolarHBondContact O-CG 3.49Å; R642-M646 PolarHBondContact O-N 3.04Å
643	N	85.1	Confident	82	Confident	0 Å²	0	59.5 Å²	59.5	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-62.7	-42.1	177.3	-173.8	74.1	0	0	0	111.3	L586 F593 T598 S639 L640 A645 M646 A647	L586-N643 HydrophobicContact CB-CB 4.41Å; L586-N643 HydrophobicContact CD2-CB 3.76Å; F593-N643 PolarHBondContact O-ND2 3.16Å; T598-N643 PolarHBondContact OG1-ND2 3.34Å; S639-N643 PolarHBondContact O-N 3.26Å; L640-N643 PolarHBondContact O-N 3.18Å; N643-A645 PolarHBondContact O-N 3.18Å; N643-M646 PolarHBondContact O-N 2.88Å; N643-A647 VanDerWaalsContact O-CB 3.27Å; N643-A647 WeakPolarHBondContact O-CB 3.31Å; N643-A647 PolarHBondContact O-N 3.48Å
644	L	85.2	Confident	80.7	Confident	23 Å²	23	64.3 Å²	64.3	12%	0.12	35%	0.349	C	S	.	.	H	α-helix	trans	-59.2	-45.7	176.9	-174.4	65.2	0	0	0	111.6	A595 T598 Y599 M602 L640 R642 M646 A647 I648	A595-L644 HydrophobicContact CB-CD1 4.05Å; T598-L644 HydrophobicContact CG2-CB 3.97Å; T598-L644 HydrophobicContact CG2-CD1 4.38Å; Y599-L644 HydrophobicContact CD2-CD1 4.41Å; Y599-L644 HydrophobicContact CE1-CD1 4.34Å; Y599-L644 HydrophobicContact CE1-CD2 4.02Å; Y599-L644 HydrophobicContact CE2-CD1 3.95Å; M602-L644 HydrophobicContact SD-CD2 4.27Å; L640-L644 WeakPolarHBondContact O-CB 3.34Å; L640-L644 PolarHBondContact O-N 2.88Å; R642-L644 VanDerWaalsContact C-N 3.33Å; R642-L644 PolarHBondContact O-N 3.33Å; L644-M646 PolarHBondContact O-N 3.22Å; L644-A647 PolarHBondContact O-N 3.15Å; L644-I648 HydrophobicContact CD1-CD1 4.01Å; L644-I648 HydrophobicContact CD1-CG1 4.28Å; L644-I648 HydrophobicContact CG-CD1 3.82Å; L644-I648 HydrophobicContact CG-CG1 4.46Å; L644-I648 WeakPolarHBondContact O-CB 3.38Å; L644-I648 VanDerWaalsContact O-CG1 3.26Å; L644-I648 WeakPolarHBondContact O-CG1 3.4Å; L644-I648 PolarHBondContact O-N 3.1Å
645	A	83.8	Confident	78.8	Confident	59 Å²	59	67.3 Å²	67.3	49%	0.488	36%	0.363	S	S	.	.	H	α-helix	trans	-61.2	-42.9	176.6	0	0	0	0	0	112.1	A641 R642 N643 V649	A641-A645 WeakPolarHBondContact O-CB 3.29Å; A641-A645 PolarHBondContact O-N 3.18Å; R642-A645 PolarHBondContact O-N 3.24Å; N643-A645 PolarHBondContact O-N 3.18Å; A645-V649 VanDerWaalsContact O-CG2 3.28Å; A645-V649 WeakPolarHBondContact O-CG2 3.27Å; A645-V649 PolarHBondContact O-N 2.89Å
646	M	82.6	Confident	76.7	Confident	71 Å²	71	71.9 Å²	71.9	35%	0.35	40%	0.395	S	S	.	.	H	α-helix	trans	-67.7	-39.6	176.4	-67.5	-172.9	-63	0	0	112.5	V591 R642 N643 L644 K650	V591-M646 HydrophobicContact CG2-CB 3.81Å; R642-M646 WeakPolarHBondContact O-CG 3.49Å; R642-M646 PolarHBondContact O-N 3.04Å; N643-M646 PolarHBondContact O-N 2.88Å; L644-M646 PolarHBondContact O-N 3.22Å; M646-K650 VanDerWaalsContact O-CB 3.31Å; M646-K650 WeakPolarHBondContact O-CB 3.45Å; M646-K650 PolarHBondContact O-N 2.99Å
647	A	83.6	Confident	76.3	Confident	0 Å²	0	75.5 Å²	75.5	0%	0	41%	0.414	C	S	.	.	H	α-helix	trans	-65.8	-47.8	179.9	0	0	0	0	0	111.5	V591 N643 L644 V649 K650 E651	V591-A647 HydrophobicContact CG1-CB 3.66Å; N643-A647 VanDerWaalsContact O-CB 3.27Å; N643-A647 WeakPolarHBondContact O-CB 3.31Å; N643-A647 PolarHBondContact O-N 3.48Å; L644-A647 PolarHBondContact O-N 3.15Å; A647-V649 VanDerWaalsContact C-N 3.33Å; A647-V649 PolarHBondContact O-N 2.96Å; A647-K650 PolarHBondContact O-N 3.06Å; A647-E651 VanDerWaalsContact O-CB 3.32Å; A647-E651 WeakPolarHBondContact O-CB 3.32Å; A647-E651 WeakPolarHBondContact O-CG 3.5Å; A647-E651 PolarHBondContact O-N 3.46Å
648	I	84.1	Confident	75.8	Confident	85 Å²	85	73.1 Å²	73.1	44%	0.436	41%	0.412	S	S	.	.	H	α-helix	trans	-59.4	-44.2	177.5	-69.2	168.8	0	0	0	111.1	A595 L644 G652	A595-I648 HydrophobicContact CB-CG1 4.23Å; L644-I648 HydrophobicContact CD1-CD1 4.01Å; L644-I648 HydrophobicContact CD1-CG1 4.28Å; L644-I648 HydrophobicContact CG-CD1 3.82Å; L644-I648 HydrophobicContact CG-CG1 4.46Å; L644-I648 WeakPolarHBondContact O-CB 3.38Å; L644-I648 VanDerWaalsContact O-CG1 3.26Å; L644-I648 WeakPolarHBondContact O-CG1 3.4Å; L644-I648 PolarHBondContact O-N 3.1Å; I648-G652 PolarHBondContact O-N 2.73Å
649	V	82.1	Confident	75.2	Confident	99 Å²	99	72.6 Å²	72.6	60%	0.6	41%	0.411	S	S	*	.	H	α-helix	trans	-63.5	-46.7	177.3	172.2	0	0	0	0	110.3	A645 A647 T653	A645-V649 VanDerWaalsContact O-CG2 3.28Å; A645-V649 WeakPolarHBondContact O-CG2 3.27Å; A645-V649 PolarHBondContact O-N 2.89Å; A647-V649 VanDerWaalsContact C-N 3.33Å; A647-V649 PolarHBondContact O-N 2.96Å; V649-T653 HydrophobicContact CG1-CG2 4.47Å; V649-T653 WeakPolarHBondContact O-CB 3.41Å; V649-T653 WeakPolarHBondContact O-CG2 3.3Å; V649-T653 PolarHBondContact O-N 2.87Å; V649-T653 PolarHBondContact O-OG1 3.21Å
650	K	79.9	Confident	74.7	Confident	91 Å²	91	76.8 Å²	76.8	40%	0.396	44%	0.435	S	S	.	.	H	α-helix	trans	-67.8	-46.1	-177	-167.5	177.5	-178.5	176.4	0	112.4	V591 M646 A647 T653 V654	V591-K650 HydrophobicContact CB-CD 3.8Å; V591-K650 HydrophobicContact CG2-CB 4.15Å; V591-K650 HydrophobicContact CG2-CD 3.65Å; M646-K650 VanDerWaalsContact O-CB 3.31Å; M646-K650 WeakPolarHBondContact O-CB 3.45Å; M646-K650 PolarHBondContact O-N 2.99Å; A647-K650 PolarHBondContact O-N 3.06Å; K650-T653 WeakPolarHBondContact CA-OG1 3.24Å; K650-T653 PolarHBondContact O-N 3.39Å; K650-T653 PolarHBondContact O-OG1 2.76Å; K650-V654 VanDerWaalsContact O-CG2 3.25Å; K650-V654 WeakPolarHBondContact O-CG2 3.44Å; K650-V654 PolarHBondContact O-N 3.2Å
651	E	80.5	Confident	74	Confident	80 Å²	80	81.4 Å²	81.4	37%	0.374	46%	0.461	S	S	.	.	H	α-helix	trans	-65.2	-42.1	177.6	-70.5	168.9	-173.3	0	0	110.9	S594 A595 A647 T653 V654	S594-E651 WeakPolarHBondContact CA-OE1 3.14Å; S594-E651 WeakPolarHBondContact CB-OE1 3.39Å; A595-E651 VanDerWaalsContact CB-OE2 3.3Å; A595-E651 WeakPolarHBondContact CB-OE2 3.5Å; A595-E651 PolarHBondContact N-OE1 3.03Å; A595-E651 VanDerWaalsContact N-OE1 3.1Å; A647-E651 VanDerWaalsContact O-CB 3.32Å; A647-E651 WeakPolarHBondContact O-CB 3.32Å; A647-E651 WeakPolarHBondContact O-CG 3.5Å; A647-E651 PolarHBondContact O-N 3.46Å; E651-T653 VanDerWaalsContact C-N 3.29Å; E651-T653 PolarHBondContact O-N 2.93Å; E651-V654 PolarHBondContact O-N 3.06Å
652	G	65.8	Low	73.3	Confident	51 Å²	51	83.2 Å²	83.2	53%	0.526	46%	0.462	S	S	.	.	H	α-helix	trans	-67.1	-24	174.9	0	0	0	0	0	114.5	I648	I648-G652 PolarHBondContact O-N 2.73Å
653	T	64.3	Low	72.5	Confident	83 Å²	83	79.5 Å²	79.5	51%	0.509	46%	0.458	S	S	.	.	H	α-helix	trans	-85	-13.5	174.9	52.6	0	0	0	0	114.7	V649 K650 E651	V649-T653 HydrophobicContact CG1-CG2 4.47Å; V649-T653 WeakPolarHBondContact O-CB 3.41Å; V649-T653 WeakPolarHBondContact O-CG2 3.3Å; V649-T653 PolarHBondContact O-N 2.87Å; V649-T653 PolarHBondContact O-OG1 3.21Å; K650-T653 WeakPolarHBondContact CA-OG1 3.24Å; K650-T653 PolarHBondContact O-N 3.39Å; K650-T653 PolarHBondContact O-OG1 2.76Å; E651-T653 VanDerWaalsContact C-N 3.29Å; E651-T653 PolarHBondContact O-N 2.93Å
654	V	56.3	Low	71.6	Confident	113 Å²	113	85.6 Å²	85.6	69%	0.685	49%	0.494	S	S	*	.	H	α-helix	trans	-88.1	-11.6	-178.6	174.1	0	0	0	0	112	K650 E651 T656	K650-V654 VanDerWaalsContact O-CG2 3.25Å; K650-V654 WeakPolarHBondContact O-CG2 3.44Å; K650-V654 PolarHBondContact O-N 3.2Å; E651-V654 PolarHBondContact O-N 3.06Å; V654-T656 VanDerWaalsContact C-N 3.33Å; V654-T656 PolarHBondContact O-N 3.47Å
655	E	43.5	Very low	70.4	Confident	179 Å²	179	90.8 Å²	90.8	84%	0.836	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.2	18.8	175	-70.8	-165.9	152.2	0	0	115
656	T	38.7	Very low	69.2	Low	179 Å²	179	93.7 Å²	93.7	100%	1.098	53%	0.528	S	S	*	.			trans	-127.9	0	166.7	55.5	0	0	0	0	110.6	V654	V654-T656 VanDerWaalsContact C-N 3.33Å; V654-T656 PolarHBondContact O-N 3.47Å

Retrieved 656 of 656 residues in 1113 ms (Link to these results)

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