A0A096M137_POEFO Loading...

Sodium/glucose cotransporter 1

AlphaFold DB , UniProt , Accession A0A096M137, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 657 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	V	32.8	Very low	26.2	Very low	165 Å²	165	153.1 Å²	153.1	100%	1	75%	0.748	S	S	*	*				0	-29.8	0	-174.6	0	0	0	0	113.2	L3	V1-L3 PolarHBondContact O-N 3.46Å
2	Y	23.8	Very low	26.1	Very low	215 Å²	215	149.8 Å²	149.8	84%	0.843	75%	0.752	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.8	-22.1	176.7	-78.1	-84.8	0	0	0	116.1
3	L	25.2	Very low	26.3	Very low	161 Å²	161	152.8 Å²	152.8	84%	0.843	76%	0.762	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.7	-19.1	178.7	-85.6	149.8	0	0	0	114.7	V1	V1-L3 PolarHBondContact O-N 3.46Å
4	W	23.9	Very low	26.6	Very low	220 Å²	220	156.4 Å²	156.4	83%	0.833	76%	0.762	S	S	*	*	S	Bend	trans	-93.8	-13.5	-177.2	-94.5	75.8	0	0	0	114.2
5	R	23.3	Very low	26.9	Very low	195 Å²	195	156.1 Å²	156.1	74%	0.736	77%	0.765	S	S	*	*	H	α-helix	trans	-78.1	-24	177.7	-92.3	-175.2	171.1	-166.7	-2.6	113.7	S8	R5-S8 PolarHBondContact O-N 3.21Å
6	F	28.6	Very low	27.2	Very low	178 Å²	178	158 Å²	158	78%	0.781	77%	0.772	S	S	*	*	H	α-helix	trans	-71.5	-27.8	173.9	-96.7	-83.4	0	0	0	113.4	S8	F6-S8 VanDerWaalsContact C-N 3.31Å; F6-S8 PolarHBondContact O-N 3.07Å
7	A	27.4	Very low	27.5	Very low	63 Å²	63	155.2 Å²	155.2	52%	0.521	77%	0.772	S	S	.	*	H	α-helix	trans	-72.5	-23.6	178	0	0	0	0	0	113.3
8	S	22.9	Very low	28.3	Very low	90 Å²	90	154.4 Å²	154.4	63%	0.629	77%	0.766	S	S	*	*	H	α-helix	trans	-82.4	-31.8	-177.6	178.8	0	0	0	0	112.9	R5 F6 S10	R5-S8 PolarHBondContact O-N 3.21Å; F6-S8 VanDerWaalsContact C-N 3.31Å; F6-S8 PolarHBondContact O-N 3.07Å; S8-S10 VanDerWaalsContact C-N 3.34Å; S8-S10 PolarHBondContact O-N 2.75Å
9	I	26.4	Very low	29.2	Very low	135 Å²	135	153.5 Å²	153.5	69%	0.692	77%	0.77	S	S	*	*	H	α-helix	trans	-77.4	-19.7	-176.7	-60.9	172.6	0	0	0	112.1	K11	I9-K11 VanDerWaalsContact C-N 3.35Å; I9-K11 PolarHBondContact O-N 2.87Å
10	S	27.9	Very low	30.5	Very low	80 Å²	80	151.5 Å²	151.5	56%	0.559	76%	0.759	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.4	-8.7	-179.1	94.1	0	0	0	0	115.1	S8	S8-S10 VanDerWaalsContact C-N 3.34Å; S8-S10 PolarHBondContact O-N 2.75Å
11	K	26.3	Very low	31.8	Very low	182 Å²	182	145 Å²	145	79%	0.791	73%	0.73	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.6	-19.2	-178.1	-105.2	-178.9	177.2	-179.9	0	114.5	I9	I9-K11 VanDerWaalsContact C-N 3.35Å; I9-K11 PolarHBondContact O-N 2.87Å
12	S	24.2	Very low	33.3	Very low	113 Å²	113	138.5 Å²	138.5	79%	0.79	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.4	-2.3	-168.3	-164.5	0	0	0	0	116
13	Q	28.9	Very low	35.4	Very low	190 Å²	190	134.3 Å²	134.3	89%	0.888	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.2	15.2	178.7	-94.2	-173.7	-26.5	0	0	113.8	N15	Q13-N15 VanDerWaalsContact C-N 3.32Å; Q13-N15 PolarHBondContact O-N 3.49Å
14	R	31.1	Very low	38	Very low	202 Å²	202	128.5 Å²	128.5	76%	0.762	65%	0.651	S	S	*	*			trans	-93.1	60.5	178.5	-161.8	-173.2	-84.9	-168.9	-7.3	110.3
15	N	31.4	Very low	40.9	Very low	152 Å²	152	122.9 Å²	122.9	81%	0.813	64%	0.642	S	S	*	*			trans	-149.6	134.6	166.7	-97	-16.2	0	0	0	110.6	Q13	Q13-N15 VanDerWaalsContact C-N 3.32Å; Q13-N15 PolarHBondContact O-N 3.49Å
16	E	31	Very low	43.8	Very low	187 Å²	187	115.5 Å²	115.5	87%	0.874	62%	0.623	S	S	*	*	S	Bend	trans	88.4	101.6	175.6	-57.8	-179.9	176.1	0	0	116.5
17	S	32.9	Very low	46.5	Very low	110 Å²	110	107 Å²	107	77%	0.769	59%	0.586	S	S	*	*			trans	82.8	50.5	158.4	72.6	0	0	0	0	120.7
18	Q	41	Very low	49.2	Very low	141 Å²	141	108 Å²	108	66%	0.659	58%	0.582	S	S	*	*			trans	-119.5	83.3	149.6	-79.6	-172.2	-12.4	0	0	109.6	M20	Q18-M20 PolarHBondContact O-N 3.43Å
19	T	45.9	Very low	52.3	Low	137 Å²	137	107 Å²	107	84%	0.84	58%	0.575	S	S	*	*			trans	-57.9	118.2	163.5	2.6	0	0	0	0	107.8	A21	T19-A21 PolarHBondContact O-N 2.9Å
20	M	55	Low	55.2	Low	113 Å²	113	102.8 Å²	102.8	56%	0.557	56%	0.555	S	S	*	*			trans	-54.1	117.9	170.8	-71.4	-177.6	-70.2	0	0	108	Q18 I22	Q18-M20 PolarHBondContact O-N 3.43Å; M20-I22 PolarHBondContact O-N 2.85Å
21	A	58.3	Low	57.9	Low	17 Å²	17	100.6 Å²	100.6	14%	0.14	54%	0.537	C	S	.	.	S	Bend	trans	-60.6	-38.9	-178.9	0	0	0	0	0	110.3	T19 N23 A170 V368 R376	T19-A21 PolarHBondContact O-N 2.9Å; A21-N23 PolarHBondContact O-N 3.48Å; A21-A170 WeakPolarHBondContact CB-O 3.19Å; A21-V368 HydrophobicContact CB-CG1 3.47Å; A21-V368 VanDerWaalsContact CB-CG1 3.47Å; A21-V368 HydrophobicContact CB-CG2 4.39Å; A21-R376 PolarHBondContact O-NH1 3.43Å; A21-R376 PolarHBondContact O-NH2 3.46Å
22	I	63.9	Low	60.7	Low	28 Å²	28	95.7 Å²	95.7	14%	0.144	52%	0.522	C	S	.	.			trans	-87.5	84.4	175.1	-43.1	175	0	0	0	110.1	M20 D27 I28 I31 A170 M171 L380	M20-I22 PolarHBondContact O-N 2.85Å; I22-D27 HydrophobicContact CG2-CB 4.06Å; I22-I28 HydrophobicContact CG2-CG1 3.81Å; I22-I31 HydrophobicContact CD1-CD1 4.25Å; I22-I31 HydrophobicContact CG2-CD1 4.44Å; I22-A170 HydrophobicContact CD1-CB 4.5Å; I22-M171 HydrophobicContact CD1-CG 3.72Å; I22-M171 HydrophobicContact CD1-SD 4.48Å; I22-L380 HydrophobicContact CD1-CD1 3.46Å; I22-L380 VanDerWaalsContact CD1-CD1 3.46Å; I22-L380 HydrophobicContact CG1-CD1 3.54Å
23	N	67.8	Low	63.7	Low	126 Å²	126	94.1 Å²	94.1	67%	0.674	51%	0.507	S	S	*	.			trans	-126.2	14.4	166.6	-160.3	19.7	0	0	0	112.4	A21	A21-N23 PolarHBondContact O-N 3.48Å
24	N	80.4	Confident	66.4	Low	40 Å²	40	85.6 Å²	85.6	21%	0.214	47%	0.467	C	S	.	.			trans	-104.1	129.9	-178.4	-170.2	-24	0	0	0	110.6	A26 D27 I28 N373	N24-A26 PolarHBondContact O-N 2.85Å; N24-A26 VanDerWaalsContact O-N 3.15Å; N24-A26 PolarHBondContact OD1-N 2.92Å; N24-D27 PolarHBondContact O-N 3.39Å; N24-D27 VanDerWaalsContact O-N 3.17Å; N24-I28 PolarHBondContact O-N 3.22Å; N24-N373 VanDerWaalsContact ND2-CB 3.32Å; N24-N373 WeakPolarHBondContact ND2-CB 3.36Å; N24-N373 PolarHBondContact ND2-ND2 3.36Å; N24-N373 VanDerWaalsContact ND2-ND2 3.15Å; N24-N373 PolarHBondContact ND2-OD1 3.21Å
25	P	84.6	Confident	68.9	Low	101 Å²	101	79 Å²	79	66%	0.656	44%	0.444	S	S	*	.	H	α-helix	trans	-54	-30.2	174.2	21.1	-34.9	0	0	0	114	S29	P25-S29 VanDerWaalsContact O-CB 3.28Å; P25-S29 WeakPolarHBondContact O-CB 3.46Å; P25-S29 PolarHBondContact O-N 3.22Å
26	A	85	Confident	71.4	Confident	40 Å²	40	76.7 Å²	76.7	33%	0.331	43%	0.431	S	S	.	.	H	α-helix	trans	-63.1	-45.8	177.7	0	0	0	0	0	112.5	N24 V30	N24-A26 PolarHBondContact O-N 2.85Å; N24-A26 VanDerWaalsContact O-N 3.15Å; N24-A26 PolarHBondContact OD1-N 2.92Å; A26-V30 VanDerWaalsContact O-CG2 3.29Å; A26-V30 WeakPolarHBondContact O-CG2 3.47Å; A26-V30 PolarHBondContact O-N 3.16Å; A26-V30 VanDerWaalsContact O-N 3.11Å
27	D	83.8	Confident	74	Confident	0 Å²	0	71 Å²	71	0%	0	41%	0.409	C	S	.	.	H	α-helix	trans	-65.6	-44.4	179.3	-72.1	-31.9	0	0	0	111.1	I22 N24 V30 I31 G374 R376 G377	I22-D27 HydrophobicContact CG2-CB 4.06Å; N24-D27 PolarHBondContact O-N 3.39Å; N24-D27 VanDerWaalsContact O-N 3.17Å; D27-V30 PolarHBondContact O-N 3.21Å; D27-I31 WeakPolarHBondContact O-CD1 3.35Å; D27-I31 WeakPolarHBondContact O-CG1 3.4Å; D27-I31 PolarHBondContact O-N 3.1Å; D27-G374 WeakPolarHBondContact OD1-CA 3.43Å; D27-G374 PolarHBondContact OD1-N 3.49Å; D27-R376 IonicContact OD2-CZ 3.63Å; D27-R376 VanDerWaalsContact OD2-CZ 3.29Å; D27-R376 IonicContact OD2-NE 3.47Å; D27-R376 PolarHBondContact OD2-NE 2.91Å; D27-R376 IonicContact OD2-NH2 2.77Å; D27-R376 PolarHBondContact OD2-NH2 2.97Å; D27-G377 PolarHBondContact OD1-N 3.1Å
28	I	84.6	Confident	76.2	Confident	85 Å²	85	66.6 Å²	66.6	44%	0.436	38%	0.377	S	S	.	.	H	α-helix	trans	-63.5	-45	179.9	-61.3	173	0	0	0	110.6	I22 N24 V30 I31 V32	I22-I28 HydrophobicContact CG2-CG1 3.81Å; N24-I28 PolarHBondContact O-N 3.22Å; I28-V30 VanDerWaalsContact C-N 3.32Å; I28-V30 PolarHBondContact O-N 2.72Å; I28-I31 PolarHBondContact O-N 3.04Å; I28-V32 HydrophobicContact CG2-CG2 4.47Å; I28-V32 WeakPolarHBondContact O-CG2 3.21Å; I28-V32 PolarHBondContact O-N 2.94Å
29	S	87.2	Confident	78	Confident	69 Å²	69	64.1 Å²	64.1	48%	0.483	37%	0.368	S	S	.	.	H	α-helix	trans	-60.2	-43.5	178.1	-174.8	0	0	0	0	111.5	P25 I31 V32 V33	P25-S29 VanDerWaalsContact O-CB 3.28Å; P25-S29 WeakPolarHBondContact O-CB 3.46Å; P25-S29 PolarHBondContact O-N 3.22Å; S29-I31 VanDerWaalsContact C-N 3.35Å; S29-V32 PolarHBondContact O-N 2.94Å; S29-V33 WeakPolarHBondContact O-CB 3.44Å; S29-V33 VanDerWaalsContact O-CG2 3.26Å; S29-V33 WeakPolarHBondContact O-CG2 3.27Å; S29-V33 PolarHBondContact O-N 2.99Å
30	V	87.4	Confident	79.6	Confident	45 Å²	45	60.3 Å²	60.3	27%	0.273	35%	0.35	S	S	.	.	H	α-helix	trans	-64.6	-41.2	178.2	172	0	0	0	0	111	A26 D27 I28 V33 Y34 L378	A26-V30 VanDerWaalsContact O-CG2 3.29Å; A26-V30 WeakPolarHBondContact O-CG2 3.47Å; A26-V30 PolarHBondContact O-N 3.16Å; A26-V30 VanDerWaalsContact O-N 3.11Å; D27-V30 PolarHBondContact O-N 3.21Å; I28-V30 VanDerWaalsContact C-N 3.32Å; I28-V30 PolarHBondContact O-N 2.72Å; V30-V33 PolarHBondContact O-N 2.89Å; V30-Y34 VanDerWaalsContact O-CB 3.27Å; V30-Y34 WeakPolarHBondContact O-CB 3.48Å; V30-Y34 PolarHBondContact O-N 3.44Å; V30-L378 HydrophobicContact CG1-CB 3.75Å; V30-L378 HydrophobicContact CG1-CD1 3.98Å; V30-L378 HydrophobicContact CG1-CG 4.48Å
31	I	84.5	Confident	80.8	Confident	34 Å²	34	57.4 Å²	57.4	17%	0.174	34%	0.339	C	S	.	.	H	α-helix	trans	-59.5	-49	175.9	-67	159.5	0	0	0	111.3	I22 D27 I28 S29 Y34 F35 G377 S381	I22-I31 HydrophobicContact CD1-CD1 4.25Å; I22-I31 HydrophobicContact CG2-CD1 4.44Å; D27-I31 WeakPolarHBondContact O-CD1 3.35Å; D27-I31 WeakPolarHBondContact O-CG1 3.4Å; D27-I31 PolarHBondContact O-N 3.1Å; I28-I31 PolarHBondContact O-N 3.04Å; S29-I31 VanDerWaalsContact C-N 3.35Å; I31-Y34 PolarHBondContact O-N 2.86Å; I31-F35 HydrophobicContact CG2-CD2 3.76Å; I31-F35 HydrophobicContact CG2-CE2 3.76Å; I31-F35 VanDerWaalsContact O-CD2 3.28Å; I31-F35 WeakPolarHBondContact O-CD2 3.3Å; I31-F35 PolarHBondContact O-N 2.85Å; I31-G377 WeakPolarHBondContact CG1-O 3.46Å; I31-S381 VanDerWaalsContact CA-OG 3.22Å; I31-S381 WeakPolarHBondContact CA-OG 3.45Å; I31-S381 WeakPolarHBondContact CG1-OG 3.4Å
32	V	85.3	Confident	81.6	Confident	79 Å²	79	56.6 Å²	56.6	48%	0.479	33%	0.332	S	S	.	.	H	α-helix	trans	-62.1	-47.3	179.7	173.5	0	0	0	0	110.9	I28 S29 Y34 F35 L36	I28-V32 HydrophobicContact CG2-CG2 4.47Å; I28-V32 WeakPolarHBondContact O-CG2 3.21Å; I28-V32 PolarHBondContact O-N 2.94Å; S29-V32 PolarHBondContact O-N 2.94Å; V32-Y34 VanDerWaalsContact C-N 3.31Å; V32-Y34 PolarHBondContact O-N 3.21Å; V32-F35 PolarHBondContact O-N 3.32Å; V32-L36 HydrophobicContact CG1-CD1 3.96Å; V32-L36 HydrophobicContact CG1-CG 4.4Å; V32-L36 VanDerWaalsContact O-CG 3.29Å; V32-L36 WeakPolarHBondContact O-CG 3.45Å; V32-L36 PolarHBondContact O-N 3.35Å
33	V	88.3	Confident	82.1	Confident	80 Å²	80	59.4 Å²	59.4	49%	0.485	35%	0.347	S	S	.	.	H	α-helix	trans	-60	-43	178.1	170.5	0	0	0	0	111.1	S29 V30 L36 V37	S29-V33 WeakPolarHBondContact O-CB 3.44Å; S29-V33 VanDerWaalsContact O-CG2 3.26Å; S29-V33 WeakPolarHBondContact O-CG2 3.27Å; S29-V33 PolarHBondContact O-N 2.99Å; V30-V33 PolarHBondContact O-N 2.89Å; V33-L36 PolarHBondContact O-N 3.2Å; V33-V37 HydrophobicContact CG1-CG2 4.45Å; V33-V37 WeakPolarHBondContact O-CG2 3.18Å; V33-V37 PolarHBondContact O-N 3.28Å
34	Y	86.1	Confident	82.4	Confident	12 Å²	12	55.2 Å²	55.2	5%	0.047	33%	0.334	C	S	.	.	H	α-helix	trans	-58.5	-51.7	177.8	176.1	-87.2	0	0	0	111.7	V30 I31 V32 L36 V37 V38 I208 L378 S381 V382 A385	V30-Y34 VanDerWaalsContact O-CB 3.27Å; V30-Y34 WeakPolarHBondContact O-CB 3.48Å; V30-Y34 PolarHBondContact O-N 3.44Å; I31-Y34 PolarHBondContact O-N 2.86Å; V32-Y34 VanDerWaalsContact C-N 3.31Å; V32-Y34 PolarHBondContact O-N 3.21Å; Y34-L36 VanDerWaalsContact C-N 3.3Å; Y34-L36 PolarHBondContact O-N 2.99Å; Y34-V37 PolarHBondContact O-N 3.39Å; Y34-V38 HydrophobicContact CD1-CG2 4.16Å; Y34-V38 HydrophobicContact CE1-CG2 3.63Å; Y34-V38 HydrophobicContact CE2-CG2 4.31Å; Y34-V38 WeakPolarHBondContact O-CG2 3.38Å; Y34-V38 PolarHBondContact O-N 3.4Å; Y34-I208 HydrophobicContact CD2-CD1 4.13Å; Y34-I208 HydrophobicContact CE2-CD1 3.61Å; Y34-I208 HydrophobicContact CE2-CG2 4.24Å; Y34-L378 HydrophobicContact CD2-CD1 4.32Å; Y34-S381 VanDerWaalsContact CD1-CB 3.48Å; Y34-V382 HydrophobicContact CE2-CG2 4.15Å; Y34-A385 HydrophobicContact CE1-CB 3.54Å; Y34-A385 WeakPolarHBondContact OH-CB 3.41Å
35	F	82.6	Confident	82	Confident	62 Å²	62	53.8 Å²	53.8	27%	0.272	33%	0.328	S	S	.	.	H	α-helix	trans	-64.4	-35	179.7	-82.1	-68.7	0	0	0	112.6	I31 V32 V38 L39 M384	I31-F35 HydrophobicContact CG2-CD2 3.76Å; I31-F35 HydrophobicContact CG2-CE2 3.76Å; I31-F35 VanDerWaalsContact O-CD2 3.28Å; I31-F35 WeakPolarHBondContact O-CD2 3.3Å; I31-F35 PolarHBondContact O-N 2.85Å; V32-F35 PolarHBondContact O-N 3.32Å; F35-V38 PolarHBondContact O-N 3.42Å; F35-L39 WeakPolarHBondContact O-CB 3.42Å; F35-L39 PolarHBondContact O-N 2.8Å; F35-M384 HydrophobicContact CZ-CB 4.05Å; F35-M384 HydrophobicContact CZ-CG 3.69Å
36	L	84.6	Confident	81.1	Confident	105 Å²	105	50.1 Å²	50.1	55%	0.55	30%	0.302	S	S	.	.	H	α-helix	trans	-63.7	-41.9	173.6	-72.1	173.9	0	0	0	112	V32 V33 Y34 L39 A40	V32-L36 HydrophobicContact CG1-CD1 3.96Å; V32-L36 HydrophobicContact CG1-CG 4.4Å; V32-L36 VanDerWaalsContact O-CG 3.29Å; V32-L36 WeakPolarHBondContact O-CG 3.45Å; V32-L36 PolarHBondContact O-N 3.35Å; V33-L36 PolarHBondContact O-N 3.2Å; Y34-L36 VanDerWaalsContact C-N 3.3Å; Y34-L36 PolarHBondContact O-N 2.99Å; L36-L39 PolarHBondContact O-N 3.38Å; L36-A40 VanDerWaalsContact O-CB 3.29Å; L36-A40 WeakPolarHBondContact O-CB 3.29Å; L36-A40 PolarHBondContact O-N 3.34Å
37	V	84.4	Confident	80.2	Confident	67 Å²	67	54 Å²	54	41%	0.406	32%	0.322	S	S	.	.	H	α-helix	trans	-65.9	-45.2	177.1	171.5	0	0	0	0	110.9	V33 Y34 L39 A40 V41 L204	V33-V37 HydrophobicContact CG1-CG2 4.45Å; V33-V37 WeakPolarHBondContact O-CG2 3.18Å; V33-V37 PolarHBondContact O-N 3.28Å; Y34-V37 PolarHBondContact O-N 3.39Å; V37-L39 VanDerWaalsContact C-N 3.32Å; V37-L39 PolarHBondContact O-N 2.85Å; V37-A40 PolarHBondContact O-N 3.31Å; V37-V41 WeakPolarHBondContact O-CG2 3.15Å; V37-V41 PolarHBondContact O-N 3.38Å; V37-L204 HydrophobicContact CG1-CD2 3.88Å
38	V	79.7	Confident	79.2	Confident	17 Å²	17	65.1 Å²	65.1	10%	0.103	36%	0.363	C	S	.	.	H	α-helix	trans	-60.4	-44.8	176.6	172.9	0	0	0	0	110.7	Y34 F35 A40 V41 G42 Y189 T201 L204	Y34-V38 HydrophobicContact CD1-CG2 4.16Å; Y34-V38 HydrophobicContact CE1-CG2 3.63Å; Y34-V38 HydrophobicContact CE2-CG2 4.31Å; Y34-V38 WeakPolarHBondContact O-CG2 3.38Å; Y34-V38 PolarHBondContact O-N 3.4Å; F35-V38 PolarHBondContact O-N 3.42Å; V38-A40 PolarHBondContact O-N 3.36Å; V38-V41 PolarHBondContact O-N 3.11Å; V38-G42 PolarHBondContact O-N 3.28Å; V38-Y189 HydrophobicContact CG1-CE2 4.43Å; V38-T201 HydrophobicContact CG1-CG2 4.03Å; V38-L204 HydrophobicContact CG2-CD2 4.29Å
39	L	78.1	Confident	78	Confident	89 Å²	89	62.8 Å²	62.8	47%	0.466	35%	0.353	S	S	.	.	H	α-helix	trans	-64.2	-39.6	177.4	-174.5	141.5	0	0	0	111.7	F35 L36 V37 G42 L43	F35-L39 WeakPolarHBondContact O-CB 3.42Å; F35-L39 PolarHBondContact O-N 2.8Å; L36-L39 PolarHBondContact O-N 3.38Å; V37-L39 VanDerWaalsContact C-N 3.32Å; V37-L39 PolarHBondContact O-N 2.85Å; L39-G42 PolarHBondContact O-N 3.2Å; L39-L43 HydrophobicContact CD2-CD1 3.46Å; L39-L43 VanDerWaalsContact CD2-CD1 3.46Å; L39-L43 HydrophobicContact CD2-CG 4.21Å; L39-L43 HydrophobicContact CG-CD1 4.33Å; L39-L43 WeakPolarHBondContact O-CB 3.24Å; L39-L43 VanDerWaalsContact O-CG 3.3Å; L39-L43 WeakPolarHBondContact O-CG 3.48Å; L39-L43 PolarHBondContact O-N 3.16Å
40	A	81.2	Confident	76.6	Confident	57 Å²	57	63.2 Å²	63.2	47%	0.471	35%	0.35	S	S	.	.	H	α-helix	trans	-65.2	-42.9	175.9	0	0	0	0	0	112.5	L36 V37 V38 L43 G44	L36-A40 VanDerWaalsContact O-CB 3.29Å; L36-A40 WeakPolarHBondContact O-CB 3.29Å; L36-A40 PolarHBondContact O-N 3.34Å; V37-A40 PolarHBondContact O-N 3.31Å; V38-A40 PolarHBondContact O-N 3.36Å; A40-L43 PolarHBondContact O-N 3.26Å; A40-G44 PolarHBondContact O-N 3.31Å
41	V	79.8	Confident	75.2	Confident	52 Å²	52	62.9 Å²	62.9	32%	0.315	34%	0.344	S	S	.	.	H	α-helix	trans	-65.2	-42.8	174.8	171.2	0	0	0	0	110.8	V37 V38 G44 A45 T201 L204	V37-V41 WeakPolarHBondContact O-CG2 3.15Å; V37-V41 PolarHBondContact O-N 3.38Å; V38-V41 PolarHBondContact O-N 3.11Å; V41-G44 PolarHBondContact O-N 3.44Å; V41-A45 WeakPolarHBondContact O-CB 3.5Å; V41-A45 PolarHBondContact O-N 3.41Å; V41-T201 HydrophobicContact CB-CG2 4.49Å; V41-T201 HydrophobicContact CG1-CG2 4.18Å; V41-L204 HydrophobicContact CG2-CD2 4.06Å
42	G	75.2	Confident	73.8	Confident	0 Å²	0	62 Å²	62	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-53.9	-59.3	172.8	0	0	0	0	0	110.8	V38 L39 G44 A45 M46	V38-G42 PolarHBondContact O-N 3.28Å; L39-G42 PolarHBondContact O-N 3.2Å; G42-G44 VanDerWaalsContact C-N 3.35Å; G42-G44 PolarHBondContact O-N 3.12Å; G42-A45 WeakPolarHBondContact O-CB 3.37Å; G42-A45 PolarHBondContact O-N 2.81Å; G42-A45 VanDerWaalsContact O-N 3.15Å; G42-M46 WeakPolarHBondContact O-CG 3.33Å; G42-M46 PolarHBondContact O-N 3.35Å
43	L	74.8	Confident	72.6	Confident	87 Å²	87	60.4 Å²	60.4	46%	0.455	33%	0.332	S	S	.	.	H	α-helix	trans	-55.1	-44	177.1	-73.9	175.2	0	0	0	112.7	L39 A40 A45 M46 V47	L39-L43 HydrophobicContact CD2-CD1 3.46Å; L39-L43 VanDerWaalsContact CD2-CD1 3.46Å; L39-L43 HydrophobicContact CD2-CG 4.21Å; L39-L43 HydrophobicContact CG-CD1 4.33Å; L39-L43 WeakPolarHBondContact O-CB 3.24Å; L39-L43 VanDerWaalsContact O-CG 3.3Å; L39-L43 WeakPolarHBondContact O-CG 3.48Å; L39-L43 PolarHBondContact O-N 3.16Å; A40-L43 PolarHBondContact O-N 3.26Å; L43-A45 VanDerWaalsContact C-N 3.34Å; L43-A45 PolarHBondContact O-N 2.85Å; L43-M46 HydrophobicContact CD2-CE 3.61Å; L43-M46 HydrophobicContact CD2-SD 4.02Å; L43-M46 HydrophobicContact CG-CE 4.05Å; L43-M46 VanDerWaalsContact O-CB 3.25Å; L43-M46 WeakPolarHBondContact O-CB 3.23Å; L43-M46 PolarHBondContact O-N 2.82Å; L43-M46 VanDerWaalsContact O-N 3.11Å; L43-V47 WeakPolarHBondContact O-CG2 3.25Å; L43-V47 PolarHBondContact O-N 2.93Å; L43-V47 VanDerWaalsContact O-N 3.11Å
44	G	74.2	Confident	71.1	Confident	39 Å²	39	57.9 Å²	57.9	40%	0.402	32%	0.317	S	S	.	.	H	α-helix	trans	-62.6	-39.8	177.5	0	0	0	0	0	112.9	A40 V41 G42 M46	A40-G44 PolarHBondContact O-N 3.31Å; V41-G44 PolarHBondContact O-N 3.44Å; G42-G44 VanDerWaalsContact C-N 3.35Å; G42-G44 PolarHBondContact O-N 3.12Å; G44-M46 VanDerWaalsContact C-N 3.34Å
45	A	71.3	Confident	69.7	Low	9 Å²	9	58.6 Å²	58.6	7%	0.074	33%	0.328	C	S	.	.	H	α-helix	trans	-66.3	-37.9	172.7	0	0	0	0	0	111.5	V41 G42 L43 V47 R48 T49 A197 Y200	V41-A45 WeakPolarHBondContact O-CB 3.5Å; V41-A45 PolarHBondContact O-N 3.41Å; G42-A45 WeakPolarHBondContact O-CB 3.37Å; G42-A45 PolarHBondContact O-N 2.81Å; G42-A45 VanDerWaalsContact O-N 3.15Å; L43-A45 VanDerWaalsContact C-N 3.34Å; L43-A45 PolarHBondContact O-N 2.85Å; A45-V47 PolarHBondContact O-N 2.82Å; A45-R48 PolarHBondContact O-N 3.32Å; A45-T49 PolarHBondContact O-N 3.15Å; A45-T49 PolarHBondContact O-OG1 3.22Å; A45-A197 HydrophobicContact CB-CB 4.39Å; A45-Y200 HydrophobicContact CB-CD2 3.65Å; A45-Y200 HydrophobicContact CB-CE2 4.44Å; A45-Y200 HydrophobicContact CB-CG 4.23Å
46	M	66.1	Low	68.4	Low	25 Å²	25	56.2 Å²	56.2	12%	0.123	32%	0.321	C	S	.	.	H	α-helix	trans	-58.4	-47.4	178.4	-51.9	-157.3	-151.4	0	0	112.5	G42 L43 G44 R48 T49 R51	G42-M46 WeakPolarHBondContact O-CG 3.33Å; G42-M46 PolarHBondContact O-N 3.35Å; L43-M46 HydrophobicContact CD2-CE 3.61Å; L43-M46 HydrophobicContact CD2-SD 4.02Å; L43-M46 HydrophobicContact CG-CE 4.05Å; L43-M46 VanDerWaalsContact O-CB 3.25Å; L43-M46 WeakPolarHBondContact O-CB 3.23Å; L43-M46 PolarHBondContact O-N 2.82Å; L43-M46 VanDerWaalsContact O-N 3.11Å; G44-M46 VanDerWaalsContact C-N 3.34Å; M46-R48 PolarHBondContact O-N 3.46Å; M46-T49 PolarHBondContact O-N 3.29Å; M46-R51 VanDerWaalsContact SD-CZ 3.54Å; M46-R51 PolarHBondContact SD-NH1 3.42Å; M46-R51 PolarHBondContact SD-NH2 3.45Å
47	V	66.3	Low	67.2	Low	122 Å²	122	52.5 Å²	52.5	74%	0.739	30%	0.3	S	S	*	.	H	α-helix	trans	-67.5	-28.9	-176.3	174.9	0	0	0	0	111.6	L43 A45	L43-V47 WeakPolarHBondContact O-CG2 3.25Å; L43-V47 PolarHBondContact O-N 2.93Å; L43-V47 VanDerWaalsContact O-N 3.11Å; A45-V47 PolarHBondContact O-N 2.82Å
48	R	61	Low	65.9	Low	232 Å²	232	49.5 Å²	49.5	88%	0.875	28%	0.282	S	S	*	.	H	α-helix	trans	-86.5	-12.2	-178.8	-72.6	-174.1	175.1	177.2	0.1	114.5	A45 M46	A45-R48 PolarHBondContact O-N 3.32Å; M46-R48 PolarHBondContact O-N 3.46Å
49	T	60	Low	64.9	Low	36 Å²	36	49 Å²	49	22%	0.221	28%	0.279	C	S	.	.	S	Bend	trans	-107.8	137.5	-179.4	27.9	0	0	0	0	112.7	A45 M46 R51 A196	A45-T49 PolarHBondContact O-N 3.15Å; A45-T49 PolarHBondContact O-OG1 3.22Å; M46-T49 PolarHBondContact O-N 3.29Å; T49-R51 PolarHBondContact O-N 2.89Å; T49-A196 HydrophobicContact CG2-CB 3.63Å
50	N	58.4	Low	64	Low	79 Å²	79	44.9 Å²	44.9	42%	0.422	26%	0.258	S	S	.	.			trans	-79.1	107.3	176.1	-155.6	-1	0	0	0	109.1	G56	N50-G56 WeakPolarHBondContact O-CA 3.34Å
51	R	57.6	Low	63	Low	38 Å²	38	44.7 Å²	44.7	14%	0.143	26%	0.261	C	S	.	.			trans	-91.7	-9.5	-174.2	-66	168.6	172.7	-136.4	-32.8	114	M46 T49 T53 T192	M46-R51 VanDerWaalsContact SD-CZ 3.54Å; M46-R51 PolarHBondContact SD-NH1 3.42Å; M46-R51 PolarHBondContact SD-NH2 3.45Å; T49-R51 PolarHBondContact O-N 2.89Å; R51-T53 PolarHBondContact O-N 2.91Å; R51-T53 VanDerWaalsContact O-N 3.16Å; R51-T192 PolarHBondContact NH1-O 3.27Å; R51-T192 PolarHBondContact NH2-O 2.92Å; R51-T192 VanDerWaalsContact NH2-O 3.13Å
52	A	55	Low	62.5	Low	16 Å²	16	44.4 Å²	44.4	13%	0.132	25%	0.254	C	S	.	.	S	Bend	trans	-66.8	-16.5	-172.2	0	0	0	0	0	112.9	K608	A52-K608 HydrophobicContact CB-CB 4.23Å; A52-K608 WeakPolarHBondContact CB-O 3.22Å
53	T	59.6	Low	62.5	Low	45 Å²	45	47.8 Å²	47.8	28%	0.276	28%	0.278	S	S	.	.	S	Bend	trans	-115	148.6	-178.7	66.3	0	0	0	0	112.4	R51 G55 G56 F57 E416 A610	R51-T53 PolarHBondContact O-N 2.91Å; R51-T53 VanDerWaalsContact O-N 3.16Å; T53-G55 VanDerWaalsContact C-N 3.26Å; T53-G55 PolarHBondContact O-N 3.16Å; T53-G56 WeakPolarHBondContact O-CA 3.2Å; T53-G56 PolarHBondContact O-N 2.87Å; T53-G56 PolarHBondContact OG1-N 2.84Å; T53-F57 PolarHBondContact O-N 3.42Å; T53-E416 WeakPolarHBondContact CA-OE1 3.32Å; T53-A610 HydrophobicContact CG2-CB 3.67Å
54	V	56.4	Low	62.8	Low	26 Å²	26	43.8 Å²	43.8	16%	0.158	26%	0.257	C	S	.	.	H	α-helix	trans	-51.8	-43.2	174.3	172.4	0	0	0	0	111.6	G56 F57 F58 M404 E416	V54-G56 PolarHBondContact O-N 3.46Å; V54-F57 PolarHBondContact O-N 2.87Å; V54-F58 HydrophobicContact CB-CD2 4.4Å; V54-F58 HydrophobicContact CG1-CD2 3.55Å; V54-F58 HydrophobicContact CG1-CE2 3.9Å; V54-F58 WeakPolarHBondContact O-CB 3.15Å; V54-F58 VanDerWaalsContact O-CD2 3.29Å; V54-F58 WeakPolarHBondContact O-CD2 3.3Å; V54-F58 PolarHBondContact O-N 3.27Å; V54-M404 HydrophobicContact CG1-CE 4.03Å; V54-M404 HydrophobicContact CG1-SD 3.91Å; V54-E416 HydrophobicContact CG2-CG 4.04Å; V54-E416 PolarHBondContact N-OE1 3.01Å
55	G	57	Low	63.6	Low	28 Å²	28	44.9 Å²	44.9	29%	0.289	26%	0.256	S	S	.	.	H	α-helix	trans	-67.1	-33.3	176.6	0	0	0	0	0	114.1	T53 L59 G61	T53-G55 VanDerWaalsContact C-N 3.26Å; T53-G55 PolarHBondContact O-N 3.16Å; G55-L59 CarbonylContact O-C 3.56Å; G55-L59 WeakPolarHBondContact O-CA 3.25Å; G55-L59 VanDerWaalsContact O-CB 3.32Å; G55-L59 WeakPolarHBondContact O-CB 3.43Å; G55-L59 PolarHBondContact O-N 2.97Å; G55-G61 PolarHBondContact O-N 3Å
56	G	56.5	Low	64.6	Low	12 Å²	12	49.6 Å²	49.6	12%	0.124	27%	0.272	C	S	.	.	H	α-helix	trans	-67.9	-42.6	173.7	0	0	0	0	0	112.4	N50 T53 V54 A60	N50-G56 WeakPolarHBondContact O-CA 3.34Å; T53-G56 WeakPolarHBondContact O-CA 3.2Å; T53-G56 PolarHBondContact O-N 2.87Å; T53-G56 PolarHBondContact OG1-N 2.84Å; V54-G56 PolarHBondContact O-N 3.46Å; G56-A60 WeakPolarHBondContact O-CA 3.42Å; G56-A60 PolarHBondContact O-N 3.44Å
57	F	58.7	Low	65.9	Low	26 Å²	26	52.3 Å²	52.3	11%	0.114	29%	0.286	C	S	.	.	H	α-helix	trans	-72.3	-47.7	-179.8	-172.2	-96.5	0	0	0	112.9	T53 V54 L195	T53-F57 PolarHBondContact O-N 3.42Å; V54-F57 PolarHBondContact O-N 2.87Å; F57-L195 WeakPolarHBondContact O-CB 3.17Å; F57-L195 PolarHBondContact O-N 3.23Å
58	F	57.7	Low	67.1	Low	5 Å²	5	46.9 Å²	46.9	2%	0.022	25%	0.254	C	S	.	.	H	α-helix	trans	-94	-19.2	-173.1	-66.2	-64.4	0	0	0	115.5	V54 L195 Q296 T400	V54-F58 HydrophobicContact CB-CD2 4.4Å; V54-F58 HydrophobicContact CG1-CD2 3.55Å; V54-F58 HydrophobicContact CG1-CE2 3.9Å; V54-F58 WeakPolarHBondContact O-CB 3.15Å; V54-F58 VanDerWaalsContact O-CD2 3.29Å; V54-F58 WeakPolarHBondContact O-CD2 3.3Å; V54-F58 PolarHBondContact O-N 3.27Å; F58-L195 WeakPolarHBondContact O-CD2 3.33Å; F58-Q296 PolarHBondContact O-NE2 3.43Å; F58-T400 HydrophobicContact CD1-CG2 4.02Å; F58-T400 WeakPolarHBondContact CD1-OG1 3.33Å; F58-T400 HydrophobicContact CE1-CG2 4.34Å; F58-T400 VanDerWaalsContact CE1-OG1 3.23Å; F58-T400 WeakPolarHBondContact CE1-OG1 2.84Å; F58-T400 HydrophobicContact CG-CG2 4.2Å
59	L	58.9	Low	68.5	Low	7 Å²	7	35.9 Å²	35.9	4%	0.037	21%	0.212	C	C	.	.	H	α-helix	trans	-123.2	7.2	-178	-72	168.7	0	0	0	113.6	G55 G61 R62 I124 L299 S300	G55-L59 CarbonylContact O-C 3.56Å; G55-L59 WeakPolarHBondContact O-CA 3.25Å; G55-L59 VanDerWaalsContact O-CB 3.32Å; G55-L59 WeakPolarHBondContact O-CB 3.43Å; G55-L59 PolarHBondContact O-N 2.97Å; L59-G61 PolarHBondContact O-N 3.44Å; L59-R62 HydrophobicContact CB-CG 4.22Å; L59-R62 PolarHBondContact O-N 2.84Å; L59-I124 HydrophobicContact CD1-CB 4.48Å; L59-I124 HydrophobicContact CD1-CD1 4.38Å; L59-I124 HydrophobicContact CD1-CG1 4Å; L59-I124 HydrophobicContact CD1-CG2 4.1Å; L59-I124 HydrophobicContact CG-CG2 4.28Å; L59-L299 HydrophobicContact CD2-CB 4.03Å; L59-S300 VanDerWaalsContact O-CB 3.31Å; L59-S300 WeakPolarHBondContact O-CB 3.12Å
60	A	59.4	Low	70.1	Confident	2 Å²	2	34.1 Å²	34.1	2%	0.017	20%	0.201	C	C	.	.	G	3₁₀ helix	trans	52.3	28.9	-176.9	0	0	0	0	0	113.3	G56 R62 S63 M64 A196	G56-A60 WeakPolarHBondContact O-CA 3.42Å; G56-A60 PolarHBondContact O-N 3.44Å; A60-R62 PolarHBondContact O-N 3.09Å; A60-S63 PolarHBondContact O-OG 2.97Å; A60-M64 HydrophobicContact CB-CG 4.1Å; A60-M64 HydrophobicContact CB-SD 4.13Å; A60-A196 HydrophobicContact CB-CB 3.66Å
61	G	59.6	Low	71.7	Confident	53 Å²	53	30.6 Å²	30.6	55%	0.546	18%	0.183	S	C	.	.	G	3₁₀ helix	trans	62.6	19.7	-176.6	0	0	0	0	0	115	G55 L59 S63	G55-G61 PolarHBondContact O-N 3Å; L59-G61 PolarHBondContact O-N 3.44Å; G61-S63 PolarHBondContact O-N 3.44Å; G61-S63 VanDerWaalsContact O-N 3.16Å
62	R	68.3	Low	73.3	Confident	46 Å²	46	28.8 Å²	28.8	17%	0.174	18%	0.176	C	C	.	.	G	3₁₀ helix	trans	51.4	36.9	178.6	-60.9	-170.4	170.9	159.6	2.2	114.7	L59 A60 V123 L299 S300 A301 K302 L625	L59-R62 HydrophobicContact CB-CG 4.22Å; L59-R62 PolarHBondContact O-N 2.84Å; A60-R62 PolarHBondContact O-N 3.09Å; R62-V123 PolarHBondContact NH2-O 3.13Å; R62-L299 WeakPolarHBondContact CG-O 3.22Å; R62-S300 CarbonylContact C-O 3.52Å; R62-S300 WeakPolarHBondContact CA-O 3.06Å; R62-A301 CarbonylContact O-C 3.58Å; R62-K302 VanDerWaalsContact O-CA 3.26Å; R62-K302 WeakPolarHBondContact O-CA 3.4Å; R62-L625 HydrophobicContact CB-CD2 4.02Å; R62-L625 HydrophobicContact CG-CD2 4.41Å
63	S	75.8	Confident	75.1	Confident	71 Å²	71	28 Å²	28	50%	0.497	17%	0.17	S	C	.	.			trans	-112.3	5	-174.1	62.8	0	0	0	0	113.9	A60 G61 S300	A60-S63 PolarHBondContact O-OG 2.97Å; G61-S63 PolarHBondContact O-N 3.44Å; G61-S63 VanDerWaalsContact O-N 3.16Å; S63-S300 PolarHBondContact N-O 2.76Å
64	M	82.1	Confident	76.6	Confident	3 Å²	3	26.1 Å²	26.1	2%	0.015	16%	0.158	C	C	.	.	B	Isolated β-bridge	trans	-72.8	140.1	-170	-56.9	-57.5	-89	0	0	112	A60 P68 I69 I199 Y200 S300 A301 K302	A60-M64 HydrophobicContact CB-CG 4.1Å; A60-M64 HydrophobicContact CB-SD 4.13Å; M64-P68 HydrophobicContact CE-CB 4.32Å; M64-I69 HydrophobicContact CB-CD1 4.04Å; M64-I69 HydrophobicContact CB-CG1 3.9Å; M64-I199 HydrophobicContact CE-CB 3.58Å; M64-I199 HydrophobicContact CE-CD1 3.89Å; M64-I199 HydrophobicContact CE-CG1 4.34Å; M64-I199 HydrophobicContact CE-CG2 3.21Å; M64-I199 HydrophobicContact CG-CD1 4.22Å; M64-Y200 HydrophobicContact CE-CD2 4.3Å; M64-Y200 HydrophobicContact CE-CE2 3.91Å; M64-Y200 HydrophobicContact SD-CE2 4.38Å; M64-S300 WeakPolarHBondContact CB-O 3.45Å; M64-S300 WeakPolarHBondContact CG-O 3.17Å; M64-S300 PolarHBondContact N-O 3.31Å; M64-A301 WeakPolarHBondContact O-CA 3.47Å; M64-K302 PolarHBondContact O-N 3.23Å; M64-K302 VanDerWaalsContact O-N 3.09Å
65	V	89.7	Confident	78.3	Confident	61 Å²	61	24.9 Å²	24.9	37%	0.37	15%	0.15	S	C	.	.			trans	-91	170	175.5	-60.1	0	0	0	0	111.2	L67 P68 I69 K302	V65-L67 PolarHBondContact O-N 2.97Å; V65-P68 HydrophobicContact CG2-CG 4.03Å; V65-P68 WeakPolarHBondContact O-CD 3.19Å; V65-I69 WeakPolarHBondContact O-CD1 3.37Å; V65-I69 VanDerWaalsContact O-CG1 3.23Å; V65-I69 WeakPolarHBondContact O-CG1 3.26Å; V65-I69 PolarHBondContact O-N 3.05Å; V65-K302 HydrophobicContact CG1-CD 4.45Å
66	W	92	Very high	79.7	Confident	109 Å²	109	24.2 Å²	24.2	41%	0.413	14%	0.141	S	C	.	.	H	α-helix	trans	-67.7	-35	-163.8	63.8	-92.2	0	0	0	113.5	I69 G70 H306 A309 G310 L313	W66-I69 PolarHBondContact O-N 3.16Å; W66-G70 PolarHBondContact O-N 3.2Å; W66-H306 HydrophobicContact CB-CB 4.35Å; W66-H306 WeakPolarHBondContact CB-O 3.37Å; W66-H306 AromaticContact CD1-CE1 3.62Å; W66-H306 AromaticContact CD1-ND1 3.69Å; W66-H306 PolarHBondContact N-ND1 3.47Å; W66-H306 VanDerWaalsContact N-ND1 3.16Å; W66-A309 HydrophobicContact CB-CB 3.57Å; W66-A309 HydrophobicContact CD2-CB 4.36Å; W66-A309 HydrophobicContact CG-CB 3.96Å; W66-G310 WeakPolarHBondContact O-CA 3.42Å; W66-L313 HydrophobicContact CE3-CB 4.29Å; W66-L313 HydrophobicContact CE3-CD2 4.02Å; W66-L313 HydrophobicContact CZ3-CB 4.21Å; W66-L313 HydrophobicContact CZ3-CD1 4.36Å; W66-L313 HydrophobicContact CZ3-CD2 3.8Å; W66-L313 HydrophobicContact CZ3-CG 4.34Å
67	L	93.3	Very high	81.3	Confident	81 Å²	81	24.5 Å²	24.5	42%	0.424	14%	0.14	S	C	.	.	H	α-helix	trans	-67.5	-52.3	-175.9	-178.7	158.9	0	0	0	112.2	V65 I69 G70 A71 T203 L313	V65-L67 PolarHBondContact O-N 2.97Å; L67-I69 VanDerWaalsContact C-N 3.26Å; L67-I69 PolarHBondContact O-N 2.83Å; L67-G70 PolarHBondContact O-N 3.39Å; L67-A71 WeakPolarHBondContact O-CB 3.47Å; L67-A71 PolarHBondContact O-N 3.37Å; L67-T203 HydrophobicContact CD2-CG2 3.56Å; L67-L313 HydrophobicContact CB-CD2 4.43Å; L67-L313 HydrophobicContact CG-CD2 4.29Å
68	P	91.1	Very high	82.8	Confident	9 Å²	9	23.2 Å²	23.2	6%	0.058	14%	0.135	C	C	.	.	H	α-helix	trans	-61.1	-33.9	174.7	-25.1	34.7	0	0	0	113.6	M64 V65 S72 I199 Y200 T203	M64-P68 HydrophobicContact CE-CB 4.32Å; V65-P68 HydrophobicContact CG2-CG 4.03Å; V65-P68 WeakPolarHBondContact O-CD 3.19Å; P68-S72 WeakPolarHBondContact O-CB 3.15Å; P68-S72 PolarHBondContact O-N 3.49Å; P68-I199 HydrophobicContact CB-CG2 3.61Å; P68-I199 WeakPolarHBondContact O-CG2 3.46Å; P68-Y200 HydrophobicContact CG-CE1 4.48Å; P68-T203 VanDerWaalsContact CA-OG1 3.25Å; P68-T203 WeakPolarHBondContact CA-OG1 3.34Å; P68-T203 WeakPolarHBondContact CB-OG1 3.29Å
69	I	90.6	Very high	84.1	Confident	0 Å²	0	23 Å²	23	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-63.2	-53.9	175.4	-64.9	161.7	0	0	0	110.2	M64 V65 W66 L67 A71 S72 L73 A301	M64-I69 HydrophobicContact CB-CD1 4.04Å; M64-I69 HydrophobicContact CB-CG1 3.9Å; V65-I69 WeakPolarHBondContact O-CD1 3.37Å; V65-I69 VanDerWaalsContact O-CG1 3.23Å; V65-I69 WeakPolarHBondContact O-CG1 3.26Å; V65-I69 PolarHBondContact O-N 3.05Å; W66-I69 PolarHBondContact O-N 3.16Å; L67-I69 VanDerWaalsContact C-N 3.26Å; L67-I69 PolarHBondContact O-N 2.83Å; I69-A71 PolarHBondContact O-N 2.91Å; I69-S72 PolarHBondContact O-N 3.49Å; I69-L73 HydrophobicContact CG2-CD1 3.86Å; I69-L73 HydrophobicContact CG2-CG 4.26Å; I69-L73 WeakPolarHBondContact O-CB 3.31Å; I69-L73 VanDerWaalsContact O-CG 3.23Å; I69-L73 WeakPolarHBondContact O-CG 3.29Å; I69-L73 PolarHBondContact O-N 2.86Å; I69-A301 HydrophobicContact CD1-CB 3.32Å
70	G	93.9	Very high	85.3	Confident	0 Å²	0	22.8 Å²	22.8	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-63.2	-40.7	-178	0	0	0	0	0	113	W66 L67 F74 G310	W66-G70 PolarHBondContact O-N 3.2Å; L67-G70 PolarHBondContact O-N 3.39Å; G70-F74 WeakPolarHBondContact O-CB 3.43Å; G70-F74 PolarHBondContact O-N 3.37Å; G70-F74 VanDerWaalsContact O-N 3.08Å; G70-G310 WeakPolarHBondContact CA-O 3.43Å
71	A	92.8	Very high	86.8	Confident	5 Å²	5	23.3 Å²	23.3	4%	0.041	14%	0.136	C	C	.	.	H	α-helix	trans	-65.5	-42.9	175.5	0	0	0	0	0	111.9	L67 I69 F74 A75 T203 T206	L67-A71 WeakPolarHBondContact O-CB 3.47Å; L67-A71 PolarHBondContact O-N 3.37Å; I69-A71 PolarHBondContact O-N 2.91Å; A71-F74 PolarHBondContact O-N 3.11Å; A71-A75 WeakPolarHBondContact O-CB 2.99Å; A71-A75 PolarHBondContact O-N 3.47Å; A71-T203 HydrophobicContact CB-CG2 4.07Å; A71-T206 HydrophobicContact CB-CG2 4.23Å; A71-T206 PolarHBondContact O-OG1 3.33Å; A71-T206 VanDerWaalsContact O-OG1 3.12Å
72	S	90.6	Very high	88.4	Confident	0 Å²	0	21.6 Å²	21.6	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-70.2	-35.4	178.4	-175.8	0	0	0	0	112.9	P68 I69 F74 A75 S76 D202 R297	P68-S72 WeakPolarHBondContact O-CB 3.15Å; P68-S72 PolarHBondContact O-N 3.49Å; I69-S72 PolarHBondContact O-N 3.49Å; S72-F74 VanDerWaalsContact C-N 3.31Å; S72-F74 PolarHBondContact O-N 3.15Å; S72-A75 PolarHBondContact O-N 3.39Å; S72-S76 VanDerWaalsContact O-CB 3.26Å; S72-S76 WeakPolarHBondContact O-CB 3.32Å; S72-S76 PolarHBondContact O-N 3.03Å; S72-S76 PolarHBondContact O-OG 2.84Å; S72-D202 PolarHBondContact OG-OD2 3.02Å; S72-R297 WeakPolarHBondContact OG-CD 3.46Å; S72-R297 PolarHBondContact OG-NE 3.24Å
73	L	92.2	Very high	89.4	Confident	0 Å²	0	19.4 Å²	19.4	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-59.2	-43.4	169.8	-72.4	171.2	0	0	0	111.3	I69 N77 I294 R297 C314	I69-L73 HydrophobicContact CG2-CD1 3.86Å; I69-L73 HydrophobicContact CG2-CG 4.26Å; I69-L73 WeakPolarHBondContact O-CB 3.31Å; I69-L73 VanDerWaalsContact O-CG 3.23Å; I69-L73 WeakPolarHBondContact O-CG 3.29Å; I69-L73 PolarHBondContact O-N 2.86Å; L73-N77 PolarHBondContact O-N 2.97Å; L73-I294 HydrophobicContact CD2-CG2 3.71Å; L73-R297 HydrophobicContact CD2-CB 4.1Å; L73-C314 HydrophobicContact CB-CB 4.03Å; L73-C314 HydrophobicContact CD1-CB 4.37Å
74	F	92.9	Very high	90.2	Very high	4 Å²	4	16 Å²	16	2%	0.018	8%	0.082	C	C	.	.	H	α-helix	trans	-67.5	-50.4	177	178.5	-101.8	0	0	0	112.1	G70 A71 S72 S76 N77 I78 T206 M209 L210 L317 P321	G70-F74 WeakPolarHBondContact O-CB 3.43Å; G70-F74 PolarHBondContact O-N 3.37Å; G70-F74 VanDerWaalsContact O-N 3.08Å; A71-F74 PolarHBondContact O-N 3.11Å; S72-F74 VanDerWaalsContact C-N 3.31Å; S72-F74 PolarHBondContact O-N 3.15Å; F74-S76 VanDerWaalsContact C-N 3.31Å; F74-S76 PolarHBondContact O-N 2.94Å; F74-N77 PolarHBondContact O-N 3.45Å; F74-I78 HydrophobicContact CD1-CG1 4.39Å; F74-I78 HydrophobicContact CD2-CG1 3.81Å; F74-I78 HydrophobicContact CE1-CB 4.28Å; F74-I78 HydrophobicContact CE1-CG1 4.13Å; F74-I78 HydrophobicContact CE1-CG2 4.47Å; F74-I78 HydrophobicContact CE2-CB 4.5Å; F74-I78 HydrophobicContact CE2-CD1 4.28Å; F74-I78 HydrophobicContact CE2-CG1 3.5Å; F74-I78 HydrophobicContact CG-CG1 4.26Å; F74-I78 HydrophobicContact CZ-CB 4.26Å; F74-I78 HydrophobicContact CZ-CG1 3.68Å; F74-I78 HydrophobicContact CZ-CG2 4.36Å; F74-I78 WeakPolarHBondContact O-CB 3.42Å; F74-I78 WeakPolarHBondContact O-CG1 3.49Å; F74-I78 PolarHBondContact O-N 2.73Å; F74-T206 HydrophobicContact CD1-CG2 3.65Å; F74-T206 HydrophobicContact CE1-CG2 4.12Å; F74-M209 HydrophobicContact CD1-CE 3.99Å; F74-M209 HydrophobicContact CE1-CE 3.4Å; F74-M209 HydrophobicContact CZ-CE 4.29Å; F74-L210 HydrophobicContact CE1-CD2 3.87Å; F74-L210 HydrophobicContact CE1-CG 4.33Å; F74-L210 HydrophobicContact CZ-CD2 3.92Å; F74-L317 HydrophobicContact CB-CB 4.36Å; F74-L317 HydrophobicContact CB-CD1 3.88Å; F74-L317 HydrophobicContact CD1-CB 4.37Å; F74-L317 HydrophobicContact CD1-CD1 4.05Å; F74-L317 HydrophobicContact CD2-CB 3.48Å; F74-L317 VanDerWaalsContact CD2-CB 3.48Å; F74-L317 HydrophobicContact CD2-CD1 4.4Å; F74-L317 HydrophobicContact CE2-CB 3.7Å; F74-L317 WeakPolarHBondContact CE2-O 3.32Å; F74-L317 HydrophobicContact CG-CB 3.83Å; F74-L317 HydrophobicContact CG-CD1 3.87Å; F74-L317 HydrophobicContact CZ-CB 4.24Å; F74-P321 HydrophobicContact CE2-CG 4.38Å
75	A	90.3	Very high	90.6	Very high	0 Å²	0	15.9 Å²	15.9	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-62.2	-35.2	179.8	0	0	0	0	0	113.4	A71 S72 N77 I78 D202	A71-A75 WeakPolarHBondContact O-CB 2.99Å; A71-A75 PolarHBondContact O-N 3.47Å; S72-A75 PolarHBondContact O-N 3.39Å; A75-N77 VanDerWaalsContact C-N 3.27Å; A75-N77 PolarHBondContact O-N 3.38Å; A75-I78 CarbonylContact O-C 3.56Å; A75-D202 HydrophobicContact CB-CB 3.88Å
76	S	87.8	Confident	90.9	Very high	14 Å²	14	13 Å²	13	10%	0.098	6%	0.063	C	C	.	.	H	α-helix	trans	-68.2	-31.2	178.9	-57.6	0	0	0	0	112.3	S72 F74 R297	S72-S76 VanDerWaalsContact O-CB 3.26Å; S72-S76 WeakPolarHBondContact O-CB 3.32Å; S72-S76 PolarHBondContact O-N 3.03Å; S72-S76 PolarHBondContact O-OG 2.84Å; F74-S76 VanDerWaalsContact C-N 3.31Å; F74-S76 PolarHBondContact O-N 2.94Å; S76-R297 PolarHBondContact OG-NE 3.46Å; S76-R297 PolarHBondContact OG-NH1 3.11Å; S76-R297 PolarHBondContact OG-NH2 3.34Å
77	N	89.9	Confident	91	Very high	18 Å²	18	7.8 Å²	7.8	10%	0.096	4%	0.044	C	C	.	.	H	α-helix	trans	-80.6	-52.4	171.8	-179.9	108.8	0	0	0	110.7	L73 F74 A75 G79 H82 F287 W288 K318	L73-N77 PolarHBondContact O-N 2.97Å; F74-N77 PolarHBondContact O-N 3.45Å; A75-N77 VanDerWaalsContact C-N 3.27Å; A75-N77 PolarHBondContact O-N 3.38Å; N77-G79 PolarHBondContact O-N 3.49Å; N77-H82 PolarHBondContact ND2-CE1 3.39Å; N77-H82 VanDerWaalsContact ND2-CE1 3.3Å; N77-H82 PolarHBondContact ND2-NE2 3Å; N77-H82 PolarHBondContact O-CE1 3Å; N77-H82 PolarHBondContact O-ND1 3.13Å; N77-F287 HydrophobicContact CB-CE1 4.11Å; N77-F287 HydrophobicContact CB-CZ 4.13Å; N77-F287 WeakPolarHBondContact OD1-CE1 3.41Å; N77-F287 WeakPolarHBondContact OD1-CZ 3.3Å; N77-W288 HydrophobicContact CB-CH2 3.94Å; N77-W288 HydrophobicContact CB-CZ2 4.14Å; N77-W288 WeakPolarHBondContact OD1-CZ2 3.33Å; N77-K318 PolarHBondContact ND2-NZ 3.43Å; N77-K318 PolarHBondContact OD1-NZ 3.25Å
78	I	89	Confident	91	Very high	0 Å²	0	4 Å²	4	0%	0	2%	0.023	C	C	.	.	S	Bend	trans	-82.1	85.6	-173.3	-57.7	-64.9	0	0	0	110.2	F74 A75 H82 F83 M209 P321 M325	F74-I78 HydrophobicContact CD1-CG1 4.39Å; F74-I78 HydrophobicContact CD2-CG1 3.81Å; F74-I78 HydrophobicContact CE1-CB 4.28Å; F74-I78 HydrophobicContact CE1-CG1 4.13Å; F74-I78 HydrophobicContact CE1-CG2 4.47Å; F74-I78 HydrophobicContact CE2-CB 4.5Å; F74-I78 HydrophobicContact CE2-CD1 4.28Å; F74-I78 HydrophobicContact CE2-CG1 3.5Å; F74-I78 HydrophobicContact CG-CG1 4.26Å; F74-I78 HydrophobicContact CZ-CB 4.26Å; F74-I78 HydrophobicContact CZ-CG1 3.68Å; F74-I78 HydrophobicContact CZ-CG2 4.36Å; F74-I78 WeakPolarHBondContact O-CB 3.42Å; F74-I78 WeakPolarHBondContact O-CG1 3.49Å; F74-I78 PolarHBondContact O-N 2.73Å; A75-I78 CarbonylContact O-C 3.56Å; I78-H82 HydrophobicContact CD1-CB 4.3Å; I78-H82 HydrophobicContact CG2-CB 4.46Å; I78-F83 HydrophobicContact CG2-CE2 4.44Å; I78-M209 HydrophobicContact CB-CE 4.04Å; I78-M209 HydrophobicContact CG2-CE 3.59Å; I78-M209 HydrophobicContact CG2-SD 4.06Å; I78-P321 HydrophobicContact CD1-CG 4.03Å; I78-M325 HydrophobicContact CG2-CE 3.28Å; I78-M325 HydrophobicContact CG2-SD 4.44Å
79	G	85.2	Confident	91.2	Very high	1 Å²	1	3.5 Å²	3.5	1%	0.01	2%	0.021	C	C	.	.	S	Bend	trans	-109	-161.4	171.4	0	0	0	0	0	113.4	N77 V81 H82 F83 S390	N77-G79 PolarHBondContact O-N 3.49Å; G79-V81 VanDerWaalsContact C-N 3.26Å; G79-V81 PolarHBondContact O-N 2.99Å; G79-H82 PolarHBondContact O-N 3.27Å; G79-H82 VanDerWaalsContact O-N 3.11Å; G79-F83 WeakPolarHBondContact O-CD2 3.31Å; G79-F83 PolarHBondContact O-N 2.91Å; G79-S390 WeakPolarHBondContact CA-OG 3.36Å
80	S	84.9	Confident	91.4	Very high	2 Å²	2	3.5 Å²	3.5	1%	0.014	2%	0.021	C	C	.	.	H	α-helix	trans	-61.8	-32.7	179	64.1	0	0	0	0	113.5	H82 F83 V84 S162 L387	S80-H82 PolarHBondContact O-N 3.09Å; S80-F83 PolarHBondContact O-N 3.37Å; S80-F83 VanDerWaalsContact O-N 3.11Å; S80-V84 WeakPolarHBondContact O-CB 3.25Å; S80-V84 WeakPolarHBondContact O-CG2 3.46Å; S80-V84 PolarHBondContact O-N 2.98Å; S80-S162 WeakPolarHBondContact CB-OG 3.48Å; S80-S162 PolarHBondContact O-OG 3.44Å; S80-S162 WeakPolarHBondContact OG-CB 3.5Å; S80-S162 PolarHBondContact OG-OG 3.18Å; S80-L387 WeakPolarHBondContact OG-CD2 3.29Å
81	V	90	Very high	91.4	Very high	12 Å²	12	3.5 Å²	3.5	7%	0.073	2%	0.021	C	C	.	.	I	π-helix	trans	-58.2	-30.9	177.8	168.5	0	0	0	0	110.9	G79 G85 L86 A158 D159 S162 F450 I453	G79-V81 VanDerWaalsContact C-N 3.26Å; G79-V81 PolarHBondContact O-N 2.99Å; V81-G85 CarbonylContact O-C 3.57Å; V81-G85 WeakPolarHBondContact O-CA 3.45Å; V81-G85 PolarHBondContact O-N 3.24Å; V81-L86 PolarHBondContact O-N 2.82Å; V81-L86 VanDerWaalsContact O-N 3.08Å; V81-A158 HydrophobicContact CG2-CB 3.88Å; V81-D159 WeakPolarHBondContact CG2-OD1 3.45Å; V81-S162 PolarHBondContact N-OG 3.28Å; V81-F450 HydrophobicContact CG1-CD2 4.03Å; V81-I453 HydrophobicContact CB-CD1 4.47Å; V81-I453 HydrophobicContact CG1-CD1 3.51Å; V81-I453 HydrophobicContact CG2-CD1 4.07Å
82	H	93.3	Very high	91.3	Very high	18 Å²	18	4.4 Å²	4.4	8%	0.083	3%	0.028	C	C	.	.	I	π-helix	trans	-78.3	-45.6	175.3	-65	71.7	0	0	0	110.7	N77 I78 G79 S80 V84 L86 A87 E101 M325	N77-H82 PolarHBondContact ND2-CE1 3.39Å; N77-H82 VanDerWaalsContact ND2-CE1 3.3Å; N77-H82 PolarHBondContact ND2-NE2 3Å; N77-H82 PolarHBondContact O-CE1 3Å; N77-H82 PolarHBondContact O-ND1 3.13Å; I78-H82 HydrophobicContact CD1-CB 4.3Å; I78-H82 HydrophobicContact CG2-CB 4.46Å; G79-H82 PolarHBondContact O-N 3.27Å; G79-H82 VanDerWaalsContact O-N 3.11Å; S80-H82 PolarHBondContact O-N 3.09Å; H82-V84 PolarHBondContact O-N 2.94Å; H82-L86 HydrophobicContact CB-CB 4.32Å; H82-L86 WeakPolarHBondContact O-CA 3.17Å; H82-L86 WeakPolarHBondContact O-CB 3.33Å; H82-L86 PolarHBondContact O-N 3.42Å; H82-L86 VanDerWaalsContact O-N 3.13Å; H82-A87 PolarHBondContact O-N 3.42Å; H82-E101 IonicContact CD2-OE1 3.57Å; H82-E101 PolarHBondContact CD2-OE1 2.91Å; H82-E101 IonicContact NE2-OE1 3.85Å; H82-E101 PolarHBondContact NE2-OE1 2.68Å; H82-M325 HydrophobicContact CB-CE 4.4Å; H82-M325 HydrophobicContact CB-SD 3.73Å
83	F	91.1	Very high	91.3	Very high	0 Å²	0	4.5 Å²	4.5	0%	0	3%	0.028	C	C	.	.	I	π-helix	trans	-62.8	-39.2	177.3	-75	-69.4	0	0	0	114	I78 G79 S80 A87 M209 M325 Y363 M383	I78-F83 HydrophobicContact CG2-CE2 4.44Å; G79-F83 WeakPolarHBondContact O-CD2 3.31Å; G79-F83 PolarHBondContact O-N 2.91Å; S80-F83 PolarHBondContact O-N 3.37Å; S80-F83 VanDerWaalsContact O-N 3.11Å; F83-A87 WeakPolarHBondContact O-CB 3.38Å; F83-M209 HydrophobicContact CE2-CG 3.95Å; F83-M209 HydrophobicContact CE2-SD 3.54Å; F83-M209 VanDerWaalsContact CE2-SD 3.54Å; F83-M209 HydrophobicContact CZ-CG 3.55Å; F83-M209 HydrophobicContact CZ-SD 3.74Å; F83-M325 HydrophobicContact CD1-CE 3.8Å; F83-M325 HydrophobicContact CD1-CG 4.33Å; F83-M325 HydrophobicContact CD1-SD 4.36Å; F83-M325 HydrophobicContact CD2-CE 4.2Å; F83-M325 HydrophobicContact CE1-CE 3.43Å; F83-M325 VanDerWaalsContact CE1-CE 3.43Å; F83-M325 HydrophobicContact CE1-CG 4.37Å; F83-M325 HydrophobicContact CE1-SD 4.48Å; F83-M325 HydrophobicContact CE2-CE 3.85Å; F83-M325 HydrophobicContact CG-CE 4.18Å; F83-M325 HydrophobicContact CZ-CE 3.45Å; F83-M325 VanDerWaalsContact CZ-CE 3.45Å; F83-Y363 HydrophobicContact CB-CD1 4.23Å; F83-Y363 AromaticContact CD1-CD1 3.79Å; F83-Y363 HydrophobicContact CD1-CD1 3.79Å; F83-Y363 HydrophobicContact CD1-CD2 4.38Å; F83-Y363 AromaticContact CD1-CE1 3.33Å; F83-Y363 HydrophobicContact CD1-CE1 3.33Å; F83-Y363 AromaticContact CD1-CE2 3.97Å; F83-Y363 HydrophobicContact CD1-CE2 3.97Å; F83-Y363 HydrophobicContact CD1-CG 4.3Å; F83-Y363 AromaticContact CD1-CZ 3.42Å; F83-Y363 VanDerWaalsContact CD1-CZ 3.42Å; F83-Y363 AromaticContact CE1-CE1 3.8Å; F83-Y363 HydrophobicContact CE1-CE1 3.8Å; F83-Y363 HydrophobicContact CE1-CE2 4.35Å; F83-Y363 AromaticContact CE1-CZ 3.6Å; F83-Y363 WeakPolarHBondContact CE1-OH 3.34Å; F83-Y363 HydrophobicContact CG-CD1 4.43Å; F83-Y363 HydrophobicContact CG-CE1 4.27Å; F83-Y363 WeakPolarHBondContact O-CB 3.35Å; F83-M383 HydrophobicContact CB-CE 3.47Å; F83-M383 VanDerWaalsContact CB-CE 3.47Å; F83-M383 HydrophobicContact CD1-CE 4.34Å; F83-M383 HydrophobicContact CD2-CE 4.25Å; F83-M383 HydrophobicContact CD2-CG 4.41Å; F83-M383 HydrophobicContact CG-CE 3.79Å; F83-M383 HydrophobicContact CG-SD 4.46Å
84	V	91.1	Very high	91.3	Very high	0 Å²	0	4.5 Å²	4.5	0%	0	3%	0.028	C	C	.	.	I	π-helix	trans	-92.9	-51.7	-176.4	173.7	0	0	0	0	110.2	S80 H82 G88 S162 L165 N360 P364	S80-V84 WeakPolarHBondContact O-CB 3.25Å; S80-V84 WeakPolarHBondContact O-CG2 3.46Å; S80-V84 PolarHBondContact O-N 2.98Å; H82-V84 PolarHBondContact O-N 2.94Å; V84-G88 WeakPolarHBondContact O-CA 3.27Å; V84-G88 PolarHBondContact O-N 3.42Å; V84-S162 VanDerWaalsContact CB-OG 3.29Å; V84-S162 WeakPolarHBondContact CB-OG 3.02Å; V84-S162 WeakPolarHBondContact CG2-OG 3.29Å; V84-L165 HydrophobicContact CG1-CD1 4.09Å; V84-N360 HydrophobicContact CG1-CB 3.89Å; V84-N360 VanDerWaalsContact CG1-O 3.25Å; V84-N360 WeakPolarHBondContact CG1-O 3.3Å; V84-P364 HydrophobicContact CG2-CG 4.26Å
85	G	91.9	Very high	91.4	Very high	0 Å²	0	4.3 Å²	4.3	0%	0	3%	0.028	C	C	.	.	I	π-helix	trans	-77.6	-57.6	-175.9	0	0	0	0	0	112.8	V81 A87 G88 T89	V81-G85 CarbonylContact O-C 3.57Å; V81-G85 WeakPolarHBondContact O-CA 3.45Å; V81-G85 PolarHBondContact O-N 3.24Å; G85-A87 PolarHBondContact O-N 3.3Å; G85-G88 PolarHBondContact O-N 2.91Å; G85-G88 VanDerWaalsContact O-N 3.13Å; G85-T89 PolarHBondContact O-N 2.72Å; G85-T89 PolarHBondContact O-OG1 3.11Å
86	L	94.3	Very high	91.5	Very high	0 Å²	0	4.3 Å²	4.3	0%	0	3%	0.028	C	C	.	.	I	π-helix	trans	-60.8	-45.6	-177.5	-171.6	83.2	0	0	0	111	V81 H82 G88 A90 I97 E101 P321 M325 V326 F450	V81-L86 PolarHBondContact O-N 2.82Å; V81-L86 VanDerWaalsContact O-N 3.08Å; H82-L86 HydrophobicContact CB-CB 4.32Å; H82-L86 WeakPolarHBondContact O-CA 3.17Å; H82-L86 WeakPolarHBondContact O-CB 3.33Å; H82-L86 PolarHBondContact O-N 3.42Å; H82-L86 VanDerWaalsContact O-N 3.13Å; L86-G88 VanDerWaalsContact C-N 3.34Å; L86-A90 WeakPolarHBondContact O-CB 3.44Å; L86-A90 PolarHBondContact O-N 3.29Å; L86-I97 HydrophobicContact CD1-CB 4.35Å; L86-I97 HydrophobicContact CD1-CG1 3.48Å; L86-I97 VanDerWaalsContact CD1-CG1 3.48Å; L86-I97 HydrophobicContact CD1-CG2 4.11Å; L86-I97 HydrophobicContact CG-CG1 4.43Å; L86-I97 HydrophobicContact CG-CG2 4.35Å; L86-E101 HydrophobicContact CD2-CG 4.16Å; L86-P321 HydrophobicContact CD2-CB 4.31Å; L86-M325 HydrophobicContact CD2-CB 4.34Å; L86-M325 HydrophobicContact CD2-SD 4.36Å; L86-V326 HydrophobicContact CD2-CG2 4.14Å; L86-V326 HydrophobicContact CG-CG2 4.32Å; L86-F450 HydrophobicContact CB-CD2 4.1Å; L86-F450 HydrophobicContact CB-CE2 4.19Å; L86-F450 HydrophobicContact CD1-CD1 4.31Å; L86-F450 HydrophobicContact CD1-CD2 4.31Å; L86-F450 HydrophobicContact CD1-CE1 3.87Å; L86-F450 HydrophobicContact CD1-CE2 3.89Å; L86-F450 HydrophobicContact CD1-CZ 3.64Å
87	A	95.1	Very high	91.8	Very high	0 Å²	0	3.7 Å²	3.7	0%	0	2%	0.023	C	C	.	.	H	α-helix	trans	-67.7	-33.1	176.1	0	0	0	0	0	112.7	H82 F83 G85 A90 A91 M325 G329 Y363	H82-A87 PolarHBondContact O-N 3.42Å; F83-A87 WeakPolarHBondContact O-CB 3.38Å; G85-A87 PolarHBondContact O-N 3.3Å; A87-A90 PolarHBondContact O-N 3.4Å; A87-A91 PolarHBondContact O-N 3.5Å; A87-M325 WeakPolarHBondContact CB-O 3.48Å; A87-G329 WeakPolarHBondContact O-CA 3.44Å; A87-Y363 HydrophobicContact CB-CD2 4Å; A87-Y363 HydrophobicContact CB-CG 4.34Å
88	G	93.7	Very high	92	Very high	0 Å²	0	2.8 Å²	2.8	0%	0	2%	0.019	C	C	.	.	H	α-helix	trans	-68.7	-46.2	175.4	0	0	0	0	0	112.6	V84 G85 L86 A90 A91 A92 T359	V84-G88 WeakPolarHBondContact O-CA 3.27Å; V84-G88 PolarHBondContact O-N 3.42Å; G85-G88 PolarHBondContact O-N 2.91Å; G85-G88 VanDerWaalsContact O-N 3.13Å; L86-G88 VanDerWaalsContact C-N 3.34Å; G88-A90 VanDerWaalsContact C-N 3.29Å; G88-A90 PolarHBondContact O-N 3.39Å; G88-A91 WeakPolarHBondContact O-CB 3.33Å; G88-A91 PolarHBondContact O-N 3.13Å; G88-A91 VanDerWaalsContact O-N 3.13Å; G88-A92 PolarHBondContact O-N 3.07Å; G88-T359 WeakPolarHBondContact CA-O 3.27Å; G88-T359 WeakPolarHBondContact O-CB 3.4Å
89	T	93.8	Very high	92.2	Very high	0 Å²	0	2.8 Å²	2.8	0%	0	2%	0.019	C	C	.	.	H	α-helix	trans	-61.7	-39.4	171.5	-65.7	0	0	0	0	110.5	G85 A91 A92 S93 I97 D451	G85-T89 PolarHBondContact O-N 2.72Å; G85-T89 PolarHBondContact O-OG1 3.11Å; T89-A91 VanDerWaalsContact C-N 3.32Å; T89-A91 PolarHBondContact O-N 3.07Å; T89-A92 CarbonylContact O-C 3.59Å; T89-A92 WeakPolarHBondContact O-CB 3.47Å; T89-A92 PolarHBondContact O-N 3.31Å; T89-S93 WeakPolarHBondContact CG2-OG 3.31Å; T89-S93 PolarHBondContact O-N 3.29Å; T89-S93 PolarHBondContact O-OG 3.18Å; T89-I97 HydrophobicContact CG2-CB 4.21Å; T89-I97 HydrophobicContact CG2-CD1 3.66Å; T89-I97 HydrophobicContact CG2-CG1 3.87Å; T89-D451 WeakPolarHBondContact CG2-OD2 3.34Å; T89-D451 PolarHBondContact OG1-OD2 2.81Å; T89-D451 VanDerWaalsContact OG1-OD2 3.06Å
90	A	95	Very high	92.6	Very high	0 Å²	0	3.6 Å²	3.6	0%	0	2%	0.022	C	C	.	.	H	α-helix	trans	-60.7	-38.4	173.1	0	0	0	0	0	113	L86 A87 G88 A92 G94 I97 V326 M330	L86-A90 WeakPolarHBondContact O-CB 3.44Å; L86-A90 PolarHBondContact O-N 3.29Å; A87-A90 PolarHBondContact O-N 3.4Å; G88-A90 VanDerWaalsContact C-N 3.29Å; G88-A90 PolarHBondContact O-N 3.39Å; A90-A92 VanDerWaalsContact C-N 3.27Å; A90-A92 PolarHBondContact O-N 2.85Å; A90-G94 VanDerWaalsContact O-CA 3.25Å; A90-G94 WeakPolarHBondContact O-CA 3.45Å; A90-G94 PolarHBondContact O-N 3.23Å; A90-I97 HydrophobicContact CB-CG2 3.96Å; A90-V326 HydrophobicContact CB-CB 4.03Å; A90-V326 HydrophobicContact CB-CG1 3.68Å; A90-V326 HydrophobicContact CB-CG2 4.3Å; A90-V326 WeakPolarHBondContact CB-O 3.46Å; A90-M330 HydrophobicContact CB-CG 4.48Å; A90-M330 VanDerWaalsContact O-CG 3.3Å; A90-M330 WeakPolarHBondContact O-CG 3.09Å
91	A	94.3	Very high	93	Very high	0 Å²	0	3.7 Å²	3.7	0%	0	2%	0.022	C	C	.	.	H	α-helix	trans	-64.4	-33	173.4	0	0	0	0	0	112.1	A87 G88 T89 Y237 G329 R333 V340 A362	A87-A91 PolarHBondContact O-N 3.5Å; G88-A91 WeakPolarHBondContact O-CB 3.33Å; G88-A91 PolarHBondContact O-N 3.13Å; G88-A91 VanDerWaalsContact O-N 3.13Å; T89-A91 VanDerWaalsContact C-N 3.32Å; T89-A91 PolarHBondContact O-N 3.07Å; A91-Y237 PolarHBondContact O-OH 2.84Å; A91-G329 VanDerWaalsContact CB-O 3.24Å; A91-G329 WeakPolarHBondContact CB-O 3.39Å; A91-R333 HydrophobicContact CB-CB 4.4Å; A91-R333 WeakPolarHBondContact O-CD 3.08Å; A91-R333 PolarHBondContact O-NH1 2.97Å; A91-V340 HydrophobicContact CB-CG1 3.96Å; A91-A362 HydrophobicContact CB-CB 3.89Å
92	A	91	Very high	93.2	Very high	23 Å²	23	3.1 Å²	3.1	19%	0.19	2%	0.018	C	C	.	.	H	α-helix	trans	-78.3	-50.9	178.7	0	0	0	0	0	112.2	G88 T89 A90 R333 T359 Q448	G88-A92 PolarHBondContact O-N 3.07Å; T89-A92 CarbonylContact O-C 3.59Å; T89-A92 WeakPolarHBondContact O-CB 3.47Å; T89-A92 PolarHBondContact O-N 3.31Å; A90-A92 VanDerWaalsContact C-N 3.27Å; A90-A92 PolarHBondContact O-N 2.85Å; A92-R333 PolarHBondContact O-NH1 2.73Å; A92-T359 HydrophobicContact CB-CG2 4Å; A92-Q448 HydrophobicContact CB-CG 4.27Å
93	S	90.3	Very high	93.1	Very high	2 Å²	2	2.9 Å²	2.9	1%	0.014	2%	0.018	C	C	.	.	H	α-helix	trans	-115.4	-14.8	-163.9	73.4	0	0	0	0	114.7	T89 R264 D270	T89-S93 WeakPolarHBondContact CG2-OG 3.31Å; T89-S93 PolarHBondContact O-N 3.29Å; T89-S93 PolarHBondContact O-OG 3.18Å; S93-R264 PolarHBondContact O-NH1 3.33Å; S93-R264 PolarHBondContact O-NH2 3.38Å; S93-D270 WeakPolarHBondContact CB-OD2 3.4Å
94	G	92.8	Very high	93.2	Very high	0 Å²	0	3.1 Å²	3.1	0%	0	2%	0.02	C	C	.	.			trans	91.3	-150.3	179.4	0	0	0	0	0	115.2	A90 A96 A259	A90-G94 VanDerWaalsContact O-CA 3.25Å; A90-G94 WeakPolarHBondContact O-CA 3.45Å; A90-G94 PolarHBondContact O-N 3.23Å; G94-A96 PolarHBondContact O-N 2.99Å; G94-A259 CarbonylContact C-O 3.49Å; G94-A259 WeakPolarHBondContact CA-O 3.41Å
95	I	94.8	Very high	93.4	Very high	1 Å²	1	3.1 Å²	3.1	1%	0.005	2%	0.02	C	C	.	.	G	3₁₀ helix	trans	-77.4	-18.2	-164.5	75.4	172.7	0	0	0	115	I97 A98 A259 F260 M322 V326 F327 M330 F656	I95-I97 PolarHBondContact O-N 3.06Å; I95-A98 WeakPolarHBondContact O-CB 3.45Å; I95-A98 PolarHBondContact O-N 3.26Å; I95-A259 PolarHBondContact N-O 3.42Å; I95-F260 VanDerWaalsContact CD1-C 3.42Å; I95-F260 WeakPolarHBondContact CD1-O 3.27Å; I95-F260 HydrophobicContact CG2-CD1 4.21Å; I95-M322 HydrophobicContact CB-CE 4.23Å; I95-M322 HydrophobicContact CD1-CE 4.14Å; I95-M322 HydrophobicContact CG2-CE 4.46Å; I95-V326 HydrophobicContact CB-CG1 4.4Å; I95-V326 HydrophobicContact CG2-CG1 4.42Å; I95-F327 HydrophobicContact CG2-CD1 4.5Å; I95-F327 HydrophobicContact CG2-CE1 3.92Å; I95-M330 HydrophobicContact CG2-CE 4.21Å; I95-M330 HydrophobicContact CG2-SD 3.52Å; I95-M330 VanDerWaalsContact CG2-SD 3.52Å; I95-F656 HydrophobicContact CD1-CB 4.05Å; I95-F656 HydrophobicContact CD1-CD1 3.62Å; I95-F656 HydrophobicContact CD1-CE1 4.48Å; I95-F656 HydrophobicContact CD1-CG 4.22Å
96	A	93.3	Very high	93.5	Very high	0 Å²	0	5.3 Å²	5.3	0%	0	3%	0.033	C	C	.	.	G	3₁₀ helix	trans	-57.9	-26.8	-174.8	0	0	0	0	0	113.5	G94 A98 G99 R264 L271	G94-A96 PolarHBondContact O-N 2.99Å; A96-A98 PolarHBondContact O-N 3.1Å; A96-G99 PolarHBondContact O-N 3.44Å; A96-R264 HydrophobicContact CB-CG 4.44Å; A96-L271 HydrophobicContact CB-CB 4.33Å; A96-L271 HydrophobicContact CB-CD1 3.9Å
97	I	93.9	Very high	93.5	Very high	0 Å²	0	5.6 Å²	5.6	0%	0	4%	0.035	C	C	.	.	G	3₁₀ helix	trans	-63.9	-22.1	177.2	-158.1	70	0	0	0	113	L86 T89 A90 I95 G99 F100 L271 V326 F450	L86-I97 HydrophobicContact CD1-CB 4.35Å; L86-I97 HydrophobicContact CD1-CG1 3.48Å; L86-I97 VanDerWaalsContact CD1-CG1 3.48Å; L86-I97 HydrophobicContact CD1-CG2 4.11Å; L86-I97 HydrophobicContact CG-CG1 4.43Å; L86-I97 HydrophobicContact CG-CG2 4.35Å; T89-I97 HydrophobicContact CG2-CB 4.21Å; T89-I97 HydrophobicContact CG2-CD1 3.66Å; T89-I97 HydrophobicContact CG2-CG1 3.87Å; A90-I97 HydrophobicContact CB-CG2 3.96Å; I95-I97 PolarHBondContact O-N 3.06Å; I97-G99 PolarHBondContact O-N 3.11Å; I97-G99 VanDerWaalsContact O-N 3.11Å; I97-F100 HydrophobicContact CD1-CD2 3.55Å; I97-F100 HydrophobicContact CD1-CE2 3.46Å; I97-F100 VanDerWaalsContact CD1-CE2 3.46Å; I97-F100 HydrophobicContact CD1-CZ 4.46Å; I97-F100 HydrophobicContact CG1-CD2 4.18Å; I97-F100 PolarHBondContact O-N 3.11Å; I97-F100 VanDerWaalsContact O-N 3.13Å; I97-L271 HydrophobicContact CB-CD1 4.38Å; I97-L271 HydrophobicContact CD1-CD1 3.89Å; I97-V326 HydrophobicContact CG2-CG1 4.29Å; I97-V326 HydrophobicContact CG2-CG2 3.86Å; I97-F450 HydrophobicContact CD1-CD1 3.78Å; I97-F450 HydrophobicContact CD1-CE1 3.93Å; I97-F450 HydrophobicContact CG1-CD1 4.15Å; I97-F450 HydrophobicContact CG1-CE1 4.18Å
98	A	93.7	Very high	93.4	Very high	0 Å²	0	5.6 Å²	5.6	0%	0	4%	0.035	C	C	.	.	H	α-helix	trans	-59.8	-20.6	171.1	0	0	0	0	0	112.5	I95 A96 F100 E101 W102 L262 M322 V326	I95-A98 WeakPolarHBondContact O-CB 3.45Å; I95-A98 PolarHBondContact O-N 3.26Å; A96-A98 PolarHBondContact O-N 3.1Å; A98-F100 PolarHBondContact O-N 3.26Å; A98-E101 WeakPolarHBondContact O-CB 3.4Å; A98-E101 PolarHBondContact O-N 3.34Å; A98-W102 PolarHBondContact O-N 3.29Å; A98-W102 VanDerWaalsContact O-N 3.12Å; A98-L262 HydrophobicContact CB-CD1 4.49Å; A98-M322 HydrophobicContact CB-CB 4.22Å; A98-M322 HydrophobicContact CB-CG 4.11Å; A98-V326 HydrophobicContact CB-CG2 4.35Å
99	G	93	Very high	93.5	Very high	0 Å²	0	6 Å²	6	0%	0	4%	0.037	C	C	.	.	H	α-helix	trans	-58.2	-30.8	174.7	0	0	0	0	0	113.3	A96 I97 E101 N103	A96-G99 PolarHBondContact O-N 3.44Å; I97-G99 PolarHBondContact O-N 3.11Å; I97-G99 VanDerWaalsContact O-N 3.11Å; G99-E101 VanDerWaalsContact C-N 3.31Å; G99-E101 PolarHBondContact O-N 2.9Å; G99-N103 VanDerWaalsContact O-CB 3.31Å; G99-N103 WeakPolarHBondContact O-CB 3.4Å; G99-N103 PolarHBondContact O-N 3.35Å; G99-N103 PolarHBondContact O-ND2 3.27Å
100	F	92.9	Very high	93.4	Very high	17 Å²	17	9 Å²	9	8%	0.075	5%	0.052	C	C	.	.	H	α-helix	trans	-61.7	-41	173.3	-78.7	-97.6	0	0	0	111.8	I97 A98 A104 L271 L280 F450 Q454	I97-F100 HydrophobicContact CD1-CD2 3.55Å; I97-F100 HydrophobicContact CD1-CE2 3.46Å; I97-F100 VanDerWaalsContact CD1-CE2 3.46Å; I97-F100 HydrophobicContact CD1-CZ 4.46Å; I97-F100 HydrophobicContact CG1-CD2 4.18Å; I97-F100 PolarHBondContact O-N 3.11Å; I97-F100 VanDerWaalsContact O-N 3.13Å; A98-F100 PolarHBondContact O-N 3.26Å; F100-A104 WeakPolarHBondContact O-CB 3.4Å; F100-A104 PolarHBondContact O-N 2.93Å; F100-A104 VanDerWaalsContact O-N 3.09Å; F100-L271 HydrophobicContact CE2-CD1 4.4Å; F100-L271 HydrophobicContact CE2-CD2 3.85Å; F100-L271 HydrophobicContact CZ-CD2 4.38Å; F100-L280 HydrophobicContact CD1-CD1 4.37Å; F100-L280 HydrophobicContact CD1-CD2 3.53Å; F100-L280 HydrophobicContact CD2-CD1 4.03Å; F100-L280 HydrophobicContact CD2-CD2 4.22Å; F100-L280 HydrophobicContact CE1-CD2 3.15Å; F100-L280 HydrophobicContact CE1-CG 4.46Å; F100-L280 HydrophobicContact CE2-CD1 4.25Å; F100-L280 HydrophobicContact CE2-CD2 3.89Å; F100-L280 HydrophobicContact CG-CD1 4.11Å; F100-L280 HydrophobicContact CG-CD2 4.06Å; F100-L280 HydrophobicContact CZ-CD2 3.36Å; F100-F450 HydrophobicContact CB-CE1 4.31Å; F100-F450 HydrophobicContact CB-CZ 4.33Å; F100-F450 AromaticContact CD1-CE1 3.89Å; F100-F450 HydrophobicContact CD1-CE1 3.89Å; F100-F450 HydrophobicContact CD1-CZ 4.29Å; F100-F450 AromaticContact CD2-CE1 3.99Å; F100-F450 HydrophobicContact CD2-CE1 3.99Å; F100-F450 HydrophobicContact CE1-CE1 4.14Å; F100-F450 HydrophobicContact CE2-CE1 4.24Å; F100-F450 AromaticContact CG-CE1 3.8Å; F100-F450 HydrophobicContact CG-CE1 3.8Å; F100-F450 HydrophobicContact CG-CZ 4.25Å; F100-F450 HydrophobicContact CZ-CE1 4.3Å; F100-Q454 HydrophobicContact CD1-CG 4.1Å; F100-Q454 HydrophobicContact CE1-CB 3.82Å; F100-Q454 VanDerWaalsContact CE1-CD 3.46Å; F100-Q454 HydrophobicContact CE1-CG 3.39Å; F100-Q454 HydrophobicContact CZ-CB 4.04Å; F100-Q454 HydrophobicContact CZ-CG 3.85Å
101	E	93.9	Very high	93.3	Very high	4 Å²	4	9 Å²	9	2%	0.019	5%	0.052	C	C	.	.	H	α-helix	trans	-74.7	-40.6	-176.7	-63.9	-62.6	148.3	0	0	112.1	H82 L86 A98 G99 A104 L105 K318 P321	H82-E101 IonicContact CD2-OE1 3.57Å; H82-E101 PolarHBondContact CD2-OE1 2.91Å; H82-E101 IonicContact NE2-OE1 3.85Å; H82-E101 PolarHBondContact NE2-OE1 2.68Å; L86-E101 HydrophobicContact CD2-CG 4.16Å; A98-E101 WeakPolarHBondContact O-CB 3.4Å; A98-E101 PolarHBondContact O-N 3.34Å; G99-E101 VanDerWaalsContact C-N 3.31Å; G99-E101 PolarHBondContact O-N 2.9Å; E101-A104 WeakPolarHBondContact O-CB 3.32Å; E101-A104 PolarHBondContact O-N 3.47Å; E101-L105 PolarHBondContact O-N 3.06Å; E101-K318 IonicContact OE1-NZ 3.9Å; E101-K318 WeakPolarHBondContact OE2-CD 3.48Å; E101-K318 WeakPolarHBondContact OE2-CE 3.34Å; E101-K318 IonicContact OE2-NZ 2.68Å; E101-K318 PolarHBondContact OE2-NZ 2.94Å; E101-P321 HydrophobicContact CG-CB 3.94Å; E101-P321 HydrophobicContact CG-CG 4.29Å
102	W	93.3	Very high	93	Very high	0 Å²	0	9 Å²	9	0%	0	5%	0.052	C	C	.	.	H	α-helix	trans	-78.5	-32.2	-179.8	-62.1	-14.3	0	0	0	113.4	A98 L105 V106 L262 M322 L652 H653 F656	A98-W102 PolarHBondContact O-N 3.29Å; A98-W102 VanDerWaalsContact O-N 3.12Å; W102-L105 WeakPolarHBondContact O-CB 3.2Å; W102-L105 PolarHBondContact O-N 3.38Å; W102-V106 PolarHBondContact O-N 3.39Å; W102-L262 HydrophobicContact CE3-CD2 4.03Å; W102-L262 HydrophobicContact CZ3-CD1 4.32Å; W102-L262 HydrophobicContact CZ3-CD2 3.97Å; W102-M322 HydrophobicContact CH2-CE 4.02Å; W102-M322 HydrophobicContact CH2-SD 3.49Å; W102-M322 WeakPolarHBondContact CH2-SD 3.23Å; W102-M322 HydrophobicContact CZ2-CB 4.27Å; W102-M322 HydrophobicContact CZ2-CE 4.34Å; W102-M322 HydrophobicContact CZ2-CG 4.29Å; W102-M322 HydrophobicContact CZ2-SD 3.23Å; W102-M322 WeakPolarHBondContact CZ2-SD 3.46Å; W102-L652 HydrophobicContact CD2-CB 4.49Å; W102-L652 HydrophobicContact CE3-CB 4.26Å; W102-L652 HydrophobicContact CH2-CB 3.7Å; W102-L652 HydrophobicContact CZ2-CB 3.88Å; W102-L652 HydrophobicContact CZ2-CD1 4.07Å; W102-L652 HydrophobicContact CZ2-CD2 4.45Å; W102-L652 HydrophobicContact CZ2-CG 4.37Å; W102-L652 HydrophobicContact CZ3-CB 3.87Å; W102-L652 WeakPolarHBondContact CZ3-O 3.42Å; W102-H653 WeakPolarHBondContact CB-CE1 3.48Å; W102-H653 AromaticContact CE3-CE1 3.94Å; W102-H653 AromaticContact CE3-ND1 3.87Å; W102-F656 HydrophobicContact CH2-CB 4.23Å; W102-F656 AromaticContact CH2-CD2 3.48Å; W102-F656 HydrophobicContact CH2-CD2 3.48Å; W102-F656 VanDerWaalsContact CH2-CD2 3.48Å; W102-F656 HydrophobicContact CH2-CE2 4.11Å; W102-F656 HydrophobicContact CH2-CG 4.12Å; W102-F656 HydrophobicContact CZ2-CD2 4.42Å; W102-F656 HydrophobicContact CZ3-CB 4.28Å; W102-F656 HydrophobicContact CZ3-CD2 4.24Å
103	N	92.8	Very high	93	Very high	14 Å²	14	10.2 Å²	10.2	8%	0.075	5%	0.052	C	C	.	.	H	α-helix	trans	-64.1	-44.9	167.9	-82.3	-80.2	0	0	0	110.4	G99 L105 V106 L107 L276 L280	G99-N103 VanDerWaalsContact O-CB 3.31Å; G99-N103 WeakPolarHBondContact O-CB 3.4Å; G99-N103 PolarHBondContact O-N 3.35Å; G99-N103 PolarHBondContact O-ND2 3.27Å; N103-L105 VanDerWaalsContact C-N 3.28Å; N103-L105 PolarHBondContact O-N 3.31Å; N103-V106 PolarHBondContact O-N 3.02Å; N103-V106 VanDerWaalsContact O-N 3.12Å; N103-L107 WeakPolarHBondContact O-CD2 3.25Å; N103-L107 PolarHBondContact O-N 3.31Å; N103-L276 WeakPolarHBondContact ND2-CD2 3.41Å; N103-L276 PolarHBondContact ND2-O 3.36Å; N103-L280 HydrophobicContact CB-CB 4.15Å
104	A	92.7	Very high	93	Very high	5 Å²	5	11.1 Å²	11.1	4%	0.041	6%	0.058	C	C	.	.	H	α-helix	trans	-53.4	-43.6	174.2	0	0	0	0	0	112.6	F100 E101 V106 L107 V108 W288	F100-A104 WeakPolarHBondContact O-CB 3.4Å; F100-A104 PolarHBondContact O-N 2.93Å; F100-A104 VanDerWaalsContact O-N 3.09Å; E101-A104 WeakPolarHBondContact O-CB 3.32Å; E101-A104 PolarHBondContact O-N 3.47Å; A104-V106 VanDerWaalsContact C-N 3.32Å; A104-V106 PolarHBondContact O-N 3.36Å; A104-L107 PolarHBondContact O-N 3.43Å; A104-L107 VanDerWaalsContact O-N 3.1Å; A104-V108 WeakPolarHBondContact O-CG2 3.4Å; A104-V108 PolarHBondContact O-N 2.96Å; A104-W288 HydrophobicContact CB-CZ2 4.19Å
105	L	94.4	Very high	92.5	Very high	0 Å²	0	11.4 Å²	11.4	0%	0	6%	0.059	C	C	.	.	H	α-helix	trans	-52.9	-46.7	176.3	175.7	170	0	0	0	112.3	E101 W102 N103 L107 V108 V109 G315 K318 L319 L645 L646 C649	E101-L105 PolarHBondContact O-N 3.06Å; W102-L105 WeakPolarHBondContact O-CB 3.2Å; W102-L105 PolarHBondContact O-N 3.38Å; N103-L105 VanDerWaalsContact C-N 3.28Å; N103-L105 PolarHBondContact O-N 3.31Å; L105-L107 VanDerWaalsContact C-N 3.31Å; L105-L107 PolarHBondContact O-N 3.49Å; L105-V108 PolarHBondContact O-N 2.98Å; L105-V109 PolarHBondContact O-N 3.12Å; L105-G315 VanDerWaalsContact CD1-O 3.22Å; L105-G315 WeakPolarHBondContact CD1-O 3.41Å; L105-K318 HydrophobicContact CB-CB 4.12Å; L105-L319 HydrophobicContact CD1-CD2 3.32Å; L105-L319 HydrophobicContact CD1-CG 3.75Å; L105-L645 HydrophobicContact CD1-CD1 3.94Å; L105-L645 HydrophobicContact CD1-CG 4.45Å; L105-L645 HydrophobicContact CD2-CD1 4.34Å; L105-L645 HydrophobicContact CD2-CD2 4.2Å; L105-L645 HydrophobicContact CD2-CG 3.96Å; L105-L645 HydrophobicContact CG-CD1 4.34Å; L105-L645 HydrophobicContact CG-CD2 4.43Å; L105-L645 HydrophobicContact CG-CG 4.4Å; L105-L646 HydrophobicContact CD2-CD2 4.49Å; L105-C649 HydrophobicContact CD1-CB 4.29Å; L105-C649 HydrophobicContact CD2-CB 3.97Å
106	V	94.3	Very high	91.8	Very high	45 Å²	45	11.3 Å²	11.3	27%	0.273	6%	0.058	S	C	.	.	H	α-helix	trans	-62.4	-42.2	179.6	180	0	0	0	0	110.5	W102 N103 A104 V109 I110 L646	W102-V106 PolarHBondContact O-N 3.39Å; N103-V106 PolarHBondContact O-N 3.02Å; N103-V106 VanDerWaalsContact O-N 3.12Å; A104-V106 VanDerWaalsContact C-N 3.32Å; A104-V106 PolarHBondContact O-N 3.36Å; V106-V109 PolarHBondContact O-N 2.76Å; V106-I110 HydrophobicContact CG1-CD1 3.98Å; V106-I110 WeakPolarHBondContact O-CG1 3.45Å; V106-I110 PolarHBondContact O-N 3.38Å; V106-L646 HydrophobicContact CG1-CD2 4.3Å; V106-L646 HydrophobicContact CG2-CD2 4.21Å
107	L	94.5	Very high	90.9	Very high	7 Å²	7	13.3 Å²	13.3	4%	0.037	7%	0.066	C	C	.	.	H	α-helix	trans	-70.7	-32.4	179.6	-82.2	-59.5	0	0	0	112.8	N103 A104 L105 V109 I110 L111 T281 A284 T285 W288	N103-L107 WeakPolarHBondContact O-CD2 3.25Å; N103-L107 PolarHBondContact O-N 3.31Å; A104-L107 PolarHBondContact O-N 3.43Å; A104-L107 VanDerWaalsContact O-N 3.1Å; L105-L107 VanDerWaalsContact C-N 3.31Å; L105-L107 PolarHBondContact O-N 3.49Å; L107-V109 VanDerWaalsContact C-N 3.28Å; L107-V109 PolarHBondContact O-N 3.42Å; L107-I110 HydrophobicContact CD1-CB 4.49Å; L107-I110 HydrophobicContact CD1-CD1 4.15Å; L107-I110 PolarHBondContact O-N 3.44Å; L107-L111 WeakPolarHBondContact O-CB 3.23Å; L107-L111 PolarHBondContact O-N 3.38Å; L107-T281 HydrophobicContact CD2-CG2 4.24Å; L107-A284 HydrophobicContact CB-CB 4.07Å; L107-A284 HydrophobicContact CD2-CB 3.94Å; L107-A284 HydrophobicContact CG-CB 3.71Å; L107-T285 WeakPolarHBondContact CD1-OG1 3.34Å; L107-W288 HydrophobicContact CB-CB 4.27Å; L107-W288 HydrophobicContact CB-CG 4.4Å
108	V	93.9	Very high	89.5	Confident	0 Å²	0	13.4 Å²	13.4	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-61.5	-39.6	172.5	-179.6	0	0	0	0	110.8	A104 L105 L111 G112 W288 C311 C314	A104-V108 WeakPolarHBondContact O-CG2 3.4Å; A104-V108 PolarHBondContact O-N 2.96Å; L105-V108 PolarHBondContact O-N 2.98Å; V108-L111 WeakPolarHBondContact O-CB 3.32Å; V108-G112 PolarHBondContact O-N 2.82Å; V108-W288 HydrophobicContact CB-CE3 4.3Å; V108-W288 HydrophobicContact CG1-CE3 4.47Å; V108-W288 HydrophobicContact CG2-CD2 3.33Å; V108-W288 HydrophobicContact CG2-CE3 3.31Å; V108-W288 HydrophobicContact CG2-CG 4.01Å; V108-W288 HydrophobicContact CG2-CH2 3.82Å; V108-W288 HydrophobicContact CG2-CZ2 3.84Å; V108-W288 HydrophobicContact CG2-CZ3 3.56Å; V108-C311 HydrophobicContact CG1-CB 3.97Å; V108-C311 WeakPolarHBondContact CG1-O 3.37Å; V108-C311 WeakPolarHBondContact O-CB 3.33Å; V108-C314 HydrophobicContact CG1-CB 4.05Å
109	V	93.9	Very high	88.2	Confident	9 Å²	9	13.4 Å²	13.4	6%	0.055	7%	0.067	C	C	.	.	H	α-helix	trans	-68	-45	173.7	177.9	0	0	0	0	109.9	L105 V106 L107 L111 G112 W113 A642 L645 L646	L105-V109 PolarHBondContact O-N 3.12Å; V106-V109 PolarHBondContact O-N 2.76Å; L107-V109 VanDerWaalsContact C-N 3.28Å; L107-V109 PolarHBondContact O-N 3.42Å; V109-L111 VanDerWaalsContact C-N 3.27Å; V109-L111 PolarHBondContact O-N 3.29Å; V109-G112 PolarHBondContact O-N 3.12Å; V109-G112 VanDerWaalsContact O-N 3.1Å; V109-W113 HydrophobicContact CG1-CE3 3.93Å; V109-W113 HydrophobicContact CG1-CH2 4.42Å; V109-W113 HydrophobicContact CG1-CZ3 3.81Å; V109-W113 PolarHBondContact O-N 3.33Å; V109-A642 HydrophobicContact CG1-CB 4.24Å; V109-L645 HydrophobicContact CG2-CD2 3.85Å; V109-L646 HydrophobicContact CG1-CD1 4.44Å
110	I	93.3	Very high	86.7	Confident	62 Å²	62	14.4 Å²	14.4	32%	0.318	7%	0.071	S	C	.	.	H	α-helix	trans	-60.7	-36.9	178	-69.6	168.4	0	0	0	111.9	V106 L107 G112 W113 V114 F115	V106-I110 HydrophobicContact CG1-CD1 3.98Å; V106-I110 WeakPolarHBondContact O-CG1 3.45Å; V106-I110 PolarHBondContact O-N 3.38Å; L107-I110 HydrophobicContact CD1-CB 4.49Å; L107-I110 HydrophobicContact CD1-CD1 4.15Å; L107-I110 PolarHBondContact O-N 3.44Å; I110-G112 VanDerWaalsContact C-N 3.32Å; I110-G112 PolarHBondContact O-N 3.14Å; I110-W113 PolarHBondContact O-N 3.41Å; I110-V114 HydrophobicContact CG2-CB 4.07Å; I110-V114 HydrophobicContact CG2-CG2 4.06Å; I110-V114 WeakPolarHBondContact O-CB 3.26Å; I110-V114 PolarHBondContact O-N 3.03Å; I110-F115 HydrophobicContact CG2-CD2 3.85Å; I110-F115 HydrophobicContact CG2-CE2 3.71Å
111	L	91.9	Very high	85	Confident	0 Å²	0	14.1 Å²	14.1	0%	0	7%	0.072	C	C	.	.	I	π-helix	trans	-52.1	-51.2	172.8	169.8	64.9	0	0	0	111	L107 V108 V109 W113 F115 L116 W288 I294 V295	L107-L111 WeakPolarHBondContact O-CB 3.23Å; L107-L111 PolarHBondContact O-N 3.38Å; V108-L111 WeakPolarHBondContact O-CB 3.32Å; V109-L111 VanDerWaalsContact C-N 3.27Å; V109-L111 PolarHBondContact O-N 3.29Å; L111-W113 VanDerWaalsContact C-N 3.34Å; L111-W113 PolarHBondContact O-N 3.23Å; L111-F115 HydrophobicContact CD1-CB 4.05Å; L111-F115 PolarHBondContact O-N 3.23Å; L111-L116 HydrophobicContact CD1-CD1 4.11Å; L111-L116 HydrophobicContact CD1-CD2 4.42Å; L111-L116 HydrophobicContact CD1-CG 3.85Å; L111-L116 HydrophobicContact CG-CD1 3.86Å; L111-L116 HydrophobicContact CG-CG 4.18Å; L111-L116 WeakPolarHBondContact O-CB 3.44Å; L111-L116 WeakPolarHBondContact O-CD1 3.43Å; L111-L116 WeakPolarHBondContact O-CG 3.36Å; L111-L116 PolarHBondContact O-N 3.24Å; L111-W288 WeakPolarHBondContact CD2-O 3.43Å; L111-I294 HydrophobicContact CD2-CG2 4.03Å; L111-V295 HydrophobicContact CD1-CG2 4.29Å
112	G	89	Confident	83.6	Confident	0 Å²	0	15 Å²	15	0%	0	8%	0.083	C	C	.	.	I	π-helix	trans	-58.2	-36.4	-179.9	0	0	0	0	0	115.3	V108 V109 I110	V108-G112 PolarHBondContact O-N 2.82Å; V109-G112 PolarHBondContact O-N 3.12Å; V109-G112 VanDerWaalsContact O-N 3.1Å; I110-G112 VanDerWaalsContact C-N 3.32Å; I110-G112 PolarHBondContact O-N 3.14Å
113	W	90.3	Very high	82.6	Confident	48 Å²	48	15 Å²	15	18%	0.182	8%	0.083	C	C	.	.	I	π-helix	trans	-106.5	-20.1	-170.9	-83.8	-107.2	0	0	0	114.4	V109 I110 L111 Y117 K308 I312 W558 V638 N639 A642	V109-W113 HydrophobicContact CG1-CE3 3.93Å; V109-W113 HydrophobicContact CG1-CH2 4.42Å; V109-W113 HydrophobicContact CG1-CZ3 3.81Å; V109-W113 PolarHBondContact O-N 3.33Å; I110-W113 PolarHBondContact O-N 3.41Å; L111-W113 VanDerWaalsContact C-N 3.34Å; L111-W113 PolarHBondContact O-N 3.23Å; W113-Y117 WeakPolarHBondContact O-CD2 3.44Å; W113-Y117 WeakPolarHBondContact O-CE2 3.46Å; W113-K308 HydrophobicContact CD2-CD 4.2Å; W113-K308 HydrophobicContact CD2-CG 4.31Å; W113-K308 HydrophobicContact CE3-CG 4.16Å; W113-K308 HydrophobicContact CH2-CB 4.01Å; W113-K308 HydrophobicContact CH2-CG 4.34Å; W113-K308 HydrophobicContact CZ2-CB 4.34Å; W113-K308 HydrophobicContact CZ2-CD 4.15Å; W113-K308 HydrophobicContact CZ2-CG 4.41Å; W113-K308 HydrophobicContact CZ3-CB 4.13Å; W113-K308 HydrophobicContact CZ3-CG 4.21Å; W113-I312 HydrophobicContact CH2-CD1 3.82Å; W113-I312 HydrophobicContact CH2-CG1 3.77Å; W113-I312 HydrophobicContact CZ3-CG1 4.32Å; W113-W558 WeakPolarHBondContact O-CH2 2.97Å; W113-W558 WeakPolarHBondContact O-CZ3 3.38Å; W113-V638 HydrophobicContact CZ2-CB 4.4Å; W113-V638 HydrophobicContact CZ2-CG2 4.35Å; W113-N639 PolarHBondContact NE1-OD1 3Å; W113-A642 HydrophobicContact CH2-CB 3.48Å; W113-A642 VanDerWaalsContact CH2-CB 3.48Å; W113-A642 HydrophobicContact CZ2-CB 3.55Å; W113-A642 HydrophobicContact CZ3-CB 4.33Å
114	V	89.5	Confident	81.4	Confident	22 Å²	22	16 Å²	16	13%	0.133	9%	0.087	C	C	.	.	I	π-helix	trans	-117.5	-64.4	-175.2	179.6	0	0	0	0	110.8	I110 L116 P118 I472 F473 W558	I110-V114 HydrophobicContact CG2-CB 4.07Å; I110-V114 HydrophobicContact CG2-CG2 4.06Å; I110-V114 WeakPolarHBondContact O-CB 3.26Å; I110-V114 PolarHBondContact O-N 3.03Å; V114-L116 PolarHBondContact O-N 3.29Å; V114-P118 VanDerWaalsContact O-CD 3.24Å; V114-P118 WeakPolarHBondContact O-CD 3.34Å; V114-I472 HydrophobicContact CG1-CG2 4.29Å; V114-F473 HydrophobicContact CG1-CE1 4.01Å; V114-F473 HydrophobicContact CG1-CE2 4.28Å; V114-F473 HydrophobicContact CG1-CZ 3.5Å; V114-W558 HydrophobicContact CB-CZ3 4.28Å; V114-W558 HydrophobicContact CG1-CE3 4.14Å; V114-W558 HydrophobicContact CG1-CZ3 4.22Å; V114-W558 HydrophobicContact CG2-CH2 4.3Å; V114-W558 HydrophobicContact CG2-CZ3 4.35Å
115	F	83.9	Confident	81	Confident	5 Å²	5	15.7 Å²	15.7	2%	0.022	9%	0.085	C	C	.	.	I	π-helix	trans	-73.5	-29.1	-167.3	-74.5	-104.4	0	0	0	112.9	I110 L111 Y117 P118 F119 T285 C289 I472	I110-F115 HydrophobicContact CG2-CD2 3.85Å; I110-F115 HydrophobicContact CG2-CE2 3.71Å; L111-F115 HydrophobicContact CD1-CB 4.05Å; L111-F115 PolarHBondContact O-N 3.23Å; F115-Y117 PolarHBondContact O-N 3.12Å; F115-P118 WeakPolarHBondContact O-CD 3.4Å; F115-P118 VanDerWaalsContact O-CG 3.28Å; F115-P118 WeakPolarHBondContact O-CG 3.47Å; F115-F119 HydrophobicContact CB-CD2 4.41Å; F115-F119 HydrophobicContact CB-CE2 3.8Å; F115-F119 HydrophobicContact CB-CZ 4.32Å; F115-F119 HydrophobicContact CD1-CE2 4.33Å; F115-F119 HydrophobicContact CD1-CZ 4.15Å; F115-F119 WeakPolarHBondContact O-CD2 3.49Å; F115-F119 WeakPolarHBondContact O-CE2 3.28Å; F115-F119 WeakPolarHBondContact O-CG 2.91Å; F115-T285 HydrophobicContact CE1-CG2 4.46Å; F115-T285 HydrophobicContact CZ-CG2 3.98Å; F115-C289 HydrophobicContact CB-CB 4.21Å; F115-C289 HydrophobicContact CD1-CB 3.38Å; F115-C289 HydrophobicContact CD2-CB 3.9Å; F115-C289 HydrophobicContact CE1-CB 3.56Å; F115-C289 HydrophobicContact CE2-CB 4.08Å; F115-C289 HydrophobicContact CG-CB 3.57Å; F115-C289 HydrophobicContact CZ-CB 3.91Å; F115-I472 HydrophobicContact CB-CD1 4.24Å; F115-I472 HydrophobicContact CD1-CD1 3.05Å; F115-I472 HydrophobicContact CE1-CD1 3.41Å; F115-I472 VanDerWaalsContact CE1-CD1 3.41Å; F115-I472 HydrophobicContact CG-CD1 3.72Å; F115-I472 HydrophobicContact CZ-CD1 4.29Å
116	L	79.8	Confident	80.7	Confident	0 Å²	0	15.8 Å²	15.8	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-76.1	-21.1	-178.6	-78.9	161.5	0	0	0	115.2	L111 V114 F119 K120 C298 V307	L111-L116 HydrophobicContact CD1-CD1 4.11Å; L111-L116 HydrophobicContact CD1-CD2 4.42Å; L111-L116 HydrophobicContact CD1-CG 3.85Å; L111-L116 HydrophobicContact CG-CD1 3.86Å; L111-L116 HydrophobicContact CG-CG 4.18Å; L111-L116 WeakPolarHBondContact O-CB 3.44Å; L111-L116 WeakPolarHBondContact O-CD1 3.43Å; L111-L116 WeakPolarHBondContact O-CG 3.36Å; L111-L116 PolarHBondContact O-N 3.24Å; V114-L116 PolarHBondContact O-N 3.29Å; L116-F119 PolarHBondContact O-N 3.3Å; L116-K120 PolarHBondContact O-N 3.38Å; L116-K120 VanDerWaalsContact O-N 3.13Å; L116-C298 HydrophobicContact CD1-CB 3.96Å; L116-C298 HydrophobicContact CD2-CB 3.53Å; L116-C298 HydrophobicContact CG-CB 4.35Å; L116-V307 HydrophobicContact CD1-CB 4.26Å; L116-V307 HydrophobicContact CD1-CG1 3.17Å; L116-V307 HydrophobicContact CD2-CG1 4.49Å; L116-V307 HydrophobicContact CG-CG1 4.39Å
117	Y	72.9	Confident	80.4	Confident	41 Å²	41	13.6 Å²	13.6	16%	0.161	7%	0.072	C	C	.	.	H	α-helix	trans	-58.9	-52.7	175.3	-82.3	-85.6	0	0	0	112.2	W113 F115 L304 K308 W558 T628	W113-Y117 WeakPolarHBondContact O-CD2 3.44Å; W113-Y117 WeakPolarHBondContact O-CE2 3.46Å; F115-Y117 PolarHBondContact O-N 3.12Å; Y117-L304 HydrophobicContact CD1-CD2 4.31Å; Y117-L304 HydrophobicContact CE1-CD2 3.56Å; Y117-L304 HydrophobicContact CE2-CD2 4.18Å; Y117-L304 VanDerWaalsContact CZ-CD2 3.49Å; Y117-L304 WeakPolarHBondContact OH-CD2 3.3Å; Y117-K308 PolarHBondContact OH-NZ 2.91Å; Y117-W558 HydrophobicContact CD2-CZ3 4.16Å; Y117-T628 HydrophobicContact CD1-CG2 4.16Å
118	P	65.6	Low	79.9	Confident	2 Å²	2	13.9 Å²	13.9	1%	0.013	7%	0.074	C	C	.	.	H	α-helix	trans	-70.8	-29.5	177.2	26.1	-33.9	0	0	0	113.6	V114 F115 K120 A121 Y129 I472 R555 L556	V114-P118 VanDerWaalsContact O-CD 3.24Å; V114-P118 WeakPolarHBondContact O-CD 3.34Å; F115-P118 WeakPolarHBondContact O-CD 3.4Å; F115-P118 VanDerWaalsContact O-CG 3.28Å; F115-P118 WeakPolarHBondContact O-CG 3.47Å; P118-K120 VanDerWaalsContact C-N 3.29Å; P118-K120 PolarHBondContact O-N 3.05Å; P118-A121 VanDerWaalsContact O-CB 3.31Å; P118-A121 WeakPolarHBondContact O-CB 3.05Å; P118-A121 PolarHBondContact O-N 2.63Å; P118-Y129 HydrophobicContact CB-CE2 3.97Å; P118-I472 HydrophobicContact CG-CD1 4.23Å; P118-I472 HydrophobicContact CG-CG1 4.08Å; P118-R555 WeakPolarHBondContact CA-O 3.47Å; P118-L556 WeakPolarHBondContact CB-O 3.48Å
119	F	65.4	Low	79.6	Confident	0 Å²	0	13.9 Å²	13.9	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-74.7	-16.3	-179.9	-56.9	-23.5	0	0	0	113.8	F115 L116 A121 V123 M126 Y129 C289 V295 L299 F468 I472	F115-F119 HydrophobicContact CB-CD2 4.41Å; F115-F119 HydrophobicContact CB-CE2 3.8Å; F115-F119 HydrophobicContact CB-CZ 4.32Å; F115-F119 HydrophobicContact CD1-CE2 4.33Å; F115-F119 HydrophobicContact CD1-CZ 4.15Å; F115-F119 WeakPolarHBondContact O-CD2 3.49Å; F115-F119 WeakPolarHBondContact O-CE2 3.28Å; F115-F119 WeakPolarHBondContact O-CG 2.91Å; L116-F119 PolarHBondContact O-N 3.3Å; F119-A121 PolarHBondContact O-N 3.28Å; F119-V123 HydrophobicContact CB-CG2 4.23Å; F119-V123 WeakPolarHBondContact O-CG2 3.29Å; F119-M126 HydrophobicContact CD2-SD 4.26Å; F119-M126 HydrophobicContact CE1-SD 4.48Å; F119-M126 HydrophobicContact CE2-SD 4.05Å; F119-M126 HydrophobicContact CZ-SD 4.17Å; F119-Y129 HydrophobicContact CD1-CD1 4.14Å; F119-Y129 AromaticContact CD1-CD2 3.63Å; F119-Y129 HydrophobicContact CD1-CD2 3.63Å; F119-Y129 HydrophobicContact CD1-CE1 4.36Å; F119-Y129 AromaticContact CD1-CE2 3.88Å; F119-Y129 HydrophobicContact CD1-CE2 3.88Å; F119-Y129 AromaticContact CD1-CG 3.75Å; F119-Y129 HydrophobicContact CD1-CG 3.75Å; F119-Y129 AromaticContact CE1-CD1 3.58Å; F119-Y129 HydrophobicContact CE1-CD1 3.58Å; F119-Y129 AromaticContact CE1-CD2 3.87Å; F119-Y129 HydrophobicContact CE1-CD2 3.87Å; F119-Y129 AromaticContact CE1-CE1 3.6Å; F119-Y129 HydrophobicContact CE1-CE1 3.6Å; F119-Y129 AromaticContact CE1-CE2 3.9Å; F119-Y129 HydrophobicContact CE1-CE2 3.9Å; F119-Y129 AromaticContact CE1-CG 3.69Å; F119-Y129 HydrophobicContact CE1-CG 3.69Å; F119-Y129 AromaticContact CE1-CZ 3.74Å; F119-C289 WeakPolarHBondContact CE2-O 3.46Å; F119-V295 HydrophobicContact CD2-CG1 3.63Å; F119-V295 HydrophobicContact CE2-CG1 4.12Å; F119-V295 HydrophobicContact CE2-CG2 4.35Å; F119-V295 HydrophobicContact CG-CG1 4.44Å; F119-L299 HydrophobicContact CB-CD2 4.14Å; F119-L299 WeakPolarHBondContact O-CD2 3.39Å; F119-F468 HydrophobicContact CE1-CD1 4.33Å; F119-F468 HydrophobicContact CE1-CE1 4.32Å; F119-F468 AromaticContact CZ-CD1 3.97Å; F119-F468 HydrophobicContact CZ-CD1 3.97Å; F119-F468 HydrophobicContact CZ-CE1 4.17Å; F119-I472 HydrophobicContact CE1-CD1 4.47Å; F119-I472 HydrophobicContact CZ-CD1 4.26Å
120	K	61.9	Low	79.4	Confident	21 Å²	21	13.5 Å²	13.5	9%	0.091	7%	0.071	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.9	4.2	171.2	-79.6	-159.5	172.3	-158.9	0	114.5	L116 P118 G122 L304	L116-K120 PolarHBondContact O-N 3.38Å; L116-K120 VanDerWaalsContact O-N 3.13Å; P118-K120 VanDerWaalsContact C-N 3.29Å; P118-K120 PolarHBondContact O-N 3.05Å; K120-G122 PolarHBondContact O-N 3.5Å; K120-L304 HydrophobicContact CD-CD1 4.4Å; K120-L304 VanDerWaalsContact NZ-N 3.14Å
121	A	58.5	Low	79.1	Confident	12 Å²	12	10.8 Å²	10.8	10%	0.099	6%	0.057	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.8	29.2	172.5	0	0	0	0	0	114.4	P118 F119 L556	P118-A121 VanDerWaalsContact O-CB 3.31Å; P118-A121 WeakPolarHBondContact O-CB 3.05Å; P118-A121 PolarHBondContact O-N 2.63Å; F119-A121 PolarHBondContact O-N 3.28Å; A121-L556 HydrophobicContact CB-CD2 3.95Å
122	G	64.3	Low	78.8	Confident	23 Å²	23	12.3 Å²	12.3	24%	0.237	6%	0.064	C	C	.	.	T	Hydrogen-bonded Turn	trans	78.1	20.3	176.8	0	0	0	0	0	115.2	K120	K120-G122 PolarHBondContact O-N 3.5Å
123	V	71.9	Confident	78.7	Confident	0 Å²	0	12.3 Å²	12.3	0%	0	6%	0.064	C	C	.	.			trans	-80.4	149.8	176.7	-67.7	0	0	0	0	112	R62 F119 E128 K132	R62-V123 PolarHBondContact NH2-O 3.13Å; F119-V123 HydrophobicContact CB-CG2 4.23Å; F119-V123 WeakPolarHBondContact O-CG2 3.29Å; V123-E128 HydrophobicContact CG1-CG 4.28Å; V123-K132 HydrophobicContact CG1-CD 3.78Å
124	I	68.4	Low	78.6	Confident	33 Å²	33	10.4 Å²	10.4	17%	0.169	6%	0.057	C	C	.	.	S	Bend	trans	-105.8	-39.1	174	-51.6	-176.2	0	0	0	109.6	L59 E128 Q292 M404	L59-I124 HydrophobicContact CD1-CB 4.48Å; L59-I124 HydrophobicContact CD1-CD1 4.38Å; L59-I124 HydrophobicContact CD1-CG1 4Å; L59-I124 HydrophobicContact CD1-CG2 4.1Å; L59-I124 HydrophobicContact CG-CG2 4.28Å; I124-E128 WeakPolarHBondContact CB-OE2 3.2Å; I124-E128 PolarHBondContact N-OE2 3.31Å; I124-Q292 PolarHBondContact O-NE2 2.98Å; I124-M404 HydrophobicContact CD1-CE 4.32Å
125	T	82.5	Confident	78.3	Confident	0 Å²	0	9.6 Å²	9.6	0%	0	5%	0.053	C	C	.	.	S	Bend	trans	-118.4	152.2	-179.9	79.4	0	0	0	0	113.4	E128 Y129 Q292 T400 M404 D405	T125-E128 PolarHBondContact N-OE2 2.76Å; T125-E128 WeakPolarHBondContact O-CB 2.98Å; T125-E128 PolarHBondContact O-N 2.81Å; T125-E128 VanDerWaalsContact OG1-CB 3.27Å; T125-E128 WeakPolarHBondContact OG1-CB 3.45Å; T125-E128 PolarHBondContact OG1-N 2.96Å; T125-E128 VanDerWaalsContact OG1-N 3.1Å; T125-Y129 PolarHBondContact O-N 3.35Å; T125-Y129 VanDerWaalsContact O-N 3.08Å; T125-Q292 VanDerWaalsContact CA-OE1 3.32Å; T125-T400 HydrophobicContact CG2-CG2 3.92Å; T125-M404 HydrophobicContact CG2-CB 4.29Å; T125-D405 WeakPolarHBondContact CB-OD2 3.23Å; T125-D405 PolarHBondContact OG1-OD1 2.65Å; T125-D405 PolarHBondContact OG1-OD2 3.33Å
126	M	88.3	Confident	78	Confident	1 Å²	1	10.1 Å²	10.1	1%	0.005	6%	0.06	C	C	.	.	H	α-helix	trans	-64.2	-39.5	174.7	-63.2	-56.2	101.7	0	0	112.6	F119 E128 Y129 L130 A290 V295 L299 F468	F119-M126 HydrophobicContact CD2-SD 4.26Å; F119-M126 HydrophobicContact CE1-SD 4.48Å; F119-M126 HydrophobicContact CE2-SD 4.05Å; F119-M126 HydrophobicContact CZ-SD 4.17Å; M126-E128 VanDerWaalsContact C-N 3.31Å; M126-E128 PolarHBondContact O-N 3.48Å; M126-Y129 WeakPolarHBondContact O-CB 3.46Å; M126-Y129 PolarHBondContact O-N 2.86Å; M126-L130 PolarHBondContact O-N 3.4Å; M126-L130 VanDerWaalsContact O-N 3.13Å; M126-A290 WeakPolarHBondContact CG-O 3.38Å; M126-V295 HydrophobicContact CE-CB 3.77Å; M126-V295 HydrophobicContact CE-CG1 3.25Å; M126-V295 HydrophobicContact CG-CB 4.4Å; M126-V295 HydrophobicContact SD-CB 3.77Å; M126-V295 HydrophobicContact SD-CG1 3.59Å; M126-V295 VanDerWaalsContact SD-CG1 3.59Å; M126-V295 HydrophobicContact SD-CG2 3.94Å; M126-L299 HydrophobicContact CE-CD1 3.94Å; M126-F468 HydrophobicContact CB-CE1 4.22Å; M126-F468 HydrophobicContact CB-CZ 3.85Å; M126-F468 HydrophobicContact SD-CE1 4.38Å
127	P	88.3	Confident	78.1	Confident	0 Å²	0	14.9 Å²	14.9	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-57.7	-38.1	167	-25.7	32.9	0	0	0	114.3	Y129 L130 K131 R140 H143 S144 L401 D405	P127-Y129 VanDerWaalsContact C-N 3.33Å; P127-L130 PolarHBondContact O-N 2.9Å; P127-K131 PolarHBondContact O-N 2.97Å; P127-R140 HydrophobicContact CB-CB 4.42Å; P127-R140 HydrophobicContact CB-CG 3.67Å; P127-H143 HydrophobicContact CG-CB 4.49Å; P127-S144 WeakPolarHBondContact CB-OG 3.16Å; P127-S144 WeakPolarHBondContact CG-OG 3.43Å; P127-L401 HydrophobicContact CG-CD2 3.66Å; P127-D405 WeakPolarHBondContact CG-OD2 3.23Å
128	E	84.3	Confident	78.8	Confident	13 Å²	13	21.6 Å²	21.6	6%	0.061	11%	0.105	C	C	.	.	H	α-helix	trans	-64.3	-39	176	-171.4	-161.4	151.9	0	0	111.3	V123 I124 T125 M126 L130 K131 K132	V123-E128 HydrophobicContact CG1-CG 4.28Å; I124-E128 WeakPolarHBondContact CB-OE2 3.2Å; I124-E128 PolarHBondContact N-OE2 3.31Å; T125-E128 PolarHBondContact N-OE2 2.76Å; T125-E128 WeakPolarHBondContact O-CB 2.98Å; T125-E128 PolarHBondContact O-N 2.81Å; T125-E128 VanDerWaalsContact OG1-CB 3.27Å; T125-E128 WeakPolarHBondContact OG1-CB 3.45Å; T125-E128 PolarHBondContact OG1-N 2.96Å; T125-E128 VanDerWaalsContact OG1-N 3.1Å; M126-E128 VanDerWaalsContact C-N 3.31Å; M126-E128 PolarHBondContact O-N 3.48Å; E128-L130 PolarHBondContact O-N 3.45Å; E128-K131 WeakPolarHBondContact O-CB 3.34Å; E128-K131 PolarHBondContact O-N 3.17Å; E128-K132 PolarHBondContact O-N 3.45Å; E128-K132 VanDerWaalsContact OE1-CE 3.28Å; E128-K132 WeakPolarHBondContact OE1-CE 3.22Å; E128-K132 IonicContact OE1-NZ 3.72Å; E128-K132 PolarHBondContact OE1-NZ 3.47Å
129	Y	88.2	Confident	79.9	Confident	0 Å²	0	21.5 Å²	21.5	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-58	-46.8	170.2	167.1	-99.6	0	0	0	112.1	P118 F119 T125 M126 P127 K131 K132 R133 F468 A471 I472 L556	P118-Y129 HydrophobicContact CB-CE2 3.97Å; F119-Y129 HydrophobicContact CD1-CD1 4.14Å; F119-Y129 AromaticContact CD1-CD2 3.63Å; F119-Y129 HydrophobicContact CD1-CD2 3.63Å; F119-Y129 HydrophobicContact CD1-CE1 4.36Å; F119-Y129 AromaticContact CD1-CE2 3.88Å; F119-Y129 HydrophobicContact CD1-CE2 3.88Å; F119-Y129 AromaticContact CD1-CG 3.75Å; F119-Y129 HydrophobicContact CD1-CG 3.75Å; F119-Y129 AromaticContact CE1-CD1 3.58Å; F119-Y129 HydrophobicContact CE1-CD1 3.58Å; F119-Y129 AromaticContact CE1-CD2 3.87Å; F119-Y129 HydrophobicContact CE1-CD2 3.87Å; F119-Y129 AromaticContact CE1-CE1 3.6Å; F119-Y129 HydrophobicContact CE1-CE1 3.6Å; F119-Y129 AromaticContact CE1-CE2 3.9Å; F119-Y129 HydrophobicContact CE1-CE2 3.9Å; F119-Y129 AromaticContact CE1-CG 3.69Å; F119-Y129 HydrophobicContact CE1-CG 3.69Å; F119-Y129 AromaticContact CE1-CZ 3.74Å; T125-Y129 PolarHBondContact O-N 3.35Å; T125-Y129 VanDerWaalsContact O-N 3.08Å; M126-Y129 WeakPolarHBondContact O-CB 3.46Å; M126-Y129 PolarHBondContact O-N 2.86Å; P127-Y129 VanDerWaalsContact C-N 3.33Å; Y129-K131 VanDerWaalsContact C-N 3.31Å; Y129-K131 PolarHBondContact O-N 2.78Å; Y129-K132 PolarHBondContact O-N 2.97Å; Y129-R133 VanDerWaalsContact O-CB 3.26Å; Y129-R133 WeakPolarHBondContact O-CB 3.37Å; Y129-R133 PolarHBondContact O-N 3.32Å; Y129-F468 HydrophobicContact CD1-CD1 4.2Å; Y129-F468 AromaticContact CD1-CE1 3.66Å; Y129-F468 HydrophobicContact CD1-CE1 3.66Å; Y129-F468 HydrophobicContact CD1-CZ 4.49Å; Y129-F468 HydrophobicContact CE1-CD1 4.14Å; Y129-F468 HydrophobicContact CE1-CE1 4.08Å; Y129-A471 HydrophobicContact CE1-CB 4.2Å; Y129-I472 WeakPolarHBondContact OH-CG1 3.46Å; Y129-L556 HydrophobicContact CD2-CD2 4.11Å; Y129-L556 HydrophobicContact CE2-CD2 4.02Å; Y129-L556 PolarHBondContact OH-O 3.17Å; Y129-L556 VanDerWaalsContact OH-O 3.06Å
130	L	89.3	Confident	81	Confident	0 Å²	0	21.8 Å²	21.8	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-61.9	-39.1	176.9	-64.6	-178.1	0	0	0	112	M126 P127 E128 R133 F134 I139 H143 V467 F468	M126-L130 PolarHBondContact O-N 3.4Å; M126-L130 VanDerWaalsContact O-N 3.13Å; P127-L130 PolarHBondContact O-N 2.9Å; E128-L130 PolarHBondContact O-N 3.45Å; L130-R133 PolarHBondContact O-N 3.22Å; L130-F134 HydrophobicContact CB-CD2 4.48Å; L130-F134 HydrophobicContact CD2-CD2 4.22Å; L130-F134 HydrophobicContact CD2-CE2 3.89Å; L130-F134 WeakPolarHBondContact O-CB 3.33Å; L130-F134 PolarHBondContact O-N 2.99Å; L130-I139 HydrophobicContact CB-CG2 4.46Å; L130-I139 HydrophobicContact CD1-CG1 4.41Å; L130-H143 HydrophobicContact CD1-CB 4.09Å; L130-V467 HydrophobicContact CD1-CG1 4.45Å; L130-V467 HydrophobicContact CD2-CG1 3.86Å; L130-F468 HydrophobicContact CD1-CE2 3.76Å; L130-F468 HydrophobicContact CD1-CZ 3.87Å; L130-F468 HydrophobicContact CD2-CD2 4.44Å; L130-F468 HydrophobicContact CD2-CE1 4.13Å; L130-F468 HydrophobicContact CD2-CE2 4.01Å; L130-F468 HydrophobicContact CD2-CZ 3.83Å; L130-F468 HydrophobicContact CG-CE1 4.35Å; L130-F468 HydrophobicContact CG-CE2 4.05Å; L130-F468 HydrophobicContact CG-CZ 3.71Å
131	K	87.3	Confident	82.3	Confident	6 Å²	6	24 Å²	24	3%	0.026	12%	0.118	C	C	.	.	H	α-helix	trans	-60.5	-48.5	173.4	-174	-169.8	168	-160.7	0	111	P127 E128 Y129 R133 G135 R140 T572 D573 D574	P127-K131 PolarHBondContact O-N 2.97Å; E128-K131 WeakPolarHBondContact O-CB 3.34Å; E128-K131 PolarHBondContact O-N 3.17Å; Y129-K131 VanDerWaalsContact C-N 3.31Å; Y129-K131 PolarHBondContact O-N 2.78Å; K131-R133 VanDerWaalsContact C-N 3.28Å; K131-R133 PolarHBondContact O-N 3.5Å; K131-G135 WeakPolarHBondContact O-CA 3.41Å; K131-G135 PolarHBondContact O-N 3.35Å; K131-R140 HydrophobicContact CB-CB 4.32Å; K131-T572 PolarHBondContact NZ-O 3.46Å; K131-D573 IonicContact NZ-OD1 2.77Å; K131-D573 PolarHBondContact NZ-OD1 2.84Å; K131-D574 IonicContact NZ-OD1 3.96Å
132	K	85	Confident	83.8	Confident	31 Å²	31	25.5 Å²	25.5	14%	0.135	12%	0.121	C	C	.	.	H	α-helix	trans	-64.7	-34.3	178.8	-71.3	-176.1	-175.6	168.1	0	112.1	V123 E128 Y129 L556 D573	V123-K132 HydrophobicContact CG1-CD 3.78Å; E128-K132 PolarHBondContact O-N 3.45Å; E128-K132 VanDerWaalsContact OE1-CE 3.28Å; E128-K132 WeakPolarHBondContact OE1-CE 3.22Å; E128-K132 IonicContact OE1-NZ 3.72Å; E128-K132 PolarHBondContact OE1-NZ 3.47Å; Y129-K132 PolarHBondContact O-N 2.97Å; K132-L556 HydrophobicContact CB-CD1 4.17Å; K132-L556 HydrophobicContact CB-CD2 4.34Å; K132-L556 WeakPolarHBondContact O-CD1 3.22Å; K132-D573 WeakPolarHBondContact CE-OD2 3.36Å; K132-D573 IonicContact NZ-OD2 2.76Å
133	R	87.5	Confident	85.1	Confident	0 Å²	0	24.5 Å²	24.5	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-76.3	-40.2	-178.4	174.7	59	-173.2	81.8	-1.4	113.8	Y129 L130 K131 A471 C474 K475 V477 L553 C557	Y129-R133 VanDerWaalsContact O-CB 3.26Å; Y129-R133 WeakPolarHBondContact O-CB 3.37Å; Y129-R133 PolarHBondContact O-N 3.32Å; L130-R133 PolarHBondContact O-N 3.22Å; K131-R133 VanDerWaalsContact C-N 3.28Å; K131-R133 PolarHBondContact O-N 3.5Å; R133-A471 HydrophobicContact CG-CB 4.18Å; R133-A471 PolarHBondContact NE-O 3.2Å; R133-C474 PolarHBondContact NH2-O 3.05Å; R133-K475 PolarHBondContact NH2-O 2.99Å; R133-V477 PolarHBondContact NH1-O 2.94Å; R133-V477 VanDerWaalsContact NH1-O 3.12Å; R133-V477 PolarHBondContact NH2-O 2.85Å; R133-V477 VanDerWaalsContact NH2-O 3.14Å; R133-L553 VanDerWaalsContact NH1-CD2 3.27Å; R133-C557 PolarHBondContact NE-SG 3.28Å
134	F	88.1	Confident	86	Confident	9 Å²	9	24.5 Å²	24.5	4%	0.039	11%	0.111	C	C	.	.	H	α-helix	trans	-114.4	-19.3	-171.2	-63.4	-54.2	0	0	0	113.9	L130 I139 V467 A471 V477 E479 A482 I548	L130-F134 HydrophobicContact CB-CD2 4.48Å; L130-F134 HydrophobicContact CD2-CD2 4.22Å; L130-F134 HydrophobicContact CD2-CE2 3.89Å; L130-F134 WeakPolarHBondContact O-CB 3.33Å; L130-F134 PolarHBondContact O-N 2.99Å; F134-I139 HydrophobicContact CD2-CD1 3.68Å; F134-I139 HydrophobicContact CE2-CD1 4.31Å; F134-I139 HydrophobicContact CG-CD1 4.43Å; F134-V467 HydrophobicContact CE2-CG1 3.93Å; F134-A471 HydrophobicContact CE2-CB 3.95Å; F134-A471 HydrophobicContact CZ-CB 3.62Å; F134-V477 HydrophobicContact CE1-CB 3.97Å; F134-V477 HydrophobicContact CE1-CG1 3.56Å; F134-V477 WeakPolarHBondContact CE1-O 3.37Å; F134-V477 HydrophobicContact CZ-CB 4.43Å; F134-V477 HydrophobicContact CZ-CG1 3.75Å; F134-E479 HydrophobicContact CB-CB 3.92Å; F134-E479 HydrophobicContact CB-CG 4.42Å; F134-A482 HydrophobicContact CD2-CB 4.15Å; F134-A482 HydrophobicContact CE2-CB 3.92Å; F134-A482 HydrophobicContact CZ-CB 4.23Å; F134-I548 HydrophobicContact CD1-CD1 4.41Å
135	G	82.4	Confident	87.1	Confident	5 Å²	5	26 Å²	26	5%	0.052	12%	0.121	C	C	.	.			trans	78.9	172.7	-167.3	0	0	0	0	0	112.2	K131	K131-G135 WeakPolarHBondContact O-CA 3.41Å; K131-G135 PolarHBondContact O-N 3.35Å
136	G	77.9	Confident	87.6	Confident	16 Å²	16	26.6 Å²	26.6	17%	0.165	12%	0.124	C	C	.	.			trans	82.8	141.7	170.4	0	0	0	0	0	115.7	E571	G136-E571 PolarHBondContact N-OE1 3.36Å
137	K	81.4	Confident	87.7	Confident	99 Å²	99	26.9 Å²	26.9	43%	0.43	13%	0.126	S	C	.	.	H	α-helix	trans	-76.7	-23.4	178.5	-59.1	-173.1	-172.6	-168.8	0	113.2	I141 D574	K137-I141 WeakPolarHBondContact O-CG1 3.32Å; K137-I141 PolarHBondContact O-N 3.49Å; K137-D574 IonicContact NZ-OD1 2.6Å; K137-D574 IonicContact NZ-OD2 2.66Å; K137-D574 PolarHBondContact NZ-OD2 3.33Å
138	R	89.1	Confident	87.9	Confident	182 Å²	182	27.4 Å²	27.4	69%	0.687	13%	0.129	S	C	*	.	H	α-helix	trans	-65.1	-50	-172.9	-65.1	178.9	-178.7	176.8	0.2	112.2	R140 I141 Y142	R138-R140 VanDerWaalsContact C-N 3.32Å; R138-R140 PolarHBondContact O-N 2.99Å; R138-I141 PolarHBondContact O-N 2.8Å; R138-Y142 VanDerWaalsContact O-CB 3.25Å; R138-Y142 WeakPolarHBondContact O-CB 2.9Å; R138-Y142 PolarHBondContact O-N 2.68Å
139	I	88.1	Confident	88.2	Confident	0 Å²	0	31 Å²	31	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-63.3	-38	-177.6	-162.7	166.2	0	0	0	112.6	L130 F134 H143 E479 A482 M486	L130-I139 HydrophobicContact CB-CG2 4.46Å; L130-I139 HydrophobicContact CD1-CG1 4.41Å; F134-I139 HydrophobicContact CD2-CD1 3.68Å; F134-I139 HydrophobicContact CE2-CD1 4.31Å; F134-I139 HydrophobicContact CG-CD1 4.43Å; I139-H143 WeakPolarHBondContact O-CB 3.5Å; I139-H143 PolarHBondContact O-N 3.47Å; I139-E479 HydrophobicContact CB-CG 4.42Å; I139-E479 HydrophobicContact CG2-CG 4.45Å; I139-A482 HydrophobicContact CD1-CB 3.52Å; I139-M486 HydrophobicContact CD1-CE 4.08Å; I139-M486 HydrophobicContact CG1-CE 3.63Å
140	R	87.8	Confident	88.3	Confident	7 Å²	7	31 Å²	31	3%	0.026	15%	0.148	C	C	.	.	H	α-helix	trans	-63	-51.8	177.4	-175.3	176.6	179.6	173.4	-3.6	111.4	P127 K131 R138 S144 M404 D405 D573	P127-R140 HydrophobicContact CB-CB 4.42Å; P127-R140 HydrophobicContact CB-CG 3.67Å; K131-R140 HydrophobicContact CB-CB 4.32Å; R138-R140 VanDerWaalsContact C-N 3.32Å; R138-R140 PolarHBondContact O-N 2.99Å; R140-S144 WeakPolarHBondContact O-CB 3.5Å; R140-S144 PolarHBondContact O-N 3.08Å; R140-S144 PolarHBondContact O-OG 2.87Å; R140-M404 PolarHBondContact NH2-O 3.35Å; R140-M404 VanDerWaalsContact NH2-O 3.08Å; R140-D405 HydrophobicContact CG-CB 4.31Å; R140-D405 IonicContact CZ-OD1 3.2Å; R140-D405 IonicContact NE-OD1 3.49Å; R140-D405 PolarHBondContact NE-OD1 3.46Å; R140-D405 IonicContact NH2-OD1 2.86Å; R140-D405 PolarHBondContact NH2-OD1 2.76Å; R140-D573 IonicContact NH1-OD1 3.21Å; R140-D573 PolarHBondContact NH1-OD1 3.36Å
141	I	89.8	Confident	88.4	Confident	68 Å²	68	31.1 Å²	31.1	35%	0.349	15%	0.149	S	C	.	.	H	α-helix	trans	-63.8	-46.3	179.4	-65.7	170	0	0	0	110	K137 R138 H143 S144 V145	K137-I141 WeakPolarHBondContact O-CG1 3.32Å; K137-I141 PolarHBondContact O-N 3.49Å; R138-I141 PolarHBondContact O-N 2.8Å; I141-H143 PolarHBondContact O-N 2.87Å; I141-S144 PolarHBondContact O-N 3.4Å; I141-V145 HydrophobicContact CG2-CG2 4.22Å; I141-V145 WeakPolarHBondContact O-CG2 3.41Å; I141-V145 PolarHBondContact O-N 3.39Å
142	Y	90.8	Very high	88.5	Confident	43 Å²	43	31 Å²	31	17%	0.169	15%	0.149	C	C	.	.	H	α-helix	trans	-56.2	-51.7	179.7	178	-86	0	0	0	111.9	R138 S144 V145 L146 F483 M486 L490	R138-Y142 VanDerWaalsContact O-CB 3.25Å; R138-Y142 WeakPolarHBondContact O-CB 2.9Å; R138-Y142 PolarHBondContact O-N 2.68Å; Y142-S144 VanDerWaalsContact C-N 3.34Å; Y142-S144 PolarHBondContact O-N 3.15Å; Y142-V145 PolarHBondContact O-N 3.06Å; Y142-L146 HydrophobicContact CE1-CD2 4.04Å; Y142-L146 WeakPolarHBondContact O-CB 3.37Å; Y142-L146 PolarHBondContact O-N 3.41Å; Y142-F483 HydrophobicContact CD2-CE2 4.3Å; Y142-M486 HydrophobicContact CD1-CB 4.41Å; Y142-M486 HydrophobicContact CD1-CE 3.46Å; Y142-M486 VanDerWaalsContact CD1-CE 3.46Å; Y142-M486 HydrophobicContact CD1-SD 4.13Å; Y142-M486 HydrophobicContact CE1-CB 3.56Å; Y142-M486 HydrophobicContact CE1-CE 3.74Å; Y142-M486 HydrophobicContact CE1-CG 4.36Å; Y142-M486 HydrophobicContact CE1-SD 3.99Å; Y142-M486 HydrophobicContact CG-CE 4.45Å; Y142-M486 PolarHBondContact OH-O 2.77Å; Y142-L490 HydrophobicContact CE2-CD2 4.44Å; Y142-L490 WeakPolarHBondContact OH-CB 3.2Å; Y142-L490 VanDerWaalsContact OH-CD2 3.23Å; Y142-L490 WeakPolarHBondContact OH-CD2 3.27Å
143	H	90.9	Very high	88.5	Confident	2 Å²	2	32.6 Å²	32.6	1%	0.009	16%	0.156	C	C	.	.	H	α-helix	trans	-64.1	-39.4	179.7	-174.5	-82.6	0	0	0	112.1	P127 L130 I139 I141 L146 S147 I464 F468	P127-H143 HydrophobicContact CG-CB 4.49Å; L130-H143 HydrophobicContact CD1-CB 4.09Å; I139-H143 WeakPolarHBondContact O-CB 3.5Å; I139-H143 PolarHBondContact O-N 3.47Å; I141-H143 PolarHBondContact O-N 2.87Å; H143-L146 PolarHBondContact O-N 3.42Å; H143-S147 PolarHBondContact CE1-OG 2.94Å; H143-S147 PolarHBondContact ND1-OG 3.49Å; H143-S147 WeakPolarHBondContact O-CB 3.36Å; H143-S147 PolarHBondContact O-N 3.37Å; H143-S147 PolarHBondContact O-OG 3.39Å; H143-I464 WeakPolarHBondContact NE2-CG2 3.45Å; H143-F468 AromaticContact CD2-CE2 3.95Å; H143-F468 AromaticContact NE2-CE2 3.46Å; H143-F468 WeakPolarHBondContact NE2-CE2 3.14Å
144	S	91.4	Very high	88.5	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-62.5	-48.7	178.4	-54.3	0	0	0	0	111.1	P127 R140 I141 Y142 S147 L148 D405	P127-S144 WeakPolarHBondContact CB-OG 3.16Å; P127-S144 WeakPolarHBondContact CG-OG 3.43Å; R140-S144 WeakPolarHBondContact O-CB 3.5Å; R140-S144 PolarHBondContact O-N 3.08Å; R140-S144 PolarHBondContact O-OG 2.87Å; I141-S144 PolarHBondContact O-N 3.4Å; Y142-S144 VanDerWaalsContact C-N 3.34Å; Y142-S144 PolarHBondContact O-N 3.15Å; S144-S147 PolarHBondContact O-N 2.94Å; S144-L148 WeakPolarHBondContact O-CB 3.49Å; S144-L148 WeakPolarHBondContact O-CG 3.46Å; S144-L148 PolarHBondContact O-N 2.81Å; S144-D405 WeakPolarHBondContact OG-CB 3.27Å
145	V	91.9	Very high	88.5	Confident	65 Å²	65	33.6 Å²	33.6	39%	0.394	16%	0.161	S	C	.	.	H	α-helix	trans	-62.1	-46.2	177.7	172.9	0	0	0	0	110.8	I141 Y142 S147 L148 L149 I406	I141-V145 HydrophobicContact CG2-CG2 4.22Å; I141-V145 WeakPolarHBondContact O-CG2 3.41Å; I141-V145 PolarHBondContact O-N 3.39Å; Y142-V145 PolarHBondContact O-N 3.06Å; V145-S147 PolarHBondContact O-N 2.8Å; V145-L148 PolarHBondContact O-N 3.09Å; V145-L149 HydrophobicContact CG1-CD1 4.23Å; V145-L149 HydrophobicContact CG1-CG 4.48Å; V145-L149 WeakPolarHBondContact O-CG 3.33Å; V145-L149 PolarHBondContact O-N 3.13Å; V145-I406 HydrophobicContact CG2-CD1 4.01Å
146	L	91.1	Very high	88.9	Confident	12 Å²	12	33.3 Å²	33.3	6%	0.063	16%	0.158	C	C	.	.	H	α-helix	trans	-60.8	-43.4	178.7	-179.3	57.8	0	0	0	112.1	Y142 H143 L148 L149 L150 I464 L490	Y142-L146 HydrophobicContact CE1-CD2 4.04Å; Y142-L146 WeakPolarHBondContact O-CB 3.37Å; Y142-L146 PolarHBondContact O-N 3.41Å; H143-L146 PolarHBondContact O-N 3.42Å; L146-L148 PolarHBondContact O-N 2.92Å; L146-L149 PolarHBondContact O-N 2.83Å; L146-L150 HydrophobicContact CG-CD1 4.46Å; L146-L150 WeakPolarHBondContact O-CG 3.23Å; L146-L150 PolarHBondContact O-N 3.45Å; L146-I464 HydrophobicContact CD2-CD1 3.69Å; L146-I464 HydrophobicContact CD2-CG1 3.86Å; L146-I464 HydrophobicContact CG-CD1 4.06Å; L146-L490 HydrophobicContact CD1-CD1 3.66Å; L146-L490 HydrophobicContact CD1-CD2 4.09Å
147	S	91.4	Very high	89.5	Confident	7 Å²	7	32.6 Å²	32.6	5%	0.049	15%	0.15	C	C	.	.	H	α-helix	trans	-63.9	-40.4	177.4	-56.8	0	0	0	0	111.9	H143 S144 V145 L150 Y151	H143-S147 PolarHBondContact CE1-OG 2.94Å; H143-S147 PolarHBondContact ND1-OG 3.49Å; H143-S147 WeakPolarHBondContact O-CB 3.36Å; H143-S147 PolarHBondContact O-N 3.37Å; H143-S147 PolarHBondContact O-OG 3.39Å; S144-S147 PolarHBondContact O-N 2.94Å; V145-S147 PolarHBondContact O-N 2.8Å; S147-L150 WeakPolarHBondContact O-CB 3.43Å; S147-L150 PolarHBondContact O-N 3.06Å; S147-Y151 PolarHBondContact O-N 2.64Å
148	L	92.3	Very high	89.9	Confident	11 Å²	11	28 Å²	28	6%	0.058	13%	0.131	C	C	.	.	H	α-helix	trans	-65.2	-39.6	176.7	-71.2	172.4	0	0	0	112.5	S144 V145 L146 Y151 A152 A398 L401 F402 I406 F426	S144-L148 WeakPolarHBondContact O-CB 3.49Å; S144-L148 WeakPolarHBondContact O-CG 3.46Å; S144-L148 PolarHBondContact O-N 2.81Å; V145-L148 PolarHBondContact O-N 3.09Å; L146-L148 PolarHBondContact O-N 2.92Å; L148-Y151 PolarHBondContact O-N 3.45Å; L148-A152 PolarHBondContact O-N 3.3Å; L148-A398 HydrophobicContact CD2-CB 3.74Å; L148-L401 HydrophobicContact CD2-CB 4.2Å; L148-L401 HydrophobicContact CD2-CD1 4.37Å; L148-L401 HydrophobicContact CG-CB 4.42Å; L148-F402 HydrophobicContact CD1-CB 4.33Å; L148-I406 HydrophobicContact CD1-CD1 3.67Å; L148-F426 HydrophobicContact CD1-CE1 4.1Å; L148-F426 HydrophobicContact CD1-CZ 3.79Å; L148-F426 HydrophobicContact CD2-CE1 3.66Å; L148-F426 HydrophobicContact CD2-CZ 4Å; L148-F426 HydrophobicContact CG-CE1 4.44Å; L148-F426 HydrophobicContact CG-CZ 4.34Å
149	L	89.9	Confident	89.9	Confident	87 Å²	87	19.9 Å²	19.9	46%	0.455	10%	0.101	S	C	.	.	H	α-helix	trans	-65	-41.6	173.9	-66.8	175.9	0	0	0	111.3	V145 L146 A152 F153	V145-L149 HydrophobicContact CG1-CD1 4.23Å; V145-L149 HydrophobicContact CG1-CG 4.48Å; V145-L149 WeakPolarHBondContact O-CG 3.33Å; V145-L149 PolarHBondContact O-N 3.13Å; L146-L149 PolarHBondContact O-N 2.83Å; L149-A152 PolarHBondContact O-N 2.86Å; L149-F153 HydrophobicContact CB-CD2 4.31Å; L149-F153 HydrophobicContact CB-CE2 4.36Å; L149-F153 HydrophobicContact CD2-CE2 3.93Å; L149-F153 WeakPolarHBondContact O-CD2 3.5Å; L149-F153 PolarHBondContact O-N 2.93Å
150	L	90	Very high	90	Very high	2 Å²	2	19.9 Å²	19.9	1%	0.01	10%	0.101	C	C	.	.	H	α-helix	trans	-58.4	-49.6	174	-75.6	171.1	0	0	0	111.1	L146 S147 A152 F153 T154 W286 L460 I464	L146-L150 HydrophobicContact CG-CD1 4.46Å; L146-L150 WeakPolarHBondContact O-CG 3.23Å; L146-L150 PolarHBondContact O-N 3.45Å; S147-L150 WeakPolarHBondContact O-CB 3.43Å; S147-L150 PolarHBondContact O-N 3.06Å; L150-A152 VanDerWaalsContact C-N 3.32Å; L150-A152 PolarHBondContact O-N 2.92Å; L150-F153 PolarHBondContact O-N 3.1Å; L150-T154 HydrophobicContact CD2-CG2 4.41Å; L150-T154 PolarHBondContact O-N 3.37Å; L150-T154 PolarHBondContact O-OG1 2.92Å; L150-W286 HydrophobicContact CD1-CZ2 3.9Å; L150-L460 HydrophobicContact CD2-CB 3.61Å; L150-L460 HydrophobicContact CD2-CD1 3.57Å; L150-L460 HydrophobicContact CD2-CG 4.25Å; L150-I464 HydrophobicContact CD1-CD1 3.83Å
151	Y	91.4	Very high	90.1	Very high	1 Å²	1	19.6 Å²	19.6	0%	0.004	10%	0.1	C	C	.	.	I	π-helix	trans	-57.8	-43.4	177.2	-65.3	-19.2	0	0	0	112.7	S147 L148 Q155 I156 D291 Q292 V293 I394 A398 L401	S147-Y151 PolarHBondContact O-N 2.64Å; L148-Y151 PolarHBondContact O-N 3.45Å; Y151-Q155 HydrophobicContact CD1-CG 4.46Å; Y151-Q155 PolarHBondContact O-N 3.29Å; Y151-I156 WeakPolarHBondContact O-CB 3.44Å; Y151-I156 VanDerWaalsContact O-CG1 3.22Å; Y151-I156 WeakPolarHBondContact O-CG1 3.19Å; Y151-I156 PolarHBondContact O-N 3.46Å; Y151-D291 VanDerWaalsContact CE1-OD1 3.25Å; Y151-D291 WeakPolarHBondContact CE1-OD1 3.21Å; Y151-D291 VanDerWaalsContact CZ-OD1 3.31Å; Y151-D291 PolarHBondContact OH-OD1 3.24Å; Y151-Q292 WeakPolarHBondContact OH-CB 3.36Å; Y151-Q292 PolarHBondContact OH-N 3.31Å; Y151-V293 HydrophobicContact CE1-CG2 4.37Å; Y151-I394 HydrophobicContact CD1-CG2 4.37Å; Y151-I394 HydrophobicContact CD2-CG2 4.19Å; Y151-I394 HydrophobicContact CG-CG2 3.92Å; Y151-A398 HydrophobicContact CD2-CB 3.98Å; Y151-L401 HydrophobicContact CE2-CD1 3.73Å
152	A	89.9	Confident	90	Very high	3 Å²	3	16.4 Å²	16.4	3%	0.025	8%	0.084	C	C	.	.	I	π-helix	trans	-64.1	-46.4	-179.2	0	0	0	0	0	113.1	L148 L149 L150 L430 V433 S434	L148-A152 PolarHBondContact O-N 3.3Å; L149-A152 PolarHBondContact O-N 2.86Å; L150-A152 VanDerWaalsContact C-N 3.32Å; L150-A152 PolarHBondContact O-N 2.92Å; A152-L430 HydrophobicContact CB-CD2 4.1Å; A152-V433 HydrophobicContact CB-CG1 4.39Å; A152-S434 PolarHBondContact O-OG 2.82Å
153	F	86.1	Confident	89.9	Confident	66 Å²	66	14.3 Å²	14.3	29%	0.289	8%	0.076	S	C	.	.	I	π-helix	trans	-92.7	-25	-170.3	-64.9	-55.5	0	0	0	114.6	L149 L150 S157 V433 W437	L149-F153 HydrophobicContact CB-CD2 4.31Å; L149-F153 HydrophobicContact CB-CE2 4.36Å; L149-F153 HydrophobicContact CD2-CE2 3.93Å; L149-F153 WeakPolarHBondContact O-CD2 3.5Å; L149-F153 PolarHBondContact O-N 2.93Å; L150-F153 PolarHBondContact O-N 3.1Å; F153-S157 VanDerWaalsContact C-OG 3.24Å; F153-S157 PolarHBondContact O-OG 3Å; F153-V433 HydrophobicContact CE1-CG1 4.17Å; F153-V433 HydrophobicContact CZ-CG1 4.46Å; F153-W437 HydrophobicContact CD1-CB 4.41Å; F153-W437 AromaticContact CD1-CD2 3.5Å; F153-W437 HydrophobicContact CD1-CD2 3.5Å; F153-W437 AromaticContact CD1-CE2 3.8Å; F153-W437 AromaticContact CD1-CE3 3.73Å; F153-W437 HydrophobicContact CD1-CE3 3.73Å; F153-W437 AromaticContact CD1-CG 3.81Å; F153-W437 HydrophobicContact CD1-CG 3.81Å; F153-W437 HydrophobicContact CD1-CH2 4.46Å; F153-W437 HydrophobicContact CD1-CZ2 4.29Å; F153-W437 HydrophobicContact CD1-CZ3 4.21Å; F153-W437 AromaticContact CE1-CD2 3.9Å; F153-W437 HydrophobicContact CE1-CD2 3.9Å; F153-W437 AromaticContact CE1-CE3 3.61Å; F153-W437 HydrophobicContact CE1-CE3 3.61Å; F153-W437 HydrophobicContact CE1-CG 4.42Å; F153-W437 AromaticContact CE1-CZ3 3.96Å; F153-W437 HydrophobicContact CE1-CZ3 3.96Å
154	T	85.9	Confident	89.7	Confident	3 Å²	3	14.2 Å²	14.2	2%	0.018	8%	0.075	C	C	.	.	I	π-helix	trans	-107.7	-63.8	-178.9	69.4	0	0	0	0	112.1	L150 S157 A158 I456	L150-T154 HydrophobicContact CD2-CG2 4.41Å; L150-T154 PolarHBondContact O-N 3.37Å; L150-T154 PolarHBondContact O-OG1 2.92Å; T154-S157 PolarHBondContact O-OG 3.32Å; T154-A158 WeakPolarHBondContact O-CB 3.34Å; T154-A158 PolarHBondContact O-N 2.95Å; T154-I456 HydrophobicContact CG2-CB 4.07Å; T154-I456 HydrophobicContact CG2-CG2 3.42Å; T154-I456 VanDerWaalsContact CG2-CG2 3.42Å
155	Q	88.9	Confident	89.4	Confident	26 Å²	26	14.7 Å²	14.7	12%	0.121	8%	0.077	C	C	.	.	I	π-helix	trans	-75.3	-54.1	-168.8	-59.8	-170	13	0	0	112.7	Y151 A158 D159 I394	Y151-Q155 HydrophobicContact CD1-CG 4.46Å; Y151-Q155 PolarHBondContact O-N 3.29Å; Q155-A158 PolarHBondContact O-N 3.44Å; Q155-D159 WeakPolarHBondContact O-CB 3.29Å; Q155-D159 PolarHBondContact O-N 2.94Å; Q155-I394 HydrophobicContact CB-CD1 3.7Å; Q155-I394 HydrophobicContact CB-CG1 4.48Å
156	I	90.9	Very high	88.9	Confident	0 Å²	0	11.8 Å²	11.8	0%	0	6%	0.059	C	C	.	.	I	π-helix	trans	-65.4	-46.7	-174.8	-61.8	165.9	0	0	0	110.8	Y151 A158 D159 I160 L391 I394 F395 L430 S434	Y151-I156 WeakPolarHBondContact O-CB 3.44Å; Y151-I156 VanDerWaalsContact O-CG1 3.22Å; Y151-I156 WeakPolarHBondContact O-CG1 3.19Å; Y151-I156 PolarHBondContact O-N 3.46Å; I156-A158 VanDerWaalsContact C-N 3.34Å; I156-A158 PolarHBondContact O-N 2.83Å; I156-D159 PolarHBondContact O-N 3.03Å; I156-I160 HydrophobicContact CG2-CD1 3.6Å; I156-I160 HydrophobicContact CG2-CG1 4.34Å; I156-I160 WeakPolarHBondContact O-CB 3.5Å; I156-I160 WeakPolarHBondContact O-CG1 3.41Å; I156-I160 PolarHBondContact O-N 3.4Å; I156-L391 HydrophobicContact CG2-CD2 4.22Å; I156-I394 HydrophobicContact CD1-CG2 3.9Å; I156-I394 HydrophobicContact CG1-CB 4.45Å; I156-I394 HydrophobicContact CG1-CG2 3.6Å; I156-F395 HydrophobicContact CD1-CD1 4.18Å; I156-F395 HydrophobicContact CD1-CE1 3.83Å; I156-F395 HydrophobicContact CG1-CE1 4Å; I156-F395 HydrophobicContact CG2-CE1 3.99Å; I156-F395 HydrophobicContact CG2-CZ 4.38Å; I156-L430 HydrophobicContact CD1-CB 4.39Å; I156-L430 HydrophobicContact CD1-CD1 4.45Å; I156-S434 WeakPolarHBondContact CB-OG 3.1Å; I156-S434 VanDerWaalsContact CG2-OG 3.29Å; I156-S434 WeakPolarHBondContact CG2-OG 3.31Å
157	S	89.9	Confident	88.6	Confident	0 Å²	0	11.5 Å²	11.5	0%	0	6%	0.058	C	C	.	.	H	α-helix	trans	-61.5	-42.6	-179.8	60.3	0	0	0	0	111.6	F153 T154 F161	F153-S157 VanDerWaalsContact C-OG 3.24Å; F153-S157 PolarHBondContact O-OG 3Å; T154-S157 PolarHBondContact O-OG 3.32Å; S157-F161 VanDerWaalsContact O-CB 3.23Å; S157-F161 WeakPolarHBondContact O-CB 3.33Å; S157-F161 PolarHBondContact O-N 3.48Å
158	A	89.4	Confident	88.2	Confident	2 Å²	2	13.4 Å²	13.4	2%	0.017	7%	0.066	C	C	.	.	H	α-helix	trans	-67.7	-45.3	178.1	0	0	0	0	0	113.2	V81 T154 Q155 I156 F161 S162 I453	V81-A158 HydrophobicContact CG2-CB 3.88Å; T154-A158 WeakPolarHBondContact O-CB 3.34Å; T154-A158 PolarHBondContact O-N 2.95Å; Q155-A158 PolarHBondContact O-N 3.44Å; I156-A158 VanDerWaalsContact C-N 3.34Å; I156-A158 PolarHBondContact O-N 2.83Å; A158-F161 PolarHBondContact O-N 3.13Å; A158-S162 WeakPolarHBondContact O-CB 3.38Å; A158-S162 PolarHBondContact O-N 3.1Å; A158-I453 HydrophobicContact CB-CD1 3.31Å; A158-I453 HydrophobicContact CB-CG1 3.77Å
159	D	90.1	Very high	87.7	Confident	13 Å²	13	15 Å²	15	7%	0.07	7%	0.073	C	C	.	.	H	α-helix	trans	-62.6	-45.2	178.3	-82.8	-21.5	0	0	0	110.9	V81 Q155 I156 F161 G163 L387 S390 L391 I394	V81-D159 WeakPolarHBondContact CG2-OD1 3.45Å; Q155-D159 WeakPolarHBondContact O-CB 3.29Å; Q155-D159 PolarHBondContact O-N 2.94Å; I156-D159 PolarHBondContact O-N 3.03Å; D159-F161 PolarHBondContact O-N 3.22Å; D159-G163 PolarHBondContact O-N 3.22Å; D159-L387 VanDerWaalsContact O-CD2 3.24Å; D159-L387 WeakPolarHBondContact O-CD2 3.43Å; D159-S390 WeakPolarHBondContact OD2-CB 3.5Å; D159-L391 HydrophobicContact CB-CD2 3.78Å; D159-L391 HydrophobicContact CB-CG 4.22Å; D159-I394 WeakPolarHBondContact OD2-CD1 3.26Å
160	I	90	Very high	87.2	Confident	0 Å²	0	11 Å²	11	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-61.2	-46.6	176.2	-68.4	169.2	0	0	0	110.6	I156 G163 A164 V179 L183 L391 I438	I156-I160 HydrophobicContact CG2-CD1 3.6Å; I156-I160 HydrophobicContact CG2-CG1 4.34Å; I156-I160 WeakPolarHBondContact O-CB 3.5Å; I156-I160 WeakPolarHBondContact O-CG1 3.41Å; I156-I160 PolarHBondContact O-N 3.4Å; I160-G163 PolarHBondContact O-N 3.36Å; I160-A164 VanDerWaalsContact O-CB 3.27Å; I160-A164 WeakPolarHBondContact O-CB 3.39Å; I160-A164 PolarHBondContact O-N 3.39Å; I160-V179 HydrophobicContact CG2-CB 4.23Å; I160-V179 HydrophobicContact CG2-CG1 3.67Å; I160-V179 HydrophobicContact CG2-CG2 3.67Å; I160-L183 HydrophobicContact CD1-CD2 3.83Å; I160-L183 HydrophobicContact CG1-CD2 4.15Å; I160-L391 HydrophobicContact CG1-CD1 4.32Å; I160-L391 HydrophobicContact CG1-CD2 4.19Å; I160-I438 HydrophobicContact CG2-CD1 3.77Å
161	F	89.1	Confident	86.7	Confident	1 Å²	1	14.8 Å²	14.8	0%	0.004	7%	0.072	C	C	.	.	H	α-helix	trans	-64.8	-48.9	-178.5	176.6	-103.3	0	0	0	111.9	S157 A158 D159 G163 A164 L165 I175 I438 V441 Q442 Q445 L449	S157-F161 VanDerWaalsContact O-CB 3.23Å; S157-F161 WeakPolarHBondContact O-CB 3.33Å; S157-F161 PolarHBondContact O-N 3.48Å; A158-F161 PolarHBondContact O-N 3.13Å; D159-F161 PolarHBondContact O-N 3.22Å; F161-G163 VanDerWaalsContact C-N 3.34Å; F161-G163 PolarHBondContact O-N 3.37Å; F161-A164 PolarHBondContact O-N 2.85Å; F161-L165 HydrophobicContact CD1-CD1 4.16Å; F161-L165 HydrophobicContact CE1-CD1 3.38Å; F161-L165 HydrophobicContact CE1-CG 3.96Å; F161-L165 HydrophobicContact CE2-CD1 4.49Å; F161-L165 HydrophobicContact CE2-CD2 4.38Å; F161-L165 HydrophobicContact CE2-CG 4.23Å; F161-L165 HydrophobicContact CZ-CD1 3.57Å; F161-L165 HydrophobicContact CZ-CD2 3.96Å; F161-L165 HydrophobicContact CZ-CG 3.75Å; F161-L165 PolarHBondContact O-N 2.84Å; F161-I175 HydrophobicContact CD2-CD1 3.92Å; F161-I175 HydrophobicContact CE2-CD1 3.63Å; F161-I438 HydrophobicContact CD2-CG2 4.15Å; F161-V441 HydrophobicContact CB-CG1 4.39Å; F161-V441 HydrophobicContact CD1-CG1 4.03Å; F161-V441 HydrophobicContact CG-CG1 4.14Å; F161-Q442 HydrophobicContact CD2-CG 3.99Å; F161-Q442 HydrophobicContact CE2-CG 3.44Å; F161-Q442 VanDerWaalsContact CE2-CG 3.44Å; F161-Q442 HydrophobicContact CZ-CG 4.15Å; F161-Q445 VanDerWaalsContact CE1-OE1 3.25Å; F161-L449 HydrophobicContact CD1-CD1 3.93Å; F161-L449 HydrophobicContact CD1-CD2 3.86Å; F161-L449 HydrophobicContact CE1-CD1 4.35Å; F161-L449 HydrophobicContact CE1-CD2 4.3Å
162	S	89	Confident	86	Confident	0 Å²	0	16.4 Å²	16.4	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-58.8	-43.7	175.9	171.4	0	0	0	0	111.9	S80 V81 V84 A158 L165 F166	S80-S162 WeakPolarHBondContact CB-OG 3.48Å; S80-S162 PolarHBondContact O-OG 3.44Å; S80-S162 WeakPolarHBondContact OG-CB 3.5Å; S80-S162 PolarHBondContact OG-OG 3.18Å; V81-S162 PolarHBondContact N-OG 3.28Å; V84-S162 VanDerWaalsContact CB-OG 3.29Å; V84-S162 WeakPolarHBondContact CB-OG 3.02Å; V84-S162 WeakPolarHBondContact CG2-OG 3.29Å; A158-S162 WeakPolarHBondContact O-CB 3.38Å; A158-S162 PolarHBondContact O-N 3.1Å; S162-L165 PolarHBondContact O-N 3.08Å; S162-F166 PolarHBondContact O-N 3.28Å; S162-F166 VanDerWaalsContact O-N 3.12Å
163	G	88.2	Confident	85.5	Confident	0 Å²	0	19 Å²	19	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-65.7	-39.5	176.3	0	0	0	0	0	113.4	D159 I160 F161 F166 I167 L387	D159-G163 PolarHBondContact O-N 3.22Å; I160-G163 PolarHBondContact O-N 3.36Å; F161-G163 VanDerWaalsContact C-N 3.34Å; F161-G163 PolarHBondContact O-N 3.37Å; G163-F166 WeakPolarHBondContact O-CB 3.28Å; G163-F166 PolarHBondContact O-N 2.89Å; G163-I167 WeakPolarHBondContact O-CG1 3.28Å; G163-I167 PolarHBondContact O-N 2.98Å; G163-L387 VanDerWaalsContact CA-CD2 3.44Å
164	A	86.6	Confident	85.4	Confident	0 Å²	0	19.7 Å²	19.7	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-65.9	-39.1	176.6	0	0	0	0	0	112.2	I160 F161 F166 I167 Q168 I175 A178 V179	I160-A164 VanDerWaalsContact O-CB 3.27Å; I160-A164 WeakPolarHBondContact O-CB 3.39Å; I160-A164 PolarHBondContact O-N 3.39Å; F161-A164 PolarHBondContact O-N 2.85Å; A164-F166 VanDerWaalsContact C-N 3.3Å; A164-F166 PolarHBondContact O-N 3.42Å; A164-I167 PolarHBondContact O-N 3.08Å; A164-Q168 VanDerWaalsContact O-CB 3.29Å; A164-Q168 WeakPolarHBondContact O-CB 3.32Å; A164-Q168 PolarHBondContact O-N 3.3Å; A164-I175 HydrophobicContact CB-CD1 4.31Å; A164-I175 HydrophobicContact CB-CG1 3.54Å; A164-A178 HydrophobicContact CB-CB 4.2Å; A164-V179 HydrophobicContact CB-CG2 3.57Å
165	L	84.3	Confident	85	Confident	9 Å²	9	20.3 Å²	20.3	5%	0.047	11%	0.111	C	C	.	.	H	α-helix	trans	-58.3	-44	171.5	-75.7	179.9	0	0	0	111.4	V84 F161 S162 Q168 Q169 N360	V84-L165 HydrophobicContact CG1-CD1 4.09Å; F161-L165 HydrophobicContact CD1-CD1 4.16Å; F161-L165 HydrophobicContact CE1-CD1 3.38Å; F161-L165 HydrophobicContact CE1-CG 3.96Å; F161-L165 HydrophobicContact CE2-CD1 4.49Å; F161-L165 HydrophobicContact CE2-CD2 4.38Å; F161-L165 HydrophobicContact CE2-CG 4.23Å; F161-L165 HydrophobicContact CZ-CD1 3.57Å; F161-L165 HydrophobicContact CZ-CD2 3.96Å; F161-L165 HydrophobicContact CZ-CG 3.75Å; F161-L165 PolarHBondContact O-N 2.84Å; S162-L165 PolarHBondContact O-N 3.08Å; L165-Q168 WeakPolarHBondContact O-CB 3.27Å; L165-Q168 PolarHBondContact O-N 3.13Å; L165-Q169 WeakPolarHBondContact O-CG 2.91Å; L165-Q169 PolarHBondContact O-N 3.39Å; L165-N360 HydrophobicContact CD1-CB 4.27Å
166	F	83.3	Confident	84.8	Confident	4 Å²	4	24.4 Å²	24.4	2%	0.018	13%	0.127	C	C	.	.	H	α-helix	trans	-62.7	-47.8	178.7	-175.1	-103.5	0	0	0	112.4	S162 G163 A164 Q168 Q169 A170 P364 L380 M383	S162-F166 PolarHBondContact O-N 3.28Å; S162-F166 VanDerWaalsContact O-N 3.12Å; G163-F166 WeakPolarHBondContact O-CB 3.28Å; G163-F166 PolarHBondContact O-N 2.89Å; A164-F166 VanDerWaalsContact C-N 3.3Å; A164-F166 PolarHBondContact O-N 3.42Å; F166-Q168 VanDerWaalsContact C-N 3.29Å; F166-Q168 PolarHBondContact O-N 3.42Å; F166-Q169 PolarHBondContact O-N 3.44Å; F166-A170 WeakPolarHBondContact O-CB 3.35Å; F166-A170 PolarHBondContact O-N 3.07Å; F166-P364 HydrophobicContact CD2-CB 3.72Å; F166-P364 HydrophobicContact CD2-CG 3.86Å; F166-P364 HydrophobicContact CE2-CB 4.09Å; F166-L380 HydrophobicContact CE1-CB 4.45Å; F166-L380 HydrophobicContact CE1-CD2 3.57Å; F166-L380 HydrophobicContact CE2-CD2 4.25Å; F166-L380 HydrophobicContact CZ-CD2 3.34Å; F166-L380 HydrophobicContact CZ-CG 4.46Å; F166-M383 HydrophobicContact CD1-CB 4.19Å; F166-M383 HydrophobicContact CD1-CE 4.47Å; F166-M383 HydrophobicContact CD2-CE 3.31Å; F166-M383 HydrophobicContact CD2-SD 4.02Å; F166-M383 HydrophobicContact CE1-CB 3.59Å; F166-M383 HydrophobicContact CE1-CE 4.3Å; F166-M383 HydrophobicContact CE1-CG 4.41Å; F166-M383 HydrophobicContact CE1-SD 4.16Å; F166-M383 HydrophobicContact CE2-CB 4.34Å; F166-M383 HydrophobicContact CE2-CE 3.13Å; F166-M383 HydrophobicContact CE2-CG 4.39Å; F166-M383 HydrophobicContact CE2-SD 3.18Å; F166-M383 WeakPolarHBondContact CE2-SD 3.17Å; F166-M383 HydrophobicContact CG-CE 3.99Å; F166-M383 HydrophobicContact CZ-CB 3.65Å; F166-M383 HydrophobicContact CZ-CE 3.64Å; F166-M383 HydrophobicContact CZ-CG 3.95Å; F166-M383 HydrophobicContact CZ-SD 3.22Å; F166-M383 WeakPolarHBondContact CZ-SD 3.35Å
167	I	83.7	Confident	84.5	Confident	7 Å²	7	28.1 Å²	28.1	4%	0.036	15%	0.149	C	C	.	.	H	α-helix	trans	-61.7	-39.5	177.1	-65.4	167.6	0	0	0	111.1	G163 A164 Q169 A170 M171 L173 A178 L182 M384	G163-I167 WeakPolarHBondContact O-CG1 3.28Å; G163-I167 PolarHBondContact O-N 2.98Å; A164-I167 PolarHBondContact O-N 3.08Å; I167-Q169 VanDerWaalsContact C-N 3.35Å; I167-A170 PolarHBondContact O-N 3.27Å; I167-M171 HydrophobicContact CG2-SD 4.11Å; I167-M171 WeakPolarHBondContact O-CB 2.99Å; I167-M171 PolarHBondContact O-N 2.91Å; I167-L173 HydrophobicContact CG2-CB 4.45Å; I167-L173 HydrophobicContact CG2-CD1 3.92Å; I167-A178 HydrophobicContact CB-CB 3.68Å; I167-A178 HydrophobicContact CD1-CB 4.09Å; I167-A178 HydrophobicContact CG1-CB 4.5Å; I167-A178 HydrophobicContact CG2-CB 3.47Å; I167-A178 VanDerWaalsContact CG2-CB 3.47Å; I167-L182 HydrophobicContact CD1-CB 4.19Å; I167-L182 HydrophobicContact CD1-CD1 4.22Å; I167-M384 HydrophobicContact CD1-CE 3.47Å; I167-M384 VanDerWaalsContact CD1-CE 3.47Å; I167-M384 HydrophobicContact CD1-SD 3.98Å; I167-M384 HydrophobicContact CG1-CE 3.36Å; I167-M384 HydrophobicContact CG1-SD 4.37Å
168	Q	83.3	Confident	84.2	Confident	47 Å²	47	28.1 Å²	28.1	22%	0.22	15%	0.149	C	C	.	.	H	α-helix	trans	-60.4	-44.6	175.9	177.5	177.7	34.4	0	0	111.3	A164 L165 F166 G172 L173	A164-Q168 VanDerWaalsContact O-CB 3.29Å; A164-Q168 WeakPolarHBondContact O-CB 3.32Å; A164-Q168 PolarHBondContact O-N 3.3Å; L165-Q168 WeakPolarHBondContact O-CB 3.27Å; L165-Q168 PolarHBondContact O-N 3.13Å; F166-Q168 VanDerWaalsContact C-N 3.29Å; F166-Q168 PolarHBondContact O-N 3.42Å; Q168-G172 WeakPolarHBondContact O-CA 3.43Å; Q168-G172 PolarHBondContact O-N 3.13Å; Q168-L173 WeakPolarHBondContact CG-O 3.33Å
169	Q	81.9	Confident	83.9	Confident	43 Å²	43	28.3 Å²	28.3	20%	0.201	15%	0.15	C	C	.	.	H	α-helix	trans	-68.8	-35.3	177.8	-66.6	-59.9	-37.1	0	0	112.6	L165 F166 I167 I361 P364	L165-Q169 WeakPolarHBondContact O-CG 2.91Å; L165-Q169 PolarHBondContact O-N 3.39Å; F166-Q169 PolarHBondContact O-N 3.44Å; I167-Q169 VanDerWaalsContact C-N 3.35Å; Q169-I361 HydrophobicContact CG-CB 4.29Å; Q169-I361 HydrophobicContact CG-CG2 4.24Å; Q169-P364 HydrophobicContact CB-CB 3.91Å; Q169-P364 HydrophobicContact CG-CB 4.11Å
170	A	80.2	Confident	83.7	Confident	4 Å²	4	33.3 Å²	33.3	3%	0.033	18%	0.175	C	C	.	.	H	α-helix	trans	-78.7	-40.7	-179	0	0	0	0	0	113.7	A21 I22 F166 I167 L380	A21-A170 WeakPolarHBondContact CB-O 3.19Å; I22-A170 HydrophobicContact CD1-CB 4.5Å; F166-A170 WeakPolarHBondContact O-CB 3.35Å; F166-A170 PolarHBondContact O-N 3.07Å; I167-A170 PolarHBondContact O-N 3.27Å; A170-L380 HydrophobicContact CB-CD1 4.25Å; A170-L380 HydrophobicContact CB-CD2 3.5Å; A170-L380 VanDerWaalsContact CB-CD2 3.5Å
171	M	79.1	Confident	83.2	Confident	82 Å²	82	35.4 Å²	35.4	40%	0.404	19%	0.193	S	C	.	.	H	α-helix	trans	-114.9	-7	-169.9	-61	-178.4	71.1	0	0	113.9	I22 I167 L173	I22-M171 HydrophobicContact CD1-CG 3.72Å; I22-M171 HydrophobicContact CD1-SD 4.48Å; I167-M171 HydrophobicContact CG2-SD 4.11Å; I167-M171 WeakPolarHBondContact O-CB 2.99Å; I167-M171 PolarHBondContact O-N 2.91Å; M171-L173 HydrophobicContact CB-CD1 3.94Å; M171-L173 HydrophobicContact CB-CG 3.72Å; M171-L173 HydrophobicContact CE-CD1 3.87Å; M171-L173 PolarHBondContact O-N 3.09Å; M171-L173 HydrophobicContact SD-CD1 3.86Å
172	G	76.4	Confident	82.8	Confident	35 Å²	35	35.4 Å²	35.4	36%	0.361	19%	0.193	S	C	.	.			trans	65.9	17.7	-174.3	0	0	0	0	0	113.4	Q168	Q168-G172 WeakPolarHBondContact O-CA 3.43Å; Q168-G172 PolarHBondContact O-N 3.13Å
173	L	79.2	Confident	82.4	Confident	56 Å²	56	36.1 Å²	36.1	29%	0.293	20%	0.197	S	C	.	.			trans	-75.1	151.7	-178.5	-67.3	177	0	0	0	111.2	I167 Q168 M171	I167-L173 HydrophobicContact CG2-CB 4.45Å; I167-L173 HydrophobicContact CG2-CD1 3.92Å; Q168-L173 WeakPolarHBondContact CG-O 3.33Å; M171-L173 HydrophobicContact CB-CD1 3.94Å; M171-L173 HydrophobicContact CB-CG 3.72Å; M171-L173 HydrophobicContact CE-CD1 3.87Å; M171-L173 PolarHBondContact O-N 3.09Å; M171-L173 HydrophobicContact SD-CD1 3.86Å
174	N	83.1	Confident	82	Confident	81 Å²	81	39.1 Å²	39.1	43%	0.433	22%	0.222	S	C	.	.			trans	-62.6	139.2	168.5	-177.8	-75.6	0	0	0	109.9	Y176 V177 A178	N174-Y176 PolarHBondContact O-N 3.45Å; N174-Y176 VanDerWaalsContact O-N 3.15Å; N174-Y176 WeakPolarHBondContact OD1-CD2 3.5Å; N174-Y176 PolarHBondContact OD1-N 3.31Å; N174-V177 HydrophobicContact CB-CG2 4.16Å; N174-V177 WeakPolarHBondContact O-CB 3.45Å; N174-V177 PolarHBondContact O-N 2.88Å; N174-A178 PolarHBondContact O-N 2.59Å
175	I	79	Confident	81.5	Confident	16 Å²	16	42.7 Å²	42.7	8%	0.082	24%	0.24	C	C	.	.	H	α-helix	trans	-51.9	-39.9	-177.1	-162.3	174.8	0	0	0	113	F161 A164 A178 V179	F161-I175 HydrophobicContact CD2-CD1 3.92Å; F161-I175 HydrophobicContact CE2-CD1 3.63Å; A164-I175 HydrophobicContact CB-CD1 4.31Å; A164-I175 HydrophobicContact CB-CG1 3.54Å; I175-A178 WeakPolarHBondContact O-CB 3.27Å; I175-A178 PolarHBondContact O-N 3.32Å; I175-V179 VanDerWaalsContact O-CG2 3.28Å; I175-V179 WeakPolarHBondContact O-CG2 2.98Å; I175-V179 PolarHBondContact O-N 2.93Å
176	Y	84.3	Confident	81.1	Confident	113 Å²	113	42.3 Å²	42.3	44%	0.443	24%	0.238	S	C	.	.	H	α-helix	trans	-71.3	-34.1	179.9	-66.6	-77.9	0	0	0	112.7	N174 V179 I180	N174-Y176 PolarHBondContact O-N 3.45Å; N174-Y176 VanDerWaalsContact O-N 3.15Å; N174-Y176 WeakPolarHBondContact OD1-CD2 3.5Å; N174-Y176 PolarHBondContact OD1-N 3.31Å; Y176-V179 PolarHBondContact O-N 3.4Å; Y176-I180 WeakPolarHBondContact O-CG1 3.25Å; Y176-I180 PolarHBondContact O-N 2.98Å
177	V	84.4	Confident	80.6	Confident	77 Å²	77	44 Å²	44	47%	0.467	25%	0.252	S	S	.	.	H	α-helix	trans	-68.2	-41.1	174.3	178.4	0	0	0	0	109.9	N174 I180 A181	N174-V177 HydrophobicContact CB-CG2 4.16Å; N174-V177 WeakPolarHBondContact O-CB 3.45Å; N174-V177 PolarHBondContact O-N 2.88Å; V177-I180 PolarHBondContact O-N 3.34Å; V177-A181 WeakPolarHBondContact O-CB 3.29Å; V177-A181 PolarHBondContact O-N 2.83Å
178	A	83.2	Confident	79.9	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-60.1	-43.9	173.8	0	0	0	0	0	112.1	A164 I167 N174 I175 A181 L182	A164-A178 HydrophobicContact CB-CB 4.2Å; I167-A178 HydrophobicContact CB-CB 3.68Å; I167-A178 HydrophobicContact CD1-CB 4.09Å; I167-A178 HydrophobicContact CG1-CB 4.5Å; I167-A178 HydrophobicContact CG2-CB 3.47Å; I167-A178 VanDerWaalsContact CG2-CB 3.47Å; N174-A178 PolarHBondContact O-N 2.59Å; I175-A178 WeakPolarHBondContact O-CB 3.27Å; I175-A178 PolarHBondContact O-N 3.32Å; A178-A181 PolarHBondContact O-N 2.8Å; A178-L182 VanDerWaalsContact O-CB 3.27Å; A178-L182 WeakPolarHBondContact O-CB 3.22Å; A178-L182 PolarHBondContact O-N 3.48Å
179	V	84	Confident	79.1	Confident	6 Å²	6	48 Å²	48	4%	0.036	27%	0.272	C	S	.	.	H	α-helix	trans	-59.9	-48.3	175.4	169.2	0	0	0	0	111.5	I160 A164 I175 Y176 A181 L182 L183 I435 I438	I160-V179 HydrophobicContact CG2-CB 4.23Å; I160-V179 HydrophobicContact CG2-CG1 3.67Å; I160-V179 HydrophobicContact CG2-CG2 3.67Å; A164-V179 HydrophobicContact CB-CG2 3.57Å; I175-V179 VanDerWaalsContact O-CG2 3.28Å; I175-V179 WeakPolarHBondContact O-CG2 2.98Å; I175-V179 PolarHBondContact O-N 2.93Å; Y176-V179 PolarHBondContact O-N 3.4Å; V179-A181 PolarHBondContact O-N 3.38Å; V179-L182 PolarHBondContact O-N 3.22Å; V179-L183 HydrophobicContact CG1-CD1 3.7Å; V179-L183 HydrophobicContact CG1-CG 4.33Å; V179-L183 WeakPolarHBondContact O-CB 3.18Å; V179-L183 VanDerWaalsContact O-CG 3.3Å; V179-L183 WeakPolarHBondContact O-CG 3.39Å; V179-L183 PolarHBondContact O-N 3Å; V179-I435 HydrophobicContact CG1-CG1 4.36Å; V179-I438 HydrophobicContact CG1-CD1 4.3Å; V179-I438 HydrophobicContact CG2-CD1 4.09Å
180	I	84.6	Confident	78.4	Confident	118 Å²	118	46.9 Å²	46.9	61%	0.605	27%	0.269	S	S	*	.	H	α-helix	trans	-63.1	-43.9	-179.6	-68.2	166.6	0	0	0	110.7	Y176 V177 L183 A184	Y176-I180 WeakPolarHBondContact O-CG1 3.25Å; Y176-I180 PolarHBondContact O-N 2.98Å; V177-I180 PolarHBondContact O-N 3.34Å; I180-L183 PolarHBondContact O-N 3.09Å; I180-A184 WeakPolarHBondContact O-CB 3.27Å; I180-A184 PolarHBondContact O-N 3.34Å
181	A	80.9	Confident	77.6	Confident	44 Å²	44	48.9 Å²	48.9	36%	0.364	28%	0.281	S	S	.	.	H	α-helix	trans	-62.3	-45.1	177.7	0	0	0	0	0	111.7	V177 A178 V179 A184 I185	V177-A181 WeakPolarHBondContact O-CB 3.29Å; V177-A181 PolarHBondContact O-N 2.83Å; A178-A181 PolarHBondContact O-N 2.8Å; V179-A181 PolarHBondContact O-N 3.38Å; A181-A184 PolarHBondContact O-N 3.07Å; A181-I185 WeakPolarHBondContact O-CG1 3.44Å; A181-I185 PolarHBondContact O-N 3.11Å
182	L	80.5	Confident	76.6	Confident	1 Å²	1	45.8 Å²	45.8	1%	0.005	27%	0.266	C	S	.	.	H	α-helix	trans	-56.8	-55.5	175.9	-175.9	77.3	0	0	0	110.4	I167 A178 V179 A184 I185 T186 M384 L387 M388 L391	I167-L182 HydrophobicContact CD1-CB 4.19Å; I167-L182 HydrophobicContact CD1-CD1 4.22Å; A178-L182 VanDerWaalsContact O-CB 3.27Å; A178-L182 WeakPolarHBondContact O-CB 3.22Å; A178-L182 PolarHBondContact O-N 3.48Å; V179-L182 PolarHBondContact O-N 3.22Å; L182-A184 VanDerWaalsContact C-N 3.33Å; L182-A184 PolarHBondContact O-N 3.29Å; L182-I185 PolarHBondContact O-N 3.42Å; L182-I185 VanDerWaalsContact O-N 3.16Å; L182-T186 PolarHBondContact O-N 3.32Å; L182-T186 PolarHBondContact O-OG1 3.4Å; L182-M384 HydrophobicContact CD1-SD 3.41Å; L182-M384 WeakPolarHBondContact CD1-SD 3.3Å; L182-L387 HydrophobicContact CD1-CB 4Å; L182-L387 HydrophobicContact CD1-CD1 3.97Å; L182-L387 HydrophobicContact CD1-CG 4.47Å; L182-M388 HydrophobicContact CD1-CE 3.36Å; L182-M388 HydrophobicContact CG-CE 4.06Å; L182-M388 WeakPolarHBondContact O-CE 3.48Å; L182-L391 HydrophobicContact CD2-CD1 4.2Å
183	L	81.1	Confident	75.8	Confident	16 Å²	16	44.4 Å²	44.4	8%	0.084	25%	0.252	C	S	.	.	H	α-helix	trans	-64.2	-35.2	-176.5	-70.8	173.6	0	0	0	113.2	I160 V179 I180 I185 T186 A187 I431 I435	I160-L183 HydrophobicContact CD1-CD2 3.83Å; I160-L183 HydrophobicContact CG1-CD2 4.15Å; V179-L183 HydrophobicContact CG1-CD1 3.7Å; V179-L183 HydrophobicContact CG1-CG 4.33Å; V179-L183 WeakPolarHBondContact O-CB 3.18Å; V179-L183 VanDerWaalsContact O-CG 3.3Å; V179-L183 WeakPolarHBondContact O-CG 3.39Å; V179-L183 PolarHBondContact O-N 3Å; I180-L183 PolarHBondContact O-N 3.09Å; L183-I185 VanDerWaalsContact C-N 3.34Å; L183-T186 PolarHBondContact O-N 2.88Å; L183-A187 WeakPolarHBondContact O-CB 3.42Å; L183-A187 PolarHBondContact O-N 3.42Å; L183-I431 HydrophobicContact CD1-CG2 3.67Å; L183-I431 HydrophobicContact CD2-CD1 4.45Å; L183-I431 HydrophobicContact CD2-CG1 4.41Å; L183-I431 HydrophobicContact CD2-CG2 3.94Å; L183-I431 HydrophobicContact CG-CG2 4.38Å; L183-I435 HydrophobicContact CD1-CD1 3.5Å; L183-I435 HydrophobicContact CD1-CG1 3.9Å
184	A	79.1	Confident	75.3	Confident	63 Å²	63	42 Å²	42	52%	0.521	24%	0.241	S	C	.	.	H	α-helix	trans	-61.8	-43.5	175.4	0	0	0	0	0	111.4	I180 A181 L182 L188	I180-A184 WeakPolarHBondContact O-CB 3.27Å; I180-A184 PolarHBondContact O-N 3.34Å; A181-A184 PolarHBondContact O-N 3.07Å; L182-A184 VanDerWaalsContact C-N 3.33Å; L182-A184 PolarHBondContact O-N 3.29Å; A184-L188 PolarHBondContact O-N 3.34Å; A184-L188 VanDerWaalsContact O-N 3.17Å
185	I	75.1	Confident	74.8	Confident	75 Å²	75	38.2 Å²	38.2	39%	0.385	22%	0.22	S	C	.	.	H	α-helix	trans	-68.7	-44.5	177.2	-62.1	167.1	0	0	0	110.2	A181 L182 L183 A187 L188 Y189 M388	A181-I185 WeakPolarHBondContact O-CG1 3.44Å; A181-I185 PolarHBondContact O-N 3.11Å; L182-I185 PolarHBondContact O-N 3.42Å; L182-I185 VanDerWaalsContact O-N 3.16Å; L183-I185 VanDerWaalsContact C-N 3.34Å; I185-A187 VanDerWaalsContact C-N 3.33Å; I185-A187 PolarHBondContact O-N 3.41Å; I185-L188 PolarHBondContact O-N 2.98Å; I185-Y189 PolarHBondContact O-N 2.91Å; I185-M388 HydrophobicContact CB-CE 3.72Å; I185-M388 HydrophobicContact CB-SD 4.21Å; I185-M388 HydrophobicContact CG2-CE 3.68Å; I185-M388 HydrophobicContact CG2-CG 4.44Å; I185-M388 HydrophobicContact CG2-SD 3.89Å
186	T	76.9	Confident	74.6	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-60.2	-43.2	177.2	-44.2	0	0	0	0	111.4	L182 L183 Y189 T190 M388 L391 T392 F395	L182-T186 PolarHBondContact O-N 3.32Å; L182-T186 PolarHBondContact O-OG1 3.4Å; L183-T186 PolarHBondContact O-N 2.88Å; T186-Y189 PolarHBondContact O-N 3.38Å; T186-T190 WeakPolarHBondContact O-CB 3.24Å; T186-T190 PolarHBondContact O-N 3.06Å; T186-T190 PolarHBondContact O-OG1 3.4Å; T186-M388 WeakPolarHBondContact CA-SD 3.48Å; T186-M388 HydrophobicContact CG2-SD 4.14Å; T186-M388 PolarHBondContact N-SD 3.4Å; T186-M388 VanDerWaalsContact N-SD 3.36Å; T186-M388 PolarHBondContact OG1-SD 2.93Å; T186-L391 HydrophobicContact CG2-CB 3.69Å; T186-L391 HydrophobicContact CG2-CD1 4.15Å; T186-T392 HydrophobicContact CG2-CG2 3.98Å; T186-F395 HydrophobicContact CG2-CD2 4.21Å; T186-F395 HydrophobicContact CG2-CE2 3.75Å
187	A	73.1	Confident	74.2	Confident	40 Å²	40	32.1 Å²	32.1	33%	0.331	20%	0.196	S	C	.	.	H	α-helix	trans	-63.9	-43.9	-179.1	0	0	0	0	0	111.6	L183 I185 Y189 T190 V191	L183-A187 WeakPolarHBondContact O-CB 3.42Å; L183-A187 PolarHBondContact O-N 3.42Å; I185-A187 VanDerWaalsContact C-N 3.33Å; I185-A187 PolarHBondContact O-N 3.41Å; A187-Y189 VanDerWaalsContact C-N 3.26Å; A187-Y189 PolarHBondContact O-N 2.54Å; A187-T190 PolarHBondContact O-N 3.08Å; A187-V191 WeakPolarHBondContact O-CB 3.36Å; A187-V191 VanDerWaalsContact O-CG2 3.24Å; A187-V191 WeakPolarHBondContact O-CG2 3.04Å; A187-V191 PolarHBondContact O-N 3.05Å
188	L	68.9	Low	73.9	Confident	104 Å²	104	28.7 Å²	28.7	55%	0.545	18%	0.175	S	C	.	.	H	α-helix	trans	-57.4	-41.9	176.2	-172.6	69.9	0	0	0	111.6	A184 I185 T192 F602	A184-L188 PolarHBondContact O-N 3.34Å; A184-L188 VanDerWaalsContact O-N 3.17Å; I185-L188 PolarHBondContact O-N 2.98Å; L188-T192 WeakPolarHBondContact O-CG2 3.26Å; L188-T192 PolarHBondContact O-OG1 3.31Å; L188-F602 HydrophobicContact CD1-CE1 4.43Å; L188-F602 HydrophobicContact CD1-CZ 3.77Å
189	Y	66.6	Low	74	Confident	33 Å²	33	28.7 Å²	28.7	13%	0.129	18%	0.175	C	C	.	.	H	α-helix	trans	-74.3	-40.5	-180	-166.1	-95.5	0	0	0	112.7	V38 I185 T186 A187 V191 T192 G193 T201 T392	V38-Y189 HydrophobicContact CG1-CE2 4.43Å; I185-Y189 PolarHBondContact O-N 2.91Å; T186-Y189 PolarHBondContact O-N 3.38Å; A187-Y189 VanDerWaalsContact C-N 3.26Å; A187-Y189 PolarHBondContact O-N 2.54Å; Y189-V191 PolarHBondContact O-N 2.96Å; Y189-T192 PolarHBondContact O-N 2.68Å; Y189-T192 PolarHBondContact O-OG1 2.96Å; Y189-T192 VanDerWaalsContact O-OG1 3.08Å; Y189-G193 PolarHBondContact O-N 3.4Å; Y189-T201 VanDerWaalsContact OH-CB 3.3Å; Y189-T201 WeakPolarHBondContact OH-CB 3.49Å; Y189-T201 WeakPolarHBondContact OH-CG2 3.39Å; Y189-T201 PolarHBondContact OH-OG1 3.47Å; Y189-T392 HydrophobicContact CD1-CG2 3.63Å; Y189-T392 HydrophobicContact CE1-CG2 4.37Å
190	T	67.5	Low	74	Confident	20 Å²	20	33.4 Å²	33.4	12%	0.123	19%	0.193	C	C	.	.	H	α-helix	trans	-67.8	-37.4	-179	-52	0	0	0	0	112	T186 A187 T192 T392 F395 I427	T186-T190 WeakPolarHBondContact O-CB 3.24Å; T186-T190 PolarHBondContact O-N 3.06Å; T186-T190 PolarHBondContact O-OG1 3.4Å; A187-T190 PolarHBondContact O-N 3.08Å; T190-T192 VanDerWaalsContact C-N 3.26Å; T190-T192 PolarHBondContact O-N 3.19Å; T190-T392 VanDerWaalsContact OG1-CG2 3.25Å; T190-T392 WeakPolarHBondContact OG1-CG2 3.44Å; T190-F395 HydrophobicContact CG2-CB 4.02Å; T190-F395 HydrophobicContact CG2-CD2 4.2Å; T190-I427 HydrophobicContact CG2-CD1 4.08Å
191	V	61.7	Low	74	Confident	47 Å²	47	28.1 Å²	28.1	29%	0.285	17%	0.166	S	C	.	.	H	α-helix	trans	-69.4	-26.8	-179.9	171.4	0	0	0	0	112	A187 Y189 R424	A187-V191 WeakPolarHBondContact O-CB 3.36Å; A187-V191 VanDerWaalsContact O-CG2 3.24Å; A187-V191 WeakPolarHBondContact O-CG2 3.04Å; A187-V191 PolarHBondContact O-N 3.05Å; Y189-V191 PolarHBondContact O-N 2.96Å; V191-R424 PolarHBondContact O-NH2 3.03Å; V191-R424 VanDerWaalsContact O-NH2 3.15Å
192	T	58.4	Low	74.3	Confident	16 Å²	16	26 Å²	26	10%	0.098	15%	0.149	C	C	.	.	H	α-helix	trans	-97.6	-25	-174.5	54.3	0	0	0	0	113.6	R51 L188 Y189 T190 F602	R51-T192 PolarHBondContact NH1-O 3.27Å; R51-T192 PolarHBondContact NH2-O 2.92Å; R51-T192 VanDerWaalsContact NH2-O 3.13Å; L188-T192 WeakPolarHBondContact O-CG2 3.26Å; L188-T192 PolarHBondContact O-OG1 3.31Å; Y189-T192 PolarHBondContact O-N 2.68Å; Y189-T192 PolarHBondContact O-OG1 2.96Å; Y189-T192 VanDerWaalsContact O-OG1 3.08Å; T190-T192 VanDerWaalsContact C-N 3.26Å; T190-T192 PolarHBondContact O-N 3.19Å; T192-F602 HydrophobicContact CG2-CD1 3.95Å; T192-F602 HydrophobicContact CG2-CD2 3.97Å; T192-F602 HydrophobicContact CG2-CE1 3.48Å; T192-F602 VanDerWaalsContact CG2-CE1 3.48Å; T192-F602 HydrophobicContact CG2-CE2 3.49Å; T192-F602 VanDerWaalsContact CG2-CE2 3.49Å; T192-F602 HydrophobicContact CG2-CG 4.18Å; T192-F602 HydrophobicContact CG2-CZ 3.23Å
193	G	60.9	Low	74.7	Confident	7 Å²	7	26.9 Å²	26.9	7%	0.072	15%	0.154	C	C	.	.			trans	-96.2	142.4	-175.9	0	0	0	0	0	115.2	Y189	Y189-G193 PolarHBondContact O-N 3.4Å
194	G	68.6	Low	75	Confident	5 Å²	5	28.4 Å²	28.4	5%	0.052	16%	0.163	C	C	.	.			trans	-103.5	176.1	161.3	0	0	0	0	0	110.8	A196 A197 V198	G194-A196 PolarHBondContact O-N 3.49Å; G194-A197 WeakPolarHBondContact O-CB 3.37Å; G194-A197 PolarHBondContact O-N 3.25Å; G194-V198 PolarHBondContact O-N 3.1Å
195	L	71.7	Confident	75.5	Confident	1 Å²	1	25.8 Å²	25.8	1%	0.005	14%	0.139	C	C	.	.	H	α-helix	trans	-52.4	-37.4	-174.4	-179.7	67.4	0	0	0	112.9	F57 F58 A197 V198 I199 Q296	F57-L195 WeakPolarHBondContact O-CB 3.17Å; F57-L195 PolarHBondContact O-N 3.23Å; F58-L195 WeakPolarHBondContact O-CD2 3.33Å; L195-A197 PolarHBondContact O-N 2.9Å; L195-V198 WeakPolarHBondContact O-CB 3.32Å; L195-V198 PolarHBondContact O-N 3.22Å; L195-I199 HydrophobicContact CD1-CD1 4.2Å; L195-I199 HydrophobicContact CD1-CG1 4.29Å; L195-I199 HydrophobicContact CD2-CD1 4.21Å; L195-I199 HydrophobicContact CG-CD1 3.82Å; L195-I199 HydrophobicContact CG-CG1 4.33Å; L195-I199 WeakPolarHBondContact O-CG1 3.48Å; L195-I199 PolarHBondContact O-N 2.97Å; L195-Q296 HydrophobicContact CD2-CG 4.14Å
196	A	74.3	Confident	76.2	Confident	2 Å²	2	22.4 Å²	22.4	2%	0.017	12%	0.122	C	C	.	.	H	α-helix	trans	-61.7	-44.5	177.9	0	0	0	0	0	112.8	T49 A60 G194 V198 I199 Y200	T49-A196 HydrophobicContact CG2-CB 3.63Å; A60-A196 HydrophobicContact CB-CB 3.66Å; G194-A196 PolarHBondContact O-N 3.49Å; A196-V198 VanDerWaalsContact C-N 3.3Å; A196-V198 PolarHBondContact O-N 2.79Å; A196-I199 PolarHBondContact O-N 2.76Å; A196-Y200 WeakPolarHBondContact O-CD2 3.47Å; A196-Y200 PolarHBondContact O-N 2.72Å; A196-Y200 VanDerWaalsContact O-N 3.12Å
197	A	76.8	Confident	77	Confident	0 Å²	0	26.5 Å²	26.5	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-62.6	-42.5	178.2	0	0	0	0	0	110.3	A45 G194 L195 Y200 T201	A45-A197 HydrophobicContact CB-CB 4.39Å; G194-A197 WeakPolarHBondContact O-CB 3.37Å; G194-A197 PolarHBondContact O-N 3.25Å; L195-A197 PolarHBondContact O-N 2.9Å; A197-Y200 PolarHBondContact O-N 2.91Å; A197-T201 PolarHBondContact O-N 3.41Å; A197-T201 PolarHBondContact O-OG1 3.42Å
198	V	78.8	Confident	77.8	Confident	5 Å²	5	26.2 Å²	26.2	3%	0.03	14%	0.14	C	C	.	.	H	α-helix	trans	-57.3	-52.5	175.5	179.6	0	0	0	0	110.6	G194 L195 A196 Y200 T201 D202	G194-V198 PolarHBondContact O-N 3.1Å; L195-V198 WeakPolarHBondContact O-CB 3.32Å; L195-V198 PolarHBondContact O-N 3.22Å; A196-V198 VanDerWaalsContact C-N 3.3Å; A196-V198 PolarHBondContact O-N 2.79Å; V198-Y200 VanDerWaalsContact C-N 3.34Å; V198-Y200 PolarHBondContact O-N 3.45Å; V198-T201 PolarHBondContact O-N 3.2Å; V198-T201 PolarHBondContact O-OG1 2.9Å; V198-D202 WeakPolarHBondContact O-CB 3.37Å; V198-D202 PolarHBondContact O-N 3.24Å; V198-D202 VanDerWaalsContact O-OD1 3.06Å
199	I	84.4	Confident	78.8	Confident	0 Å²	0	21.4 Å²	21.4	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-60.7	-40.4	-178.1	-66.4	167.1	0	0	0	112.4	M64 P68 L195 A196 D202 T203	M64-I199 HydrophobicContact CE-CB 3.58Å; M64-I199 HydrophobicContact CE-CD1 3.89Å; M64-I199 HydrophobicContact CE-CG1 4.34Å; M64-I199 HydrophobicContact CE-CG2 3.21Å; M64-I199 HydrophobicContact CG-CD1 4.22Å; P68-I199 HydrophobicContact CB-CG2 3.61Å; P68-I199 WeakPolarHBondContact O-CG2 3.46Å; L195-I199 HydrophobicContact CD1-CD1 4.2Å; L195-I199 HydrophobicContact CD1-CG1 4.29Å; L195-I199 HydrophobicContact CD2-CD1 4.21Å; L195-I199 HydrophobicContact CG-CD1 3.82Å; L195-I199 HydrophobicContact CG-CG1 4.33Å; L195-I199 WeakPolarHBondContact O-CG1 3.48Å; L195-I199 PolarHBondContact O-N 2.97Å; A196-I199 PolarHBondContact O-N 2.76Å; I199-D202 PolarHBondContact O-N 2.91Å; I199-T203 PolarHBondContact O-N 3.41Å; I199-T203 PolarHBondContact O-OG1 3.08Å
200	Y	84.3	Confident	80.1	Confident	105 Å²	105	20.9 Å²	20.9	41%	0.412	11%	0.114	S	C	.	.	H	α-helix	trans	-68.9	-40.9	178.6	-79.2	-66.6	0	0	0	112.4	A45 M64 P68 A196 A197 V198 T203 L204	A45-Y200 HydrophobicContact CB-CD2 3.65Å; A45-Y200 HydrophobicContact CB-CE2 4.44Å; A45-Y200 HydrophobicContact CB-CG 4.23Å; M64-Y200 HydrophobicContact CE-CD2 4.3Å; M64-Y200 HydrophobicContact CE-CE2 3.91Å; M64-Y200 HydrophobicContact SD-CE2 4.38Å; P68-Y200 HydrophobicContact CG-CE1 4.48Å; A196-Y200 WeakPolarHBondContact O-CD2 3.47Å; A196-Y200 PolarHBondContact O-N 2.72Å; A196-Y200 VanDerWaalsContact O-N 3.12Å; A197-Y200 PolarHBondContact O-N 2.91Å; V198-Y200 VanDerWaalsContact C-N 3.34Å; V198-Y200 PolarHBondContact O-N 3.45Å; Y200-T203 WeakPolarHBondContact O-CB 3.37Å; Y200-T203 PolarHBondContact O-N 3.42Å; Y200-L204 PolarHBondContact O-N 2.89Å
201	T	84	Confident	81.3	Confident	6 Å²	6	23.4 Å²	23.4	4%	0.037	13%	0.129	C	C	.	.	H	α-helix	trans	-68.7	-36	175.3	51.3	0	0	0	0	112.5	V38 V41 Y189 A197 V198 T203 L204 Q205	V38-T201 HydrophobicContact CG1-CG2 4.03Å; V41-T201 HydrophobicContact CB-CG2 4.49Å; V41-T201 HydrophobicContact CG1-CG2 4.18Å; Y189-T201 VanDerWaalsContact OH-CB 3.3Å; Y189-T201 WeakPolarHBondContact OH-CB 3.49Å; Y189-T201 WeakPolarHBondContact OH-CG2 3.39Å; Y189-T201 PolarHBondContact OH-OG1 3.47Å; A197-T201 PolarHBondContact O-N 3.41Å; A197-T201 PolarHBondContact O-OG1 3.42Å; V198-T201 PolarHBondContact O-N 3.2Å; V198-T201 PolarHBondContact O-OG1 2.9Å; T201-T203 PolarHBondContact O-N 2.71Å; T201-L204 PolarHBondContact O-N 3.46Å; T201-Q205 VanDerWaalsContact O-CB 3.26Å; T201-Q205 WeakPolarHBondContact O-CB 3.37Å; T201-Q205 PolarHBondContact O-N 3.42Å
202	D	87.5	Confident	82.8	Confident	0 Å²	0	21.2 Å²	21.2	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-60	-38.1	173.2	-67	-6.4	0	0	0	111.2	S72 A75 V198 I199 Q205 T206 R297 S389	S72-D202 PolarHBondContact OG-OD2 3.02Å; A75-D202 HydrophobicContact CB-CB 3.88Å; V198-D202 WeakPolarHBondContact O-CB 3.37Å; V198-D202 PolarHBondContact O-N 3.24Å; V198-D202 VanDerWaalsContact O-OD1 3.06Å; I199-D202 PolarHBondContact O-N 2.91Å; D202-Q205 PolarHBondContact O-N 3.2Å; D202-T206 WeakPolarHBondContact O-CB 3.49Å; D202-T206 PolarHBondContact O-N 3.37Å; D202-T206 PolarHBondContact O-OG1 3.28Å; D202-R297 IonicContact OD2-NH2 2.65Å; D202-R297 PolarHBondContact OD2-NH2 2.7Å; D202-S389 VanDerWaalsContact CG-OG 3.29Å; D202-S389 WeakPolarHBondContact OD1-CB 3.36Å; D202-S389 PolarHBondContact OD1-OG 3.01Å
203	T	88.9	Confident	84.4	Confident	19 Å²	19	20.5 Å²	20.5	12%	0.117	11%	0.112	C	C	.	.	H	α-helix	trans	-63.3	-50.4	178.7	-54.6	0	0	0	0	111.1	L67 P68 A71 I199 Y200 T201 Q205 T206 V207	L67-T203 HydrophobicContact CD2-CG2 3.56Å; P68-T203 VanDerWaalsContact CA-OG1 3.25Å; P68-T203 WeakPolarHBondContact CA-OG1 3.34Å; P68-T203 WeakPolarHBondContact CB-OG1 3.29Å; A71-T203 HydrophobicContact CB-CG2 4.07Å; I199-T203 PolarHBondContact O-N 3.41Å; I199-T203 PolarHBondContact O-OG1 3.08Å; Y200-T203 WeakPolarHBondContact O-CB 3.37Å; Y200-T203 PolarHBondContact O-N 3.42Å; T201-T203 PolarHBondContact O-N 2.71Å; T203-Q205 VanDerWaalsContact C-N 3.35Å; T203-T206 PolarHBondContact O-N 3.32Å; T203-V207 PolarHBondContact O-N 3.17Å
204	L	87.9	Confident	86	Confident	49 Å²	49	24.5 Å²	24.5	26%	0.257	13%	0.128	S	C	.	.	H	α-helix	trans	-60	-48.1	176.5	175	67	0	0	0	110.7	V37 V38 V41 Y200 T201 T206 V207 I208	V37-L204 HydrophobicContact CG1-CD2 3.88Å; V38-L204 HydrophobicContact CG2-CD2 4.29Å; V41-L204 HydrophobicContact CG2-CD2 4.06Å; Y200-L204 PolarHBondContact O-N 2.89Å; T201-L204 PolarHBondContact O-N 3.46Å; L204-T206 VanDerWaalsContact C-N 3.32Å; L204-T206 PolarHBondContact O-N 2.84Å; L204-V207 PolarHBondContact O-N 2.99Å; L204-I208 HydrophobicContact CD1-CD1 3.86Å; L204-I208 HydrophobicContact CD1-CG1 4.33Å; L204-I208 HydrophobicContact CD2-CD1 4.43Å; L204-I208 HydrophobicContact CG-CD1 3.84Å; L204-I208 WeakPolarHBondContact O-CG1 3.5Å; L204-I208 PolarHBondContact O-N 3Å
205	Q	88.3	Confident	87.2	Confident	7 Å²	7	27.1 Å²	27.1	3%	0.033	14%	0.14	C	C	.	.	H	α-helix	trans	-60.3	-42.2	-178.7	-176.4	-167.2	-65.3	0	0	111.7	T201 D202 T203 V207 I208 M209 A385	T201-Q205 VanDerWaalsContact O-CB 3.26Å; T201-Q205 WeakPolarHBondContact O-CB 3.37Å; T201-Q205 PolarHBondContact O-N 3.42Å; D202-Q205 PolarHBondContact O-N 3.2Å; T203-Q205 VanDerWaalsContact C-N 3.35Å; Q205-V207 VanDerWaalsContact C-N 3.3Å; Q205-V207 PolarHBondContact O-N 2.69Å; Q205-I208 PolarHBondContact O-N 2.67Å; Q205-M209 WeakPolarHBondContact O-CB 3.1Å; Q205-M209 PolarHBondContact O-N 2.88Å; Q205-A385 HydrophobicContact CG-CB 4.17Å; Q205-A385 PolarHBondContact OE1-O 2.92Å
206	T	91.4	Very high	88.2	Confident	4 Å²	4	27.1 Å²	27.1	3%	0.025	14%	0.139	C	C	.	.	H	α-helix	trans	-55.6	-46.6	177.2	-62.1	0	0	0	0	111.3	A71 F74 D202 T203 L204 M209 L210 L317	A71-T206 HydrophobicContact CB-CG2 4.23Å; A71-T206 PolarHBondContact O-OG1 3.33Å; A71-T206 VanDerWaalsContact O-OG1 3.12Å; F74-T206 HydrophobicContact CD1-CG2 3.65Å; F74-T206 HydrophobicContact CE1-CG2 4.12Å; D202-T206 WeakPolarHBondContact O-CB 3.49Å; D202-T206 PolarHBondContact O-N 3.37Å; D202-T206 PolarHBondContact O-OG1 3.28Å; T203-T206 PolarHBondContact O-N 3.32Å; L204-T206 VanDerWaalsContact C-N 3.32Å; L204-T206 PolarHBondContact O-N 2.84Å; T206-M209 PolarHBondContact O-N 3.01Å; T206-L210 HydrophobicContact CG2-CD1 3.86Å; T206-L210 HydrophobicContact CG2-CG 4.36Å; T206-L210 WeakPolarHBondContact O-CB 3.38Å; T206-L210 VanDerWaalsContact O-CG 3.22Å; T206-L210 WeakPolarHBondContact O-CG 3.11Å; T206-L210 PolarHBondContact O-N 3.27Å; T206-L317 HydrophobicContact CG2-CD1 4Å
207	V	92.1	Very high	89.1	Confident	87 Å²	87	28.8 Å²	28.8	53%	0.527	15%	0.148	S	C	.	.	H	α-helix	trans	-62.8	-47.6	-179.5	175.3	0	0	0	0	111.3	T203 L204 Q205 M209 T211	T203-V207 PolarHBondContact O-N 3.17Å; L204-V207 PolarHBondContact O-N 2.99Å; Q205-V207 VanDerWaalsContact C-N 3.3Å; Q205-V207 PolarHBondContact O-N 2.69Å; V207-M209 VanDerWaalsContact C-N 3.33Å; V207-M209 PolarHBondContact O-N 3.11Å; V207-T211 WeakPolarHBondContact O-CB 3.42Å; V207-T211 PolarHBondContact O-N 2.69Å; V207-T211 VanDerWaalsContact O-N 3.07Å; V207-T211 PolarHBondContact O-OG1 3.22Å
208	I	90.4	Very high	89.9	Confident	34 Å²	34	30.8 Å²	30.8	17%	0.174	17%	0.168	C	C	.	.	H	α-helix	trans	-67.6	-38.9	-178.7	-54.1	171.4	0	0	0	110.2	Y34 L204 Q205 T211 G212 L378 V382	Y34-I208 HydrophobicContact CD2-CD1 4.13Å; Y34-I208 HydrophobicContact CE2-CD1 3.61Å; Y34-I208 HydrophobicContact CE2-CG2 4.24Å; L204-I208 HydrophobicContact CD1-CD1 3.86Å; L204-I208 HydrophobicContact CD1-CG1 4.33Å; L204-I208 HydrophobicContact CD2-CD1 4.43Å; L204-I208 HydrophobicContact CG-CD1 3.84Å; L204-I208 WeakPolarHBondContact O-CG1 3.5Å; L204-I208 PolarHBondContact O-N 3Å; Q205-I208 PolarHBondContact O-N 2.67Å; I208-T211 PolarHBondContact O-N 2.77Å; I208-G212 PolarHBondContact O-N 3.4Å; I208-L378 HydrophobicContact CG2-CD1 4.06Å; I208-L378 HydrophobicContact CG2-CG 4.35Å; I208-V382 HydrophobicContact CB-CG2 4.06Å; I208-V382 HydrophobicContact CG2-CG2 3.29Å
209	M	91.1	Very high	90.5	Very high	2 Å²	2	34.6 Å²	34.6	1%	0.01	19%	0.185	C	C	.	.	H	α-helix	trans	-62.7	-47.4	178.3	-175.3	176.1	74	0	0	113.2	F74 I78 F83 Q205 T206 V207 S213 V382	F74-M209 HydrophobicContact CD1-CE 3.99Å; F74-M209 HydrophobicContact CE1-CE 3.4Å; F74-M209 HydrophobicContact CZ-CE 4.29Å; I78-M209 HydrophobicContact CB-CE 4.04Å; I78-M209 HydrophobicContact CG2-CE 3.59Å; I78-M209 HydrophobicContact CG2-SD 4.06Å; F83-M209 HydrophobicContact CE2-CG 3.95Å; F83-M209 HydrophobicContact CE2-SD 3.54Å; F83-M209 VanDerWaalsContact CE2-SD 3.54Å; F83-M209 HydrophobicContact CZ-CG 3.55Å; F83-M209 HydrophobicContact CZ-SD 3.74Å; Q205-M209 WeakPolarHBondContact O-CB 3.1Å; Q205-M209 PolarHBondContact O-N 2.88Å; T206-M209 PolarHBondContact O-N 3.01Å; V207-M209 VanDerWaalsContact C-N 3.33Å; V207-M209 PolarHBondContact O-N 3.11Å; M209-S213 VanDerWaalsContact O-CB 3.32Å; M209-S213 WeakPolarHBondContact O-CB 3.11Å; M209-S213 PolarHBondContact O-N 3.06Å; M209-S213 PolarHBondContact O-OG 3.34Å; M209-V382 VanDerWaalsContact CA-CG1 3.45Å; M209-V382 HydrophobicContact CB-CG1 3.63Å; M209-V382 HydrophobicContact CG-CG1 3.85Å
210	L	93.3	Very high	90.8	Very high	22 Å²	22	34.6 Å²	34.6	12%	0.115	19%	0.185	C	C	.	.	H	α-helix	trans	-62.3	-47.7	175.8	-68.7	172.7	0	0	0	110.1	F74 T206 G212 S213 F214 L317 L320 L324	F74-L210 HydrophobicContact CE1-CD2 3.87Å; F74-L210 HydrophobicContact CE1-CG 4.33Å; F74-L210 HydrophobicContact CZ-CD2 3.92Å; T206-L210 HydrophobicContact CG2-CD1 3.86Å; T206-L210 HydrophobicContact CG2-CG 4.36Å; T206-L210 WeakPolarHBondContact O-CB 3.38Å; T206-L210 VanDerWaalsContact O-CG 3.22Å; T206-L210 WeakPolarHBondContact O-CG 3.11Å; T206-L210 PolarHBondContact O-N 3.27Å; L210-G212 PolarHBondContact O-N 3.2Å; L210-S213 PolarHBondContact O-N 2.79Å; L210-F214 HydrophobicContact CB-CE2 4.48Å; L210-F214 WeakPolarHBondContact O-CD2 3.46Å; L210-F214 PolarHBondContact O-N 2.68Å; L210-L317 HydrophobicContact CD1-CD2 3.56Å; L210-L320 HydrophobicContact CD1-CD1 4.42Å; L210-L320 HydrophobicContact CD2-CD1 3.73Å; L210-L324 HydrophobicContact CD2-CD1 3.74Å
211	T	92.9	Very high	91	Very high	73 Å²	73	32.7 Å²	32.7	45%	0.448	18%	0.178	S	C	.	.	H	α-helix	trans	-57.7	-50.8	-179.8	-55	0	0	0	0	111.4	V207 I208 S213 F214 I215	V207-T211 WeakPolarHBondContact O-CB 3.42Å; V207-T211 PolarHBondContact O-N 2.69Å; V207-T211 VanDerWaalsContact O-N 3.07Å; V207-T211 PolarHBondContact O-OG1 3.22Å; I208-T211 PolarHBondContact O-N 2.77Å; T211-S213 VanDerWaalsContact C-N 3.34Å; T211-S213 PolarHBondContact O-N 3.03Å; T211-F214 PolarHBondContact O-N 3.41Å; T211-I215 HydrophobicContact CG2-CD1 4.13Å; T211-I215 VanDerWaalsContact O-CG1 3.29Å; T211-I215 WeakPolarHBondContact O-CG1 3.36Å; T211-I215 PolarHBondContact O-N 3.29Å; T211-I215 VanDerWaalsContact O-N 3.09Å
212	G	91.8	Very high	91.3	Very high	1 Å²	1	36 Å²	36	1%	0.01	20%	0.202	C	C	.	.	H	α-helix	trans	-65.2	-36	179.6	0	0	0	0	0	113.4	I208 L210 I215 L216 M379	I208-G212 PolarHBondContact O-N 3.4Å; L210-G212 PolarHBondContact O-N 3.2Å; G212-I215 PolarHBondContact O-N 3.29Å; G212-L216 PolarHBondContact O-N 3.47Å; G212-M379 WeakPolarHBondContact CA-SD 3.29Å
213	S	93	Very high	91.4	Very high	1 Å²	1	40.1 Å²	40.1	1%	0.007	22%	0.22	C	C	.	.	H	α-helix	trans	-68.8	-38.6	175.7	-55.1	0	0	0	0	112.4	M209 L210 T211 I215 L216 M217 Y363	M209-S213 VanDerWaalsContact O-CB 3.32Å; M209-S213 WeakPolarHBondContact O-CB 3.11Å; M209-S213 PolarHBondContact O-N 3.06Å; M209-S213 PolarHBondContact O-OG 3.34Å; L210-S213 PolarHBondContact O-N 2.79Å; T211-S213 VanDerWaalsContact C-N 3.34Å; T211-S213 PolarHBondContact O-N 3.03Å; S213-I215 VanDerWaalsContact C-N 3.31Å; S213-I215 PolarHBondContact O-N 3.1Å; S213-L216 PolarHBondContact O-N 3.36Å; S213-M217 WeakPolarHBondContact O-CB 3.22Å; S213-M217 PolarHBondContact O-N 3.31Å; S213-Y363 PolarHBondContact OG-OH 3.02Å
214	F	94.6	Very high	91.2	Very high	92 Å²	92	39.4 Å²	39.4	40%	0.404	22%	0.215	S	C	.	.	H	α-helix	trans	-61.5	-41.9	173.3	-86	-68	0	0	0	111.5	L210 T211 M217 G218 L320 L324	L210-F214 HydrophobicContact CB-CE2 4.48Å; L210-F214 WeakPolarHBondContact O-CD2 3.46Å; L210-F214 PolarHBondContact O-N 2.68Å; T211-F214 PolarHBondContact O-N 3.41Å; F214-M217 HydrophobicContact CD1-CE 4.01Å; F214-M217 HydrophobicContact CE1-CE 4.41Å; F214-M217 PolarHBondContact O-N 3.39Å; F214-G218 PolarHBondContact O-N 3.01Å; F214-L320 HydrophobicContact CE2-CD1 4.34Å; F214-L320 HydrophobicContact CZ-CD1 4.29Å; F214-L320 HydrophobicContact CZ-CD2 3.98Å; F214-L324 HydrophobicContact CB-CD2 4.42Å; F214-L324 HydrophobicContact CD1-CD2 3.62Å; F214-L324 HydrophobicContact CD2-CD1 4.35Å; F214-L324 HydrophobicContact CD2-CD2 4.23Å; F214-L324 HydrophobicContact CE1-CD2 3.81Å; F214-L324 HydrophobicContact CE2-CD1 4.09Å; F214-L324 HydrophobicContact CE2-CD2 4.38Å; F214-L324 HydrophobicContact CG-CD2 3.82Å; F214-L324 HydrophobicContact CZ-CD1 4.29Å; F214-L324 HydrophobicContact CZ-CD2 4.18Å
215	I	93.8	Very high	90.8	Very high	60 Å²	60	40 Å²	40	31%	0.308	22%	0.224	S	C	.	.	H	α-helix	trans	-65.1	-44.5	177.6	-60.4	162.3	0	0	0	110.3	T211 G212 S213 M217 G218 F219 L375	T211-I215 HydrophobicContact CG2-CD1 4.13Å; T211-I215 VanDerWaalsContact O-CG1 3.29Å; T211-I215 WeakPolarHBondContact O-CG1 3.36Å; T211-I215 PolarHBondContact O-N 3.29Å; T211-I215 VanDerWaalsContact O-N 3.09Å; G212-I215 PolarHBondContact O-N 3.29Å; S213-I215 VanDerWaalsContact C-N 3.31Å; S213-I215 PolarHBondContact O-N 3.1Å; I215-M217 VanDerWaalsContact C-N 3.33Å; I215-M217 PolarHBondContact O-N 2.98Å; I215-G218 PolarHBondContact O-N 2.84Å; I215-F219 HydrophobicContact CG2-CD2 3.66Å; I215-F219 HydrophobicContact CG2-CE2 3.46Å; I215-F219 VanDerWaalsContact CG2-CE2 3.46Å; I215-F219 VanDerWaalsContact O-CD2 3.27Å; I215-F219 WeakPolarHBondContact O-CD2 3.42Å; I215-F219 PolarHBondContact O-N 3.03Å; I215-L375 HydrophobicContact CB-CD2 4.22Å; I215-L375 HydrophobicContact CD1-CD1 3.96Å; I215-L375 HydrophobicContact CD1-CD2 4.5Å; I215-L375 HydrophobicContact CG2-CD2 3.33Å
216	L	93.1	Very high	90.3	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-57.5	-47.8	175.7	-176.1	55.3	0	0	0	111.7	G212 S213 G218 F219 A220 Y363 M366 V367 M371	G212-L216 PolarHBondContact O-N 3.47Å; S213-L216 PolarHBondContact O-N 3.36Å; L216-G218 VanDerWaalsContact C-N 3.3Å; L216-G218 PolarHBondContact O-N 3.42Å; L216-F219 PolarHBondContact O-N 2.93Å; L216-A220 WeakPolarHBondContact O-CB 3.31Å; L216-A220 PolarHBondContact O-N 2.97Å; L216-Y363 HydrophobicContact CD2-CD1 4.39Å; L216-Y363 HydrophobicContact CD2-CD2 4.36Å; L216-Y363 HydrophobicContact CD2-CE1 3.74Å; L216-Y363 HydrophobicContact CD2-CE2 3.71Å; L216-Y363 WeakPolarHBondContact CD2-OH 3.29Å; L216-M366 HydrophobicContact CD1-CB 4.14Å; L216-M366 HydrophobicContact CD2-CB 4.48Å; L216-M366 HydrophobicContact CD2-CE 4.38Å; L216-V367 HydrophobicContact CD2-CG2 3.83Å; L216-M371 HydrophobicContact CB-CE 3.37Å; L216-M371 HydrophobicContact CD1-CE 3.42Å; L216-M371 VanDerWaalsContact CD1-CE 3.42Å; L216-M371 HydrophobicContact CD1-CG 4.2Å; L216-M371 HydrophobicContact CD2-CE 3.9Å; L216-M371 HydrophobicContact CG-CE 3.68Å
217	M	93.2	Very high	89.3	Confident	38 Å²	38	49.1 Å²	49.1	19%	0.187	28%	0.275	C	S	.	.	H	α-helix	trans	-55.2	-48.3	178.3	-176	-176.8	77.8	0	0	110.2	S213 F214 I215 F219 A220 F221 F323 L324 P328	S213-M217 WeakPolarHBondContact O-CB 3.22Å; S213-M217 PolarHBondContact O-N 3.31Å; F214-M217 HydrophobicContact CD1-CE 4.01Å; F214-M217 HydrophobicContact CE1-CE 4.41Å; F214-M217 PolarHBondContact O-N 3.39Å; I215-M217 VanDerWaalsContact C-N 3.33Å; I215-M217 PolarHBondContact O-N 2.98Å; M217-F219 PolarHBondContact O-N 3.4Å; M217-A220 WeakPolarHBondContact O-CB 3.48Å; M217-A220 PolarHBondContact O-N 3.32Å; M217-F221 HydrophobicContact CG-CD2 3.71Å; M217-F221 HydrophobicContact CG-CE2 3.65Å; M217-F221 VanDerWaalsContact O-CD2 3.29Å; M217-F221 WeakPolarHBondContact O-CD2 3.43Å; M217-F221 PolarHBondContact O-N 3.29Å; M217-F221 HydrophobicContact SD-CE2 4.33Å; M217-F323 HydrophobicContact SD-CB 3.73Å; M217-L324 HydrophobicContact SD-CD2 4.11Å; M217-P328 HydrophobicContact CB-CG 4.43Å; M217-P328 HydrophobicContact CG-CG 4.5Å
218	G	92.4	Very high	88	Confident	42 Å²	42	48.9 Å²	48.9	43%	0.433	27%	0.267	S	S	.	.	H	α-helix	trans	-56.4	-45.5	176.2	0	0	0	0	0	113.5	F214 I215 L216 S222	F214-G218 PolarHBondContact O-N 3.01Å; I215-G218 PolarHBondContact O-N 2.84Å; L216-G218 VanDerWaalsContact C-N 3.3Å; L216-G218 PolarHBondContact O-N 3.42Å; G218-S222 WeakPolarHBondContact O-CB 3.35Å; G218-S222 PolarHBondContact O-N 3.26Å
219	F	92.1	Very high	86.5	Confident	85 Å²	85	57 Å²	57	37%	0.373	30%	0.297	S	S	.	.	H	α-helix	trans	-65.2	-41	175.7	-81.1	-69.4	0	0	0	112.8	I215 L216 M217 S222 K223 P372 L375	I215-F219 HydrophobicContact CG2-CD2 3.66Å; I215-F219 HydrophobicContact CG2-CE2 3.46Å; I215-F219 VanDerWaalsContact CG2-CE2 3.46Å; I215-F219 VanDerWaalsContact O-CD2 3.27Å; I215-F219 WeakPolarHBondContact O-CD2 3.42Å; I215-F219 PolarHBondContact O-N 3.03Å; L216-F219 PolarHBondContact O-N 2.93Å; M217-F219 PolarHBondContact O-N 3.4Å; F219-S222 PolarHBondContact O-N 3.13Å; F219-K223 WeakPolarHBondContact O-CB 3.33Å; F219-K223 PolarHBondContact O-N 3.39Å; F219-P372 HydrophobicContact CZ-CG 4.27Å; F219-L375 HydrophobicContact CE2-CD2 4.01Å
220	A	90.9	Very high	84.9	Confident	0 Å²	0	65.9 Å²	65.9	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-61.2	-47.8	179.2	0	0	0	0	0	111.5	L216 M217 K223 I224 I331 M366 L370	L216-A220 WeakPolarHBondContact O-CB 3.31Å; L216-A220 PolarHBondContact O-N 2.97Å; M217-A220 WeakPolarHBondContact O-CB 3.48Å; M217-A220 PolarHBondContact O-N 3.32Å; A220-K223 PolarHBondContact O-N 2.75Å; A220-I224 PolarHBondContact O-N 3.09Å; A220-I331 HydrophobicContact CB-CD1 4.09Å; A220-I331 HydrophobicContact CB-CG2 3.78Å; A220-M366 HydrophobicContact CB-SD 4.38Å; A220-L370 HydrophobicContact CB-CD1 4.33Å
221	F	89.1	Confident	83.6	Confident	64 Å²	64	69.5 Å²	69.5	28%	0.281	35%	0.354	S	S	.	.	H	α-helix	trans	-64.5	-43.5	175.4	-84	-80.1	0	0	0	112.4	M217 K223 I224 S225 Q233 F327 I331	M217-F221 HydrophobicContact CG-CD2 3.71Å; M217-F221 HydrophobicContact CG-CE2 3.65Å; M217-F221 VanDerWaalsContact O-CD2 3.29Å; M217-F221 WeakPolarHBondContact O-CD2 3.43Å; M217-F221 PolarHBondContact O-N 3.29Å; M217-F221 HydrophobicContact SD-CE2 4.33Å; F221-K223 VanDerWaalsContact C-N 3.31Å; F221-K223 PolarHBondContact O-N 3.07Å; F221-I224 PolarHBondContact O-N 2.9Å; F221-S225 WeakPolarHBondContact O-CB 3.36Å; F221-S225 PolarHBondContact O-N 3.48Å; F221-Q233 VanDerWaalsContact CD1-NE2 3.31Å; F221-F327 HydrophobicContact CE2-CB 4.49Å; F221-F327 HydrophobicContact CZ-CB 4.33Å; F221-I331 HydrophobicContact CD1-CD1 4.28Å; F221-I331 HydrophobicContact CD2-CD1 4Å; F221-I331 HydrophobicContact CE1-CD1 4.13Å; F221-I331 HydrophobicContact CE2-CD1 3.87Å; F221-I331 HydrophobicContact CG-CD1 4.19Å; F221-I331 HydrophobicContact CZ-CD1 3.92Å
222	S	89.9	Confident	82.7	Confident	76 Å²	76	71.8 Å²	71.8	53%	0.531	36%	0.364	S	S	.	.	H	α-helix	trans	-61.7	-39.1	177.6	178.1	0	0	0	0	112.2	G218 F219 S225 S226	G218-S222 WeakPolarHBondContact O-CB 3.35Å; G218-S222 PolarHBondContact O-N 3.26Å; F219-S222 PolarHBondContact O-N 3.13Å; S222-S225 PolarHBondContact O-N 3.47Å; S222-S226 WeakPolarHBondContact O-CB 3.44Å; S222-S226 PolarHBondContact O-N 3.33Å; S222-S226 PolarHBondContact O-OG 2.84Å
223	K	88.3	Confident	81.8	Confident	87 Å²	87	75.9 Å²	75.9	38%	0.378	38%	0.383	S	S	.	.	H	α-helix	trans	-64.9	-48	179.9	-173.8	66	175.8	-178.8	0	111.4	F219 A220 F221 S226 Q227 L335 L370	F219-K223 WeakPolarHBondContact O-CB 3.33Å; F219-K223 PolarHBondContact O-N 3.39Å; A220-K223 PolarHBondContact O-N 2.75Å; F221-K223 VanDerWaalsContact C-N 3.31Å; F221-K223 PolarHBondContact O-N 3.07Å; K223-S226 PolarHBondContact O-N 3.44Å; K223-S226 PolarHBondContact O-OG 3.24Å; K223-Q227 PolarHBondContact O-N 3.44Å; K223-L335 HydrophobicContact CB-CD1 4.45Å; K223-L335 HydrophobicContact CG-CD1 4.17Å; K223-L335 HydrophobicContact CG-CD2 3.89Å; K223-L370 HydrophobicContact CB-CD2 4.25Å; K223-L370 HydrophobicContact CD-CD2 4.32Å; K223-L370 HydrophobicContact CG-CD2 3.89Å
224	I	84.8	Confident	81.2	Confident	4 Å²	4	81.1 Å²	81.1	2%	0.021	41%	0.407	C	S	.	.	H	α-helix	trans	-58.8	-50.4	176.1	-73.3	-179.8	0	0	0	110.9	A220 F221 S226 Q227 K228 L236 I331 I334 L335	A220-I224 PolarHBondContact O-N 3.09Å; F221-I224 PolarHBondContact O-N 2.9Å; I224-S226 PolarHBondContact O-N 2.89Å; I224-Q227 PolarHBondContact O-N 3.18Å; I224-Q227 VanDerWaalsContact O-N 3.14Å; I224-K228 PolarHBondContact O-N 3.02Å; I224-L236 HydrophobicContact CG2-CD1 3.38Å; I224-I331 HydrophobicContact CD1-CB 3.72Å; I224-I331 HydrophobicContact CD1-CD1 4.09Å; I224-I331 HydrophobicContact CD1-CG1 3.47Å; I224-I331 VanDerWaalsContact CD1-CG1 3.47Å; I224-I331 HydrophobicContact CD1-CG2 3.31Å; I224-I331 HydrophobicContact CG1-CG2 3.93Å; I224-I334 HydrophobicContact CD1-CB 4.39Å; I224-I334 HydrophobicContact CD1-CD1 3.97Å; I224-I334 HydrophobicContact CD1-CG2 4.35Å; I224-L335 HydrophobicContact CG1-CD2 3.96Å; I224-L335 HydrophobicContact CG1-CG 4.25Å
225	S	80.8	Confident	80.6	Confident	62 Å²	62	80.6 Å²	80.6	43%	0.434	41%	0.409	S	S	.	.	H	α-helix	trans	-59.7	-34.6	-179.1	179.8	0	0	0	0	112	F221 S222 Y229	F221-S225 WeakPolarHBondContact O-CB 3.36Å; F221-S225 PolarHBondContact O-N 3.48Å; S222-S225 PolarHBondContact O-N 3.47Å; S225-Y229 WeakPolarHBondContact O-CA 3.24Å; S225-Y229 PolarHBondContact O-N 3.39Å
226	S	76.6	Confident	80.2	Confident	81 Å²	81	77.9 Å²	77.9	57%	0.566	40%	0.395	S	S	*	.	H	α-helix	trans	-73.5	-34.9	176.5	73.2	0	0	0	0	114.3	S222 K223 I224	S222-S226 WeakPolarHBondContact O-CB 3.44Å; S222-S226 PolarHBondContact O-N 3.33Å; S222-S226 PolarHBondContact O-OG 2.84Å; K223-S226 PolarHBondContact O-N 3.44Å; K223-S226 PolarHBondContact O-OG 3.24Å; I224-S226 PolarHBondContact O-N 2.89Å
227	Q	71	Confident	79.9	Confident	121 Å²	121	78 Å²	78	57%	0.565	40%	0.395	S	S	*	.	H	α-helix	trans	-82	-31	-176.4	-101.8	176.8	-51.3	0	0	112.8	K223 I224	K223-Q227 PolarHBondContact O-N 3.44Å; I224-Q227 PolarHBondContact O-N 3.18Å; I224-Q227 VanDerWaalsContact O-N 3.14Å
228	K	65.8	Low	79.7	Confident	82 Å²	82	79.9 Å²	79.9	36%	0.357	40%	0.4	S	S	.	.			trans	-140.1	66.1	-174.7	-69.1	-168.3	165.5	-153.8	0	110.5	I224 Q230 E231 L236	I224-K228 PolarHBondContact O-N 3.02Å; K228-Q230 PolarHBondContact O-N 2.87Å; K228-E231 WeakPolarHBondContact CD-OE2 3.37Å; K228-E231 IonicContact NZ-OE2 3.23Å; K228-E231 PolarHBondContact NZ-OE2 2.88Å; K228-L236 HydrophobicContact CB-CD1 3.99Å; K228-L236 HydrophobicContact CB-CD2 4.08Å; K228-L236 HydrophobicContact CD-CD1 4.06Å; K228-L236 HydrophobicContact CD-CD2 3.15Å; K228-L236 HydrophobicContact CD-CG 4.2Å; K228-L236 HydrophobicContact CG-CD2 4.28Å
229	Y	57.3	Low	79.5	Confident	204 Å²	204	81.9 Å²	81.9	80%	0.8	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-17.4	-173.6	-174.2	-102.7	0	0	0	114.8	S225	S225-Y229 WeakPolarHBondContact O-CA 3.24Å; S225-Y229 PolarHBondContact O-N 3.39Å
230	Q	58.2	Low	79.3	Confident	189 Å²	189	78 Å²	78	88%	0.883	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.1	-0.8	-167.8	-159.7	152.6	11.2	0	0	114.6	K228	K228-Q230 PolarHBondContact O-N 2.87Å
231	E	65.4	Low	79.3	Confident	98 Å²	98	80.8 Å²	80.8	46%	0.458	40%	0.402	S	S	.	.	S	Bend	trans	-108.8	139	179.7	-74.2	175.8	-168.8	0	0	110.1	K228 L236	K228-E231 WeakPolarHBondContact CD-OE2 3.37Å; K228-E231 IonicContact NZ-OE2 3.23Å; K228-E231 PolarHBondContact NZ-OE2 2.88Å; E231-L236 HydrophobicContact CB-CD2 3.51Å; E231-L236 HydrophobicContact CB-CG 4.27Å; E231-L236 HydrophobicContact CG-CD2 4.27Å; E231-L236 WeakPolarHBondContact OE2-CD2 3.09Å
232	D	74.3	Confident	79.3	Confident	121 Å²	121	78 Å²	78	65%	0.647	39%	0.391	S	S	*	.			trans	-63.1	136.7	173.7	-78.4	-26.5	0	0	0	109.8	Q234 D235 L236	D232-Q234 PolarHBondContact O-N 3.44Å; D232-D235 WeakPolarHBondContact O-CB 3.47Å; D232-D235 PolarHBondContact O-N 3.1Å; D232-L236 PolarHBondContact O-N 3.44Å
233	Q	72.4	Confident	79.2	Confident	86 Å²	86	79.1 Å²	79.1	40%	0.402	40%	0.398	S	S	.	.	H	α-helix	trans	-58.6	-26.5	-173.9	-59.1	-168.1	-70.4	0	0	113.5	F221 L236 Y237	F221-Q233 VanDerWaalsContact CD1-NE2 3.31Å; Q233-L236 WeakPolarHBondContact O-CB 3.42Å; Q233-Y237 PolarHBondContact O-N 3.38Å
234	Q	80.1	Confident	79	Confident	111 Å²	111	78.3 Å²	78.3	52%	0.519	40%	0.4	S	S	.	.	H	α-helix	trans	-71	-39.6	176.2	-64.5	-176.9	2.1	0	0	111.6	D232 L236 Y237 W238 F260	D232-Q234 PolarHBondContact O-N 3.44Å; Q234-L236 PolarHBondContact O-N 3.35Å; Q234-Y237 WeakPolarHBondContact O-CB 3.36Å; Q234-Y237 PolarHBondContact O-N 3.3Å; Q234-Y237 VanDerWaalsContact O-N 3.09Å; Q234-W238 PolarHBondContact O-N 2.8Å; Q234-F260 HydrophobicContact CB-CE2 4.08Å; Q234-F260 HydrophobicContact CB-CZ 4.19Å; Q234-F260 HydrophobicContact CG-CD1 4.43Å; Q234-F260 HydrophobicContact CG-CD2 4.47Å; Q234-F260 HydrophobicContact CG-CE1 4.08Å; Q234-F260 HydrophobicContact CG-CE2 4.12Å; Q234-F260 HydrophobicContact CG-CZ 3.91Å
235	D	82.4	Confident	78.8	Confident	82 Å²	82	80 Å²	80	44%	0.439	41%	0.411	S	S	.	.	H	α-helix	trans	-65.7	-32.1	176.9	-64.2	-21.2	0	0	0	111.5	D232 Y237 W238 T239	D232-D235 WeakPolarHBondContact O-CB 3.47Å; D232-D235 PolarHBondContact O-N 3.1Å; D235-Y237 VanDerWaalsContact C-N 3.29Å; D235-Y237 PolarHBondContact O-N 3.34Å; D235-W238 PolarHBondContact O-N 3.43Å; D235-T239 PolarHBondContact O-N 3.28Å; D235-T239 VanDerWaalsContact O-N 3.09Å; D235-T239 PolarHBondContact O-OG1 3.21Å
236	L	85.7	Confident	78.7	Confident	3 Å²	3	79.3 Å²	79.3	2%	0.016	41%	0.414	C	S	.	.	H	α-helix	trans	-62.2	-38.9	173.1	-57.1	-170	0	0	0	112.6	I224 K228 E231 D232 Q233 Q234 T239 A240 I334	I224-L236 HydrophobicContact CG2-CD1 3.38Å; K228-L236 HydrophobicContact CB-CD1 3.99Å; K228-L236 HydrophobicContact CB-CD2 4.08Å; K228-L236 HydrophobicContact CD-CD1 4.06Å; K228-L236 HydrophobicContact CD-CD2 3.15Å; K228-L236 HydrophobicContact CD-CG 4.2Å; K228-L236 HydrophobicContact CG-CD2 4.28Å; E231-L236 HydrophobicContact CB-CD2 3.51Å; E231-L236 HydrophobicContact CB-CG 4.27Å; E231-L236 HydrophobicContact CG-CD2 4.27Å; E231-L236 WeakPolarHBondContact OE2-CD2 3.09Å; D232-L236 PolarHBondContact O-N 3.44Å; Q233-L236 WeakPolarHBondContact O-CB 3.42Å; Q234-L236 PolarHBondContact O-N 3.35Å; L236-T239 PolarHBondContact O-N 2.83Å; L236-T239 PolarHBondContact O-OG1 3.36Å; L236-A240 PolarHBondContact O-N 3.28Å; L236-I334 HydrophobicContact CB-CD1 3.96Å; L236-I334 HydrophobicContact CB-CG1 4.36Å; L236-I334 HydrophobicContact CB-CG2 3.88Å
237	Y	87.6	Confident	78.9	Confident	1 Å²	1	83.9 Å²	83.9	0%	0.004	43%	0.432	C	S	.	.	H	α-helix	trans	-66.5	-42.5	177	-172.9	-102.4	0	0	0	110.6	A91 Q233 Q234 D235 T239 A240 P255 A259 F260 M330 R333 I334	A91-Y237 PolarHBondContact O-OH 2.84Å; Q233-Y237 PolarHBondContact O-N 3.38Å; Q234-Y237 WeakPolarHBondContact O-CB 3.36Å; Q234-Y237 PolarHBondContact O-N 3.3Å; Q234-Y237 VanDerWaalsContact O-N 3.09Å; D235-Y237 VanDerWaalsContact C-N 3.29Å; D235-Y237 PolarHBondContact O-N 3.34Å; Y237-T239 VanDerWaalsContact C-N 3.28Å; Y237-T239 PolarHBondContact O-N 3.03Å; Y237-A240 WeakPolarHBondContact O-CB 3.44Å; Y237-A240 PolarHBondContact O-N 3.44Å; Y237-A240 VanDerWaalsContact O-N 3.17Å; Y237-P255 HydrophobicContact CD1-CB 3.89Å; Y237-P255 HydrophobicContact CD1-CG 4.4Å; Y237-P255 HydrophobicContact CE1-CB 3.36Å; Y237-P255 HydrophobicContact CE1-CG 4.28Å; Y237-P255 WeakPolarHBondContact O-CG 3.4Å; Y237-A259 HydrophobicContact CD1-CB 4.32Å; Y237-A259 HydrophobicContact CE1-CB 3.54Å; Y237-F260 AromaticContact CD1-CE2 3.77Å; Y237-F260 HydrophobicContact CD1-CE2 3.77Å; Y237-F260 HydrophobicContact CD1-CZ 4.17Å; Y237-F260 HydrophobicContact CG-CE2 4.13Å; Y237-F260 HydrophobicContact CG-CZ 4.12Å; Y237-M330 HydrophobicContact CD1-CE 4.05Å; Y237-M330 HydrophobicContact CD2-CB 4.02Å; Y237-M330 HydrophobicContact CD2-CE 3.97Å; Y237-M330 HydrophobicContact CE1-CE 3.95Å; Y237-M330 HydrophobicContact CE2-CB 3.82Å; Y237-M330 HydrophobicContact CE2-CE 3.87Å; Y237-M330 HydrophobicContact CE2-CG 4.02Å; Y237-M330 HydrophobicContact CG-CE 4.06Å; Y237-R333 HydrophobicContact CE2-CB 4.46Å; Y237-I334 HydrophobicContact CD2-CD1 4.39Å; Y237-I334 HydrophobicContact CD2-CG1 4.23Å
238	W	88.4	Confident	79.4	Confident	78 Å²	78	79.2 Å²	79.2	30%	0.295	41%	0.411	S	S	.	.	H	α-helix	trans	-64.4	-29.1	177.9	-62.1	145	0	0	0	114.9	Q234 D235 P255 R256 A259 F260	Q234-W238 PolarHBondContact O-N 2.8Å; D235-W238 PolarHBondContact O-N 3.43Å; W238-P255 HydrophobicContact CE3-CB 3.8Å; W238-P255 HydrophobicContact CE3-CG 4.12Å; W238-P255 HydrophobicContact CZ3-CB 3.83Å; W238-R256 WeakPolarHBondContact CH2-O 3.4Å; W238-R256 WeakPolarHBondContact CZ3-O 3.34Å; W238-A259 HydrophobicContact CH2-CB 3.32Å; W238-A259 HydrophobicContact CZ3-CB 3.57Å; W238-F260 AromaticContact CH2-CD2 3.83Å; W238-F260 HydrophobicContact CH2-CD2 3.83Å; W238-F260 HydrophobicContact CH2-CE2 4.14Å; W238-F260 AromaticContact CZ2-CD2 3.53Å; W238-F260 HydrophobicContact CZ2-CD2 3.53Å; W238-F260 AromaticContact CZ2-CE2 3.9Å; W238-F260 HydrophobicContact CZ2-CE2 3.9Å
239	T	88.6	Confident	80.3	Confident	84 Å²	84	78.4 Å²	78.4	52%	0.515	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.8	0.3	178	54.7	0	0	0	0	113.5	D235 L236 Y237 I241	D235-T239 PolarHBondContact O-N 3.28Å; D235-T239 VanDerWaalsContact O-N 3.09Å; D235-T239 PolarHBondContact O-OG1 3.21Å; L236-T239 PolarHBondContact O-N 2.83Å; L236-T239 PolarHBondContact O-OG1 3.36Å; Y237-T239 VanDerWaalsContact C-N 3.28Å; Y237-T239 PolarHBondContact O-N 3.03Å; T239-I241 VanDerWaalsContact C-N 3.29Å; T239-I241 PolarHBondContact O-N 3.21Å
240	A	88.2	Confident	81.5	Confident	5 Å²	5	70.3 Å²	70.3	4%	0.041	39%	0.391	C	S	.	.			trans	-79.6	71.2	-178.2	0	0	0	0	0	112.7	L236 Y237 R333 I334	L236-A240 PolarHBondContact O-N 3.28Å; Y237-A240 WeakPolarHBondContact O-CB 3.44Å; Y237-A240 PolarHBondContact O-N 3.44Å; Y237-A240 VanDerWaalsContact O-N 3.17Å; A240-R333 HydrophobicContact CB-CG 3.88Å; A240-R333 PolarHBondContact O-NE 2.97Å; A240-I334 HydrophobicContact CB-CG1 4.26Å
241	I	89.4	Confident	82.7	Confident	57 Å²	57	69.6 Å²	69.6	29%	0.292	39%	0.387	S	S	.	.			trans	-110.4	137.5	-178.5	-66.4	166.9	0	0	0	109.5	T239 T245 Y253 Q254	T239-I241 VanDerWaalsContact C-N 3.29Å; T239-I241 PolarHBondContact O-N 3.21Å; I241-T245 HydrophobicContact CG2-CG2 4.39Å; I241-Y253 HydrophobicContact CG1-CD2 4.46Å; I241-Y253 HydrophobicContact CG2-CD2 3.56Å; I241-Y253 HydrophobicContact CG2-CE2 3.88Å; I241-Q254 HydrophobicContact CD1-CG 3.92Å; I241-Q254 HydrophobicContact CG1-CG 4.3Å
242	P	89.2	Confident	83.5	Confident	6 Å²	6	66.9 Å²	66.9	4%	0.039	38%	0.379	C	S	.	.			trans	-64.8	146.6	173.6	30.5	-40.1	0	0	0	111.9	V244 T245 A341 V343	P242-V244 VanDerWaalsContact C-N 3.28Å; P242-V244 PolarHBondContact O-N 3.37Å; P242-T245 HydrophobicContact CG-CG2 4.28Å; P242-T245 WeakPolarHBondContact O-CG2 3.44Å; P242-A341 VanDerWaalsContact CG-O 3.29Å; P242-A341 WeakPolarHBondContact CG-O 3.49Å; P242-V343 HydrophobicContact CG-CG2 4.43Å
243	S	87.9	Confident	84	Confident	99 Å²	99	63 Å²	63	69%	0.692	36%	0.355	S	S	*	.	S	Bend	trans	-68.7	-27.8	178.4	-48.8	0	0	0	0	112.7	D338	S243-D338 VanDerWaalsContact CB-OD1 3.27Å; S243-D338 WeakPolarHBondContact CB-OD1 3.5Å; S243-D338 PolarHBondContact N-OD1 3.01Å; S243-D338 PolarHBondContact OG-OD1 2.88Å
244	V	84.9	Confident	84.8	Confident	70 Å²	70	63.4 Å²	63.4	42%	0.424	36%	0.357	S	S	.	.			trans	-111.3	105.1	179.5	-176.7	0	0	0	0	109	P242 D344 Q347	P242-V244 VanDerWaalsContact C-N 3.28Å; P242-V244 PolarHBondContact O-N 3.37Å; V244-D344 HydrophobicContact CG1-CB 4.24Å; V244-Q347 HydrophobicContact CG1-CG 4.4Å
245	T	81.6	Confident	85.3	Confident	40 Å²	40	58.7 Å²	58.7	25%	0.245	34%	0.336	C	S	.	.			trans	-105.4	-15.1	-177.5	55.3	0	0	0	0	113.8	I241 P242 I248 Y253	I241-T245 HydrophobicContact CG2-CG2 4.39Å; P242-T245 HydrophobicContact CG-CG2 4.28Å; P242-T245 WeakPolarHBondContact O-CG2 3.44Å; T245-I248 WeakPolarHBondContact O-CB 3.39Å; T245-Y253 HydrophobicContact CG2-CD1 3.81Å; T245-Y253 HydrophobicContact CG2-CD2 3.91Å; T245-Y253 HydrophobicContact CG2-CE1 3.79Å; T245-Y253 HydrophobicContact CG2-CE2 3.9Å; T245-Y253 HydrophobicContact CG2-CG 3.86Å
246	G	77.6	Confident	85.6	Confident	47 Å²	47	58.2 Å²	58.2	49%	0.485	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.5	-157.2	-176.6	0	0	0	0	0	113.2	I248	G246-I248 VanDerWaalsContact C-N 3.28Å; G246-I248 PolarHBondContact O-N 3.07Å
247	N	79.9	Confident	85.7	Confident	177 Å²	177	63.2 Å²	63.2	95%	0.947	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.9	55	173.2	-169.7	26.3	0	0	0	110.9
248	I	82.9	Confident	85.9	Confident	24 Å²	24	64.5 Å²	64.5	12%	0.123	37%	0.37	C	S	.	.			trans	-116.6	145.5	-176.1	-57.8	174.9	0	0	0	109	T245 G246 C252 V343 C508 V509	T245-I248 WeakPolarHBondContact O-CB 3.39Å; G246-I248 VanDerWaalsContact C-N 3.28Å; G246-I248 PolarHBondContact O-N 3.07Å; I248-C252 HydrophobicContact CG2-CB 3.78Å; I248-V343 HydrophobicContact CD1-CB 3.9Å; I248-V343 HydrophobicContact CD1-CG2 4.03Å; I248-V343 WeakPolarHBondContact CD1-O 3.24Å; I248-C508 HydrophobicContact CG2-CB 3.94Å; I248-V509 HydrophobicContact CD1-CG2 4.16Å
249	S	83.2	Confident	86	Confident	64 Å²	64	60.8 Å²	60.8	45%	0.448	36%	0.356	S	S	.	.			trans	-55.5	143.1	178.2	-177.3	0	0	0	0	112.1	E251 C252 Y253	S249-E251 PolarHBondContact O-N 3.4Å; S249-C252 WeakPolarHBondContact O-CB 3.32Å; S249-C252 PolarHBondContact O-N 2.79Å; S249-C252 VanDerWaalsContact O-N 3.13Å; S249-Y253 WeakPolarHBondContact O-CD1 3.17Å
250	A	83.8	Confident	86.1	Confident	35 Å²	35	58.9 Å²	58.9	29%	0.289	34%	0.341	S	S	.	.	H	α-helix	trans	-57.5	-33.2	177.5	0	0	0	0	0	113.2	C252 Y253 Q254	A250-C252 PolarHBondContact O-N 2.95Å; A250-C252 VanDerWaalsContact O-N 3.13Å; A250-Y253 VanDerWaalsContact CA-CE1 3.43Å; A250-Y253 VanDerWaalsContact CA-CZ 3.5Å; A250-Y253 HydrophobicContact CB-CE1 4.33Å; A250-Y253 HydrophobicContact CB-CE2 4.5Å; A250-Y253 PolarHBondContact O-N 3.5Å; A250-Q254 VanDerWaalsContact O-CB 3.29Å; A250-Q254 WeakPolarHBondContact O-CB 3.28Å; A250-Q254 VanDerWaalsContact O-CG 3.3Å; A250-Q254 WeakPolarHBondContact O-CG 3.44Å; A250-Q254 PolarHBondContact O-N 2.74Å
251	E	83.1	Confident	86.3	Confident	173 Å²	173	63.3 Å²	63.3	81%	0.808	36%	0.36	S	S	*	.	H	α-helix	trans	-60.4	-23.9	179.5	-63.7	175.2	173.1	0	0	113.3	S249	S249-E251 PolarHBondContact O-N 3.4Å
252	C	81.8	Confident	86.3	Confident	42 Å²	42	60.6 Å²	60.6	28%	0.284	35%	0.347	S	S	.	.	H	α-helix	trans	-83.7	-29.7	-176.2	-75.3	0	0	0	0	114	I248 S249 A250 V343 C508	I248-C252 HydrophobicContact CG2-CB 3.78Å; S249-C252 WeakPolarHBondContact O-CB 3.32Å; S249-C252 PolarHBondContact O-N 2.79Å; S249-C252 VanDerWaalsContact O-N 3.13Å; A250-C252 PolarHBondContact O-N 2.95Å; A250-C252 VanDerWaalsContact O-N 3.13Å; C252-V343 HydrophobicContact CB-CG1 4.4Å; C252-C508 HydrophobicContact CB-CB 3.7Å; C252-C508 WeakPolarHBondContact CB-SG 3.49Å; C252-C508 WeakPolarHBondContact SG-CB 3.02Å; C252-C508 CovalentContact SG-SG 2.02Å; C252-C508 PolarHBondContact SG-SG 3.01Å
253	Y	85	Confident	86.5	Confident	39 Å²	39	64 Å²	64	15%	0.153	36%	0.361	C	S	.	.	H	α-helix	trans	-109.9	-18.7	-177.8	60.6	-104.8	0	0	0	113.2	I241 T245 S249 A250 R333 V343	I241-Y253 HydrophobicContact CG1-CD2 4.46Å; I241-Y253 HydrophobicContact CG2-CD2 3.56Å; I241-Y253 HydrophobicContact CG2-CE2 3.88Å; T245-Y253 HydrophobicContact CG2-CD1 3.81Å; T245-Y253 HydrophobicContact CG2-CD2 3.91Å; T245-Y253 HydrophobicContact CG2-CE1 3.79Å; T245-Y253 HydrophobicContact CG2-CE2 3.9Å; T245-Y253 HydrophobicContact CG2-CG 3.86Å; S249-Y253 WeakPolarHBondContact O-CD1 3.17Å; A250-Y253 VanDerWaalsContact CA-CE1 3.43Å; A250-Y253 VanDerWaalsContact CA-CZ 3.5Å; A250-Y253 HydrophobicContact CB-CE1 4.33Å; A250-Y253 HydrophobicContact CB-CE2 4.5Å; A250-Y253 PolarHBondContact O-N 3.5Å; Y253-R333 PolarHBondContact O-NH2 3.48Å; Y253-V343 HydrophobicContact CD1-CG2 4.34Å
254	Q	89.1	Confident	86.7	Confident	94 Å²	94	59.5 Å²	59.5	44%	0.439	33%	0.329	S	S	.	.	S	Bend	trans	-80.7	134.6	174.8	-67	-176.2	-8.3	0	0	110.1	I241 A250	I241-Q254 HydrophobicContact CD1-CG 3.92Å; I241-Q254 HydrophobicContact CG1-CG 4.3Å; A250-Q254 VanDerWaalsContact O-CB 3.29Å; A250-Q254 WeakPolarHBondContact O-CB 3.28Å; A250-Q254 VanDerWaalsContact O-CG 3.3Å; A250-Q254 WeakPolarHBondContact O-CG 3.44Å; A250-Q254 PolarHBondContact O-N 2.74Å
255	P	90.8	Very high	87	Confident	13 Å²	13	59.8 Å²	59.8	8%	0.084	33%	0.328	C	S	.	.	P	Polyproline II helix	trans	-65.5	143.2	169.5	9.1	-2.5	0	0	0	110	Y237 W238	Y237-P255 HydrophobicContact CD1-CB 3.89Å; Y237-P255 HydrophobicContact CD1-CG 4.4Å; Y237-P255 HydrophobicContact CE1-CB 3.36Å; Y237-P255 HydrophobicContact CE1-CG 4.28Å; Y237-P255 WeakPolarHBondContact O-CG 3.4Å; W238-P255 HydrophobicContact CE3-CB 3.8Å; W238-P255 HydrophobicContact CE3-CG 4.12Å; W238-P255 HydrophobicContact CZ3-CB 3.83Å
256	R	88.7	Confident	87.5	Confident	72 Å²	72	59.9 Å²	59.9	27%	0.272	33%	0.329	S	S	.	.	P	Polyproline II helix	trans	-77	139.4	-169.2	-156.1	178.8	-17.2	131.8	0.6	112.4	W238 D258 A259 R264 D270	W238-R256 WeakPolarHBondContact CH2-O 3.4Å; W238-R256 WeakPolarHBondContact CZ3-O 3.34Å; R256-D258 WeakPolarHBondContact CD-OD1 3.37Å; R256-D258 VanDerWaalsContact CG-OD1 3.23Å; R256-D258 WeakPolarHBondContact CG-OD1 3.37Å; R256-D258 IonicContact CZ-OD1 3.74Å; R256-D258 IonicContact NE-OD1 3.67Å; R256-D258 IonicContact NH1-OD1 3.12Å; R256-D258 PolarHBondContact NH1-OD1 3.12Å; R256-D258 IonicContact NH1-OD2 2.64Å; R256-D258 PolarHBondContact O-N 3.5Å; R256-A259 VanDerWaalsContact O-CB 3.28Å; R256-A259 WeakPolarHBondContact O-CB 3.38Å; R256-A259 PolarHBondContact O-N 3.38Å; R256-R264 VanDerWaalsContact NH1-NH1 3.19Å; R256-D270 IonicContact CZ-OD1 3.29Å; R256-D270 VanDerWaalsContact CZ-OD1 3.29Å; R256-D270 IonicContact CZ-OD2 3.57Å; R256-D270 IonicContact NH1-OD1 3.32Å; R256-D270 PolarHBondContact NH1-OD1 2.82Å; R256-D270 IonicContact NH1-OD2 3.39Å; R256-D270 IonicContact NH2-OD1 3.21Å; R256-D270 PolarHBondContact NH2-OD1 2.93Å; R256-D270 IonicContact NH2-OD2 2.68Å; R256-D270 PolarHBondContact NH2-OD2 2.71Å
257	S	88.8	Confident	87.8	Confident	107 Å²	107	64.9 Å²	64.9	75%	0.748	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.6	-24.8	-176.1	53.9	0	0	0	0	115.7
258	D	90.4	Very high	88	Confident	29 Å²	29	61.9 Å²	61.9	16%	0.155	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.7	17.1	178.1	69.2	-14.3	0	0	0	113.8	R256 F260 H261 R264	R256-D258 WeakPolarHBondContact CD-OD1 3.37Å; R256-D258 VanDerWaalsContact CG-OD1 3.23Å; R256-D258 WeakPolarHBondContact CG-OD1 3.37Å; R256-D258 IonicContact CZ-OD1 3.74Å; R256-D258 IonicContact NE-OD1 3.67Å; R256-D258 IonicContact NH1-OD1 3.12Å; R256-D258 PolarHBondContact NH1-OD1 3.12Å; R256-D258 IonicContact NH1-OD2 2.64Å; R256-D258 PolarHBondContact O-N 3.5Å; D258-F260 PolarHBondContact O-N 3.26Å; D258-F260 VanDerWaalsContact O-N 3.14Å; D258-H261 PolarHBondContact O-N 3.47Å; D258-R264 PolarHBondContact O-NE 2.79Å; D258-R264 PolarHBondContact O-NH2 3.21Å; D258-R264 IonicContact OD1-NE 3.3Å; D258-R264 VanDerWaalsContact OD2-CD 3.27Å; D258-R264 WeakPolarHBondContact OD2-CD 3.42Å; D258-R264 WeakPolarHBondContact OD2-CG 3.41Å; D258-R264 IonicContact OD2-NE 2.8Å
259	A	90.1	Very high	88	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-24.5	-177	0	0	0	0	0	114.2	G94 I95 Y237 W238 R256	G94-A259 CarbonylContact C-O 3.49Å; G94-A259 WeakPolarHBondContact CA-O 3.41Å; I95-A259 PolarHBondContact N-O 3.42Å; Y237-A259 HydrophobicContact CD1-CB 4.32Å; Y237-A259 HydrophobicContact CE1-CB 3.54Å; W238-A259 HydrophobicContact CH2-CB 3.32Å; W238-A259 HydrophobicContact CZ3-CB 3.57Å; R256-A259 VanDerWaalsContact O-CB 3.28Å; R256-A259 WeakPolarHBondContact O-CB 3.38Å; R256-A259 PolarHBondContact O-N 3.38Å
260	F	92.1	Very high	88.2	Confident	43 Å²	43	60 Å²	60	19%	0.189	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98	11.5	176.4	-67.9	-83.8	0	0	0	114.1	I95 Q234 Y237 W238 D258 M330	I95-F260 VanDerWaalsContact CD1-C 3.42Å; I95-F260 WeakPolarHBondContact CD1-O 3.27Å; I95-F260 HydrophobicContact CG2-CD1 4.21Å; Q234-F260 HydrophobicContact CB-CE2 4.08Å; Q234-F260 HydrophobicContact CB-CZ 4.19Å; Q234-F260 HydrophobicContact CG-CD1 4.43Å; Q234-F260 HydrophobicContact CG-CD2 4.47Å; Q234-F260 HydrophobicContact CG-CE1 4.08Å; Q234-F260 HydrophobicContact CG-CE2 4.12Å; Q234-F260 HydrophobicContact CG-CZ 3.91Å; Y237-F260 AromaticContact CD1-CE2 3.77Å; Y237-F260 HydrophobicContact CD1-CE2 3.77Å; Y237-F260 HydrophobicContact CD1-CZ 4.17Å; Y237-F260 HydrophobicContact CG-CE2 4.13Å; Y237-F260 HydrophobicContact CG-CZ 4.12Å; W238-F260 AromaticContact CH2-CD2 3.83Å; W238-F260 HydrophobicContact CH2-CD2 3.83Å; W238-F260 HydrophobicContact CH2-CE2 4.14Å; W238-F260 AromaticContact CZ2-CD2 3.53Å; W238-F260 HydrophobicContact CZ2-CD2 3.53Å; W238-F260 AromaticContact CZ2-CE2 3.9Å; W238-F260 HydrophobicContact CZ2-CE2 3.9Å; D258-F260 PolarHBondContact O-N 3.26Å; D258-F260 VanDerWaalsContact O-N 3.14Å; F260-M330 HydrophobicContact CD1-CE 4.01Å; F260-M330 HydrophobicContact CE1-CE 3.42Å; F260-M330 VanDerWaalsContact CE1-CE 3.42Å; F260-M330 HydrophobicContact CE1-SD 4.45Å; F260-M330 HydrophobicContact CE2-CE 4.04Å; F260-M330 HydrophobicContact CZ-CE 3.43Å; F260-M330 VanDerWaalsContact CZ-CE 3.43Å
261	H	92.1	Very high	88.5	Confident	98 Å²	98	58.5 Å²	58.5	45%	0.454	31%	0.306	S	S	.	.			trans	-110.9	131.8	173.3	-63.3	98	0	0	0	110.4	D258	D258-H261 PolarHBondContact O-N 3.47Å
262	L	90.4	Very high	88.9	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	27%	0.268	C	S	.	.	S	Bend	trans	-74.6	-44.3	176	-167.5	83	0	0	0	110.8	A98 W102 R264 L276 H653 F656	A98-L262 HydrophobicContact CB-CD1 4.49Å; W102-L262 HydrophobicContact CE3-CD2 4.03Å; W102-L262 HydrophobicContact CZ3-CD1 4.32Å; W102-L262 HydrophobicContact CZ3-CD2 3.97Å; L262-R264 PolarHBondContact O-N 3.46Å; L262-L276 HydrophobicContact CG-CD1 4.12Å; L262-L276 WeakPolarHBondContact O-CD1 3.31Å; L262-H653 HydrophobicContact CD2-CB 4.48Å; L262-H653 VanDerWaalsContact CD2-CD2 3.44Å; L262-H653 WeakPolarHBondContact CD2-CD2 3.26Å; L262-F656 HydrophobicContact CB-CB 4.47Å; L262-F656 VanDerWaalsContact CB-O 3.29Å; L262-F656 WeakPolarHBondContact CB-O 3.43Å; L262-F656 PolarHBondContact N-O 3.32Å
263	F	92.8	Very high	89.4	Confident	77 Å²	77	53.7 Å²	53.7	34%	0.338	28%	0.275	S	S	.	.	S	Bend	trans	-91.7	103.8	178.7	-63.6	-50.2	0	0	0	110.5	W273 L276 V277 H653 G657	F263-W273 HydrophobicContact CB-CB 3.88Å; F263-W273 HydrophobicContact CD1-CB 3.8Å; F263-W273 HydrophobicContact CG-CB 4.22Å; F263-L276 HydrophobicContact CD1-CD2 4.39Å; F263-L276 HydrophobicContact CE1-CD2 3.96Å; F263-V277 HydrophobicContact CE1-CG2 3.98Å; F263-H653 HydrophobicContact CZ-CB 4.35Å; F263-G657 VanDerWaalsContact CD2-CA 3.41Å
264	R	92.1	Very high	89.8	Confident	5 Å²	5	52.8 Å²	52.8	2%	0.019	27%	0.274	C	S	.	.	B	Isolated β-bridge	trans	-95.3	163.9	-179.3	-59.5	-175.4	166.1	156.2	5.4	112.2	S93 A96 R256 D258 L262 D270 W273	S93-R264 PolarHBondContact O-NH1 3.33Å; S93-R264 PolarHBondContact O-NH2 3.38Å; A96-R264 HydrophobicContact CB-CG 4.44Å; R256-R264 VanDerWaalsContact NH1-NH1 3.19Å; D258-R264 PolarHBondContact O-NE 2.79Å; D258-R264 PolarHBondContact O-NH2 3.21Å; D258-R264 IonicContact OD1-NE 3.3Å; D258-R264 VanDerWaalsContact OD2-CD 3.27Å; D258-R264 WeakPolarHBondContact OD2-CD 3.42Å; D258-R264 WeakPolarHBondContact OD2-CG 3.41Å; D258-R264 IonicContact OD2-NE 2.8Å; L262-R264 PolarHBondContact O-N 3.46Å; R264-D270 WeakPolarHBondContact CD-OD1 3.39Å; R264-D270 IonicContact CZ-OD1 2.87Å; R264-D270 IonicContact NE-OD1 3.06Å; R264-D270 IonicContact NH1-OD1 2.85Å; R264-D270 PolarHBondContact NH1-OD1 2.94Å; R264-D270 IonicContact NH1-OD2 3.78Å; R264-D270 PolarHBondContact NH1-OD2 3.14Å; R264-W273 VanDerWaalsContact O-CD1 3.25Å; R264-W273 PolarHBondContact O-N 3.06Å
265	D	91.9	Very high	90	Very high	76 Å²	76	48.3 Å²	48.3	41%	0.406	25%	0.253	S	S	.	.			trans	-48.9	134.5	177.6	-177.3	-91.2	0	0	0	111.5	I267 T268 G269	D265-I267 PolarHBondContact O-N 2.93Å; D265-I267 PolarHBondContact OD1-N 3.14Å; D265-T268 WeakPolarHBondContact CB-OG1 3.26Å; D265-T268 PolarHBondContact OD1-N 3.24Å; D265-T268 PolarHBondContact OD1-OG1 3.25Å; D265-G269 PolarHBondContact O-N 3.28Å
266	P	90.1	Very high	90.1	Very high	43 Å²	43	47.8 Å²	47.8	28%	0.279	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-16.2	-173.1	25.1	-35.3	0	0	0	114.6	P272 P274 Y525	P266-P272 WeakPolarHBondContact O-CB 3.21Å; P266-P274 HydrophobicContact CB-CG 4.02Å; P266-Y525 WeakPolarHBondContact O-CE2 3.39Å; P266-Y525 PolarHBondContact O-OH 3.43Å
267	I	85.9	Confident	90.2	Very high	152 Å²	152	46.5 Å²	46.5	78%	0.779	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-117.5	-44	-174.4	-58.8	173.8	0	0	0	110.8	D265	D265-I267 PolarHBondContact O-N 2.93Å; D265-I267 PolarHBondContact OD1-N 3.14Å
268	T	83.3	Confident	90.5	Very high	113 Å²	113	47 Å²	47	69%	0.693	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.7	-15.5	-172.5	58.3	0	0	0	0	113.5	D265	D265-T268 WeakPolarHBondContact CB-OG1 3.26Å; D265-T268 PolarHBondContact OD1-N 3.24Å; D265-T268 PolarHBondContact OD1-OG1 3.25Å
269	G	83.8	Confident	90.6	Very high	8 Å²	8	45.8 Å²	45.8	8%	0.082	23%	0.232	C	C	.	.			trans	-71.6	143.4	177.1	0	0	0	0	0	112.5	D265 L271	D265-G269 PolarHBondContact O-N 3.28Å; G269-L271 VanDerWaalsContact C-N 3.26Å; G269-L271 PolarHBondContact O-N 3.13Å
270	D	86	Confident	90.8	Very high	42 Å²	42	46 Å²	46	23%	0.225	23%	0.233	C	C	.	.	S	Bend	trans	-64.9	-28.4	171.1	70.8	-34.9	0	0	0	113.4	S93 R256 R264 H522	S93-D270 WeakPolarHBondContact CB-OD2 3.4Å; R256-D270 IonicContact CZ-OD1 3.29Å; R256-D270 VanDerWaalsContact CZ-OD1 3.29Å; R256-D270 IonicContact CZ-OD2 3.57Å; R256-D270 IonicContact NH1-OD1 3.32Å; R256-D270 PolarHBondContact NH1-OD1 2.82Å; R256-D270 IonicContact NH1-OD2 3.39Å; R256-D270 IonicContact NH2-OD1 3.21Å; R256-D270 PolarHBondContact NH2-OD1 2.93Å; R256-D270 IonicContact NH2-OD2 2.68Å; R256-D270 PolarHBondContact NH2-OD2 2.71Å; R264-D270 WeakPolarHBondContact CD-OD1 3.39Å; R264-D270 IonicContact CZ-OD1 2.87Å; R264-D270 IonicContact NE-OD1 3.06Å; R264-D270 IonicContact NH1-OD1 2.85Å; R264-D270 PolarHBondContact NH1-OD1 2.94Å; R264-D270 IonicContact NH1-OD2 3.78Å; R264-D270 PolarHBondContact NH1-OD2 3.14Å; D270-H522 PolarHBondContact O-CE1 3.03Å; D270-H522 PolarHBondContact O-NE2 3.14Å
271	L	89.9	Confident	90.9	Very high	3 Å²	3	46.3 Å²	46.3	2%	0.016	24%	0.239	C	C	.	.	S	Bend	trans	-129.7	74.9	178.2	-71.5	176.2	0	0	0	106.4	A96 I97 F100 G269 W273 L524	A96-L271 HydrophobicContact CB-CB 4.33Å; A96-L271 HydrophobicContact CB-CD1 3.9Å; I97-L271 HydrophobicContact CB-CD1 4.38Å; I97-L271 HydrophobicContact CD1-CD1 3.89Å; F100-L271 HydrophobicContact CE2-CD1 4.4Å; F100-L271 HydrophobicContact CE2-CD2 3.85Å; F100-L271 HydrophobicContact CZ-CD2 4.38Å; G269-L271 VanDerWaalsContact C-N 3.26Å; G269-L271 PolarHBondContact O-N 3.13Å; L271-W273 PolarHBondContact O-N 2.94Å; L271-L524 HydrophobicContact CD2-CD1 4.11Å
272	P	92.4	Very high	91.1	Very high	2 Å²	2	42.4 Å²	42.4	1%	0.013	22%	0.221	C	C	.	.	B	Isolated β-bridge	trans	-64.6	136.9	-172.7	27.6	-35.3	0	0	0	109.7	P266 P274 G275 L276 Y525	P266-P272 WeakPolarHBondContact O-CB 3.21Å; P272-P274 VanDerWaalsContact C-N 3.35Å; P272-P274 VanDerWaalsContact O-N 3.16Å; P272-G275 CarbonylContact O-C 3.09Å; P272-G275 WeakPolarHBondContact O-CA 3.39Å; P272-G275 PolarHBondContact O-N 3.48Å; P272-L276 PolarHBondContact O-N 3.19Å; P272-Y525 HydrophobicContact CB-CE2 4.17Å; P272-Y525 WeakPolarHBondContact CB-OH 3.11Å; P272-Y525 HydrophobicContact CG-CE1 4.35Å; P272-Y525 HydrophobicContact CG-CE2 3.83Å
273	W	92.1	Very high	91.2	Very high	111 Å²	111	42.8 Å²	42.8	42%	0.42	22%	0.223	S	C	.	.	H	α-helix	trans	-54.2	-37.3	-171.7	77.4	-98.3	0	0	0	115.1	F263 R264 L271 G275 L276 V277 F278	F263-W273 HydrophobicContact CB-CB 3.88Å; F263-W273 HydrophobicContact CD1-CB 3.8Å; F263-W273 HydrophobicContact CG-CB 4.22Å; R264-W273 VanDerWaalsContact O-CD1 3.25Å; R264-W273 PolarHBondContact O-N 3.06Å; L271-W273 PolarHBondContact O-N 2.94Å; W273-G275 VanDerWaalsContact C-N 3.33Å; W273-L276 WeakPolarHBondContact O-CB 3.48Å; W273-L276 PolarHBondContact O-N 2.91Å; W273-V277 HydrophobicContact CE3-CG2 4.38Å; W273-V277 WeakPolarHBondContact O-CG2 3.48Å; W273-V277 PolarHBondContact O-N 3.16Å; W273-F278 HydrophobicContact CZ3-CE2 4.48Å
274	P	93.5	Very high	91.3	Very high	21 Å²	21	39.6 Å²	39.6	14%	0.136	21%	0.211	C	C	.	.	H	α-helix	trans	-73.6	-30.9	177.7	-1.9	17.8	0	0	0	111.1	P266 P272 L276 F278 Y525	P266-P274 HydrophobicContact CB-CG 4.02Å; P272-P274 VanDerWaalsContact C-N 3.35Å; P272-P274 VanDerWaalsContact O-N 3.16Å; P274-L276 VanDerWaalsContact C-N 3.34Å; P274-F278 HydrophobicContact CB-CD2 4.22Å; P274-F278 WeakPolarHBondContact O-CB 3.22Å; P274-F278 VanDerWaalsContact O-CD2 3.31Å; P274-F278 WeakPolarHBondContact O-CD2 3.44Å; P274-F278 PolarHBondContact O-N 3.43Å; P274-Y525 HydrophobicContact CB-CE1 3.97Å; P274-Y525 VanDerWaalsContact CD-OH 3.28Å; P274-Y525 WeakPolarHBondContact CD-OH 3.11Å; P274-Y525 HydrophobicContact CG-CE1 4.13Å; P274-Y525 VanDerWaalsContact CG-OH 3.31Å; P274-Y525 WeakPolarHBondContact CG-OH 3.43Å
275	G	92.6	Very high	91.4	Very high	0 Å²	0	40 Å²	40	0%	0	21%	0.214	C	C	.	.	I	π-helix	trans	-63.8	-41.6	169.1	0	0	0	0	0	111.5	P272 W273 G279 L280	P272-G275 CarbonylContact O-C 3.09Å; P272-G275 WeakPolarHBondContact O-CA 3.39Å; P272-G275 PolarHBondContact O-N 3.48Å; W273-G275 VanDerWaalsContact C-N 3.33Å; G275-G279 CarbonylContact O-C 3.58Å; G275-G279 WeakPolarHBondContact O-CA 3.44Å; G275-G279 PolarHBondContact O-N 3Å; G275-L280 PolarHBondContact O-N 3.34Å
276	L	92.3	Very high	91.5	Very high	1 Å²	1	36.6 Å²	36.6	1%	0.005	20%	0.195	C	C	.	.	I	π-helix	trans	-61.4	-47.1	176	-171.4	152.9	0	0	0	111.4	N103 L262 F263 P272 W273 P274 L280	N103-L276 WeakPolarHBondContact ND2-CD2 3.41Å; N103-L276 PolarHBondContact ND2-O 3.36Å; L262-L276 HydrophobicContact CG-CD1 4.12Å; L262-L276 WeakPolarHBondContact O-CD1 3.31Å; F263-L276 HydrophobicContact CD1-CD2 4.39Å; F263-L276 HydrophobicContact CE1-CD2 3.96Å; P272-L276 PolarHBondContact O-N 3.19Å; W273-L276 WeakPolarHBondContact O-CB 3.48Å; W273-L276 PolarHBondContact O-N 2.91Å; P274-L276 VanDerWaalsContact C-N 3.34Å; L276-L280 HydrophobicContact CB-CD1 4.29Å; L276-L280 HydrophobicContact CG-CD1 3.81Å; L276-L280 WeakPolarHBondContact O-CB 3.32Å; L276-L280 WeakPolarHBondContact O-CD1 3.32Å; L276-L280 VanDerWaalsContact O-CG 3.3Å; L276-L280 WeakPolarHBondContact O-CG 3.33Å
277	V	92.4	Very high	91.6	Very high	46 Å²	46	36.4 Å²	36.4	28%	0.279	19%	0.19	S	C	.	.	I	π-helix	trans	-75.1	-51.9	-177.3	174.5	0	0	0	0	111.8	F263 W273 T281	F263-V277 HydrophobicContact CE1-CG2 3.98Å; W273-V277 HydrophobicContact CE3-CG2 4.38Å; W273-V277 WeakPolarHBondContact O-CG2 3.48Å; W273-V277 PolarHBondContact O-N 3.16Å; V277-T281 VanDerWaalsContact O-CB 3.26Å; V277-T281 WeakPolarHBondContact O-CB 3.5Å; V277-T281 PolarHBondContact O-OG1 3.08Å
278	F	94.2	Very high	92	Very high	118 Å²	118	29.2 Å²	29.2	52%	0.518	15%	0.153	S	C	.	.	I	π-helix	trans	-93.3	-44.2	-171.5	-58.5	-69.9	0	0	0	112.6	W273 P274 T281 I282 I528	W273-F278 HydrophobicContact CZ3-CE2 4.48Å; P274-F278 HydrophobicContact CB-CD2 4.22Å; P274-F278 WeakPolarHBondContact O-CB 3.22Å; P274-F278 VanDerWaalsContact O-CD2 3.31Å; P274-F278 WeakPolarHBondContact O-CD2 3.44Å; P274-F278 PolarHBondContact O-N 3.43Å; F278-T281 PolarHBondContact O-N 3.32Å; F278-I282 WeakPolarHBondContact O-CG1 3.31Å; F278-I282 PolarHBondContact O-N 2.65Å; F278-I528 HydrophobicContact CB-CD1 3.65Å; F278-I528 HydrophobicContact CB-CG1 4.1Å
279	G	93.4	Very high	92.3	Very high	2 Å²	2	23.9 Å²	23.9	2%	0.021	12%	0.12	C	C	.	.	I	π-helix	trans	-66.4	-46	-178.6	0	0	0	0	0	112.4	G275 T281 I282 Q283	G275-G279 CarbonylContact O-C 3.58Å; G275-G279 WeakPolarHBondContact O-CA 3.44Å; G275-G279 PolarHBondContact O-N 3Å; G279-T281 VanDerWaalsContact C-N 3.33Å; G279-T281 PolarHBondContact O-N 3.39Å; G279-I282 PolarHBondContact O-N 3.41Å; G279-Q283 PolarHBondContact O-N 3.33Å
280	L	93.5	Very high	92.6	Very high	4 Å²	4	23.6 Å²	23.6	2%	0.021	12%	0.117	C	C	.	.	H	α-helix	trans	-66.9	-35.2	175.6	-56.5	-177.5	0	0	0	112.3	F100 N103 G275 L276 I282 Q283 A284 L524	F100-L280 HydrophobicContact CD1-CD1 4.37Å; F100-L280 HydrophobicContact CD1-CD2 3.53Å; F100-L280 HydrophobicContact CD2-CD1 4.03Å; F100-L280 HydrophobicContact CD2-CD2 4.22Å; F100-L280 HydrophobicContact CE1-CD2 3.15Å; F100-L280 HydrophobicContact CE1-CG 4.46Å; F100-L280 HydrophobicContact CE2-CD1 4.25Å; F100-L280 HydrophobicContact CE2-CD2 3.89Å; F100-L280 HydrophobicContact CG-CD1 4.11Å; F100-L280 HydrophobicContact CG-CD2 4.06Å; F100-L280 HydrophobicContact CZ-CD2 3.36Å; N103-L280 HydrophobicContact CB-CB 4.15Å; G275-L280 PolarHBondContact O-N 3.34Å; L276-L280 HydrophobicContact CB-CD1 4.29Å; L276-L280 HydrophobicContact CG-CD1 3.81Å; L276-L280 WeakPolarHBondContact O-CB 3.32Å; L276-L280 WeakPolarHBondContact O-CD1 3.32Å; L276-L280 VanDerWaalsContact O-CG 3.3Å; L276-L280 WeakPolarHBondContact O-CG 3.33Å; L280-I282 VanDerWaalsContact C-N 3.26Å; L280-I282 PolarHBondContact O-N 2.91Å; L280-Q283 PolarHBondContact O-N 2.86Å; L280-A284 WeakPolarHBondContact O-CB 3.34Å; L280-A284 PolarHBondContact O-N 3.15Å; L280-L524 HydrophobicContact CD2-CD1 4.14Å; L280-L524 HydrophobicContact CD2-CD2 3.47Å; L280-L524 VanDerWaalsContact CD2-CD2 3.47Å; L280-L524 HydrophobicContact CD2-CG 4.48Å; L280-L524 HydrophobicContact CG-CD1 4.43Å; L280-L524 HydrophobicContact CG-CD2 4.28Å
281	T	94.7	Very high	92.9	Very high	51 Å²	51	21.8 Å²	21.8	31%	0.313	11%	0.107	S	C	.	.	H	α-helix	trans	-58.5	-40.2	174.6	-71.9	0	0	0	0	111.5	L107 V277 F278 G279 T285	L107-T281 HydrophobicContact CD2-CG2 4.24Å; V277-T281 VanDerWaalsContact O-CB 3.26Å; V277-T281 WeakPolarHBondContact O-CB 3.5Å; V277-T281 PolarHBondContact O-OG1 3.08Å; F278-T281 PolarHBondContact O-N 3.32Å; G279-T281 VanDerWaalsContact C-N 3.33Å; G279-T281 PolarHBondContact O-N 3.39Å; T281-T285 WeakPolarHBondContact O-CB 3.3Å; T281-T285 PolarHBondContact O-N 3Å; T281-T285 PolarHBondContact O-OG1 2.83Å
282	I	95.4	Very high	92.9	Very high	15 Å²	15	21.8 Å²	21.8	8%	0.077	11%	0.107	C	C	.	.	H	α-helix	trans	-65.6	-46.9	177.1	-67.8	160.1	0	0	0	110.9	F278 G279 L280 T285 W286 P462 A465 I528 F531	F278-I282 WeakPolarHBondContact O-CG1 3.31Å; F278-I282 PolarHBondContact O-N 2.65Å; G279-I282 PolarHBondContact O-N 3.41Å; L280-I282 VanDerWaalsContact C-N 3.26Å; L280-I282 PolarHBondContact O-N 2.91Å; I282-T285 WeakPolarHBondContact O-CB 3.43Å; I282-T285 PolarHBondContact O-N 3.17Å; I282-W286 PolarHBondContact O-N 3.38Å; I282-W286 VanDerWaalsContact O-N 3.14Å; I282-P462 HydrophobicContact CG2-CB 3.94Å; I282-P462 HydrophobicContact CG2-CG 4.24Å; I282-A465 HydrophobicContact CG2-CB 4.13Å; I282-I528 HydrophobicContact CD1-CB 4.28Å; I282-I528 HydrophobicContact CD1-CG1 3.9Å; I282-F531 HydrophobicContact CD1-CB 3.72Å; I282-F531 HydrophobicContact CD1-CD1 4.08Å; I282-F531 HydrophobicContact CD1-CD2 4.44Å; I282-F531 HydrophobicContact CD1-CG 3.84Å; I282-F531 HydrophobicContact CG1-CB 4.31Å; I282-F531 HydrophobicContact CG1-CD1 4.34Å; I282-F531 HydrophobicContact CG1-CD2 4.15Å; I282-F531 HydrophobicContact CG1-CG 4.02Å; I282-F531 HydrophobicContact CG2-CB 4.05Å; I282-F531 HydrophobicContact CG2-CD2 3.72Å; I282-F531 HydrophobicContact CG2-CE2 4.49Å; I282-F531 HydrophobicContact CG2-CG 4.09Å
283	Q	93.6	Very high	92.8	Very high	9 Å²	9	21.9 Å²	21.9	4%	0.042	11%	0.108	C	C	.	.	H	α-helix	trans	-63	-45	177.5	-69.1	-173.9	81.6	0	0	112.1	G279 L280 T285 W286 F287 Q454 I457 S458	G279-Q283 PolarHBondContact O-N 3.33Å; L280-Q283 PolarHBondContact O-N 2.86Å; Q283-T285 VanDerWaalsContact C-N 3.27Å; Q283-T285 PolarHBondContact O-N 2.66Å; Q283-W286 PolarHBondContact O-N 3.39Å; Q283-F287 PolarHBondContact O-N 2.98Å; Q283-Q454 PolarHBondContact OE1-O 3.5Å; Q283-Q454 VanDerWaalsContact OE1-O 3.11Å; Q283-I457 HydrophobicContact CB-CG2 4.44Å; Q283-I457 HydrophobicContact CG-CG2 4.25Å; Q283-S458 PolarHBondContact NE2-OG 3.12Å; Q283-S458 PolarHBondContact OE1-OG 3Å
284	A	93.9	Very high	92.7	Very high	10 Å²	10	16.6 Å²	16.6	8%	0.083	9%	0.088	C	C	.	.	H	α-helix	trans	-63.4	-34.2	176.3	0	0	0	0	0	111.4	L107 L280 F287 W288	L107-A284 HydrophobicContact CB-CB 4.07Å; L107-A284 HydrophobicContact CD2-CB 3.94Å; L107-A284 HydrophobicContact CG-CB 3.71Å; L280-A284 WeakPolarHBondContact O-CB 3.34Å; L280-A284 PolarHBondContact O-N 3.15Å; A284-F287 PolarHBondContact O-N 3.35Å; A284-W288 WeakPolarHBondContact O-CB 3.44Å; A284-W288 VanDerWaalsContact O-CD1 3.28Å; A284-W288 PolarHBondContact O-N 3.24Å
285	T	94.3	Very high	92.6	Very high	13 Å²	13	15.6 Å²	15.6	8%	0.08	8%	0.081	C	C	.	.	H	α-helix	trans	-62.3	-45	173.7	-60.8	0	0	0	0	110.9	L107 F115 T281 I282 Q283 C289 A465	L107-T285 WeakPolarHBondContact CD1-OG1 3.34Å; F115-T285 HydrophobicContact CE1-CG2 4.46Å; F115-T285 HydrophobicContact CZ-CG2 3.98Å; T281-T285 WeakPolarHBondContact O-CB 3.3Å; T281-T285 PolarHBondContact O-N 3Å; T281-T285 PolarHBondContact O-OG1 2.83Å; I282-T285 WeakPolarHBondContact O-CB 3.43Å; I282-T285 PolarHBondContact O-N 3.17Å; Q283-T285 VanDerWaalsContact C-N 3.27Å; Q283-T285 PolarHBondContact O-N 2.66Å; T285-C289 WeakPolarHBondContact O-CA 3.34Å; T285-C289 WeakPolarHBondContact O-CB 3.11Å; T285-C289 PolarHBondContact O-N 3.31Å; T285-A465 HydrophobicContact CG2-CB 4.5Å
286	W	93.6	Very high	92.2	Very high	4 Å²	4	15.6 Å²	15.6	2%	0.015	8%	0.082	C	C	.	.	H	α-helix	trans	-61.6	-55	173.9	167.5	77.4	0	0	0	111.3	L150 I282 Q283 W288 A290 D291 I457 A461 A465	L150-W286 HydrophobicContact CD1-CZ2 3.9Å; I282-W286 PolarHBondContact O-N 3.38Å; I282-W286 VanDerWaalsContact O-N 3.14Å; Q283-W286 PolarHBondContact O-N 3.39Å; W286-W288 PolarHBondContact O-N 3.5Å; W286-A290 CarbonylContact O-C 3.45Å; W286-A290 WeakPolarHBondContact O-CA 3.45Å; W286-A290 WeakPolarHBondContact O-CB 3.48Å; W286-A290 PolarHBondContact O-N 3.44Å; W286-D291 PolarHBondContact O-N 2.83Å; W286-I457 HydrophobicContact CE3-CG2 3.82Å; W286-I457 HydrophobicContact CZ3-CD1 4.19Å; W286-I457 HydrophobicContact CZ3-CG1 4.2Å; W286-I457 HydrophobicContact CZ3-CG2 3.72Å; W286-A461 HydrophobicContact CB-CB 3.96Å; W286-A461 HydrophobicContact CD2-CB 3.47Å; W286-A461 VanDerWaalsContact CD2-CB 3.47Å; W286-A461 HydrophobicContact CE3-CB 3.77Å; W286-A461 HydrophobicContact CG-CB 3.55Å; W286-A461 HydrophobicContact CZ3-CB 4.48Å; W286-A465 HydrophobicContact CB-CB 4.08Å
287	F	92.7	Very high	92	Very high	39 Å²	39	15.7 Å²	15.7	17%	0.171	8%	0.082	C	C	.	.	H	α-helix	trans	-63.2	-45	-172.9	-177.2	-90.7	0	0	0	112.7	N77 Q283 A284 D291 I294	N77-F287 HydrophobicContact CB-CE1 4.11Å; N77-F287 HydrophobicContact CB-CZ 4.13Å; N77-F287 WeakPolarHBondContact OD1-CE1 3.41Å; N77-F287 WeakPolarHBondContact OD1-CZ 3.3Å; Q283-F287 PolarHBondContact O-N 2.98Å; A284-F287 PolarHBondContact O-N 3.35Å; F287-D291 WeakPolarHBondContact O-CB 3.14Å; F287-I294 HydrophobicContact CD1-CG1 4.35Å; F287-I294 HydrophobicContact CE1-CD1 3.99Å; F287-I294 HydrophobicContact CE1-CG1 3.96Å; F287-I294 HydrophobicContact CZ-CD1 4.16Å; F287-I294 HydrophobicContact CZ-CG1 4.27Å; F287-I294 WeakPolarHBondContact O-CG1 3.48Å
288	W	93.5	Very high	91.8	Very high	2 Å²	2	13.5 Å²	13.5	1%	0.008	7%	0.068	C	C	.	.	H	α-helix	trans	-85.4	-33.6	-176.4	-69	98.1	0	0	0	113.2	N77 A104 L107 V108 L111 A284 W286 I294	N77-W288 HydrophobicContact CB-CH2 3.94Å; N77-W288 HydrophobicContact CB-CZ2 4.14Å; N77-W288 WeakPolarHBondContact OD1-CZ2 3.33Å; A104-W288 HydrophobicContact CB-CZ2 4.19Å; L107-W288 HydrophobicContact CB-CB 4.27Å; L107-W288 HydrophobicContact CB-CG 4.4Å; V108-W288 HydrophobicContact CB-CE3 4.3Å; V108-W288 HydrophobicContact CG1-CE3 4.47Å; V108-W288 HydrophobicContact CG2-CD2 3.33Å; V108-W288 HydrophobicContact CG2-CE3 3.31Å; V108-W288 HydrophobicContact CG2-CG 4.01Å; V108-W288 HydrophobicContact CG2-CH2 3.82Å; V108-W288 HydrophobicContact CG2-CZ2 3.84Å; V108-W288 HydrophobicContact CG2-CZ3 3.56Å; L111-W288 WeakPolarHBondContact CD2-O 3.43Å; A284-W288 WeakPolarHBondContact O-CB 3.44Å; A284-W288 VanDerWaalsContact O-CD1 3.28Å; A284-W288 PolarHBondContact O-N 3.24Å; W286-W288 PolarHBondContact O-N 3.5Å; W288-I294 HydrophobicContact CE3-CG1 4.49Å; W288-I294 HydrophobicContact CE3-CG2 3.61Å; W288-I294 HydrophobicContact CZ3-CD1 4.26Å; W288-I294 HydrophobicContact CZ3-CG2 4.07Å; W288-I294 WeakPolarHBondContact O-CG2 3.37Å
289	C	90.9	Very high	91.3	Very high	0 Å²	0	8.2 Å²	8.2	0%	0	5%	0.046	C	C	.	.	H	α-helix	trans	-110.2	-15.8	-167.7	-52.9	0	0	0	0	115	F115 F119 T285	F115-C289 HydrophobicContact CB-CB 4.21Å; F115-C289 HydrophobicContact CD1-CB 3.38Å; F115-C289 HydrophobicContact CD2-CB 3.9Å; F115-C289 HydrophobicContact CE1-CB 3.56Å; F115-C289 HydrophobicContact CE2-CB 4.08Å; F115-C289 HydrophobicContact CG-CB 3.57Å; F115-C289 HydrophobicContact CZ-CB 3.91Å; F119-C289 WeakPolarHBondContact CE2-O 3.46Å; T285-C289 WeakPolarHBondContact O-CA 3.34Å; T285-C289 WeakPolarHBondContact O-CB 3.11Å; T285-C289 PolarHBondContact O-N 3.31Å
290	A	90.6	Very high	90.7	Very high	2 Å²	2	8.1 Å²	8.1	2%	0.017	5%	0.045	C	C	.	.	T	Hydrogen-bonded Turn	trans	-122.5	-15.3	-179.9	0	0	0	0	0	113.6	M126 W286 I464 F468	M126-A290 WeakPolarHBondContact CG-O 3.38Å; W286-A290 CarbonylContact O-C 3.45Å; W286-A290 WeakPolarHBondContact O-CA 3.45Å; W286-A290 WeakPolarHBondContact O-CB 3.48Å; W286-A290 PolarHBondContact O-N 3.44Å; A290-I464 HydrophobicContact CB-CG2 4.28Å; A290-F468 HydrophobicContact CB-CB 4.18Å; A290-F468 HydrophobicContact CB-CD1 4.14Å; A290-F468 HydrophobicContact CB-CD2 3.62Å; A290-F468 HydrophobicContact CB-CE1 4.47Å; A290-F468 HydrophobicContact CB-CE2 4Å; A290-F468 HydrophobicContact CB-CG 3.7Å; A290-F468 HydrophobicContact CB-CZ 4.43Å
291	D	91.7	Very high	90.3	Very high	4 Å²	4	8.2 Å²	8.2	2%	0.021	5%	0.046	C	C	.	.			trans	-74.9	133.7	-180	-169.4	32.5	0	0	0	112.4	Y151 W286 F287 V293 I294 V295	Y151-D291 VanDerWaalsContact CE1-OD1 3.25Å; Y151-D291 WeakPolarHBondContact CE1-OD1 3.21Å; Y151-D291 VanDerWaalsContact CZ-OD1 3.31Å; Y151-D291 PolarHBondContact OH-OD1 3.24Å; W286-D291 PolarHBondContact O-N 2.83Å; F287-D291 WeakPolarHBondContact O-CB 3.14Å; D291-V293 VanDerWaalsContact C-N 3.32Å; D291-V293 PolarHBondContact O-N 2.83Å; D291-V293 WeakPolarHBondContact OD2-CB 3.44Å; D291-I294 PolarHBondContact O-N 2.91Å; D291-V295 WeakPolarHBondContact O-CG2 3.2Å; D291-V295 PolarHBondContact O-N 3.49Å; D291-V295 VanDerWaalsContact O-N 3.08Å
292	Q	89.9	Confident	89.6	Confident	3 Å²	3	10.5 Å²	10.5	1%	0.014	5%	0.052	C	C	.	.	H	α-helix	trans	-63.1	-39	-177.5	-177.9	66.4	20.4	0	0	111.3	I124 T125 Y151 I294 Q296 L401	I124-Q292 PolarHBondContact O-NE2 2.98Å; T125-Q292 VanDerWaalsContact CA-OE1 3.32Å; Y151-Q292 WeakPolarHBondContact OH-CB 3.36Å; Y151-Q292 PolarHBondContact OH-N 3.31Å; Q292-I294 VanDerWaalsContact C-N 3.29Å; Q292-I294 PolarHBondContact O-N 3.27Å; Q292-Q296 WeakPolarHBondContact O-CB 3.22Å; Q292-Q296 PolarHBondContact O-N 3.37Å; Q292-L401 HydrophobicContact CB-CD1 4.25Å; Q292-L401 HydrophobicContact CB-CD2 4.37Å; Q292-L401 HydrophobicContact CB-CG 4.41Å; Q292-L401 HydrophobicContact CG-CD1 4.48Å; Q292-L401 HydrophobicContact CG-CD2 4.18Å; Q292-L401 HydrophobicContact CG-CG 4.15Å
293	V	89.5	Confident	89	Confident	4 Å²	4	12.7 Å²	12.7	2%	0.024	6%	0.063	C	C	.	.	H	α-helix	trans	-57.8	-42.9	-177.9	-179.7	0	0	0	0	111.7	Y151 D291 R297 I394 S397	Y151-V293 HydrophobicContact CE1-CG2 4.37Å; D291-V293 VanDerWaalsContact C-N 3.32Å; D291-V293 PolarHBondContact O-N 2.83Å; D291-V293 WeakPolarHBondContact OD2-CB 3.44Å; V293-R297 PolarHBondContact O-NH1 2.8Å; V293-I394 HydrophobicContact CG2-CG1 4.47Å; V293-S397 WeakPolarHBondContact CA-OG 3.49Å
294	I	91.6	Very high	88.6	Confident	0 Å²	0	12.4 Å²	12.4	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-81.4	-50.2	-176.4	-58.9	-54.4	0	0	0	111.2	L73 L111 F287 W288 D291 Q292 Q296 R297 C298	L73-I294 HydrophobicContact CD2-CG2 3.71Å; L111-I294 HydrophobicContact CD2-CG2 4.03Å; F287-I294 HydrophobicContact CD1-CG1 4.35Å; F287-I294 HydrophobicContact CE1-CD1 3.99Å; F287-I294 HydrophobicContact CE1-CG1 3.96Å; F287-I294 HydrophobicContact CZ-CD1 4.16Å; F287-I294 HydrophobicContact CZ-CG1 4.27Å; F287-I294 WeakPolarHBondContact O-CG1 3.48Å; W288-I294 HydrophobicContact CE3-CG1 4.49Å; W288-I294 HydrophobicContact CE3-CG2 3.61Å; W288-I294 HydrophobicContact CZ3-CD1 4.26Å; W288-I294 HydrophobicContact CZ3-CG2 4.07Å; W288-I294 WeakPolarHBondContact O-CG2 3.37Å; D291-I294 PolarHBondContact O-N 2.91Å; Q292-I294 VanDerWaalsContact C-N 3.29Å; Q292-I294 PolarHBondContact O-N 3.27Å; I294-Q296 VanDerWaalsContact C-N 3.34Å; I294-Q296 PolarHBondContact O-N 3.14Å; I294-R297 PolarHBondContact O-N 3.19Å; I294-C298 PolarHBondContact O-N 3.02Å
295	V	89.6	Confident	88.4	Confident	0 Å²	0	12.4 Å²	12.4	0%	0	6%	0.061	C	C	.	.	H	α-helix	trans	-67.9	-35.7	-174.4	-176.5	0	0	0	0	111.4	L111 F119 M126 D291 R297 C298 L299	L111-V295 HydrophobicContact CD1-CG2 4.29Å; F119-V295 HydrophobicContact CD2-CG1 3.63Å; F119-V295 HydrophobicContact CE2-CG1 4.12Å; F119-V295 HydrophobicContact CE2-CG2 4.35Å; F119-V295 HydrophobicContact CG-CG1 4.44Å; M126-V295 HydrophobicContact CE-CB 3.77Å; M126-V295 HydrophobicContact CE-CG1 3.25Å; M126-V295 HydrophobicContact CG-CB 4.4Å; M126-V295 HydrophobicContact SD-CB 3.77Å; M126-V295 HydrophobicContact SD-CG1 3.59Å; M126-V295 VanDerWaalsContact SD-CG1 3.59Å; M126-V295 HydrophobicContact SD-CG2 3.94Å; D291-V295 WeakPolarHBondContact O-CG2 3.2Å; D291-V295 PolarHBondContact O-N 3.49Å; D291-V295 VanDerWaalsContact O-N 3.08Å; V295-R297 PolarHBondContact O-N 2.62Å; V295-C298 WeakPolarHBondContact O-CB 3.41Å; V295-C298 PolarHBondContact O-N 3.49Å; V295-C298 VanDerWaalsContact O-N 3.07Å; V295-L299 HydrophobicContact CG1-CD1 4.15Å; V295-L299 HydrophobicContact CG1-CG 4.2Å; V295-L299 WeakPolarHBondContact O-CG 3.14Å; V295-L299 PolarHBondContact O-N 3.39Å
296	Q	85.1	Confident	88.2	Confident	1 Å²	1	13.3 Å²	13.3	1%	0.005	7%	0.065	C	C	.	.	H	α-helix	trans	-57.7	-35.1	178	-175.8	171.9	0.4	0	0	112.7	F58 L195 Q292 I294 L299 S300 N396 S397 T400	F58-Q296 PolarHBondContact O-NE2 3.43Å; L195-Q296 HydrophobicContact CD2-CG 4.14Å; Q292-Q296 WeakPolarHBondContact O-CB 3.22Å; Q292-Q296 PolarHBondContact O-N 3.37Å; I294-Q296 VanDerWaalsContact C-N 3.34Å; I294-Q296 PolarHBondContact O-N 3.14Å; Q296-L299 PolarHBondContact O-N 3.46Å; Q296-S300 PolarHBondContact O-N 3.22Å; Q296-N396 PolarHBondContact NE2-ND2 2.99Å; Q296-S397 PolarHBondContact OE1-OG 3.47Å; Q296-T400 PolarHBondContact NE2-OG1 3.41Å
297	R	88.1	Confident	88	Confident	2 Å²	2	13.1 Å²	13.1	1%	0.008	6%	0.064	C	C	.	.	H	α-helix	trans	-69.1	-41.8	175.8	-71	171.7	161.4	78.5	2.6	112.3	S72 L73 S76 D202 V293 I294 V295 L299 S300 S393	S72-R297 WeakPolarHBondContact OG-CD 3.46Å; S72-R297 PolarHBondContact OG-NE 3.24Å; L73-R297 HydrophobicContact CD2-CB 4.1Å; S76-R297 PolarHBondContact OG-NE 3.46Å; S76-R297 PolarHBondContact OG-NH1 3.11Å; S76-R297 PolarHBondContact OG-NH2 3.34Å; D202-R297 IonicContact OD2-NH2 2.65Å; D202-R297 PolarHBondContact OD2-NH2 2.7Å; V293-R297 PolarHBondContact O-NH1 2.8Å; I294-R297 PolarHBondContact O-N 3.19Å; V295-R297 PolarHBondContact O-N 2.62Å; R297-L299 VanDerWaalsContact C-N 3.25Å; R297-L299 PolarHBondContact O-N 3.25Å; R297-S300 WeakPolarHBondContact O-CB 3.36Å; R297-S300 PolarHBondContact O-N 3.13Å; R297-S300 VanDerWaalsContact O-N 3.13Å; R297-S300 PolarHBondContact O-OG 2.92Å; R297-S393 PolarHBondContact NH2-OG 3.04Å
298	C	88.3	Confident	88	Confident	0 Å²	0	11.3 Å²	11.3	0%	0	6%	0.056	C	C	.	.	H	α-helix	trans	-63	-35.5	175.2	-66.6	0	0	0	0	111.6	L116 I294 V295 S300 A301 V307	L116-C298 HydrophobicContact CD1-CB 3.96Å; L116-C298 HydrophobicContact CD2-CB 3.53Å; L116-C298 HydrophobicContact CG-CB 4.35Å; I294-C298 PolarHBondContact O-N 3.02Å; V295-C298 WeakPolarHBondContact O-CB 3.41Å; V295-C298 PolarHBondContact O-N 3.49Å; V295-C298 VanDerWaalsContact O-N 3.07Å; C298-S300 VanDerWaalsContact C-N 3.25Å; C298-S300 PolarHBondContact O-N 2.97Å; C298-A301 WeakPolarHBondContact O-CB 3.36Å; C298-A301 PolarHBondContact O-N 3.41Å; C298-V307 HydrophobicContact CB-CG1 3.73Å; C298-V307 VanDerWaalsContact O-CG2 3.32Å; C298-V307 WeakPolarHBondContact O-CG2 3.22Å
299	L	83.3	Confident	88.1	Confident	8 Å²	8	12.2 Å²	12.2	4%	0.042	6%	0.064	C	C	.	.	H	α-helix	trans	-70.8	-17.3	176.3	-66.2	174.5	0	0	0	113.8	L59 R62 F119 M126 V295 Q296 R297 A301	L59-L299 HydrophobicContact CD2-CB 4.03Å; R62-L299 WeakPolarHBondContact CG-O 3.22Å; F119-L299 HydrophobicContact CB-CD2 4.14Å; F119-L299 WeakPolarHBondContact O-CD2 3.39Å; M126-L299 HydrophobicContact CE-CD1 3.94Å; V295-L299 HydrophobicContact CG1-CD1 4.15Å; V295-L299 HydrophobicContact CG1-CG 4.2Å; V295-L299 WeakPolarHBondContact O-CG 3.14Å; V295-L299 PolarHBondContact O-N 3.39Å; Q296-L299 PolarHBondContact O-N 3.46Å; R297-L299 VanDerWaalsContact C-N 3.25Å; R297-L299 PolarHBondContact O-N 3.25Å; L299-A301 VanDerWaalsContact C-N 3.26Å; L299-A301 PolarHBondContact O-N 2.89Å
300	S	81.6	Confident	88.2	Confident	0 Å²	0	12.2 Å²	12.2	0%	0	6%	0.064	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.5	-3	176.2	78	0	0	0	0	114.2	L59 R62 S63 M64 Q296 R297 C298	L59-S300 VanDerWaalsContact O-CB 3.31Å; L59-S300 WeakPolarHBondContact O-CB 3.12Å; R62-S300 CarbonylContact C-O 3.52Å; R62-S300 WeakPolarHBondContact CA-O 3.06Å; S63-S300 PolarHBondContact N-O 2.76Å; M64-S300 WeakPolarHBondContact CB-O 3.45Å; M64-S300 WeakPolarHBondContact CG-O 3.17Å; M64-S300 PolarHBondContact N-O 3.31Å; Q296-S300 PolarHBondContact O-N 3.22Å; R297-S300 WeakPolarHBondContact O-CB 3.36Å; R297-S300 PolarHBondContact O-N 3.13Å; R297-S300 VanDerWaalsContact O-N 3.13Å; R297-S300 PolarHBondContact O-OG 2.92Å; C298-S300 VanDerWaalsContact C-N 3.25Å; C298-S300 PolarHBondContact O-N 2.97Å
301	A	83.8	Confident	88.4	Confident	5 Å²	5	12.1 Å²	12.1	4%	0.041	6%	0.063	C	C	.	.	B	Isolated β-bridge	trans	-77.6	148.8	-177.7	0	0	0	0	0	113.5	R62 M64 I69 C298 L299 N303 V307	R62-A301 CarbonylContact O-C 3.58Å; M64-A301 WeakPolarHBondContact O-CA 3.47Å; I69-A301 HydrophobicContact CD1-CB 3.32Å; C298-A301 WeakPolarHBondContact O-CB 3.36Å; C298-A301 PolarHBondContact O-N 3.41Å; L299-A301 VanDerWaalsContact C-N 3.26Å; L299-A301 PolarHBondContact O-N 2.89Å; A301-N303 PolarHBondContact O-N 3.36Å; A301-V307 HydrophobicContact CB-CB 4.38Å; A301-V307 HydrophobicContact CB-CG2 3.23Å
302	K	80.8	Confident	88.7	Confident	100 Å²	100	12.5 Å²	12.5	44%	0.435	7%	0.065	S	C	.	.	S	Bend	trans	-66	-33.9	-180	69.1	174.6	-175.6	179	0	115.4	R62 M64 V65 H306	R62-K302 VanDerWaalsContact O-CA 3.26Å; R62-K302 WeakPolarHBondContact O-CA 3.4Å; M64-K302 PolarHBondContact O-N 3.23Å; M64-K302 VanDerWaalsContact O-N 3.09Å; V65-K302 HydrophobicContact CG1-CD 4.45Å; K302-H306 WeakPolarHBondContact CE-CD2 3.36Å; K302-H306 WeakPolarHBondContact CE-CE1 3.45Å; K302-H306 WeakPolarHBondContact CE-ND1 3.48Å; K302-H306 WeakPolarHBondContact CE-NE2 3.43Å; K302-H306 HydrophobicContact CG-CB 4.3Å; K302-H306 PolarHBondContact NZ-CE1 2.67Å; K302-H306 VanDerWaalsContact NZ-CE1 3.27Å; K302-H306 PolarHBondContact NZ-NE2 3.04Å
303	N	83.6	Confident	89	Confident	61 Å²	61	14.2 Å²	14.2	33%	0.326	7%	0.074	S	C	.	.	S	Bend	trans	-155.7	172.3	-178.2	68.3	17	0	0	0	110.6	A301 S305 H306 V307	A301-N303 PolarHBondContact O-N 3.36Å; N303-S305 PolarHBondContact OD1-N 2.93Å; N303-H306 PolarHBondContact O-N 3.32Å; N303-H306 WeakPolarHBondContact OD1-CB 3.33Å; N303-H306 PolarHBondContact OD1-CD2 2.8Å; N303-H306 PolarHBondContact OD1-N 2.86Å; N303-V307 WeakPolarHBondContact O-CG2 3.43Å; N303-V307 PolarHBondContact O-N 3.4Å
304	L	84.4	Confident	89.3	Confident	2 Å²	2	14 Å²	14	1%	0.01	7%	0.073	C	C	.	.	H	α-helix	trans	-67.2	-40.2	-174.8	-173.3	64.4	0	0	0	112.8	Y117 K120 H306 V307 K308 E630	Y117-L304 HydrophobicContact CD1-CD2 4.31Å; Y117-L304 HydrophobicContact CE1-CD2 3.56Å; Y117-L304 HydrophobicContact CE2-CD2 4.18Å; Y117-L304 VanDerWaalsContact CZ-CD2 3.49Å; Y117-L304 WeakPolarHBondContact OH-CD2 3.3Å; K120-L304 HydrophobicContact CD-CD1 4.4Å; K120-L304 VanDerWaalsContact NZ-N 3.14Å; L304-H306 VanDerWaalsContact C-N 3.27Å; L304-H306 PolarHBondContact O-N 3.07Å; L304-V307 WeakPolarHBondContact O-CB 3.4Å; L304-V307 PolarHBondContact O-N 2.9Å; L304-K308 PolarHBondContact O-N 3Å; L304-E630 HydrophobicContact CB-CG 4.13Å; L304-E630 HydrophobicContact CD2-CG 4.07Å; L304-E630 HydrophobicContact CG-CG 4.42Å
305	S	88.8	Confident	89.5	Confident	10 Å²	10	14 Å²	14	7%	0.07	7%	0.073	C	C	.	.	H	α-helix	trans	-63.2	-33.7	-179.9	-50.7	0	0	0	0	112.5	N303 K308 A309 E630	N303-S305 PolarHBondContact OD1-N 2.93Å; S305-K308 PolarHBondContact O-N 3.37Å; S305-A309 VanDerWaalsContact O-CB 3.31Å; S305-A309 WeakPolarHBondContact O-CB 3.41Å; S305-A309 PolarHBondContact O-N 2.85Å; S305-E630 WeakPolarHBondContact CA-OE1 3.5Å; S305-E630 PolarHBondContact N-OE1 3.01Å; S305-E630 WeakPolarHBondContact OG-CG 3.49Å; S305-E630 PolarHBondContact OG-OE1 3.26Å
306	H	89.9	Confident	89.8	Confident	32 Å²	32	17.6 Å²	17.6	15%	0.148	9%	0.087	C	C	.	.	H	α-helix	trans	-69.7	-33.4	173.9	-84	-102.3	0	0	0	113.1	W66 K302 N303 L304 G310	W66-H306 HydrophobicContact CB-CB 4.35Å; W66-H306 WeakPolarHBondContact CB-O 3.37Å; W66-H306 AromaticContact CD1-CE1 3.62Å; W66-H306 AromaticContact CD1-ND1 3.69Å; W66-H306 PolarHBondContact N-ND1 3.47Å; W66-H306 VanDerWaalsContact N-ND1 3.16Å; K302-H306 WeakPolarHBondContact CE-CD2 3.36Å; K302-H306 WeakPolarHBondContact CE-CE1 3.45Å; K302-H306 WeakPolarHBondContact CE-ND1 3.48Å; K302-H306 WeakPolarHBondContact CE-NE2 3.43Å; K302-H306 HydrophobicContact CG-CB 4.3Å; K302-H306 PolarHBondContact NZ-CE1 2.67Å; K302-H306 VanDerWaalsContact NZ-CE1 3.27Å; K302-H306 PolarHBondContact NZ-NE2 3.04Å; N303-H306 PolarHBondContact O-N 3.32Å; N303-H306 WeakPolarHBondContact OD1-CB 3.33Å; N303-H306 PolarHBondContact OD1-CD2 2.8Å; N303-H306 PolarHBondContact OD1-N 2.86Å; L304-H306 VanDerWaalsContact C-N 3.27Å; L304-H306 PolarHBondContact O-N 3.07Å; H306-G310 PolarHBondContact O-N 2.85Å
307	V	90.3	Very high	90.3	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-66.8	-48.8	172.3	-169.3	0	0	0	0	110.3	L116 C298 A301 N303 L304 A309 G310 C311	L116-V307 HydrophobicContact CD1-CB 4.26Å; L116-V307 HydrophobicContact CD1-CG1 3.17Å; L116-V307 HydrophobicContact CD2-CG1 4.49Å; L116-V307 HydrophobicContact CG-CG1 4.39Å; C298-V307 HydrophobicContact CB-CG1 3.73Å; C298-V307 VanDerWaalsContact O-CG2 3.32Å; C298-V307 WeakPolarHBondContact O-CG2 3.22Å; A301-V307 HydrophobicContact CB-CB 4.38Å; A301-V307 HydrophobicContact CB-CG2 3.23Å; N303-V307 WeakPolarHBondContact O-CG2 3.43Å; N303-V307 PolarHBondContact O-N 3.4Å; L304-V307 WeakPolarHBondContact O-CB 3.4Å; L304-V307 PolarHBondContact O-N 2.9Å; V307-A309 VanDerWaalsContact C-N 3.32Å; V307-A309 PolarHBondContact O-N 3.47Å; V307-G310 CarbonylContact O-C 3.6Å; V307-G310 WeakPolarHBondContact O-CA 3.27Å; V307-G310 PolarHBondContact O-N 2.82Å; V307-C311 PolarHBondContact O-N 3.23Å; V307-C311 PolarHBondContact O-SG 3.41Å; V307-C311 VanDerWaalsContact O-SG 3.4Å
308	K	93.2	Very high	90.6	Very high	2 Å²	2	18.6 Å²	18.6	1%	0.009	9%	0.092	C	C	.	.	H	α-helix	trans	-57.3	-45.2	177.7	-70.1	179.7	-178.1	173.8	0	111.7	W113 Y117 L304 S305 G310 C311 I312 E630 V638	W113-K308 HydrophobicContact CD2-CD 4.2Å; W113-K308 HydrophobicContact CD2-CG 4.31Å; W113-K308 HydrophobicContact CE3-CG 4.16Å; W113-K308 HydrophobicContact CH2-CB 4.01Å; W113-K308 HydrophobicContact CH2-CG 4.34Å; W113-K308 HydrophobicContact CZ2-CB 4.34Å; W113-K308 HydrophobicContact CZ2-CD 4.15Å; W113-K308 HydrophobicContact CZ2-CG 4.41Å; W113-K308 HydrophobicContact CZ3-CB 4.13Å; W113-K308 HydrophobicContact CZ3-CG 4.21Å; Y117-K308 PolarHBondContact OH-NZ 2.91Å; L304-K308 PolarHBondContact O-N 3Å; S305-K308 PolarHBondContact O-N 3.37Å; K308-G310 VanDerWaalsContact C-N 3.33Å; K308-G310 PolarHBondContact O-N 3.16Å; K308-C311 WeakPolarHBondContact O-CB 3.44Å; K308-C311 PolarHBondContact O-N 3.24Å; K308-I312 VanDerWaalsContact O-CG1 3.27Å; K308-I312 WeakPolarHBondContact O-CG1 3.3Å; K308-I312 PolarHBondContact O-N 3.36Å; K308-E630 WeakPolarHBondContact CD-OE1 3.23Å; K308-E630 VanDerWaalsContact NZ-CD 3.31Å; K308-E630 IonicContact NZ-OE1 2.71Å; K308-E630 PolarHBondContact NZ-OE1 3.14Å; K308-E630 IonicContact NZ-OE2 2.7Å; K308-E630 PolarHBondContact NZ-OE2 3.19Å; K308-V638 HydrophobicContact CB-CB 4.23Å; K308-V638 HydrophobicContact CB-CG1 4.37Å; K308-V638 HydrophobicContact CB-CG2 4.23Å; K308-V638 HydrophobicContact CD-CG2 4.04Å
309	A	94.2	Very high	90.9	Very high	21 Å²	21	19.5 Å²	19.5	17%	0.174	10%	0.097	C	C	.	.	H	α-helix	trans	-62.6	-38	174.7	0	0	0	0	0	112.6	W66 S305 V307 I312 L313 V638	W66-A309 HydrophobicContact CB-CB 3.57Å; W66-A309 HydrophobicContact CD2-CB 4.36Å; W66-A309 HydrophobicContact CG-CB 3.96Å; S305-A309 VanDerWaalsContact O-CB 3.31Å; S305-A309 WeakPolarHBondContact O-CB 3.41Å; S305-A309 PolarHBondContact O-N 2.85Å; V307-A309 VanDerWaalsContact C-N 3.32Å; V307-A309 PolarHBondContact O-N 3.47Å; A309-I312 PolarHBondContact O-N 2.95Å; A309-L313 WeakPolarHBondContact O-CB 3.36Å; A309-L313 PolarHBondContact O-N 3.14Å; A309-V638 HydrophobicContact CB-CG1 4.18Å
310	G	94.5	Very high	91.5	Very high	0 Å²	0	21 Å²	21	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-63.7	-43.9	172.8	0	0	0	0	0	112.9	W66 G70 H306 V307 K308 L313 C314	W66-G310 WeakPolarHBondContact O-CA 3.42Å; G70-G310 WeakPolarHBondContact CA-O 3.43Å; H306-G310 PolarHBondContact O-N 2.85Å; V307-G310 CarbonylContact O-C 3.6Å; V307-G310 WeakPolarHBondContact O-CA 3.27Å; V307-G310 PolarHBondContact O-N 2.82Å; K308-G310 VanDerWaalsContact C-N 3.33Å; K308-G310 PolarHBondContact O-N 3.16Å; G310-L313 PolarHBondContact O-N 3.44Å; G310-C314 WeakPolarHBondContact O-CB 3.41Å; G310-C314 PolarHBondContact O-N 2.91Å
311	C	95.4	Very high	92.1	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-60.7	-43.4	174.1	-68.9	0	0	0	0	111.8	V108 V307 K308 C314 G315	V108-C311 HydrophobicContact CG1-CB 3.97Å; V108-C311 WeakPolarHBondContact CG1-O 3.37Å; V108-C311 WeakPolarHBondContact O-CB 3.33Å; V307-C311 PolarHBondContact O-N 3.23Å; V307-C311 PolarHBondContact O-SG 3.41Å; V307-C311 VanDerWaalsContact O-SG 3.4Å; K308-C311 WeakPolarHBondContact O-CB 3.44Å; K308-C311 PolarHBondContact O-N 3.24Å; C311-C314 PolarHBondContact O-N 3.24Å; C311-G315 PolarHBondContact O-N 2.94Å
312	I	96.6	Very high	92.6	Very high	11 Å²	11	20.9 Å²	20.9	6%	0.056	10%	0.104	C	C	.	.	H	α-helix	trans	-61.7	-47.5	175.3	-67.7	166.2	0	0	0	110.8	W113 K308 A309 C314 G315 Y316 V638 N641 A642	W113-I312 HydrophobicContact CH2-CD1 3.82Å; W113-I312 HydrophobicContact CH2-CG1 3.77Å; W113-I312 HydrophobicContact CZ3-CG1 4.32Å; K308-I312 VanDerWaalsContact O-CG1 3.27Å; K308-I312 WeakPolarHBondContact O-CG1 3.3Å; K308-I312 PolarHBondContact O-N 3.36Å; A309-I312 PolarHBondContact O-N 2.95Å; I312-C314 VanDerWaalsContact C-N 3.35Å; I312-C314 PolarHBondContact O-N 3.4Å; I312-G315 WeakPolarHBondContact O-CA 3.49Å; I312-G315 PolarHBondContact O-N 3.2Å; I312-G315 VanDerWaalsContact O-N 3.13Å; I312-Y316 HydrophobicContact CG2-CD2 3.66Å; I312-Y316 HydrophobicContact CG2-CE2 3.41Å; I312-Y316 VanDerWaalsContact CG2-CE2 3.41Å; I312-Y316 WeakPolarHBondContact O-CD2 3.25Å; I312-Y316 PolarHBondContact O-N 3.26Å; I312-V638 HydrophobicContact CD1-CB 3.8Å; I312-V638 HydrophobicContact CD1-CG1 4.25Å; I312-V638 WeakPolarHBondContact CD1-O 3.27Å; I312-N641 HydrophobicContact CD1-CB 3.96Å; I312-N641 HydrophobicContact CG2-CB 4.09Å; I312-A642 HydrophobicContact CG1-CB 4.48Å
313	L	96.3	Very high	93.2	Very high	39 Å²	39	19.5 Å²	19.5	20%	0.204	10%	0.098	C	C	.	.	H	α-helix	trans	-58.5	-48.6	178.5	175.1	63.3	0	0	0	110.7	W66 L67 A309 G310 G315 Y316 L317	W66-L313 HydrophobicContact CE3-CB 4.29Å; W66-L313 HydrophobicContact CE3-CD2 4.02Å; W66-L313 HydrophobicContact CZ3-CB 4.21Å; W66-L313 HydrophobicContact CZ3-CD1 4.36Å; W66-L313 HydrophobicContact CZ3-CD2 3.8Å; W66-L313 HydrophobicContact CZ3-CG 4.34Å; L67-L313 HydrophobicContact CB-CD2 4.43Å; L67-L313 HydrophobicContact CG-CD2 4.29Å; A309-L313 WeakPolarHBondContact O-CB 3.36Å; A309-L313 PolarHBondContact O-N 3.14Å; G310-L313 PolarHBondContact O-N 3.44Å; L313-G315 VanDerWaalsContact C-N 3.28Å; L313-G315 PolarHBondContact O-N 3.48Å; L313-Y316 PolarHBondContact O-N 3.5Å; L313-L317 HydrophobicContact CD1-CG 4.44Å; L313-L317 HydrophobicContact CG-CD1 4.41Å; L313-L317 WeakPolarHBondContact O-CG 3.39Å; L313-L317 PolarHBondContact O-N 2.88Å
314	C	96.1	Very high	93.7	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-57	-43.6	174.8	-178.7	0	0	0	0	111.3	L73 V108 G310 C311 I312 Y316 L317 K318	L73-C314 HydrophobicContact CB-CB 4.03Å; L73-C314 HydrophobicContact CD1-CB 4.37Å; V108-C314 HydrophobicContact CG1-CB 4.05Å; G310-C314 WeakPolarHBondContact O-CB 3.41Å; G310-C314 PolarHBondContact O-N 2.91Å; C311-C314 PolarHBondContact O-N 3.24Å; I312-C314 VanDerWaalsContact C-N 3.35Å; I312-C314 PolarHBondContact O-N 3.4Å; C314-Y316 PolarHBondContact O-N 3.38Å; C314-L317 PolarHBondContact O-N 2.91Å; C314-K318 WeakPolarHBondContact O-CB 3.01Å; C314-K318 VanDerWaalsContact O-CG 3.31Å; C314-K318 WeakPolarHBondContact O-CG 3.07Å; C314-K318 PolarHBondContact O-N 3.2Å
315	G	96	Very high	94.2	Very high	0 Å²	0	16.9 Å²	16.9	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-60.7	-42.1	176.7	0	0	0	0	0	114	L105 C311 I312 L313 K318	L105-G315 VanDerWaalsContact CD1-O 3.22Å; L105-G315 WeakPolarHBondContact CD1-O 3.41Å; C311-G315 PolarHBondContact O-N 2.94Å; I312-G315 WeakPolarHBondContact O-CA 3.49Å; I312-G315 PolarHBondContact O-N 3.2Å; I312-G315 VanDerWaalsContact O-N 3.13Å; L313-G315 VanDerWaalsContact C-N 3.28Å; L313-G315 PolarHBondContact O-N 3.48Å; G315-K318 WeakPolarHBondContact O-CB 3.46Å; G315-K318 PolarHBondContact O-N 2.94Å
316	Y	96.1	Very high	94.5	Very high	75 Å²	75	16.4 Å²	16.4	29%	0.294	8%	0.08	S	C	.	.	H	α-helix	trans	-63.5	-42.5	172.3	-79.4	-63.5	0	0	0	111.9	I312 L313 C314 K318 L319 L645	I312-Y316 HydrophobicContact CG2-CD2 3.66Å; I312-Y316 HydrophobicContact CG2-CE2 3.41Å; I312-Y316 VanDerWaalsContact CG2-CE2 3.41Å; I312-Y316 WeakPolarHBondContact O-CD2 3.25Å; I312-Y316 PolarHBondContact O-N 3.26Å; L313-Y316 PolarHBondContact O-N 3.5Å; C314-Y316 PolarHBondContact O-N 3.38Å; Y316-K318 PolarHBondContact O-N 2.94Å; Y316-L319 HydrophobicContact CD1-CD1 4.48Å; Y316-L319 WeakPolarHBondContact O-CB 3.15Å; Y316-L319 PolarHBondContact O-N 3.23Å; Y316-L645 HydrophobicContact CD1-CD1 3.6Å; Y316-L645 HydrophobicContact CE1-CB 4.25Å; Y316-L645 HydrophobicContact CE1-CD1 3.81Å; Y316-L645 HydrophobicContact CG-CD1 4.01Å
317	L	95.5	Very high	94.7	Very high	24 Å²	24	16.7 Å²	16.7	13%	0.126	8%	0.081	C	C	.	.	H	α-helix	trans	-63.4	-32.1	177.2	-66.1	-179.3	0	0	0	112	F74 T206 L210 L313 C314 L319 L320 P321	F74-L317 HydrophobicContact CB-CB 4.36Å; F74-L317 HydrophobicContact CB-CD1 3.88Å; F74-L317 HydrophobicContact CD1-CB 4.37Å; F74-L317 HydrophobicContact CD1-CD1 4.05Å; F74-L317 HydrophobicContact CD2-CB 3.48Å; F74-L317 VanDerWaalsContact CD2-CB 3.48Å; F74-L317 HydrophobicContact CD2-CD1 4.4Å; F74-L317 HydrophobicContact CE2-CB 3.7Å; F74-L317 WeakPolarHBondContact CE2-O 3.32Å; F74-L317 HydrophobicContact CG-CB 3.83Å; F74-L317 HydrophobicContact CG-CD1 3.87Å; F74-L317 HydrophobicContact CZ-CB 4.24Å; T206-L317 HydrophobicContact CG2-CD1 4Å; L210-L317 HydrophobicContact CD1-CD2 3.56Å; L313-L317 HydrophobicContact CD1-CG 4.44Å; L313-L317 HydrophobicContact CG-CD1 4.41Å; L313-L317 WeakPolarHBondContact O-CG 3.39Å; L313-L317 PolarHBondContact O-N 2.88Å; C314-L317 PolarHBondContact O-N 2.91Å; L317-L319 PolarHBondContact O-N 3.25Å; L317-L320 HydrophobicContact CD2-CD1 4.01Å; L317-L320 VanDerWaalsContact O-CB 3.3Å; L317-L320 WeakPolarHBondContact O-CB 3.4Å; L317-L320 WeakPolarHBondContact O-CG 3.48Å; L317-L320 PolarHBondContact O-N 3.19Å; L317-P321 WeakPolarHBondContact O-CD 3.32Å
318	K	94.8	Very high	94.9	Very high	0 Å²	0	16.7 Å²	16.7	0%	0	8%	0.081	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-11.2	176.1	-79.6	-72.5	-166.9	169.7	0	115.2	N77 E101 L105 C314 G315 Y316 L320 P321	N77-K318 PolarHBondContact ND2-NZ 3.43Å; N77-K318 PolarHBondContact OD1-NZ 3.25Å; E101-K318 IonicContact OE1-NZ 3.9Å; E101-K318 WeakPolarHBondContact OE2-CD 3.48Å; E101-K318 WeakPolarHBondContact OE2-CE 3.34Å; E101-K318 IonicContact OE2-NZ 2.68Å; E101-K318 PolarHBondContact OE2-NZ 2.94Å; L105-K318 HydrophobicContact CB-CB 4.12Å; C314-K318 WeakPolarHBondContact O-CB 3.01Å; C314-K318 VanDerWaalsContact O-CG 3.31Å; C314-K318 WeakPolarHBondContact O-CG 3.07Å; C314-K318 PolarHBondContact O-N 3.2Å; G315-K318 WeakPolarHBondContact O-CB 3.46Å; G315-K318 PolarHBondContact O-N 2.94Å; Y316-K318 PolarHBondContact O-N 2.94Å; K318-L320 VanDerWaalsContact C-N 3.31Å; K318-P321 WeakPolarHBondContact O-CD 3.31Å
319	L	94.7	Very high	95	Very high	19 Å²	19	16.6 Å²	16.6	10%	0.099	8%	0.081	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-25.2	169.3	-64	177.9	0	0	0	112.2	L105 Y316 L317 L645 V648 L652	L105-L319 HydrophobicContact CD1-CD2 3.32Å; L105-L319 HydrophobicContact CD1-CG 3.75Å; Y316-L319 HydrophobicContact CD1-CD1 4.48Å; Y316-L319 WeakPolarHBondContact O-CB 3.15Å; Y316-L319 PolarHBondContact O-N 3.23Å; L317-L319 PolarHBondContact O-N 3.25Å; L319-L645 HydrophobicContact CD1-CD1 4.11Å; L319-V648 HydrophobicContact CD1-CG1 3.74Å; L319-L652 HydrophobicContact CD2-CD1 3.57Å
320	L	95.1	Very high	95	Very high	40 Å²	40	15.9 Å²	15.9	21%	0.209	7%	0.074	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-34.4	-171.2	-56.9	178.5	0	0	0	115.7	L210 F214 L317 K318 M322 F323 L324	L210-L320 HydrophobicContact CD1-CD1 4.42Å; L210-L320 HydrophobicContact CD2-CD1 3.73Å; F214-L320 HydrophobicContact CE2-CD1 4.34Å; F214-L320 HydrophobicContact CZ-CD1 4.29Å; F214-L320 HydrophobicContact CZ-CD2 3.98Å; L317-L320 HydrophobicContact CD2-CD1 4.01Å; L317-L320 VanDerWaalsContact O-CB 3.3Å; L317-L320 WeakPolarHBondContact O-CB 3.4Å; L317-L320 WeakPolarHBondContact O-CG 3.48Å; L317-L320 PolarHBondContact O-N 3.19Å; K318-L320 VanDerWaalsContact C-N 3.31Å; L320-M322 PolarHBondContact O-N 3.05Å; L320-M322 VanDerWaalsContact O-N 3.09Å; L320-F323 PolarHBondContact O-N 3.23Å; L320-L324 HydrophobicContact CB-CD1 3.72Å; L320-L324 HydrophobicContact CB-CG 4.13Å; L320-L324 HydrophobicContact CD1-CD1 4.36Å; L320-L324 WeakPolarHBondContact O-CB 3.18Å; L320-L324 WeakPolarHBondContact O-CG 3.32Å; L320-L324 PolarHBondContact O-N 3.48Å
321	P	94.9	Very high	95	Very high	2 Å²	2	16.2 Å²	16.2	1%	0.013	8%	0.076	C	C	.	.	H	α-helix	trans	-54.3	-29.5	-178.4	-30.7	36.6	0	0	0	115.2	F74 I78 L86 E101 L317 K318 F323 M325 V326	F74-P321 HydrophobicContact CE2-CG 4.38Å; I78-P321 HydrophobicContact CD1-CG 4.03Å; L86-P321 HydrophobicContact CD2-CB 4.31Å; E101-P321 HydrophobicContact CG-CB 3.94Å; E101-P321 HydrophobicContact CG-CG 4.29Å; L317-P321 WeakPolarHBondContact O-CD 3.32Å; K318-P321 WeakPolarHBondContact O-CD 3.31Å; P321-F323 VanDerWaalsContact C-N 3.29Å; P321-F323 PolarHBondContact O-N 3.43Å; P321-M325 HydrophobicContact CB-SD 4.43Å; P321-M325 WeakPolarHBondContact O-CA 3.29Å; P321-M325 WeakPolarHBondContact O-CB 3.38Å; P321-M325 PolarHBondContact O-N 3.36Å; P321-V326 PolarHBondContact O-N 3.29Å
322	M	94.1	Very high	94.9	Very high	1 Å²	1	16.2 Å²	16.2	1%	0.005	8%	0.076	C	C	.	.	I	π-helix	trans	-56.3	-47.5	172.4	-174.6	-172.8	-162.8	0	0	111.2	I95 A98 W102 L320 V326 F327 F656	I95-M322 HydrophobicContact CB-CE 4.23Å; I95-M322 HydrophobicContact CD1-CE 4.14Å; I95-M322 HydrophobicContact CG2-CE 4.46Å; A98-M322 HydrophobicContact CB-CB 4.22Å; A98-M322 HydrophobicContact CB-CG 4.11Å; W102-M322 HydrophobicContact CH2-CE 4.02Å; W102-M322 HydrophobicContact CH2-SD 3.49Å; W102-M322 WeakPolarHBondContact CH2-SD 3.23Å; W102-M322 HydrophobicContact CZ2-CB 4.27Å; W102-M322 HydrophobicContact CZ2-CE 4.34Å; W102-M322 HydrophobicContact CZ2-CG 4.29Å; W102-M322 HydrophobicContact CZ2-SD 3.23Å; W102-M322 WeakPolarHBondContact CZ2-SD 3.46Å; L320-M322 PolarHBondContact O-N 3.05Å; L320-M322 VanDerWaalsContact O-N 3.09Å; M322-V326 WeakPolarHBondContact O-CB 3.47Å; M322-V326 PolarHBondContact O-N 3.37Å; M322-F327 HydrophobicContact CE-CE2 4.46Å; M322-F327 HydrophobicContact CE-CZ 3.95Å; M322-F327 HydrophobicContact CG-CE2 4.4Å; M322-F327 PolarHBondContact O-N 2.94Å; M322-F656 HydrophobicContact CE-CB 4.46Å; M322-F656 HydrophobicContact CE-CD1 3.5Å; M322-F656 HydrophobicContact CE-CD2 3.76Å; M322-F656 HydrophobicContact CE-CE1 3.41Å; M322-F656 VanDerWaalsContact CE-CE1 3.41Å; M322-F656 HydrophobicContact CE-CE2 3.66Å; M322-F656 HydrophobicContact CE-CG 3.65Å; M322-F656 HydrophobicContact CE-CZ 3.48Å; M322-F656 VanDerWaalsContact CE-CZ 3.48Å; M322-F656 HydrophobicContact SD-CD2 4.12Å; M322-F656 HydrophobicContact SD-CE1 4.45Å; M322-F656 HydrophobicContact SD-CE2 3.74Å; M322-F656 HydrophobicContact SD-CZ 3.92Å
323	F	93.6	Very high	94.8	Very high	70 Å²	70	16.2 Å²	16.2	31%	0.307	8%	0.075	S	C	.	.	I	π-helix	trans	-80.8	-37.6	-178.4	-54.6	-78.9	0	0	0	112.1	M217 L320 P321 F327 P328	M217-F323 HydrophobicContact SD-CB 3.73Å; L320-F323 PolarHBondContact O-N 3.23Å; P321-F323 VanDerWaalsContact C-N 3.29Å; P321-F323 PolarHBondContact O-N 3.43Å; F323-F327 AromaticContact CD1-CD2 3.83Å; F323-F327 HydrophobicContact CD1-CD2 3.83Å; F323-F327 AromaticContact CD1-CE2 3.64Å; F323-F327 HydrophobicContact CD1-CE2 3.64Å; F323-F327 HydrophobicContact CE1-CD2 4.49Å; F323-F327 AromaticContact CE1-CE2 3.84Å; F323-F327 HydrophobicContact CE1-CE2 3.84Å; F323-P328 WeakPolarHBondContact O-CD 3.22Å
324	L	94.3	Very high	94.6	Very high	4 Å²	4	15.8 Å²	15.8	2%	0.021	7%	0.072	C	C	.	.	I	π-helix	trans	-89.1	-16.3	-170.6	-62	-172.8	0	0	0	114.4	L210 F214 M217 L320 Y363	L210-L324 HydrophobicContact CD2-CD1 3.74Å; F214-L324 HydrophobicContact CB-CD2 4.42Å; F214-L324 HydrophobicContact CD1-CD2 3.62Å; F214-L324 HydrophobicContact CD2-CD1 4.35Å; F214-L324 HydrophobicContact CD2-CD2 4.23Å; F214-L324 HydrophobicContact CE1-CD2 3.81Å; F214-L324 HydrophobicContact CE2-CD1 4.09Å; F214-L324 HydrophobicContact CE2-CD2 4.38Å; F214-L324 HydrophobicContact CG-CD2 3.82Å; F214-L324 HydrophobicContact CZ-CD1 4.29Å; F214-L324 HydrophobicContact CZ-CD2 4.18Å; M217-L324 HydrophobicContact SD-CD2 4.11Å; L320-L324 HydrophobicContact CB-CD1 3.72Å; L320-L324 HydrophobicContact CB-CG 4.13Å; L320-L324 HydrophobicContact CD1-CD1 4.36Å; L320-L324 WeakPolarHBondContact O-CB 3.18Å; L320-L324 WeakPolarHBondContact O-CG 3.32Å; L320-L324 PolarHBondContact O-N 3.48Å; L324-Y363 WeakPolarHBondContact O-CE2 3.36Å
325	M	93.8	Very high	94.4	Very high	4 Å²	4	17.1 Å²	17.1	2%	0.02	8%	0.079	C	C	.	.	I	π-helix	trans	-133.3	-49.9	-176.5	-57.9	-177.2	-179.2	0	0	112.6	I78 H82 F83 L86 A87 P321 G329	I78-M325 HydrophobicContact CG2-CE 3.28Å; I78-M325 HydrophobicContact CG2-SD 4.44Å; H82-M325 HydrophobicContact CB-CE 4.4Å; H82-M325 HydrophobicContact CB-SD 3.73Å; F83-M325 HydrophobicContact CD1-CE 3.8Å; F83-M325 HydrophobicContact CD1-CG 4.33Å; F83-M325 HydrophobicContact CD1-SD 4.36Å; F83-M325 HydrophobicContact CD2-CE 4.2Å; F83-M325 HydrophobicContact CE1-CE 3.43Å; F83-M325 VanDerWaalsContact CE1-CE 3.43Å; F83-M325 HydrophobicContact CE1-CG 4.37Å; F83-M325 HydrophobicContact CE1-SD 4.48Å; F83-M325 HydrophobicContact CE2-CE 3.85Å; F83-M325 HydrophobicContact CG-CE 4.18Å; F83-M325 HydrophobicContact CZ-CE 3.45Å; F83-M325 VanDerWaalsContact CZ-CE 3.45Å; L86-M325 HydrophobicContact CD2-CB 4.34Å; L86-M325 HydrophobicContact CD2-SD 4.36Å; A87-M325 WeakPolarHBondContact CB-O 3.48Å; P321-M325 HydrophobicContact CB-SD 4.43Å; P321-M325 WeakPolarHBondContact O-CA 3.29Å; P321-M325 WeakPolarHBondContact O-CB 3.38Å; P321-M325 PolarHBondContact O-N 3.36Å; M325-G329 PolarHBondContact O-N 3.46Å
326	V	95.6	Very high	94.2	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	9%	0.087	C	C	.	.	I	π-helix	trans	-67.1	-54.3	-175.7	175.3	0	0	0	0	111	L86 A90 I95 I97 A98 P321 M322 G329 M330	L86-V326 HydrophobicContact CD2-CG2 4.14Å; L86-V326 HydrophobicContact CG-CG2 4.32Å; A90-V326 HydrophobicContact CB-CB 4.03Å; A90-V326 HydrophobicContact CB-CG1 3.68Å; A90-V326 HydrophobicContact CB-CG2 4.3Å; A90-V326 WeakPolarHBondContact CB-O 3.46Å; I95-V326 HydrophobicContact CB-CG1 4.4Å; I95-V326 HydrophobicContact CG2-CG1 4.42Å; I97-V326 HydrophobicContact CG2-CG1 4.29Å; I97-V326 HydrophobicContact CG2-CG2 3.86Å; A98-V326 HydrophobicContact CB-CG2 4.35Å; P321-V326 PolarHBondContact O-N 3.29Å; M322-V326 WeakPolarHBondContact O-CB 3.47Å; M322-V326 PolarHBondContact O-N 3.37Å; V326-G329 PolarHBondContact O-N 3.4Å; V326-G329 VanDerWaalsContact O-N 3.14Å; V326-M330 PolarHBondContact O-N 3.02Å
327	F	94.3	Very high	94	Very high	38 Å²	38	17 Å²	17	17%	0.167	8%	0.083	C	C	.	.	H	α-helix	trans	-60.4	-48.4	176.5	-75	-39.9	0	0	0	113	I95 F221 M322 F323 G329 M330 I331 F656	I95-F327 HydrophobicContact CG2-CD1 4.5Å; I95-F327 HydrophobicContact CG2-CE1 3.92Å; F221-F327 HydrophobicContact CE2-CB 4.49Å; F221-F327 HydrophobicContact CZ-CB 4.33Å; M322-F327 HydrophobicContact CE-CE2 4.46Å; M322-F327 HydrophobicContact CE-CZ 3.95Å; M322-F327 HydrophobicContact CG-CE2 4.4Å; M322-F327 PolarHBondContact O-N 2.94Å; F323-F327 AromaticContact CD1-CD2 3.83Å; F323-F327 HydrophobicContact CD1-CD2 3.83Å; F323-F327 AromaticContact CD1-CE2 3.64Å; F323-F327 HydrophobicContact CD1-CE2 3.64Å; F323-F327 HydrophobicContact CE1-CD2 4.49Å; F323-F327 AromaticContact CE1-CE2 3.84Å; F323-F327 HydrophobicContact CE1-CE2 3.84Å; F327-G329 VanDerWaalsContact C-N 3.26Å; F327-G329 PolarHBondContact O-N 3.33Å; F327-M330 HydrophobicContact CD1-SD 4.3Å; F327-M330 PolarHBondContact O-N 3.07Å; F327-M330 VanDerWaalsContact O-N 3.14Å; F327-I331 WeakPolarHBondContact O-CB 3.43Å; F327-I331 VanDerWaalsContact O-CG1 3.25Å; F327-I331 WeakPolarHBondContact O-CG1 3.41Å; F327-I331 PolarHBondContact O-N 3.26Å; F327-F656 HydrophobicContact CZ-CE1 4.28Å; F327-F656 HydrophobicContact CZ-CZ 4.47Å
328	P	94.6	Very high	93.8	Very high	0 Å²	0	19 Å²	19	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-53.9	-42	172.2	-31	37.3	0	0	0	112.7	M217 F323 M330 I331 S332 Y363 M366	M217-P328 HydrophobicContact CB-CG 4.43Å; M217-P328 HydrophobicContact CG-CG 4.5Å; F323-P328 WeakPolarHBondContact O-CD 3.22Å; P328-M330 PolarHBondContact O-N 3.33Å; P328-I331 PolarHBondContact O-N 3.4Å; P328-S332 PolarHBondContact O-N 3.12Å; P328-Y363 HydrophobicContact CB-CD2 4.27Å; P328-Y363 HydrophobicContact CB-CE2 4.13Å; P328-M366 HydrophobicContact CB-CE 3.43Å; P328-M366 VanDerWaalsContact CB-CE 3.43Å; P328-M366 HydrophobicContact CB-SD 4.14Å; P328-M366 WeakPolarHBondContact O-CE 3.32Å
329	G	94.8	Very high	93.5	Very high	0 Å²	0	20 Å²	20	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-55.3	-49.9	174.7	0	0	0	0	0	112.8	A87 A91 M325 V326 F327 I331 S332 R333	A87-G329 WeakPolarHBondContact O-CA 3.44Å; A91-G329 VanDerWaalsContact CB-O 3.24Å; A91-G329 WeakPolarHBondContact CB-O 3.39Å; M325-G329 PolarHBondContact O-N 3.46Å; V326-G329 PolarHBondContact O-N 3.4Å; V326-G329 VanDerWaalsContact O-N 3.14Å; F327-G329 VanDerWaalsContact C-N 3.26Å; F327-G329 PolarHBondContact O-N 3.33Å; G329-I331 PolarHBondContact O-N 3.02Å; G329-S332 WeakPolarHBondContact O-CB 3.4Å; G329-S332 PolarHBondContact O-N 3.19Å; G329-R333 PolarHBondContact O-N 3.27Å
330	M	94.5	Very high	93.4	Very high	6 Å²	6	19.1 Å²	19.1	3%	0.03	10%	0.095	C	C	.	.	H	α-helix	trans	-62.1	-41.5	175.9	-64.6	177.1	73.6	0	0	112.5	A90 I95 Y237 F260 V326 F327 P328 S332 R333 I334	A90-M330 HydrophobicContact CB-CG 4.48Å; A90-M330 VanDerWaalsContact O-CG 3.3Å; A90-M330 WeakPolarHBondContact O-CG 3.09Å; I95-M330 HydrophobicContact CG2-CE 4.21Å; I95-M330 HydrophobicContact CG2-SD 3.52Å; I95-M330 VanDerWaalsContact CG2-SD 3.52Å; Y237-M330 HydrophobicContact CD1-CE 4.05Å; Y237-M330 HydrophobicContact CD2-CB 4.02Å; Y237-M330 HydrophobicContact CD2-CE 3.97Å; Y237-M330 HydrophobicContact CE1-CE 3.95Å; Y237-M330 HydrophobicContact CE2-CB 3.82Å; Y237-M330 HydrophobicContact CE2-CE 3.87Å; Y237-M330 HydrophobicContact CE2-CG 4.02Å; Y237-M330 HydrophobicContact CG-CE 4.06Å; F260-M330 HydrophobicContact CD1-CE 4.01Å; F260-M330 HydrophobicContact CE1-CE 3.42Å; F260-M330 VanDerWaalsContact CE1-CE 3.42Å; F260-M330 HydrophobicContact CE1-SD 4.45Å; F260-M330 HydrophobicContact CE2-CE 4.04Å; F260-M330 HydrophobicContact CZ-CE 3.43Å; F260-M330 VanDerWaalsContact CZ-CE 3.43Å; V326-M330 PolarHBondContact O-N 3.02Å; F327-M330 HydrophobicContact CD1-SD 4.3Å; F327-M330 PolarHBondContact O-N 3.07Å; F327-M330 VanDerWaalsContact O-N 3.14Å; P328-M330 PolarHBondContact O-N 3.33Å; M330-S332 VanDerWaalsContact C-N 3.3Å; M330-S332 PolarHBondContact O-N 3.31Å; M330-R333 WeakPolarHBondContact O-CB 3.1Å; M330-R333 PolarHBondContact O-N 3.44Å; M330-I334 PolarHBondContact O-N 3.3Å
331	I	94	Very high	93.1	Very high	8 Å²	8	17.5 Å²	17.5	4%	0.041	9%	0.087	C	C	.	.	H	α-helix	trans	-62	-38.9	176.4	-69.4	174.3	0	0	0	111.1	A220 F221 I224 F327 P328 G329 R333 I334 L335 M366	A220-I331 HydrophobicContact CB-CD1 4.09Å; A220-I331 HydrophobicContact CB-CG2 3.78Å; F221-I331 HydrophobicContact CD1-CD1 4.28Å; F221-I331 HydrophobicContact CD2-CD1 4Å; F221-I331 HydrophobicContact CE1-CD1 4.13Å; F221-I331 HydrophobicContact CE2-CD1 3.87Å; F221-I331 HydrophobicContact CG-CD1 4.19Å; F221-I331 HydrophobicContact CZ-CD1 3.92Å; I224-I331 HydrophobicContact CD1-CB 3.72Å; I224-I331 HydrophobicContact CD1-CD1 4.09Å; I224-I331 HydrophobicContact CD1-CG1 3.47Å; I224-I331 VanDerWaalsContact CD1-CG1 3.47Å; I224-I331 HydrophobicContact CD1-CG2 3.31Å; I224-I331 HydrophobicContact CG1-CG2 3.93Å; F327-I331 WeakPolarHBondContact O-CB 3.43Å; F327-I331 VanDerWaalsContact O-CG1 3.25Å; F327-I331 WeakPolarHBondContact O-CG1 3.41Å; F327-I331 PolarHBondContact O-N 3.26Å; P328-I331 PolarHBondContact O-N 3.4Å; G329-I331 PolarHBondContact O-N 3.02Å; I331-R333 VanDerWaalsContact C-N 3.26Å; I331-R333 PolarHBondContact O-N 2.87Å; I331-I334 WeakPolarHBondContact O-CB 3.41Å; I331-I334 PolarHBondContact O-N 3.1Å; I331-L335 HydrophobicContact CG2-CD1 3.79Å; I331-L335 HydrophobicContact CG2-CG 4.22Å; I331-L335 WeakPolarHBondContact O-CG 3.48Å; I331-L335 PolarHBondContact O-N 2.75Å; I331-M366 HydrophobicContact CG2-SD 4.32Å
332	S	94.4	Very high	92.8	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-59.3	-38.4	177.4	-165.8	0	0	0	0	112.2	P328 G329 M330 I334 L335 Y336 A362	P328-S332 PolarHBondContact O-N 3.12Å; G329-S332 WeakPolarHBondContact O-CB 3.4Å; G329-S332 PolarHBondContact O-N 3.19Å; M330-S332 VanDerWaalsContact C-N 3.3Å; M330-S332 PolarHBondContact O-N 3.31Å; S332-I334 VanDerWaalsContact C-N 3.34Å; S332-I334 PolarHBondContact O-N 2.98Å; S332-L335 PolarHBondContact O-N 2.6Å; S332-Y336 PolarHBondContact O-N 3.21Å; S332-A362 WeakPolarHBondContact CB-O 3.46Å; S332-A362 VanDerWaalsContact OG-C 3.31Å; S332-A362 WeakPolarHBondContact OG-CA 3.35Å; S332-A362 PolarHBondContact OG-O 2.83Å
333	R	93.4	Very high	92.5	Very high	11 Å²	11	18.5 Å²	18.5	4%	0.042	9%	0.094	C	C	.	.	H	α-helix	trans	-62.9	-39.4	173.9	176.7	166	-175.2	158.9	4.6	112.6	A91 A92 Y237 A240 Y253 G329 M330 I331 P337 V340 A341	A91-R333 HydrophobicContact CB-CB 4.4Å; A91-R333 WeakPolarHBondContact O-CD 3.08Å; A91-R333 PolarHBondContact O-NH1 2.97Å; A92-R333 PolarHBondContact O-NH1 2.73Å; Y237-R333 HydrophobicContact CE2-CB 4.46Å; A240-R333 HydrophobicContact CB-CG 3.88Å; A240-R333 PolarHBondContact O-NE 2.97Å; Y253-R333 PolarHBondContact O-NH2 3.48Å; G329-R333 PolarHBondContact O-N 3.27Å; M330-R333 WeakPolarHBondContact O-CB 3.1Å; M330-R333 PolarHBondContact O-N 3.44Å; I331-R333 VanDerWaalsContact C-N 3.26Å; I331-R333 PolarHBondContact O-N 2.87Å; R333-P337 WeakPolarHBondContact O-CA 3.45Å; R333-V340 HydrophobicContact CB-CG1 4.36Å; R333-A341 HydrophobicContact CG-CB 4.11Å
334	I	92.6	Very high	92.1	Very high	29 Å²	29	16.9 Å²	16.9	15%	0.149	9%	0.088	C	C	.	.	H	α-helix	trans	-64.8	-43.3	177.1	-61.4	169	0	0	0	110.9	I224 L236 Y237 A240 M330 I331 S332	I224-I334 HydrophobicContact CD1-CB 4.39Å; I224-I334 HydrophobicContact CD1-CD1 3.97Å; I224-I334 HydrophobicContact CD1-CG2 4.35Å; L236-I334 HydrophobicContact CB-CD1 3.96Å; L236-I334 HydrophobicContact CB-CG1 4.36Å; L236-I334 HydrophobicContact CB-CG2 3.88Å; Y237-I334 HydrophobicContact CD2-CD1 4.39Å; Y237-I334 HydrophobicContact CD2-CG1 4.23Å; A240-I334 HydrophobicContact CB-CG1 4.26Å; M330-I334 PolarHBondContact O-N 3.3Å; I331-I334 WeakPolarHBondContact O-CB 3.41Å; I331-I334 PolarHBondContact O-N 3.1Å; S332-I334 VanDerWaalsContact C-N 3.34Å; S332-I334 PolarHBondContact O-N 2.98Å
335	L	90.9	Very high	91.7	Very high	28 Å²	28	18.5 Å²	18.5	15%	0.147	10%	0.099	C	C	.	.	H	α-helix	trans	-77.8	-31.4	-176.2	-66	176.7	0	0	0	113.1	K223 I224 I331 S332 L370	K223-L335 HydrophobicContact CB-CD1 4.45Å; K223-L335 HydrophobicContact CG-CD1 4.17Å; K223-L335 HydrophobicContact CG-CD2 3.89Å; I224-L335 HydrophobicContact CG1-CD2 3.96Å; I224-L335 HydrophobicContact CG1-CG 4.25Å; I331-L335 HydrophobicContact CG2-CD1 3.79Å; I331-L335 HydrophobicContact CG2-CG 4.22Å; I331-L335 WeakPolarHBondContact O-CG 3.48Å; I331-L335 PolarHBondContact O-N 2.75Å; S332-L335 PolarHBondContact O-N 2.6Å; L335-L370 HydrophobicContact CD1-CD1 3.91Å; L335-L370 HydrophobicContact CD1-CD2 4.34Å
336	Y	92.4	Very high	91.4	Very high	43 Å²	43	24.2 Å²	24.2	17%	0.169	13%	0.13	C	C	.	.			trans	-132.7	57.5	-173.3	-51.5	-69.9	0	0	0	112.7	S332 D338 V339 V340 K365 M366 D369	S332-Y336 PolarHBondContact O-N 3.21Å; Y336-D338 PolarHBondContact O-N 3.3Å; Y336-V339 PolarHBondContact O-N 2.85Å; Y336-V340 WeakPolarHBondContact O-CB 3.45Å; Y336-V340 PolarHBondContact O-N 2.96Å; Y336-K365 HydrophobicContact CD2-CG 3.83Å; Y336-K365 HydrophobicContact CE2-CG 4.04Å; Y336-K365 HydrophobicContact CG-CG 4.11Å; Y336-M366 HydrophobicContact CE2-CG 4.39Å; Y336-D369 WeakPolarHBondContact CE1-OD2 3.38Å; Y336-D369 WeakPolarHBondContact OH-CB 3.23Å
337	P	91.6	Very high	91	Very high	30 Å²	30	27.2 Å²	27.2	20%	0.195	14%	0.144	C	C	.	.	H	α-helix	trans	-62	-42.3	-173.3	24.2	-33.8	0	0	0	113	R333 V339 A341	R333-P337 WeakPolarHBondContact O-CA 3.45Å; P337-V339 PolarHBondContact O-N 3.45Å; P337-A341 CarbonylContact O-C 3.53Å; P337-A341 WeakPolarHBondContact O-CA 3.24Å; P337-A341 WeakPolarHBondContact O-CB 3.39Å; P337-A341 PolarHBondContact O-N 3.29Å
338	D	90.6	Very high	90.6	Very high	66 Å²	66	25.4 Å²	25.4	35%	0.353	14%	0.136	S	C	.	.	H	α-helix	trans	-65.8	-21.2	-179.8	-63.7	-42	0	0	0	113.9	S243 Y336 C342	S243-D338 VanDerWaalsContact CB-OD1 3.27Å; S243-D338 WeakPolarHBondContact CB-OD1 3.5Å; S243-D338 PolarHBondContact N-OD1 3.01Å; S243-D338 PolarHBondContact OG-OD1 2.88Å; Y336-D338 PolarHBondContact O-N 3.3Å; D338-C342 WeakPolarHBondContact O-CB 3.39Å
339	V	90.3	Very high	90.2	Very high	21 Å²	21	31.9 Å²	31.9	13%	0.127	16%	0.164	C	C	.	.	H	α-helix	trans	-102.1	-49.6	-174.9	175	0	0	0	0	110.6	Y336 P337 Y351 C358 I361	Y336-V339 PolarHBondContact O-N 2.85Å; P337-V339 PolarHBondContact O-N 3.45Å; V339-Y351 HydrophobicContact CG1-CD1 4.24Å; V339-Y351 HydrophobicContact CG1-CG 4.12Å; V339-Y351 HydrophobicContact CG2-CD1 4Å; V339-Y351 HydrophobicContact CG2-CD2 4.33Å; V339-Y351 HydrophobicContact CG2-CE1 3.85Å; V339-Y351 HydrophobicContact CG2-CE2 4.18Å; V339-Y351 HydrophobicContact CG2-CG 4.25Å; V339-C358 VanDerWaalsContact O-CB 3.25Å; V339-C358 WeakPolarHBondContact O-CB 3.38Å; V339-I361 HydrophobicContact CG1-CD1 3.72Å
340	V	91.1	Very high	89.8	Confident	1 Å²	1	38.7 Å²	38.7	1%	0.006	19%	0.193	C	C	.	.	H	α-helix	trans	-83.8	-40.4	-173.6	175.3	0	0	0	0	111.4	A91 R333 Y336 T359 A362	A91-V340 HydrophobicContact CB-CG1 3.96Å; R333-V340 HydrophobicContact CB-CG1 4.36Å; Y336-V340 WeakPolarHBondContact O-CB 3.45Å; Y336-V340 PolarHBondContact O-N 2.96Å; V340-T359 WeakPolarHBondContact O-CG2 3.25Å; V340-T359 PolarHBondContact O-N 2.88Å; V340-A362 HydrophobicContact CG1-CB 3.89Å; V340-A362 HydrophobicContact CG2-CB 4.49Å
341	A	90.1	Very high	89.3	Confident	5 Å²	5	42 Å²	42	4%	0.041	21%	0.206	C	C	.	.	S	Bend	trans	-99.1	21.2	179.9	0	0	0	0	0	112.6	P242 R333 P337 V343	P242-A341 VanDerWaalsContact CG-O 3.29Å; P242-A341 WeakPolarHBondContact CG-O 3.49Å; R333-A341 HydrophobicContact CG-CB 4.11Å; P337-A341 CarbonylContact O-C 3.53Å; P337-A341 WeakPolarHBondContact O-CA 3.24Å; P337-A341 WeakPolarHBondContact O-CB 3.39Å; P337-A341 PolarHBondContact O-N 3.29Å; A341-V343 PolarHBondContact O-N 3.43Å
342	C	88.9	Confident	88.6	Confident	8 Å²	8	42 Å²	42	5%	0.054	21%	0.207	C	C	.	.			trans	-56.9	140.3	175.5	75.4	0	0	0	0	110.5	D338 C348 C358	D338-C342 WeakPolarHBondContact O-CB 3.39Å; C342-C348 HydrophobicContact CB-CB 4.33Å; C342-C348 WeakPolarHBondContact CB-SG 3.22Å; C342-C348 PolarHBondContact O-SG 3.25Å; C342-C348 WeakPolarHBondContact SG-CA 3.34Å; C342-C348 WeakPolarHBondContact SG-CB 3.41Å; C342-C348 CovalentContact SG-SG 2.05Å; C342-C348 PolarHBondContact SG-SG 2.86Å; C342-C358 PolarHBondContact SG-SG 2.94Å
343	V	85.8	Confident	87.9	Confident	17 Å²	17	44.5 Å²	44.5	10%	0.103	23%	0.232	C	C	.	.			trans	-122.8	-23.6	175.1	-70.5	0	0	0	0	112.6	P242 I248 C252 Y253 A341	P242-V343 HydrophobicContact CG-CG2 4.43Å; I248-V343 HydrophobicContact CD1-CB 3.9Å; I248-V343 HydrophobicContact CD1-CG2 4.03Å; I248-V343 WeakPolarHBondContact CD1-O 3.24Å; C252-V343 HydrophobicContact CB-CG1 4.4Å; Y253-V343 HydrophobicContact CD1-CG2 4.34Å; A341-V343 PolarHBondContact O-N 3.43Å
344	D	87.1	Confident	87.2	Confident	35 Å²	35	45.2 Å²	45.2	19%	0.187	24%	0.238	C	C	.	.	S	Bend	trans	-70.9	126.2	177.4	178.4	75.2	0	0	0	111.1	V244 D346 Q347 C348	V244-D344 HydrophobicContact CG1-CB 4.24Å; D344-D346 VanDerWaalsContact C-N 3.3Å; D344-D346 PolarHBondContact O-N 3.15Å; D344-D346 PolarHBondContact OD2-N 3.31Å; D344-Q347 HydrophobicContact CB-CB 4.15Å; D344-Q347 HydrophobicContact CB-CG 4.14Å; D344-Q347 PolarHBondContact O-N 3.38Å; D344-Q347 PolarHBondContact OD2-N 3.49Å; D344-C348 WeakPolarHBondContact O-CB 3.45Å; D344-C348 PolarHBondContact O-N 2.96Å; D344-C348 PolarHBondContact O-SG 3.47Å; D344-C348 VanDerWaalsContact O-SG 3.37Å
345	P	85.7	Confident	86.6	Confident	39 Å²	39	47 Å²	47	25%	0.253	25%	0.253	S	S	.	.	H	α-helix	trans	-55.8	-37.9	-176.5	-31	37.6	0	0	0	114.9	K349 V509	P345-K349 WeakPolarHBondContact O-CB 3.44Å; P345-K349 PolarHBondContact O-N 3.3Å; P345-V509 HydrophobicContact CG-CG2 4.07Å
346	D	87.4	Confident	85.8	Confident	124 Å²	124	47.7 Å²	47.7	66%	0.663	26%	0.258	S	S	*	.	H	α-helix	trans	-75.6	-41.7	-176.7	-70.9	-36.4	0	0	0	110.9	D344 K350	D344-D346 VanDerWaalsContact C-N 3.3Å; D344-D346 PolarHBondContact O-N 3.15Å; D344-D346 PolarHBondContact OD2-N 3.31Å; D346-K350 PolarHBondContact O-N 3.41Å; D346-K350 VanDerWaalsContact O-N 3.1Å
347	Q	86.8	Confident	85.4	Confident	62 Å²	62	46 Å²	46	29%	0.29	25%	0.254	S	S	.	.	H	α-helix	trans	-62.3	-49	172.5	-68.5	-68.4	-19	0	0	111.7	V244 D344 K349 K350 Y351	V244-Q347 HydrophobicContact CG1-CG 4.4Å; D344-Q347 HydrophobicContact CB-CB 4.15Å; D344-Q347 HydrophobicContact CB-CG 4.14Å; D344-Q347 PolarHBondContact O-N 3.38Å; D344-Q347 PolarHBondContact OD2-N 3.49Å; Q347-K349 VanDerWaalsContact C-N 3.31Å; Q347-K349 PolarHBondContact O-N 2.76Å; Q347-K350 WeakPolarHBondContact O-CB 3.46Å; Q347-K350 PolarHBondContact O-N 3.45Å; Q347-K350 VanDerWaalsContact O-N 3.12Å; Q347-Y351 WeakPolarHBondContact O-CD2 3.35Å; Q347-Y351 PolarHBondContact O-N 2.98Å
348	C	86.6	Confident	85.3	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-62.3	-40.6	-180	-67.4	0	0	0	0	111.9	C342 D344 K350 Y351 C352 G353 T354 C358	C342-C348 HydrophobicContact CB-CB 4.33Å; C342-C348 WeakPolarHBondContact CB-SG 3.22Å; C342-C348 PolarHBondContact O-SG 3.25Å; C342-C348 WeakPolarHBondContact SG-CA 3.34Å; C342-C348 WeakPolarHBondContact SG-CB 3.41Å; C342-C348 CovalentContact SG-SG 2.05Å; C342-C348 PolarHBondContact SG-SG 2.86Å; D344-C348 WeakPolarHBondContact O-CB 3.45Å; D344-C348 PolarHBondContact O-N 2.96Å; D344-C348 PolarHBondContact O-SG 3.47Å; D344-C348 VanDerWaalsContact O-SG 3.37Å; C348-K350 PolarHBondContact O-N 3.15Å; C348-Y351 PolarHBondContact O-N 2.89Å; C348-C352 PolarHBondContact O-N 2.98Å; C348-C352 PolarHBondContact O-SG 3.43Å; C348-G353 PolarHBondContact O-N 3.11Å; C348-T354 CarbonylContact C-O 3.59Å; C348-T354 WeakPolarHBondContact CB-O 3.35Å; C348-C358 PolarHBondContact O-SG 3.4Å
349	K	86.3	Confident	85.4	Confident	137 Å²	137	42.3 Å²	42.3	60%	0.596	23%	0.233	S	C	*	.	H	α-helix	trans	-63.2	-33	176.8	-170.4	174	-177	179	0	112.2	P345 Q347 G353 T354	P345-K349 WeakPolarHBondContact O-CB 3.44Å; P345-K349 PolarHBondContact O-N 3.3Å; Q347-K349 VanDerWaalsContact C-N 3.31Å; Q347-K349 PolarHBondContact O-N 2.76Å; K349-G353 WeakPolarHBondContact O-CA 3.21Å; K349-G353 PolarHBondContact O-N 3.3Å; K349-G353 VanDerWaalsContact O-N 3.07Å; K349-T354 PolarHBondContact N-O 3.48Å; K349-T354 VanDerWaalsContact N-O 3.14Å
350	K	85.9	Confident	85.4	Confident	142 Å²	142	41.7 Å²	41.7	62%	0.617	23%	0.229	S	C	*	.	H	α-helix	trans	-65.5	-42.6	174.9	-174.4	-176.5	177.7	-175.4	0	112.4	D346 Q347 C348	D346-K350 PolarHBondContact O-N 3.41Å; D346-K350 VanDerWaalsContact O-N 3.1Å; Q347-K350 WeakPolarHBondContact O-CB 3.46Å; Q347-K350 PolarHBondContact O-N 3.45Å; Q347-K350 VanDerWaalsContact O-N 3.12Å; C348-K350 PolarHBondContact O-N 3.15Å
351	Y	83.5	Confident	85.4	Confident	77 Å²	77	41.9 Å²	41.9	30%	0.302	23%	0.23	S	C	.	.	H	α-helix	trans	-86.7	-42.5	-173.8	-67.5	-62	0	0	0	114.3	V339 Q347 C348	V339-Y351 HydrophobicContact CG1-CD1 4.24Å; V339-Y351 HydrophobicContact CG1-CG 4.12Å; V339-Y351 HydrophobicContact CG2-CD1 4Å; V339-Y351 HydrophobicContact CG2-CD2 4.33Å; V339-Y351 HydrophobicContact CG2-CE1 3.85Å; V339-Y351 HydrophobicContact CG2-CE2 4.18Å; V339-Y351 HydrophobicContact CG2-CG 4.25Å; Q347-Y351 WeakPolarHBondContact O-CD2 3.35Å; Q347-Y351 PolarHBondContact O-N 2.98Å; C348-Y351 PolarHBondContact O-N 2.89Å
352	C	79.9	Confident	85.5	Confident	7 Å²	7	41.6 Å²	41.6	5%	0.047	23%	0.228	C	C	.	.	H	α-helix	trans	-123.5	-2.1	-175.1	62.1	0	0	0	0	114.5	C348 T354 G357 C358 I361	C348-C352 PolarHBondContact O-N 2.98Å; C348-C352 PolarHBondContact O-SG 3.43Å; C352-T354 PolarHBondContact O-N 3.39Å; C352-T354 PolarHBondContact SG-OG1 3.38Å; C352-G357 PolarHBondContact SG-O 3.02Å; C352-C358 HydrophobicContact CB-CB 3.72Å; C352-C358 WeakPolarHBondContact CB-SG 3.25Å; C352-C358 WeakPolarHBondContact SG-CA 3.47Å; C352-C358 WeakPolarHBondContact SG-CB 3.4Å; C352-C358 CovalentContact SG-SG 2.02Å; C352-C358 PolarHBondContact SG-SG 3.04Å; C352-I361 HydrophobicContact CB-CD1 4.26Å; C352-I361 HydrophobicContact CB-CG2 3.92Å
353	G	78.8	Confident	85.7	Confident	52 Å²	52	41.2 Å²	41.2	54%	0.536	23%	0.225	S	C	.	.	S	Bend	trans	76.2	6.4	179.5	0	0	0	0	0	114.5	C348 K349	C348-G353 PolarHBondContact O-N 3.11Å; K349-G353 WeakPolarHBondContact O-CA 3.21Å; K349-G353 PolarHBondContact O-N 3.3Å; K349-G353 VanDerWaalsContact O-N 3.07Å
354	T	79.1	Confident	86	Confident	26 Å²	26	40.5 Å²	40.5	16%	0.16	22%	0.221	C	C	.	.			trans	-119.5	144.3	177	51.9	0	0	0	0	110.6	C348 K349 C352 G357	C348-T354 CarbonylContact C-O 3.59Å; C348-T354 WeakPolarHBondContact CB-O 3.35Å; K349-T354 PolarHBondContact N-O 3.48Å; K349-T354 VanDerWaalsContact N-O 3.14Å; C352-T354 PolarHBondContact O-N 3.39Å; C352-T354 PolarHBondContact SG-OG1 3.38Å; T354-G357 PolarHBondContact OG1-O 2.83Å
355	S	79.1	Confident	86.1	Confident	66 Å²	66	41 Å²	41	46%	0.462	22%	0.222	S	C	.	.	S	Bend	trans	-90.6	-0.7	-177.9	54.8	0	0	0	0	114.2
356	V	75.8	Confident	86.4	Confident	44 Å²	44	39.2 Å²	39.2	27%	0.267	21%	0.21	S	C	.	.	S	Bend	trans	-105.4	-12.9	-169.4	-66.6	0	0	0	0	113.9	N507	V356-N507 HydrophobicContact CG1-CB 4.34Å
357	G	84	Confident	86.5	Confident	7 Å²	7	33.3 Å²	33.3	7%	0.072	18%	0.178	C	C	.	.			trans	140.7	157.1	-174.8	0	0	0	0	0	111.9	C352 T354	C352-G357 PolarHBondContact SG-O 3.02Å; T354-G357 PolarHBondContact OG1-O 2.83Å
358	C	89	Confident	86.6	Confident	2 Å²	2	31.2 Å²	31.2	1%	0.014	17%	0.17	C	C	.	.			trans	-120.6	14.6	-175.9	-65.5	0	0	0	0	113.8	V339 C342 C348 C352 N360 I361	V339-C358 VanDerWaalsContact O-CB 3.25Å; V339-C358 WeakPolarHBondContact O-CB 3.38Å; C342-C358 PolarHBondContact SG-SG 2.94Å; C348-C358 PolarHBondContact O-SG 3.4Å; C352-C358 HydrophobicContact CB-CB 3.72Å; C352-C358 WeakPolarHBondContact CB-SG 3.25Å; C352-C358 WeakPolarHBondContact SG-CA 3.47Å; C352-C358 WeakPolarHBondContact SG-CB 3.4Å; C352-C358 CovalentContact SG-SG 2.02Å; C352-C358 PolarHBondContact SG-SG 3.04Å; C358-N360 PolarHBondContact O-N 2.98Å; C358-N360 VanDerWaalsContact O-N 3.09Å; C358-I361 HydrophobicContact CB-CD1 4.03Å; C358-I361 HydrophobicContact CB-CG1 4.35Å; C358-I361 VanDerWaalsContact O-CG1 3.29Å; C358-I361 WeakPolarHBondContact O-CG1 3.42Å; C358-I361 PolarHBondContact O-N 2.97Å
359	T	91.6	Very high	86.7	Confident	16 Å²	16	34.5 Å²	34.5	10%	0.098	19%	0.187	C	C	.	.	G	3₁₀ helix	trans	-58.5	-32.7	-172.1	57.5	0	0	0	0	113.3	G88 A92 V340 I361 A362 G447	G88-T359 WeakPolarHBondContact CA-O 3.27Å; G88-T359 WeakPolarHBondContact O-CB 3.4Å; A92-T359 HydrophobicContact CB-CG2 4Å; V340-T359 WeakPolarHBondContact O-CG2 3.25Å; V340-T359 PolarHBondContact O-N 2.88Å; T359-I361 PolarHBondContact O-N 3.37Å; T359-A362 WeakPolarHBondContact O-CB 3.29Å; T359-A362 PolarHBondContact O-N 2.73Å; T359-G447 PolarHBondContact OG1-O 2.92Å
360	N	91.2	Very high	86.8	Confident	8 Å²	8	29.2 Å²	29.2	4%	0.043	17%	0.165	C	C	.	.	G	3₁₀ helix	trans	-53.2	-23.9	172.5	-71.6	-33.9	0	0	0	114.7	V84 L165 C358 A362 Q445 G447 L449	V84-N360 HydrophobicContact CG1-CB 3.89Å; V84-N360 VanDerWaalsContact CG1-O 3.25Å; V84-N360 WeakPolarHBondContact CG1-O 3.3Å; L165-N360 HydrophobicContact CD1-CB 4.27Å; C358-N360 PolarHBondContact O-N 2.98Å; C358-N360 VanDerWaalsContact O-N 3.09Å; N360-A362 VanDerWaalsContact C-N 3.3Å; N360-Q445 PolarHBondContact ND2-OE1 3.42Å; N360-G447 PolarHBondContact ND2-O 2.97Å; N360-G447 VanDerWaalsContact ND2-O 3.17Å; N360-G447 PolarHBondContact OD1-O 3.26Å; N360-L449 WeakPolarHBondContact OD1-CB 3.36Å; N360-L449 PolarHBondContact OD1-N 3.33Å; N360-L449 VanDerWaalsContact OD1-N 3.13Å
361	I	90.9	Very high	87	Confident	5 Å²	5	22.9 Å²	22.9	3%	0.026	14%	0.138	C	C	.	.	G	3₁₀ helix	trans	-84.9	-1.6	178.4	83.7	-173.7	0	0	0	113.4	Q169 V339 C352 C358 T359 Y363 P364 K365	Q169-I361 HydrophobicContact CG-CB 4.29Å; Q169-I361 HydrophobicContact CG-CG2 4.24Å; V339-I361 HydrophobicContact CG1-CD1 3.72Å; C352-I361 HydrophobicContact CB-CD1 4.26Å; C352-I361 HydrophobicContact CB-CG2 3.92Å; C358-I361 HydrophobicContact CB-CD1 4.03Å; C358-I361 HydrophobicContact CB-CG1 4.35Å; C358-I361 VanDerWaalsContact O-CG1 3.29Å; C358-I361 WeakPolarHBondContact O-CG1 3.42Å; C358-I361 PolarHBondContact O-N 2.97Å; T359-I361 PolarHBondContact O-N 3.37Å; I361-Y363 PolarHBondContact O-N 3.11Å; I361-P364 VanDerWaalsContact O-CD 3.29Å; I361-P364 WeakPolarHBondContact O-CD 3.5Å; I361-K365 WeakPolarHBondContact O-CB 3.43Å; I361-K365 PolarHBondContact O-N 2.71Å
362	A	92.9	Very high	87.2	Confident	0 Å²	0	22.3 Å²	22.3	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-51.2	-54.4	-175.6	0	0	0	0	0	113.2	A91 S332 V340 T359 N360 M366	A91-A362 HydrophobicContact CB-CB 3.89Å; S332-A362 WeakPolarHBondContact CB-O 3.46Å; S332-A362 VanDerWaalsContact OG-C 3.31Å; S332-A362 WeakPolarHBondContact OG-CA 3.35Å; S332-A362 PolarHBondContact OG-O 2.83Å; V340-A362 HydrophobicContact CG1-CB 3.89Å; V340-A362 HydrophobicContact CG2-CB 4.49Å; T359-A362 WeakPolarHBondContact O-CB 3.29Å; T359-A362 PolarHBondContact O-N 2.73Å; N360-A362 VanDerWaalsContact C-N 3.3Å; A362-M366 PolarHBondContact O-N 2.89Å
363	Y	92.9	Very high	87.5	Confident	0 Å²	0	26.6 Å²	26.6	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-70.5	-49.3	180	-161.5	-83	0	0	0	113.4	F83 A87 S213 L216 L324 P328 I361 K365 M366 V367 M379 M383	F83-Y363 HydrophobicContact CB-CD1 4.23Å; F83-Y363 AromaticContact CD1-CD1 3.79Å; F83-Y363 HydrophobicContact CD1-CD1 3.79Å; F83-Y363 HydrophobicContact CD1-CD2 4.38Å; F83-Y363 AromaticContact CD1-CE1 3.33Å; F83-Y363 HydrophobicContact CD1-CE1 3.33Å; F83-Y363 AromaticContact CD1-CE2 3.97Å; F83-Y363 HydrophobicContact CD1-CE2 3.97Å; F83-Y363 HydrophobicContact CD1-CG 4.3Å; F83-Y363 AromaticContact CD1-CZ 3.42Å; F83-Y363 VanDerWaalsContact CD1-CZ 3.42Å; F83-Y363 AromaticContact CE1-CE1 3.8Å; F83-Y363 HydrophobicContact CE1-CE1 3.8Å; F83-Y363 HydrophobicContact CE1-CE2 4.35Å; F83-Y363 AromaticContact CE1-CZ 3.6Å; F83-Y363 WeakPolarHBondContact CE1-OH 3.34Å; F83-Y363 HydrophobicContact CG-CD1 4.43Å; F83-Y363 HydrophobicContact CG-CE1 4.27Å; F83-Y363 WeakPolarHBondContact O-CB 3.35Å; A87-Y363 HydrophobicContact CB-CD2 4Å; A87-Y363 HydrophobicContact CB-CG 4.34Å; S213-Y363 PolarHBondContact OG-OH 3.02Å; L216-Y363 HydrophobicContact CD2-CD1 4.39Å; L216-Y363 HydrophobicContact CD2-CD2 4.36Å; L216-Y363 HydrophobicContact CD2-CE1 3.74Å; L216-Y363 HydrophobicContact CD2-CE2 3.71Å; L216-Y363 WeakPolarHBondContact CD2-OH 3.29Å; L324-Y363 WeakPolarHBondContact O-CE2 3.36Å; P328-Y363 HydrophobicContact CB-CD2 4.27Å; P328-Y363 HydrophobicContact CB-CE2 4.13Å; I361-Y363 PolarHBondContact O-N 3.11Å; Y363-K365 PolarHBondContact O-N 3.02Å; Y363-M366 HydrophobicContact CD2-CE 3.94Å; Y363-M366 HydrophobicContact CG-CE 4.34Å; Y363-M366 PolarHBondContact O-N 3Å; Y363-V367 HydrophobicContact CD1-CG2 3.82Å; Y363-V367 HydrophobicContact CE1-CG2 3.65Å; Y363-V367 WeakPolarHBondContact O-CG2 3.35Å; Y363-V367 PolarHBondContact O-N 2.71Å; Y363-V367 VanDerWaalsContact O-N 3.14Å; Y363-M379 HydrophobicContact CE1-CE 4.19Å; Y363-M383 HydrophobicContact CD1-CE 4.1Å; Y363-M383 HydrophobicContact CD1-SD 4.08Å; Y363-M383 HydrophobicContact CE1-CE 4.37Å; Y363-M383 HydrophobicContact CE1-SD 3.87Å
364	P	90.8	Very high	87.8	Confident	1 Å²	1	24.9 Å²	24.9	1%	0.006	15%	0.148	C	C	.	.	H	α-helix	trans	-51.4	-42.5	174.2	-19	20.2	0	0	0	113.2	V84 F166 Q169 I361 M366 V367 V368	V84-P364 HydrophobicContact CG2-CG 4.26Å; F166-P364 HydrophobicContact CD2-CB 3.72Å; F166-P364 HydrophobicContact CD2-CG 3.86Å; F166-P364 HydrophobicContact CE2-CB 4.09Å; Q169-P364 HydrophobicContact CB-CB 3.91Å; Q169-P364 HydrophobicContact CG-CB 4.11Å; I361-P364 VanDerWaalsContact O-CD 3.29Å; I361-P364 WeakPolarHBondContact O-CD 3.5Å; P364-M366 PolarHBondContact O-N 2.7Å; P364-V367 PolarHBondContact O-N 3.1Å; P364-V368 WeakPolarHBondContact O-CG2 3.47Å; P364-V368 PolarHBondContact O-N 2.53Å; P364-V368 VanDerWaalsContact O-N 3.07Å
365	K	90.1	Very high	88.1	Confident	47 Å²	47	25.1 Å²	25.1	20%	0.204	15%	0.148	C	C	.	.	H	α-helix	trans	-62	-42.9	-178.7	-175	56.1	168.9	159	0	112.2	Y336 I361 Y363 V368 D369	Y336-K365 HydrophobicContact CD2-CG 3.83Å; Y336-K365 HydrophobicContact CE2-CG 4.04Å; Y336-K365 HydrophobicContact CG-CG 4.11Å; I361-K365 WeakPolarHBondContact O-CB 3.43Å; I361-K365 PolarHBondContact O-N 2.71Å; Y363-K365 PolarHBondContact O-N 3.02Å; K365-V368 PolarHBondContact O-N 3.18Å; K365-D369 WeakPolarHBondContact CE-OD2 3.5Å; K365-D369 VanDerWaalsContact NZ-CG 3.31Å; K365-D369 IonicContact NZ-OD1 2.65Å; K365-D369 PolarHBondContact NZ-OD1 3.36Å; K365-D369 IonicContact NZ-OD2 3.69Å; K365-D369 PolarHBondContact NZ-OD2 2.86Å; K365-D369 WeakPolarHBondContact O-CB 3.3Å; K365-D369 PolarHBondContact O-N 3.25Å
366	M	91	Very high	88.5	Confident	0 Å²	0	23.3 Å²	23.3	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-65.5	-40.9	175.4	-72.8	-171.7	-62.5	0	0	113	L216 A220 P328 I331 Y336 A362 Y363 P364 V368 L370	L216-M366 HydrophobicContact CD1-CB 4.14Å; L216-M366 HydrophobicContact CD2-CB 4.48Å; L216-M366 HydrophobicContact CD2-CE 4.38Å; A220-M366 HydrophobicContact CB-SD 4.38Å; P328-M366 HydrophobicContact CB-CE 3.43Å; P328-M366 VanDerWaalsContact CB-CE 3.43Å; P328-M366 HydrophobicContact CB-SD 4.14Å; P328-M366 WeakPolarHBondContact O-CE 3.32Å; I331-M366 HydrophobicContact CG2-SD 4.32Å; Y336-M366 HydrophobicContact CE2-CG 4.39Å; A362-M366 PolarHBondContact O-N 2.89Å; Y363-M366 HydrophobicContact CD2-CE 3.94Å; Y363-M366 HydrophobicContact CG-CE 4.34Å; Y363-M366 PolarHBondContact O-N 3Å; P364-M366 PolarHBondContact O-N 2.7Å; M366-V368 VanDerWaalsContact C-N 3.28Å; M366-V368 PolarHBondContact O-N 3.34Å; M366-L370 HydrophobicContact CB-CD1 4.09Å; M366-L370 HydrophobicContact CG-CD1 4.12Å; M366-L370 VanDerWaalsContact O-CB 3.23Å; M366-L370 WeakPolarHBondContact O-CB 3.36Å; M366-L370 PolarHBondContact O-N 3.08Å
367	V	91.3	Very high	89	Confident	0 Å²	0	21.2 Å²	21.2	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-59.6	-43.7	178	174.8	0	0	0	0	110.3	L216 Y363 P364 M371 M379 L380 M383	L216-V367 HydrophobicContact CD2-CG2 3.83Å; Y363-V367 HydrophobicContact CD1-CG2 3.82Å; Y363-V367 HydrophobicContact CE1-CG2 3.65Å; Y363-V367 WeakPolarHBondContact O-CG2 3.35Å; Y363-V367 PolarHBondContact O-N 2.71Å; Y363-V367 VanDerWaalsContact O-N 3.14Å; P364-V367 PolarHBondContact O-N 3.1Å; V367-M371 HydrophobicContact CB-CE 4.4Å; V367-M371 HydrophobicContact CG1-CE 4.22Å; V367-M371 HydrophobicContact CG1-SD 4.04Å; V367-M371 HydrophobicContact CG2-CE 4.09Å; V367-M371 VanDerWaalsContact O-CB 3.31Å; V367-M371 WeakPolarHBondContact O-CB 3.48Å; V367-M371 WeakPolarHBondContact O-CG 3.03Å; V367-M379 HydrophobicContact CG1-CB 3.89Å; V367-M379 HydrophobicContact CG2-CE 4.38Å; V367-L380 HydrophobicContact CG1-CD2 4.29Å; V367-M383 HydrophobicContact CG2-SD 4.24Å
368	V	88.2	Confident	89.1	Confident	19 Å²	19	23.1 Å²	23.1	12%	0.115	13%	0.127	C	C	.	.	H	α-helix	trans	-71.4	-41.8	-176.8	170.3	0	0	0	0	112.6	A21 P364 K365 M366	A21-V368 HydrophobicContact CB-CG1 3.47Å; A21-V368 VanDerWaalsContact CB-CG1 3.47Å; A21-V368 HydrophobicContact CB-CG2 4.39Å; P364-V368 WeakPolarHBondContact O-CG2 3.47Å; P364-V368 PolarHBondContact O-N 2.53Å; P364-V368 VanDerWaalsContact O-N 3.07Å; K365-V368 PolarHBondContact O-N 3.18Å; M366-V368 VanDerWaalsContact C-N 3.28Å; M366-V368 PolarHBondContact O-N 3.34Å
369	D	88.3	Confident	89	Confident	69 Å²	69	23 Å²	23	37%	0.369	13%	0.126	S	C	.	.	H	α-helix	trans	-93.8	-29	-170.3	-72.6	11.5	0	0	0	113.9	Y336 K365	Y336-D369 WeakPolarHBondContact CE1-OD2 3.38Å; Y336-D369 WeakPolarHBondContact OH-CB 3.23Å; K365-D369 WeakPolarHBondContact CE-OD2 3.5Å; K365-D369 VanDerWaalsContact NZ-CG 3.31Å; K365-D369 IonicContact NZ-OD1 2.65Å; K365-D369 PolarHBondContact NZ-OD1 3.36Å; K365-D369 IonicContact NZ-OD2 3.69Å; K365-D369 PolarHBondContact NZ-OD2 2.86Å; K365-D369 WeakPolarHBondContact O-CB 3.3Å; K365-D369 PolarHBondContact O-N 3.25Å
370	L	89.4	Confident	88.7	Confident	25 Å²	25	22.7 Å²	22.7	13%	0.131	12%	0.124	C	C	.	.	H	α-helix	trans	-96.9	-28	-175.9	-60	179.6	0	0	0	113.7	A220 K223 L335 M366	A220-L370 HydrophobicContact CB-CD1 4.33Å; K223-L370 HydrophobicContact CB-CD2 4.25Å; K223-L370 HydrophobicContact CD-CD2 4.32Å; K223-L370 HydrophobicContact CG-CD2 3.89Å; L335-L370 HydrophobicContact CD1-CD1 3.91Å; L335-L370 HydrophobicContact CD1-CD2 4.34Å; M366-L370 HydrophobicContact CB-CD1 4.09Å; M366-L370 HydrophobicContact CG-CD1 4.12Å; M366-L370 VanDerWaalsContact O-CB 3.23Å; M366-L370 WeakPolarHBondContact O-CB 3.36Å; M366-L370 PolarHBondContact O-N 3.08Å
371	M	88.4	Confident	88.4	Confident	10 Å²	10	22.4 Å²	22.4	5%	0.049	12%	0.122	C	C	.	.	S	Bend	trans	-80.8	137.4	-175.1	-64.4	-163	-175	0	0	112.6	L216 V367 L375 R376 M379	L216-M371 HydrophobicContact CB-CE 3.37Å; L216-M371 HydrophobicContact CD1-CE 3.42Å; L216-M371 VanDerWaalsContact CD1-CE 3.42Å; L216-M371 HydrophobicContact CD1-CG 4.2Å; L216-M371 HydrophobicContact CD2-CE 3.9Å; L216-M371 HydrophobicContact CG-CE 3.68Å; V367-M371 HydrophobicContact CB-CE 4.4Å; V367-M371 HydrophobicContact CG1-CE 4.22Å; V367-M371 HydrophobicContact CG1-SD 4.04Å; V367-M371 HydrophobicContact CG2-CE 4.09Å; V367-M371 VanDerWaalsContact O-CB 3.31Å; V367-M371 WeakPolarHBondContact O-CB 3.48Å; V367-M371 WeakPolarHBondContact O-CG 3.03Å; M371-L375 HydrophobicContact SD-CD2 4.34Å; M371-L375 HydrophobicContact SD-CG 4.11Å; M371-R376 HydrophobicContact CB-CB 3.87Å; M371-M379 HydrophobicContact CE-CB 3.94Å; M371-M379 HydrophobicContact CE-CE 3.81Å; M371-M379 HydrophobicContact CE-CG 3.54Å; M371-M379 HydrophobicContact CE-SD 4.37Å; M371-M379 HydrophobicContact SD-CB 3.57Å; M371-M379 VanDerWaalsContact SD-CB 3.57Å; M371-M379 HydrophobicContact SD-CG 3.47Å; M371-M379 WeakPolarHBondContact SD-CG 3.23Å
372	P	88.7	Confident	88.2	Confident	64 Å²	64	22.1 Å²	22.1	42%	0.416	12%	0.121	S	C	.	.	P	Polyproline II helix	trans	-67	160.1	172.4	29.4	-34.7	0	0	0	111.5	F219 L375 R376	F219-P372 HydrophobicContact CZ-CG 4.27Å; P372-L375 HydrophobicContact CG-CB 4.1Å; P372-L375 HydrophobicContact CG-CD2 4.37Å; P372-L375 PolarHBondContact O-N 2.94Å; P372-R376 PolarHBondContact O-N 2.77Å
373	N	86.5	Confident	87.8	Confident	98 Å²	98	22.2 Å²	22.2	52%	0.524	12%	0.122	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.8	141.8	173.3	-60.9	-40.1	0	0	0	111.3	N24 L375 R376	N24-N373 VanDerWaalsContact ND2-CB 3.32Å; N24-N373 WeakPolarHBondContact ND2-CB 3.36Å; N24-N373 PolarHBondContact ND2-ND2 3.36Å; N24-N373 VanDerWaalsContact ND2-ND2 3.15Å; N24-N373 PolarHBondContact ND2-OD1 3.21Å; N373-L375 VanDerWaalsContact C-N 3.27Å; N373-L375 PolarHBondContact O-N 3.3Å; N373-R376 PolarHBondContact OD1-NH2 3.28Å
374	G	84.4	Confident	87.4	Confident	15 Å²	15	23.6 Å²	23.6	16%	0.155	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	86.6	-55.8	-172.5	0	0	0	0	0	112.1	D27 G377 L378	D27-G374 WeakPolarHBondContact OD1-CA 3.43Å; D27-G374 PolarHBondContact OD1-N 3.49Å; G374-G377 PolarHBondContact O-N 3.26Å; G374-L378 PolarHBondContact O-N 2.99Å
375	L	86.1	Confident	87	Confident	31 Å²	31	23.8 Å²	23.8	16%	0.162	13%	0.13	C	C	.	.	H	α-helix	trans	-69.2	-37.6	178.9	-174.2	67.7	0	0	0	111.8	I215 F219 M371 P372 N373 L378 M379	I215-L375 HydrophobicContact CB-CD2 4.22Å; I215-L375 HydrophobicContact CD1-CD1 3.96Å; I215-L375 HydrophobicContact CD1-CD2 4.5Å; I215-L375 HydrophobicContact CG2-CD2 3.33Å; F219-L375 HydrophobicContact CE2-CD2 4.01Å; M371-L375 HydrophobicContact SD-CD2 4.34Å; M371-L375 HydrophobicContact SD-CG 4.11Å; P372-L375 HydrophobicContact CG-CB 4.1Å; P372-L375 HydrophobicContact CG-CD2 4.37Å; P372-L375 PolarHBondContact O-N 2.94Å; N373-L375 VanDerWaalsContact C-N 3.27Å; N373-L375 PolarHBondContact O-N 3.3Å; L375-L378 HydrophobicContact CD1-CB 4.47Å; L375-L378 HydrophobicContact CD1-CD2 4Å; L375-L378 WeakPolarHBondContact O-CB 3.33Å; L375-L378 PolarHBondContact O-N 2.97Å; L375-M379 PolarHBondContact O-N 3.39Å
376	R	87.4	Confident	86.7	Confident	28 Å²	28	21.5 Å²	21.5	11%	0.106	12%	0.12	C	C	.	.	H	α-helix	trans	-55.1	-52.3	169.8	-176.4	176.1	59.6	-179	0.1	110.4	A21 D27 M371 P372 N373 L378 M379 L380	A21-R376 PolarHBondContact O-NH1 3.43Å; A21-R376 PolarHBondContact O-NH2 3.46Å; D27-R376 IonicContact OD2-CZ 3.63Å; D27-R376 VanDerWaalsContact OD2-CZ 3.29Å; D27-R376 IonicContact OD2-NE 3.47Å; D27-R376 PolarHBondContact OD2-NE 2.91Å; D27-R376 IonicContact OD2-NH2 2.77Å; D27-R376 PolarHBondContact OD2-NH2 2.97Å; M371-R376 HydrophobicContact CB-CB 3.87Å; P372-R376 PolarHBondContact O-N 2.77Å; N373-R376 PolarHBondContact OD1-NH2 3.28Å; R376-L378 VanDerWaalsContact C-N 3.31Å; R376-L378 PolarHBondContact O-N 3.45Å; R376-M379 PolarHBondContact O-N 2.92Å; R376-M379 VanDerWaalsContact O-N 3.13Å; R376-L380 HydrophobicContact CG-CD1 4.12Å; R376-L380 HydrophobicContact CG-CG 4.39Å; R376-L380 VanDerWaalsContact O-CG 3.23Å; R376-L380 WeakPolarHBondContact O-CG 3.41Å; R376-L380 PolarHBondContact O-N 3.37Å
377	G	85.6	Confident	86.4	Confident	0 Å²	0	21.5 Å²	21.5	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-54.7	-42.6	174.3	0	0	0	0	0	113.4	D27 I31 G374 M379 L380 S381	D27-G377 PolarHBondContact OD1-N 3.1Å; I31-G377 WeakPolarHBondContact CG1-O 3.46Å; G374-G377 PolarHBondContact O-N 3.26Å; G377-M379 PolarHBondContact O-N 3.47Å; G377-L380 PolarHBondContact O-N 3.25Å; G377-S381 PolarHBondContact O-N 3.44Å; G377-S381 PolarHBondContact O-OG 2.97Å
378	L	86.6	Confident	85.9	Confident	48 Å²	48	22.1 Å²	22.1	25%	0.251	12%	0.123	S	C	.	.	H	α-helix	trans	-58.4	-48.9	174.9	-174.4	64.3	0	0	0	111.4	V30 Y34 I208 G374 L375 R376 S381 V382	V30-L378 HydrophobicContact CG1-CB 3.75Å; V30-L378 HydrophobicContact CG1-CD1 3.98Å; V30-L378 HydrophobicContact CG1-CG 4.48Å; Y34-L378 HydrophobicContact CD2-CD1 4.32Å; I208-L378 HydrophobicContact CG2-CD1 4.06Å; I208-L378 HydrophobicContact CG2-CG 4.35Å; G374-L378 PolarHBondContact O-N 2.99Å; L375-L378 HydrophobicContact CD1-CB 4.47Å; L375-L378 HydrophobicContact CD1-CD2 4Å; L375-L378 WeakPolarHBondContact O-CB 3.33Å; L375-L378 PolarHBondContact O-N 2.97Å; R376-L378 VanDerWaalsContact C-N 3.31Å; R376-L378 PolarHBondContact O-N 3.45Å; L378-S381 VanDerWaalsContact O-CB 3.31Å; L378-S381 WeakPolarHBondContact O-CB 3.31Å; L378-S381 PolarHBondContact O-N 3.42Å; L378-S381 VanDerWaalsContact O-N 3.16Å; L378-V382 VanDerWaalsContact O-CG2 3.27Å; L378-V382 WeakPolarHBondContact O-CG2 3.39Å; L378-V382 PolarHBondContact O-N 2.92Å
379	M	87	Confident	85.7	Confident	0 Å²	0	21.4 Å²	21.4	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-69	-36.4	-177.9	-83.4	-73.2	-68.5	0	0	113.1	G212 Y363 V367 M371 L375 R376 G377 S381 V382 M383	G212-M379 WeakPolarHBondContact CA-SD 3.29Å; Y363-M379 HydrophobicContact CE1-CE 4.19Å; V367-M379 HydrophobicContact CG1-CB 3.89Å; V367-M379 HydrophobicContact CG2-CE 4.38Å; M371-M379 HydrophobicContact CE-CB 3.94Å; M371-M379 HydrophobicContact CE-CE 3.81Å; M371-M379 HydrophobicContact CE-CG 3.54Å; M371-M379 HydrophobicContact CE-SD 4.37Å; M371-M379 HydrophobicContact SD-CB 3.57Å; M371-M379 VanDerWaalsContact SD-CB 3.57Å; M371-M379 HydrophobicContact SD-CG 3.47Å; M371-M379 WeakPolarHBondContact SD-CG 3.23Å; L375-M379 PolarHBondContact O-N 3.39Å; R376-M379 PolarHBondContact O-N 2.92Å; R376-M379 VanDerWaalsContact O-N 3.13Å; G377-M379 PolarHBondContact O-N 3.47Å; M379-S381 VanDerWaalsContact C-N 3.28Å; M379-S381 PolarHBondContact O-N 3.35Å; M379-V382 PolarHBondContact O-N 2.89Å; M379-V382 HydrophobicContact SD-CG1 4.49Å; M379-M383 WeakPolarHBondContact O-CB 3.4Å; M379-M383 WeakPolarHBondContact O-CG 3.18Å; M379-M383 PolarHBondContact O-N 3.47Å
380	L	84.8	Confident	85.6	Confident	9 Å²	9	18.2 Å²	18.2	5%	0.047	10%	0.102	C	C	.	.	H	α-helix	trans	-60.1	-41.5	170.3	-65.4	175.2	0	0	0	111.4	I22 F166 A170 V367 R376 G377 M384	I22-L380 HydrophobicContact CD1-CD1 3.46Å; I22-L380 VanDerWaalsContact CD1-CD1 3.46Å; I22-L380 HydrophobicContact CG1-CD1 3.54Å; F166-L380 HydrophobicContact CE1-CB 4.45Å; F166-L380 HydrophobicContact CE1-CD2 3.57Å; F166-L380 HydrophobicContact CE2-CD2 4.25Å; F166-L380 HydrophobicContact CZ-CD2 3.34Å; F166-L380 HydrophobicContact CZ-CG 4.46Å; A170-L380 HydrophobicContact CB-CD1 4.25Å; A170-L380 HydrophobicContact CB-CD2 3.5Å; A170-L380 VanDerWaalsContact CB-CD2 3.5Å; V367-L380 HydrophobicContact CG1-CD2 4.29Å; R376-L380 HydrophobicContact CG-CD1 4.12Å; R376-L380 HydrophobicContact CG-CG 4.39Å; R376-L380 VanDerWaalsContact O-CG 3.23Å; R376-L380 WeakPolarHBondContact O-CG 3.41Å; R376-L380 PolarHBondContact O-N 3.37Å; G377-L380 PolarHBondContact O-N 3.25Å; L380-M384 WeakPolarHBondContact O-CB 3.43Å; L380-M384 PolarHBondContact O-N 3.42Å
381	S	85.4	Confident	85.5	Confident	1 Å²	1	17 Å²	17	1%	0.007	10%	0.096	C	C	.	.	H	α-helix	trans	-65.4	-45.5	178	-49.1	0	0	0	0	112.2	I31 Y34 G377 L378 M379 M383 M384 A385	I31-S381 VanDerWaalsContact CA-OG 3.22Å; I31-S381 WeakPolarHBondContact CA-OG 3.45Å; I31-S381 WeakPolarHBondContact CG1-OG 3.4Å; Y34-S381 VanDerWaalsContact CD1-CB 3.48Å; G377-S381 PolarHBondContact O-N 3.44Å; G377-S381 PolarHBondContact O-OG 2.97Å; L378-S381 VanDerWaalsContact O-CB 3.31Å; L378-S381 WeakPolarHBondContact O-CB 3.31Å; L378-S381 PolarHBondContact O-N 3.42Å; L378-S381 VanDerWaalsContact O-N 3.16Å; M379-S381 VanDerWaalsContact C-N 3.28Å; M379-S381 PolarHBondContact O-N 3.35Å; S381-M383 PolarHBondContact O-N 3.04Å; S381-M384 PolarHBondContact O-N 2.98Å; S381-A385 PolarHBondContact O-N 2.92Å
382	V	85.9	Confident	85.2	Confident	0 Å²	0	16.7 Å²	16.7	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-58.7	-47.6	177.6	162.4	0	0	0	0	111.1	Y34 I208 M209 L378 M379 M384 A385 S386	Y34-V382 HydrophobicContact CE2-CG2 4.15Å; I208-V382 HydrophobicContact CB-CG2 4.06Å; I208-V382 HydrophobicContact CG2-CG2 3.29Å; M209-V382 VanDerWaalsContact CA-CG1 3.45Å; M209-V382 HydrophobicContact CB-CG1 3.63Å; M209-V382 HydrophobicContact CG-CG1 3.85Å; L378-V382 VanDerWaalsContact O-CG2 3.27Å; L378-V382 WeakPolarHBondContact O-CG2 3.39Å; L378-V382 PolarHBondContact O-N 2.92Å; M379-V382 PolarHBondContact O-N 2.89Å; M379-V382 HydrophobicContact SD-CG1 4.49Å; V382-M384 VanDerWaalsContact C-N 3.34Å; V382-A385 PolarHBondContact O-N 3.42Å; V382-S386 PolarHBondContact O-N 3.44Å
383	M	85.5	Confident	85	Confident	2 Å²	2	13.7 Å²	13.7	1%	0.01	8%	0.075	C	C	.	.	H	α-helix	trans	-67.4	-39.4	-179.6	-70.2	-175.8	63.8	0	0	110.9	F83 F166 Y363 V367 M379 S381 A385 S386 L387	F83-M383 HydrophobicContact CB-CE 3.47Å; F83-M383 VanDerWaalsContact CB-CE 3.47Å; F83-M383 HydrophobicContact CD1-CE 4.34Å; F83-M383 HydrophobicContact CD2-CE 4.25Å; F83-M383 HydrophobicContact CD2-CG 4.41Å; F83-M383 HydrophobicContact CG-CE 3.79Å; F83-M383 HydrophobicContact CG-SD 4.46Å; F166-M383 HydrophobicContact CD1-CB 4.19Å; F166-M383 HydrophobicContact CD1-CE 4.47Å; F166-M383 HydrophobicContact CD2-CE 3.31Å; F166-M383 HydrophobicContact CD2-SD 4.02Å; F166-M383 HydrophobicContact CE1-CB 3.59Å; F166-M383 HydrophobicContact CE1-CE 4.3Å; F166-M383 HydrophobicContact CE1-CG 4.41Å; F166-M383 HydrophobicContact CE1-SD 4.16Å; F166-M383 HydrophobicContact CE2-CB 4.34Å; F166-M383 HydrophobicContact CE2-CE 3.13Å; F166-M383 HydrophobicContact CE2-CG 4.39Å; F166-M383 HydrophobicContact CE2-SD 3.18Å; F166-M383 WeakPolarHBondContact CE2-SD 3.17Å; F166-M383 HydrophobicContact CG-CE 3.99Å; F166-M383 HydrophobicContact CZ-CB 3.65Å; F166-M383 HydrophobicContact CZ-CE 3.64Å; F166-M383 HydrophobicContact CZ-CG 3.95Å; F166-M383 HydrophobicContact CZ-SD 3.22Å; F166-M383 WeakPolarHBondContact CZ-SD 3.35Å; Y363-M383 HydrophobicContact CD1-CE 4.1Å; Y363-M383 HydrophobicContact CD1-SD 4.08Å; Y363-M383 HydrophobicContact CE1-CE 4.37Å; Y363-M383 HydrophobicContact CE1-SD 3.87Å; V367-M383 HydrophobicContact CG2-SD 4.24Å; M379-M383 WeakPolarHBondContact O-CB 3.4Å; M379-M383 WeakPolarHBondContact O-CG 3.18Å; M379-M383 PolarHBondContact O-N 3.47Å; S381-M383 PolarHBondContact O-N 3.04Å; M383-A385 PolarHBondContact O-N 3.24Å; M383-S386 PolarHBondContact O-N 3.36Å; M383-S386 PolarHBondContact O-OG 2.9Å; M383-L387 PolarHBondContact O-N 3.36Å; M383-L387 VanDerWaalsContact O-N 3.1Å
384	M	83.1	Confident	85.1	Confident	29 Å²	29	9.2 Å²	9.2	14%	0.143	5%	0.051	C	C	.	.	H	α-helix	trans	-60.4	-43.7	171.8	-168.7	67.7	68.5	0	0	112.2	F35 I167 L182 L380 S381 V382 L387 M388	F35-M384 HydrophobicContact CZ-CB 4.05Å; F35-M384 HydrophobicContact CZ-CG 3.69Å; I167-M384 HydrophobicContact CD1-CE 3.47Å; I167-M384 VanDerWaalsContact CD1-CE 3.47Å; I167-M384 HydrophobicContact CD1-SD 3.98Å; I167-M384 HydrophobicContact CG1-CE 3.36Å; I167-M384 HydrophobicContact CG1-SD 4.37Å; L182-M384 HydrophobicContact CD1-SD 3.41Å; L182-M384 WeakPolarHBondContact CD1-SD 3.3Å; L380-M384 WeakPolarHBondContact O-CB 3.43Å; L380-M384 PolarHBondContact O-N 3.42Å; S381-M384 PolarHBondContact O-N 2.98Å; V382-M384 VanDerWaalsContact C-N 3.34Å; M384-L387 WeakPolarHBondContact O-CB 3.41Å; M384-L387 PolarHBondContact O-N 3.04Å; M384-L387 HydrophobicContact SD-CD1 4.34Å; M384-M388 HydrophobicContact CG-CE 4.04Å; M384-M388 WeakPolarHBondContact O-CG 3.18Å; M384-M388 PolarHBondContact O-N 3.08Å; M384-M388 VanDerWaalsContact O-N 3.14Å; M384-M388 HydrophobicContact SD-CE 3.86Å
385	A	82.4	Confident	85.2	Confident	4 Å²	4	8.5 Å²	8.5	3%	0.033	4%	0.043	C	C	.	.	H	α-helix	trans	-66.4	-37.4	175	0	0	0	0	0	112.9	Y34 Q205 S381 V382 M383 L387 M388 S389	Y34-A385 HydrophobicContact CE1-CB 3.54Å; Y34-A385 WeakPolarHBondContact OH-CB 3.41Å; Q205-A385 HydrophobicContact CG-CB 4.17Å; Q205-A385 PolarHBondContact OE1-O 2.92Å; S381-A385 PolarHBondContact O-N 2.92Å; V382-A385 PolarHBondContact O-N 3.42Å; M383-A385 PolarHBondContact O-N 3.24Å; A385-L387 PolarHBondContact O-N 3.28Å; A385-M388 CarbonylContact O-C 3.41Å; A385-M388 WeakPolarHBondContact O-CA 3.29Å; A385-M388 WeakPolarHBondContact O-CB 3.34Å; A385-M388 PolarHBondContact O-N 3.43Å; A385-S389 WeakPolarHBondContact O-CB 3.26Å; A385-S389 PolarHBondContact O-N 3.35Å
386	S	84.6	Confident	85	Confident	0 Å²	0	7.6 Å²	7.6	0%	0	4%	0.039	C	C	.	.	H	α-helix	trans	-58	-39.5	175.1	76.6	0	0	0	0	112.8	V382 M383 S389 S390	V382-S386 PolarHBondContact O-N 3.44Å; M383-S386 PolarHBondContact O-N 3.36Å; M383-S386 PolarHBondContact O-OG 2.9Å; S386-S389 PolarHBondContact O-N 3.45Å; S386-S390 PolarHBondContact O-N 3.03Å; S386-S390 PolarHBondContact O-OG 3.22Å
387	L	84.5	Confident	85	Confident	0 Å²	0	6.3 Å²	6.3	0%	0	3%	0.034	C	C	.	.	H	α-helix	trans	-60.1	-47.8	170.4	-74.3	157.4	0	0	0	112.2	S80 D159 G163 L182 M383 M384 A385 S389 L391	S80-L387 WeakPolarHBondContact OG-CD2 3.29Å; D159-L387 VanDerWaalsContact O-CD2 3.24Å; D159-L387 WeakPolarHBondContact O-CD2 3.43Å; G163-L387 VanDerWaalsContact CA-CD2 3.44Å; L182-L387 HydrophobicContact CD1-CB 4Å; L182-L387 HydrophobicContact CD1-CD1 3.97Å; L182-L387 HydrophobicContact CD1-CG 4.47Å; M383-L387 PolarHBondContact O-N 3.36Å; M383-L387 VanDerWaalsContact O-N 3.1Å; M384-L387 WeakPolarHBondContact O-CB 3.41Å; M384-L387 PolarHBondContact O-N 3.04Å; M384-L387 HydrophobicContact SD-CD1 4.34Å; A385-L387 PolarHBondContact O-N 3.28Å; L387-S389 VanDerWaalsContact C-N 3.34Å; L387-S389 PolarHBondContact O-N 3.36Å; L387-L391 WeakPolarHBondContact O-CB 3.37Å; L387-L391 WeakPolarHBondContact O-CG 3.46Å; L387-L391 PolarHBondContact O-N 3.1Å
388	M	81.8	Confident	85.2	Confident	12 Å²	12	6.3 Å²	6.3	6%	0.059	3%	0.034	C	C	.	.	H	α-helix	trans	-61	-44.5	178.9	-60.3	-57.2	154.6	0	0	111.5	L182 I185 T186 M384 A385 T392	L182-M388 HydrophobicContact CD1-CE 3.36Å; L182-M388 HydrophobicContact CG-CE 4.06Å; L182-M388 WeakPolarHBondContact O-CE 3.48Å; I185-M388 HydrophobicContact CB-CE 3.72Å; I185-M388 HydrophobicContact CB-SD 4.21Å; I185-M388 HydrophobicContact CG2-CE 3.68Å; I185-M388 HydrophobicContact CG2-CG 4.44Å; I185-M388 HydrophobicContact CG2-SD 3.89Å; T186-M388 WeakPolarHBondContact CA-SD 3.48Å; T186-M388 HydrophobicContact CG2-SD 4.14Å; T186-M388 PolarHBondContact N-SD 3.4Å; T186-M388 VanDerWaalsContact N-SD 3.36Å; T186-M388 PolarHBondContact OG1-SD 2.93Å; M384-M388 HydrophobicContact CG-CE 4.04Å; M384-M388 WeakPolarHBondContact O-CG 3.18Å; M384-M388 PolarHBondContact O-N 3.08Å; M384-M388 VanDerWaalsContact O-N 3.14Å; M384-M388 HydrophobicContact SD-CE 3.86Å; A385-M388 CarbonylContact O-C 3.41Å; A385-M388 WeakPolarHBondContact O-CA 3.29Å; A385-M388 WeakPolarHBondContact O-CB 3.34Å; A385-M388 PolarHBondContact O-N 3.43Å; M388-T392 VanDerWaalsContact O-CB 3.22Å; M388-T392 WeakPolarHBondContact O-CB 3.15Å; M388-T392 WeakPolarHBondContact O-CG2 3.48Å; M388-T392 PolarHBondContact O-N 2.93Å; M388-T392 PolarHBondContact O-OG1 2.99Å
389	S	82.8	Confident	85.2	Confident	4 Å²	4	4.4 Å²	4.4	3%	0.028	3%	0.025	C	C	.	.	H	α-helix	trans	-62.6	-49.3	179.6	166.6	0	0	0	0	111.5	D202 A385 S386 L387 T392 S393	D202-S389 VanDerWaalsContact CG-OG 3.29Å; D202-S389 WeakPolarHBondContact OD1-CB 3.36Å; D202-S389 PolarHBondContact OD1-OG 3.01Å; A385-S389 WeakPolarHBondContact O-CB 3.26Å; A385-S389 PolarHBondContact O-N 3.35Å; S386-S389 PolarHBondContact O-N 3.45Å; L387-S389 VanDerWaalsContact C-N 3.34Å; L387-S389 PolarHBondContact O-N 3.36Å; S389-T392 WeakPolarHBondContact CA-OG1 3.03Å; S389-T392 PolarHBondContact O-N 3.3Å; S389-T392 PolarHBondContact O-OG1 3.48Å; S389-S393 VanDerWaalsContact O-CB 3.32Å; S389-S393 WeakPolarHBondContact O-CB 3.49Å; S389-S393 PolarHBondContact O-N 2.84Å; S389-S393 PolarHBondContact O-OG 3.41Å
390	S	86.5	Confident	85	Confident	3 Å²	3	4.4 Å²	4.4	2%	0.021	3%	0.025	C	C	.	.	H	α-helix	trans	-61.2	-49.3	177	-59.6	0	0	0	0	111.7	G79 D159 S386 T392 S393 I394	G79-S390 WeakPolarHBondContact CA-OG 3.36Å; D159-S390 WeakPolarHBondContact OD2-CB 3.5Å; S386-S390 PolarHBondContact O-N 3.03Å; S386-S390 PolarHBondContact O-OG 3.22Å; S390-T392 PolarHBondContact O-N 3.19Å; S390-S393 VanDerWaalsContact O-CB 3.31Å; S390-S393 WeakPolarHBondContact O-CB 3.36Å; S390-S393 PolarHBondContact O-N 2.84Å; S390-I394 WeakPolarHBondContact O-CD1 3.44Å; S390-I394 VanDerWaalsContact O-CG1 3.3Å; S390-I394 WeakPolarHBondContact O-CG1 3.4Å; S390-I394 PolarHBondContact O-N 2.89Å
391	L	86.8	Confident	85.2	Confident	0 Å²	0	4 Å²	4	0%	0	2%	0.023	C	C	.	.	H	α-helix	trans	-63.4	-44.4	179.9	-71.6	173.9	0	0	0	112.7	I156 D159 I160 L182 T186 L387 S393 I394 F395	I156-L391 HydrophobicContact CG2-CD2 4.22Å; D159-L391 HydrophobicContact CB-CD2 3.78Å; D159-L391 HydrophobicContact CB-CG 4.22Å; I160-L391 HydrophobicContact CG1-CD1 4.32Å; I160-L391 HydrophobicContact CG1-CD2 4.19Å; L182-L391 HydrophobicContact CD2-CD1 4.2Å; T186-L391 HydrophobicContact CG2-CB 3.69Å; T186-L391 HydrophobicContact CG2-CD1 4.15Å; L387-L391 WeakPolarHBondContact O-CB 3.37Å; L387-L391 WeakPolarHBondContact O-CG 3.46Å; L387-L391 PolarHBondContact O-N 3.1Å; L391-S393 VanDerWaalsContact C-N 3.26Å; L391-S393 PolarHBondContact O-N 2.87Å; L391-I394 PolarHBondContact O-N 3.39Å; L391-F395 HydrophobicContact CB-CE2 4.1Å; L391-F395 HydrophobicContact CB-CZ 4.3Å; L391-F395 HydrophobicContact CD2-CZ 4.23Å; L391-F395 WeakPolarHBondContact O-CB 3.12Å; L391-F395 WeakPolarHBondContact O-CD2 3.46Å; L391-F395 WeakPolarHBondContact O-CG 3.48Å; L391-F395 PolarHBondContact O-N 3.17Å
392	T	82.1	Confident	85.4	Confident	3 Å²	3	5.7 Å²	5.7	2%	0.018	3%	0.03	C	C	.	.	H	α-helix	trans	-64	-34.7	178.9	56	0	0	0	0	111.9	T186 Y189 T190 M388 S389 S390 N396	T186-T392 HydrophobicContact CG2-CG2 3.98Å; Y189-T392 HydrophobicContact CD1-CG2 3.63Å; Y189-T392 HydrophobicContact CE1-CG2 4.37Å; T190-T392 VanDerWaalsContact OG1-CG2 3.25Å; T190-T392 WeakPolarHBondContact OG1-CG2 3.44Å; M388-T392 VanDerWaalsContact O-CB 3.22Å; M388-T392 WeakPolarHBondContact O-CB 3.15Å; M388-T392 WeakPolarHBondContact O-CG2 3.48Å; M388-T392 PolarHBondContact O-N 2.93Å; M388-T392 PolarHBondContact O-OG1 2.99Å; S389-T392 WeakPolarHBondContact CA-OG1 3.03Å; S389-T392 PolarHBondContact O-N 3.3Å; S389-T392 PolarHBondContact O-OG1 3.48Å; S390-T392 PolarHBondContact O-N 3.19Å; T392-N396 VanDerWaalsContact O-CB 3.29Å; T392-N396 WeakPolarHBondContact O-CB 3.49Å; T392-N396 PolarHBondContact O-N 3.4Å
393	S	85.1	Confident	85.5	Confident	1 Å²	1	5.7 Å²	5.7	1%	0.007	3%	0.03	C	C	.	.	H	α-helix	trans	-63.1	-49	174.2	-58.8	0	0	0	0	111.9	R297 S389 S390 L391 N396 S397	R297-S393 PolarHBondContact NH2-OG 3.04Å; S389-S393 VanDerWaalsContact O-CB 3.32Å; S389-S393 WeakPolarHBondContact O-CB 3.49Å; S389-S393 PolarHBondContact O-N 2.84Å; S389-S393 PolarHBondContact O-OG 3.41Å; S390-S393 VanDerWaalsContact O-CB 3.31Å; S390-S393 WeakPolarHBondContact O-CB 3.36Å; S390-S393 PolarHBondContact O-N 2.84Å; L391-S393 VanDerWaalsContact C-N 3.26Å; L391-S393 PolarHBondContact O-N 2.87Å; S393-N396 PolarHBondContact O-N 3.04Å; S393-S397 PolarHBondContact O-N 3.46Å; S393-S397 PolarHBondContact O-OG 3.29Å
394	I	88.6	Confident	85.3	Confident	4 Å²	4	6.6 Å²	6.6	2%	0.021	3%	0.034	C	C	.	.	H	α-helix	trans	-63.9	-45.3	178.3	-61.4	160.6	0	0	0	110.1	Y151 Q155 I156 D159 V293 S390 L391 N396 S397 A398	Y151-I394 HydrophobicContact CD1-CG2 4.37Å; Y151-I394 HydrophobicContact CD2-CG2 4.19Å; Y151-I394 HydrophobicContact CG-CG2 3.92Å; Q155-I394 HydrophobicContact CB-CD1 3.7Å; Q155-I394 HydrophobicContact CB-CG1 4.48Å; I156-I394 HydrophobicContact CD1-CG2 3.9Å; I156-I394 HydrophobicContact CG1-CB 4.45Å; I156-I394 HydrophobicContact CG1-CG2 3.6Å; D159-I394 WeakPolarHBondContact OD2-CD1 3.26Å; V293-I394 HydrophobicContact CG2-CG1 4.47Å; S390-I394 WeakPolarHBondContact O-CD1 3.44Å; S390-I394 VanDerWaalsContact O-CG1 3.3Å; S390-I394 WeakPolarHBondContact O-CG1 3.4Å; S390-I394 PolarHBondContact O-N 2.89Å; L391-I394 PolarHBondContact O-N 3.39Å; I394-N396 PolarHBondContact O-N 2.88Å; I394-S397 PolarHBondContact O-N 3.09Å; I394-A398 WeakPolarHBondContact O-CB 3.46Å; I394-A398 PolarHBondContact O-N 2.9Å
395	F	86.3	Confident	85.3	Confident	0 Å²	0	5.2 Å²	5.2	0%	0	3%	0.028	C	C	.	.	H	α-helix	trans	-62.5	-41.7	178.6	-65.9	-18.9	0	0	0	112.3	I156 T186 T190 L391 S399 I427 I431	I156-F395 HydrophobicContact CD1-CD1 4.18Å; I156-F395 HydrophobicContact CD1-CE1 3.83Å; I156-F395 HydrophobicContact CG1-CE1 4Å; I156-F395 HydrophobicContact CG2-CE1 3.99Å; I156-F395 HydrophobicContact CG2-CZ 4.38Å; T186-F395 HydrophobicContact CG2-CD2 4.21Å; T186-F395 HydrophobicContact CG2-CE2 3.75Å; T190-F395 HydrophobicContact CG2-CB 4.02Å; T190-F395 HydrophobicContact CG2-CD2 4.2Å; L391-F395 HydrophobicContact CB-CE2 4.1Å; L391-F395 HydrophobicContact CB-CZ 4.3Å; L391-F395 HydrophobicContact CD2-CZ 4.23Å; L391-F395 WeakPolarHBondContact O-CB 3.12Å; L391-F395 WeakPolarHBondContact O-CD2 3.46Å; L391-F395 WeakPolarHBondContact O-CG 3.48Å; L391-F395 PolarHBondContact O-N 3.17Å; F395-S399 WeakPolarHBondContact O-CB 3.37Å; F395-S399 PolarHBondContact O-N 3.09Å; F395-I427 HydrophobicContact CB-CD1 3.96Å; F395-I427 HydrophobicContact CB-CG1 4.03Å; F395-I427 HydrophobicContact CB-CG2 4.02Å; F395-I427 HydrophobicContact CD1-CG2 4.02Å; F395-I427 HydrophobicContact CD2-CG2 3.86Å; F395-I427 HydrophobicContact CE1-CG2 4.48Å; F395-I427 HydrophobicContact CE2-CG2 4.32Å; F395-I427 HydrophobicContact CG-CG2 3.7Å; F395-I431 HydrophobicContact CE1-CD1 4.44Å; F395-I431 HydrophobicContact CE1-CG1 3.91Å; F395-I431 HydrophobicContact CE2-CD1 3.86Å; F395-I431 HydrophobicContact CE2-CG1 4.16Å; F395-I431 HydrophobicContact CZ-CD1 3.74Å; F395-I431 HydrophobicContact CZ-CG1 3.5Å; F395-I431 VanDerWaalsContact CZ-CG1 3.5Å
396	N	82.8	Confident	85.6	Confident	12 Å²	12	6.4 Å²	6.4	6%	0.064	3%	0.033	C	C	.	.	H	α-helix	trans	-62.7	-46.5	176.1	178.3	66.5	0	0	0	111.7	Q296 T392 S393 I394 S399 T400	Q296-N396 PolarHBondContact NE2-ND2 2.99Å; T392-N396 VanDerWaalsContact O-CB 3.29Å; T392-N396 WeakPolarHBondContact O-CB 3.49Å; T392-N396 PolarHBondContact O-N 3.4Å; S393-N396 PolarHBondContact O-N 3.04Å; I394-N396 PolarHBondContact O-N 2.88Å; N396-S399 PolarHBondContact O-N 3.12Å; N396-T400 PolarHBondContact O-N 3.46Å; N396-T400 PolarHBondContact O-OG1 3.01Å
397	S	86.9	Confident	85.8	Confident	0 Å²	0	8.8 Å²	8.8	0%	0	4%	0.042	C	C	.	.	H	α-helix	trans	-68.3	-40.8	178.6	-66.3	0	0	0	0	112.4	V293 Q296 S393 I394 S399 T400 L401	V293-S397 WeakPolarHBondContact CA-OG 3.49Å; Q296-S397 PolarHBondContact OE1-OG 3.47Å; S393-S397 PolarHBondContact O-N 3.46Å; S393-S397 PolarHBondContact O-OG 3.29Å; I394-S397 PolarHBondContact O-N 3.09Å; S397-S399 VanDerWaalsContact C-N 3.34Å; S397-S399 PolarHBondContact O-N 2.99Å; S397-T400 WeakPolarHBondContact O-CB 3.29Å; S397-T400 PolarHBondContact O-N 3.39Å; S397-L401 WeakPolarHBondContact O-CG 3.33Å; S397-L401 PolarHBondContact O-N 2.77Å
398	A	89.5	Confident	85.6	Confident	0 Å²	0	9 Å²	9	0%	0	4%	0.044	C	C	.	.	H	α-helix	trans	-61.9	-41.9	174.1	0	0	0	0	0	112	L148 Y151 I394 T400 L401 F402 L430	L148-A398 HydrophobicContact CD2-CB 3.74Å; Y151-A398 HydrophobicContact CD2-CB 3.98Å; I394-A398 WeakPolarHBondContact O-CB 3.46Å; I394-A398 PolarHBondContact O-N 2.9Å; A398-T400 VanDerWaalsContact C-N 3.34Å; A398-L401 PolarHBondContact O-N 2.69Å; A398-F402 WeakPolarHBondContact O-CB 3.11Å; A398-F402 PolarHBondContact O-N 3.14Å; A398-L430 HydrophobicContact CB-CD1 3.59Å
399	S	86.4	Confident	85.5	Confident	9 Å²	9	10.6 Å²	10.6	6%	0.063	5%	0.05	C	C	.	.	H	α-helix	trans	-62.3	-41.8	174.1	-163.2	0	0	0	0	111.5	F395 N396 S397 T403 G423	F395-S399 WeakPolarHBondContact O-CB 3.37Å; F395-S399 PolarHBondContact O-N 3.09Å; N396-S399 PolarHBondContact O-N 3.12Å; S397-S399 VanDerWaalsContact C-N 3.34Å; S397-S399 PolarHBondContact O-N 2.99Å; S399-T403 WeakPolarHBondContact O-CB 3.35Å; S399-T403 VanDerWaalsContact O-CG2 3.26Å; S399-T403 WeakPolarHBondContact O-CG2 3.35Å; S399-T403 PolarHBondContact O-N 3.1Å; S399-T403 PolarHBondContact O-OG1 3.25Å; S399-G423 WeakPolarHBondContact OG-CA 3.15Å; S399-G423 PolarHBondContact OG-O 2.84Å
400	T	83.1	Confident	85.7	Confident	0 Å²	0	16.5 Å²	16.5	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-62	-49.4	175.9	-48.7	0	0	0	0	111	F58 T125 Q296 N396 S397 A398 T403 M404	F58-T400 HydrophobicContact CD1-CG2 4.02Å; F58-T400 WeakPolarHBondContact CD1-OG1 3.33Å; F58-T400 HydrophobicContact CE1-CG2 4.34Å; F58-T400 VanDerWaalsContact CE1-OG1 3.23Å; F58-T400 WeakPolarHBondContact CE1-OG1 2.84Å; F58-T400 HydrophobicContact CG-CG2 4.2Å; T125-T400 HydrophobicContact CG2-CG2 3.92Å; Q296-T400 PolarHBondContact NE2-OG1 3.41Å; N396-T400 PolarHBondContact O-N 3.46Å; N396-T400 PolarHBondContact O-OG1 3.01Å; S397-T400 WeakPolarHBondContact O-CB 3.29Å; S397-T400 PolarHBondContact O-N 3.39Å; A398-T400 VanDerWaalsContact C-N 3.34Å; T400-T403 PolarHBondContact O-OG1 3.24Å; T400-M404 HydrophobicContact CG2-CG 4.18Å; T400-M404 VanDerWaalsContact O-CB 3.27Å; T400-M404 WeakPolarHBondContact O-CB 3.43Å; T400-M404 WeakPolarHBondContact O-CG 3.47Å; T400-M404 PolarHBondContact O-N 3.45Å
401	L	88.6	Confident	85.4	Confident	1 Å²	1	21.6 Å²	21.6	1%	0.005	10%	0.099	C	C	.	.	H	α-helix	trans	-60.6	-48.4	178.8	-70.6	172.4	0	0	0	111.1	P127 L148 Y151 Q292 S397 A398 D405	P127-L401 HydrophobicContact CG-CD2 3.66Å; L148-L401 HydrophobicContact CD2-CB 4.2Å; L148-L401 HydrophobicContact CD2-CD1 4.37Å; L148-L401 HydrophobicContact CG-CB 4.42Å; Y151-L401 HydrophobicContact CE2-CD1 3.73Å; Q292-L401 HydrophobicContact CB-CD1 4.25Å; Q292-L401 HydrophobicContact CB-CD2 4.37Å; Q292-L401 HydrophobicContact CB-CG 4.41Å; Q292-L401 HydrophobicContact CG-CD1 4.48Å; Q292-L401 HydrophobicContact CG-CD2 4.18Å; Q292-L401 HydrophobicContact CG-CG 4.15Å; S397-L401 WeakPolarHBondContact O-CG 3.33Å; S397-L401 PolarHBondContact O-N 2.77Å; A398-L401 PolarHBondContact O-N 2.69Å; L401-D405 WeakPolarHBondContact CD2-OD2 3.42Å; L401-D405 WeakPolarHBondContact O-CA 3.29Å; L401-D405 WeakPolarHBondContact O-CB 3.02Å; L401-D405 PolarHBondContact O-N 3.14Å
402	F	91.3	Very high	84.8	Confident	35 Å²	35	25 Å²	25	15%	0.154	12%	0.121	C	C	.	.	I	π-helix	trans	-64.3	-48.6	-179.9	175.5	-102.7	0	0	0	111.9	L148 A398 I406 Y407 A422 F426	L148-F402 HydrophobicContact CD1-CB 4.33Å; A398-F402 WeakPolarHBondContact O-CB 3.11Å; A398-F402 PolarHBondContact O-N 3.14Å; F402-I406 HydrophobicContact CD2-CB 4.25Å; F402-I406 HydrophobicContact CD2-CD1 4.3Å; F402-I406 HydrophobicContact CD2-CG2 4.38Å; F402-I406 HydrophobicContact CE2-CG2 4.27Å; F402-I406 CarbonylContact O-C 3.15Å; F402-I406 WeakPolarHBondContact O-CB 3.21Å; F402-I406 PolarHBondContact O-N 2.91Å; F402-Y407 AromaticContact CE1-CD2 3.95Å; F402-Y407 HydrophobicContact CE1-CD2 3.95Å; F402-Y407 HydrophobicContact CE1-CG 4.4Å; F402-Y407 HydrophobicContact CZ-CD2 4.05Å; F402-Y407 WeakPolarHBondContact O-CB 2.93Å; F402-Y407 PolarHBondContact O-N 3.41Å; F402-A422 HydrophobicContact CE1-CB 4.44Å; F402-F426 HydrophobicContact CB-CD1 3.41Å; F402-F426 VanDerWaalsContact CB-CD1 3.41Å; F402-F426 HydrophobicContact CB-CD2 4.37Å; F402-F426 HydrophobicContact CB-CE1 3.54Å; F402-F426 HydrophobicContact CB-CE2 4.49Å; F402-F426 HydrophobicContact CB-CG 3.86Å; F402-F426 HydrophobicContact CB-CZ 4.11Å; F402-F426 HydrophobicContact CD1-CB 3.52Å; F402-F426 AromaticContact CD1-CD1 3.99Å; F402-F426 HydrophobicContact CD1-CD1 3.99Å; F402-F426 HydrophobicContact CD1-CD2 4.02Å; F402-F426 AromaticContact CD1-CG 3.56Å; F402-F426 HydrophobicContact CD1-CG 3.56Å; F402-F426 HydrophobicContact CD2-CD1 4.19Å; F402-F426 AromaticContact CD2-CD2 3.56Å; F402-F426 HydrophobicContact CD2-CD2 3.56Å; F402-F426 HydrophobicContact CD2-CE1 4.24Å; F402-F426 AromaticContact CD2-CE2 3.66Å; F402-F426 HydrophobicContact CD2-CE2 3.66Å; F402-F426 AromaticContact CD2-CG 3.85Å; F402-F426 HydrophobicContact CD2-CG 3.85Å; F402-F426 HydrophobicContact CD2-CZ 4.01Å; F402-F426 HydrophobicContact CE1-CB 3.77Å; F402-F426 HydrophobicContact CE1-CD2 4.19Å; F402-F426 HydrophobicContact CE1-CG 4.04Å; F402-F426 AromaticContact CE2-CD2 3.75Å; F402-F426 HydrophobicContact CE2-CD2 3.75Å; F402-F426 HydrophobicContact CE2-CE2 4.06Å; F402-F426 HydrophobicContact CE2-CG 4.3Å; F402-F426 HydrophobicContact CG-CB 3.98Å; F402-F426 AromaticContact CG-CD1 3.59Å; F402-F426 HydrophobicContact CG-CD1 3.59Å; F402-F426 AromaticContact CG-CD2 3.7Å; F402-F426 HydrophobicContact CG-CD2 3.7Å; F402-F426 AromaticContact CG-CE1 3.95Å; F402-F426 HydrophobicContact CG-CE1 3.95Å; F402-F426 HydrophobicContact CG-CE2 4.08Å; F402-F426 AromaticContact CG-CG 3.45Å; F402-F426 HydrophobicContact CG-CG 3.45Å; F402-F426 VanDerWaalsContact CG-CG 3.45Å; F402-F426 HydrophobicContact CG-CZ 4.2Å; F402-F426 HydrophobicContact CZ-CB 4.42Å; F402-F426 HydrophobicContact CZ-CD2 4.06Å; F402-F426 HydrophobicContact CZ-CG 4.38Å
403	T	86.3	Confident	84.4	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.139	C	C	.	.	I	π-helix	trans	-64.4	-61.9	-178.3	51.8	0	0	0	0	110.1	S399 T400 Y407 T408 L419 G423	S399-T403 WeakPolarHBondContact O-CB 3.35Å; S399-T403 VanDerWaalsContact O-CG2 3.26Å; S399-T403 WeakPolarHBondContact O-CG2 3.35Å; S399-T403 PolarHBondContact O-N 3.1Å; S399-T403 PolarHBondContact O-OG1 3.25Å; T400-T403 PolarHBondContact O-OG1 3.24Å; T403-Y407 WeakPolarHBondContact O-CB 3.08Å; T403-Y407 PolarHBondContact O-N 3.07Å; T403-T408 VanDerWaalsContact O-CG2 3.22Å; T403-T408 WeakPolarHBondContact O-CG2 3.21Å; T403-T408 PolarHBondContact O-N 3.42Å; T403-T408 VanDerWaalsContact O-N 3.11Å; T403-L419 WeakPolarHBondContact CG2-O 3.17Å; T403-G423 VanDerWaalsContact CG2-CA 3.42Å
404	M	81.3	Confident	83.9	Confident	22 Å²	22	28 Å²	28	11%	0.108	14%	0.142	C	C	.	.	I	π-helix	trans	-71.6	-33.8	-170	-61.1	-61.2	-76.1	0	0	114.1	V54 I124 T125 R140 T400 T408 L419	V54-M404 HydrophobicContact CG1-CE 4.03Å; V54-M404 HydrophobicContact CG1-SD 3.91Å; I124-M404 HydrophobicContact CD1-CE 4.32Å; T125-M404 HydrophobicContact CG2-CB 4.29Å; R140-M404 PolarHBondContact NH2-O 3.35Å; R140-M404 VanDerWaalsContact NH2-O 3.08Å; T400-M404 HydrophobicContact CG2-CG 4.18Å; T400-M404 VanDerWaalsContact O-CB 3.27Å; T400-M404 WeakPolarHBondContact O-CB 3.43Å; T400-M404 WeakPolarHBondContact O-CG 3.47Å; T400-M404 PolarHBondContact O-N 3.45Å; M404-T408 PolarHBondContact O-OG1 3.13Å; M404-L419 HydrophobicContact SD-CD2 3.99Å
405	D	84.6	Confident	83.3	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	17%	0.17	C	C	.	.	I	π-helix	trans	-101.7	-22.4	-172.9	-57.5	-47.5	0	0	0	114.2	T125 P127 R140 S144 L401	T125-D405 WeakPolarHBondContact CB-OD2 3.23Å; T125-D405 PolarHBondContact OG1-OD1 2.65Å; T125-D405 PolarHBondContact OG1-OD2 3.33Å; P127-D405 WeakPolarHBondContact CG-OD2 3.23Å; R140-D405 HydrophobicContact CG-CB 4.31Å; R140-D405 IonicContact CZ-OD1 3.2Å; R140-D405 IonicContact NE-OD1 3.49Å; R140-D405 PolarHBondContact NE-OD1 3.46Å; R140-D405 IonicContact NH2-OD1 2.86Å; R140-D405 PolarHBondContact NH2-OD1 2.76Å; S144-D405 WeakPolarHBondContact OG-CB 3.27Å; L401-D405 WeakPolarHBondContact CD2-OD2 3.42Å; L401-D405 WeakPolarHBondContact O-CA 3.29Å; L401-D405 WeakPolarHBondContact O-CB 3.02Å; L401-D405 PolarHBondContact O-N 3.14Å
406	I	88.1	Confident	82.7	Confident	29 Å²	29	38.6 Å²	38.6	15%	0.149	19%	0.189	C	C	.	.	I	π-helix	trans	-117.5	-56.7	-176.4	-56	176.1	0	0	0	111.3	V145 L148 F402 T408 K409 I410	V145-I406 HydrophobicContact CG2-CD1 4.01Å; L148-I406 HydrophobicContact CD1-CD1 3.67Å; F402-I406 HydrophobicContact CD2-CB 4.25Å; F402-I406 HydrophobicContact CD2-CD1 4.3Å; F402-I406 HydrophobicContact CD2-CG2 4.38Å; F402-I406 HydrophobicContact CE2-CG2 4.27Å; F402-I406 CarbonylContact O-C 3.15Å; F402-I406 WeakPolarHBondContact O-CB 3.21Å; F402-I406 PolarHBondContact O-N 2.91Å; I406-T408 PolarHBondContact O-N 3.11Å; I406-K409 WeakPolarHBondContact O-CB 3.4Å; I406-K409 PolarHBondContact O-N 3.18Å; I406-I410 HydrophobicContact CG2-CD1 4.1Å; I406-I410 PolarHBondContact O-N 2.79Å
407	Y	87.8	Confident	82.2	Confident	49 Å²	49	44 Å²	44	19%	0.192	21%	0.209	C	C	.	.	I	π-helix	trans	-63.3	-42.1	-172.1	-168.8	-100	0	0	0	112.1	F402 T403 K409 I410 R411 A414 E418 A422	F402-Y407 AromaticContact CE1-CD2 3.95Å; F402-Y407 HydrophobicContact CE1-CD2 3.95Å; F402-Y407 HydrophobicContact CE1-CG 4.4Å; F402-Y407 HydrophobicContact CZ-CD2 4.05Å; F402-Y407 WeakPolarHBondContact O-CB 2.93Å; F402-Y407 PolarHBondContact O-N 3.41Å; T403-Y407 WeakPolarHBondContact O-CB 3.08Å; T403-Y407 PolarHBondContact O-N 3.07Å; Y407-K409 PolarHBondContact O-N 3.08Å; Y407-K409 VanDerWaalsContact O-N 3.1Å; Y407-I410 PolarHBondContact O-N 2.92Å; Y407-R411 HydrophobicContact CE1-CB 4.47Å; Y407-R411 PolarHBondContact O-N 3.39Å; Y407-A414 HydrophobicContact CD1-CB 4.47Å; Y407-A414 HydrophobicContact CE1-CB 4.15Å; Y407-E418 HydrophobicContact CE1-CG 3.97Å; Y407-E418 PolarHBondContact OH-OE1 2.99Å; Y407-A422 HydrophobicContact CD1-CB 4.04Å; Y407-A422 HydrophobicContact CD2-CB 3.88Å; Y407-A422 HydrophobicContact CE1-CB 3.81Å; Y407-A422 HydrophobicContact CE2-CB 3.66Å; Y407-A422 HydrophobicContact CG-CB 4.05Å
408	T	80.4	Confident	81.9	Confident	4 Å²	4	45.7 Å²	45.7	3%	0.025	22%	0.217	C	C	.	.	H	α-helix	trans	-55.7	-23.1	172.5	57.2	0	0	0	0	114.6	T403 M404 I406 R411 P412 L419 W575	T403-T408 VanDerWaalsContact O-CG2 3.22Å; T403-T408 WeakPolarHBondContact O-CG2 3.21Å; T403-T408 PolarHBondContact O-N 3.42Å; T403-T408 VanDerWaalsContact O-N 3.11Å; M404-T408 PolarHBondContact O-OG1 3.13Å; I406-T408 PolarHBondContact O-N 3.11Å; T408-R411 CarbonylContact O-C 3.54Å; T408-P412 WeakPolarHBondContact O-CA 3.23Å; T408-L419 HydrophobicContact CG2-CD2 4.23Å; T408-W575 HydrophobicContact CG2-CH2 3.83Å; T408-W575 HydrophobicContact CG2-CZ2 2.92Å
409	K	81.5	Confident	81.3	Confident	46 Å²	46	46 Å²	46	20%	0.2	22%	0.218	C	C	.	.	H	α-helix	trans	-86.8	-31.6	175.6	-61.6	-53	-169.3	-162.6	0	112.8	I406 Y407 D574	I406-K409 WeakPolarHBondContact O-CB 3.4Å; I406-K409 PolarHBondContact O-N 3.18Å; Y407-K409 PolarHBondContact O-N 3.08Å; Y407-K409 VanDerWaalsContact O-N 3.1Å; K409-D574 IonicContact NZ-OD1 3.67Å; K409-D574 PolarHBondContact NZ-OD1 2.81Å; K409-D574 IonicContact NZ-OD2 2.91Å; K409-D574 PolarHBondContact NZ-OD2 2.97Å
410	I	85.2	Confident	80.8	Confident	128 Å²	128	47 Å²	47	66%	0.656	22%	0.222	S	C	*	.	H	α-helix	trans	-74.5	-42.3	176	-59.7	171.4	0	0	0	109.3	I406 Y407	I406-I410 HydrophobicContact CG2-CD1 4.1Å; I406-I410 PolarHBondContact O-N 2.79Å; Y407-I410 PolarHBondContact O-N 2.92Å
411	R	81.9	Confident	80.7	Confident	110 Å²	110	50.9 Å²	50.9	42%	0.415	24%	0.242	S	C	.	.			trans	-125.8	98.2	174.7	-168.6	-172.1	171.2	155.3	-1.3	110.6	Y407 T408 C413 A414 E418	Y407-R411 HydrophobicContact CE1-CB 4.47Å; Y407-R411 PolarHBondContact O-N 3.39Å; T408-R411 CarbonylContact O-C 3.54Å; R411-C413 PolarHBondContact NE-O 3.01Å; R411-C413 PolarHBondContact NH2-O 3.18Å; R411-A414 HydrophobicContact CB-CB 4.3Å; R411-A414 HydrophobicContact CG-CB 4.1Å; R411-E418 VanDerWaalsContact CD-CD 3.42Å; R411-E418 WeakPolarHBondContact CD-OE1 3.49Å; R411-E418 WeakPolarHBondContact CD-OE2 3.49Å; R411-E418 VanDerWaalsContact CZ-CD 3.44Å; R411-E418 IonicContact CZ-OE1 3.29Å; R411-E418 VanDerWaalsContact CZ-OE1 3.3Å; R411-E418 IonicContact CZ-OE2 3.72Å; R411-E418 IonicContact NE-OE1 3.1Å; R411-E418 PolarHBondContact NE-OE1 3.4Å; R411-E418 IonicContact NE-OE2 3.02Å; R411-E418 PolarHBondContact NE-OE2 3.37Å; R411-E418 IonicContact NH1-OE1 3.29Å; R411-E418 PolarHBondContact NH1-OE1 2.88Å; R411-E418 IonicContact NH1-OE2 2.7Å; R411-E418 PolarHBondContact NH1-OE2 3.35Å; R411-E418 IonicContact NH2-OE2 3.52Å
412	P	73.8	Confident	80.6	Confident	72 Å²	72	51.3 Å²	51.3	47%	0.468	25%	0.246	S	C	.	.	S	Bend	trans	-62.9	-45.1	179.7	-24.9	35.3	0	0	0	113.8	T408 A414 W575	T408-P412 WeakPolarHBondContact O-CA 3.23Å; P412-A414 VanDerWaalsContact C-N 3.35Å; P412-A414 PolarHBondContact O-N 3.28Å; P412-W575 WeakPolarHBondContact O-CH2 2.82Å
413	C	72.9	Confident	80.2	Confident	58 Å²	58	49.7 Å²	49.7	39%	0.392	24%	0.239	S	C	.	.	S	Bend	trans	-94	61.5	179.7	-51.9	0	0	0	0	111	R411	R411-C413 PolarHBondContact NE-O 3.01Å; R411-C413 PolarHBondContact NH2-O 3.18Å
414	A	74.1	Confident	80	Confident	8 Å²	8	51.8 Å²	51.8	7%	0.066	25%	0.247	C	C	.	.			trans	-95.1	124.1	178.1	0	0	0	0	0	109.9	Y407 R411 P412 E418 L419 W575	Y407-A414 HydrophobicContact CD1-CB 4.47Å; Y407-A414 HydrophobicContact CE1-CB 4.15Å; R411-A414 HydrophobicContact CB-CB 4.3Å; R411-A414 HydrophobicContact CG-CB 4.1Å; P412-A414 VanDerWaalsContact C-N 3.35Å; P412-A414 PolarHBondContact O-N 3.28Å; A414-E418 WeakPolarHBondContact CA-OE2 3.43Å; A414-L419 HydrophobicContact CB-CD1 3.37Å; A414-L419 WeakPolarHBondContact O-CD1 3.4Å; A414-W575 HydrophobicContact CB-CH2 4.45Å
415	K	77.2	Confident	80.2	Confident	140 Å²	140	55.1 Å²	55.1	61%	0.609	27%	0.268	S	S	*	.			trans	-67.8	151.6	178	-66.1	-175.4	177.9	-175.2	0	109.5	R417 E418 L419	K415-R417 PolarHBondContact O-N 3.3Å; K415-R417 VanDerWaalsContact O-N 3.07Å; K415-E418 WeakPolarHBondContact O-CA 3.42Å; K415-E418 VanDerWaalsContact O-CB 3.29Å; K415-E418 WeakPolarHBondContact O-CB 3.48Å; K415-E418 PolarHBondContact O-N 2.64Å; K415-L419 VanDerWaalsContact O-CD1 3.27Å; K415-L419 WeakPolarHBondContact O-CD1 3.28Å; K415-L419 PolarHBondContact O-N 3Å
416	E	72.7	Confident	80.4	Confident	88 Å²	88	56.3 Å²	56.3	41%	0.411	27%	0.273	S	S	.	.	H	α-helix	trans	-52.1	-38.6	-179.7	-67.9	-169.9	125.6	0	0	113.2	T53 V54 E418 L419 M420	T53-E416 WeakPolarHBondContact CA-OE1 3.32Å; V54-E416 HydrophobicContact CG2-CG 4.04Å; V54-E416 PolarHBondContact N-OE1 3.01Å; E416-E418 VanDerWaalsContact C-N 3.3Å; E416-E418 PolarHBondContact O-N 3.34Å; E416-L419 PolarHBondContact O-N 3.16Å; E416-M420 WeakPolarHBondContact O-CG 3.25Å; E416-M420 PolarHBondContact O-N 3.16Å; E416-M420 VanDerWaalsContact O-N 3.07Å
417	R	71.8	Confident	80.4	Confident	124 Å²	124	55.7 Å²	55.7	47%	0.468	27%	0.27	S	S	.	.	H	α-helix	trans	-60.3	-38.9	175.7	-179.8	172.8	178.3	-174.3	-1.9	113	K415 M420 I421 L605	K415-R417 PolarHBondContact O-N 3.3Å; K415-R417 VanDerWaalsContact O-N 3.07Å; R417-M420 PolarHBondContact O-N 3.49Å; R417-I421 HydrophobicContact CG-CD1 4.06Å; R417-I421 VanDerWaalsContact O-CG1 3.31Å; R417-I421 WeakPolarHBondContact O-CG1 3.47Å; R417-I421 PolarHBondContact O-N 2.9Å; R417-I421 VanDerWaalsContact O-N 3.13Å; R417-L605 HydrophobicContact CG-CD2 4.31Å
418	E	81.2	Confident	80.3	Confident	36 Å²	36	58.6 Å²	58.6	17%	0.168	29%	0.288	C	S	.	.	H	α-helix	trans	-69.8	-43.1	179.1	-177.4	-178.3	-172.3	0	0	111.4	Y407 R411 A414 K415 E416 M420 I421 A422	Y407-E418 HydrophobicContact CE1-CG 3.97Å; Y407-E418 PolarHBondContact OH-OE1 2.99Å; R411-E418 VanDerWaalsContact CD-CD 3.42Å; R411-E418 WeakPolarHBondContact CD-OE1 3.49Å; R411-E418 WeakPolarHBondContact CD-OE2 3.49Å; R411-E418 VanDerWaalsContact CZ-CD 3.44Å; R411-E418 IonicContact CZ-OE1 3.29Å; R411-E418 VanDerWaalsContact CZ-OE1 3.3Å; R411-E418 IonicContact CZ-OE2 3.72Å; R411-E418 IonicContact NE-OE1 3.1Å; R411-E418 PolarHBondContact NE-OE1 3.4Å; R411-E418 IonicContact NE-OE2 3.02Å; R411-E418 PolarHBondContact NE-OE2 3.37Å; R411-E418 IonicContact NH1-OE1 3.29Å; R411-E418 PolarHBondContact NH1-OE1 2.88Å; R411-E418 IonicContact NH1-OE2 2.7Å; R411-E418 PolarHBondContact NH1-OE2 3.35Å; R411-E418 IonicContact NH2-OE2 3.52Å; A414-E418 WeakPolarHBondContact CA-OE2 3.43Å; K415-E418 WeakPolarHBondContact O-CA 3.42Å; K415-E418 VanDerWaalsContact O-CB 3.29Å; K415-E418 WeakPolarHBondContact O-CB 3.48Å; K415-E418 PolarHBondContact O-N 2.64Å; E416-E418 VanDerWaalsContact C-N 3.3Å; E416-E418 PolarHBondContact O-N 3.34Å; E418-M420 VanDerWaalsContact C-N 3.27Å; E418-M420 PolarHBondContact O-N 3.21Å; E418-I421 PolarHBondContact O-N 2.68Å; E418-I421 VanDerWaalsContact O-N 3.13Å; E418-A422 WeakPolarHBondContact O-CB 3.17Å; E418-A422 PolarHBondContact O-N 3.49Å
419	L	77.1	Confident	80.8	Confident	7 Å²	7	64.1 Å²	64.1	4%	0.037	31%	0.312	C	S	.	.	H	α-helix	trans	-56.7	-45.4	174.4	-82.9	76.8	0	0	0	110.5	T403 M404 T408 A414 K415 E416 I421 A422 G423 W575	T403-L419 WeakPolarHBondContact CG2-O 3.17Å; M404-L419 HydrophobicContact SD-CD2 3.99Å; T408-L419 HydrophobicContact CG2-CD2 4.23Å; A414-L419 HydrophobicContact CB-CD1 3.37Å; A414-L419 WeakPolarHBondContact O-CD1 3.4Å; K415-L419 VanDerWaalsContact O-CD1 3.27Å; K415-L419 WeakPolarHBondContact O-CD1 3.28Å; K415-L419 PolarHBondContact O-N 3Å; E416-L419 PolarHBondContact O-N 3.16Å; L419-I421 VanDerWaalsContact C-N 3.33Å; L419-I421 PolarHBondContact O-N 3.12Å; L419-A422 PolarHBondContact O-N 2.86Å; L419-G423 PolarHBondContact O-N 3.48Å; L419-W575 HydrophobicContact CD1-CH2 4.33Å
420	M	75.8	Confident	81.1	Confident	29 Å²	29	62.2 Å²	62.2	14%	0.143	30%	0.304	C	S	.	.	H	α-helix	trans	-60.5	-39.2	177.4	-71.6	-169	-77.3	0	0	113	E416 R417 E418 R424 L605	E416-M420 WeakPolarHBondContact O-CG 3.25Å; E416-M420 PolarHBondContact O-N 3.16Å; E416-M420 VanDerWaalsContact O-N 3.07Å; R417-M420 PolarHBondContact O-N 3.49Å; E418-M420 VanDerWaalsContact C-N 3.27Å; E418-M420 PolarHBondContact O-N 3.21Å; M420-R424 WeakPolarHBondContact O-CG 3.38Å; M420-R424 PolarHBondContact O-N 3.25Å; M420-L605 HydrophobicContact CB-CD2 4.37Å; M420-L605 HydrophobicContact CE-CD2 3.69Å; M420-L605 HydrophobicContact SD-CD2 4.19Å
421	I	81.9	Confident	81.2	Confident	82 Å²	82	57.2 Å²	57.2	42%	0.421	28%	0.278	S	S	.	.	H	α-helix	trans	-71.7	-48	178	-67.2	166	0	0	0	110.8	R417 E418 L419 G423 R424 V425	R417-I421 HydrophobicContact CG-CD1 4.06Å; R417-I421 VanDerWaalsContact O-CG1 3.31Å; R417-I421 WeakPolarHBondContact O-CG1 3.47Å; R417-I421 PolarHBondContact O-N 2.9Å; R417-I421 VanDerWaalsContact O-N 3.13Å; E418-I421 PolarHBondContact O-N 2.68Å; E418-I421 VanDerWaalsContact O-N 3.13Å; L419-I421 VanDerWaalsContact C-N 3.33Å; L419-I421 PolarHBondContact O-N 3.12Å; I421-G423 VanDerWaalsContact C-N 3.26Å; I421-G423 PolarHBondContact O-N 3.29Å; I421-R424 PolarHBondContact O-N 3.19Å; I421-V425 HydrophobicContact CG2-CG2 4.38Å; I421-V425 WeakPolarHBondContact O-CG2 3.5Å; I421-V425 PolarHBondContact O-N 3.47Å
422	A	86.1	Confident	81.5	Confident	11 Å²	11	55.6 Å²	55.6	9%	0.091	28%	0.283	C	S	.	.	H	α-helix	trans	-57.1	-43.1	179.2	0	0	0	0	0	111.3	F402 Y407 E418 L419 R424 V425 F426	F402-A422 HydrophobicContact CE1-CB 4.44Å; Y407-A422 HydrophobicContact CD1-CB 4.04Å; Y407-A422 HydrophobicContact CD2-CB 3.88Å; Y407-A422 HydrophobicContact CE1-CB 3.81Å; Y407-A422 HydrophobicContact CE2-CB 3.66Å; Y407-A422 HydrophobicContact CG-CB 4.05Å; E418-A422 WeakPolarHBondContact O-CB 3.17Å; E418-A422 PolarHBondContact O-N 3.49Å; L419-A422 PolarHBondContact O-N 2.86Å; A422-R424 VanDerWaalsContact C-N 3.31Å; A422-R424 PolarHBondContact O-N 3.23Å; A422-V425 PolarHBondContact O-N 3.38Å; A422-F426 WeakPolarHBondContact O-CB 3.39Å; A422-F426 PolarHBondContact O-N 3.36Å
423	G	83.3	Confident	82.4	Confident	0 Å²	0	54 Å²	54	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-59.6	-36.1	175.8	0	0	0	0	0	114	S399 T403 L419 I421 I427	S399-G423 WeakPolarHBondContact OG-CA 3.15Å; S399-G423 PolarHBondContact OG-O 2.84Å; T403-G423 VanDerWaalsContact CG2-CA 3.42Å; L419-G423 PolarHBondContact O-N 3.48Å; I421-G423 VanDerWaalsContact C-N 3.26Å; I421-G423 PolarHBondContact O-N 3.29Å; G423-I427 WeakPolarHBondContact O-CG1 3.29Å; G423-I427 PolarHBondContact O-N 2.89Å
424	R	81.3	Confident	83.1	Confident	45 Å²	45	51.3 Å²	51.3	17%	0.17	25%	0.254	C	S	.	.	H	α-helix	trans	-76.8	-41.3	178.6	-71.1	176.7	-175	-179.8	5.8	112.9	V191 M420 I421 A422 F426 I427 I428 C603	V191-R424 PolarHBondContact O-NH2 3.03Å; V191-R424 VanDerWaalsContact O-NH2 3.15Å; M420-R424 WeakPolarHBondContact O-CG 3.38Å; M420-R424 PolarHBondContact O-N 3.25Å; I421-R424 PolarHBondContact O-N 3.19Å; A422-R424 VanDerWaalsContact C-N 3.31Å; A422-R424 PolarHBondContact O-N 3.23Å; R424-F426 PolarHBondContact O-N 3.36Å; R424-I427 PolarHBondContact O-N 2.95Å; R424-I428 PolarHBondContact O-N 2.95Å; R424-C603 PolarHBondContact NH1-O 3.24Å; R424-C603 VanDerWaalsContact NH1-O 3.11Å; R424-C603 PolarHBondContact NH2-O 2.68Å
425	V	86.2	Confident	83.8	Confident	92 Å²	92	53.9 Å²	53.9	56%	0.558	27%	0.265	S	S	*	.	H	α-helix	trans	-60.6	-40	175.3	174.2	0	0	0	0	110.2	I421 A422 I427 I428 F429	I421-V425 HydrophobicContact CG2-CG2 4.38Å; I421-V425 WeakPolarHBondContact O-CG2 3.5Å; I421-V425 PolarHBondContact O-N 3.47Å; A422-V425 PolarHBondContact O-N 3.38Å; V425-I427 PolarHBondContact O-N 2.96Å; V425-I428 PolarHBondContact O-N 3.24Å; V425-F429 PolarHBondContact O-N 3.34Å; V425-F429 VanDerWaalsContact O-N 3.14Å
426	F	88.8	Confident	84.4	Confident	24 Å²	24	50.8 Å²	50.8	11%	0.105	27%	0.266	C	S	.	.	H	α-helix	trans	-64.8	-36.6	176.9	-177.1	-105.7	0	0	0	113.4	L148 F402 A422 R424 I428 F429 L430	L148-F426 HydrophobicContact CD1-CE1 4.1Å; L148-F426 HydrophobicContact CD1-CZ 3.79Å; L148-F426 HydrophobicContact CD2-CE1 3.66Å; L148-F426 HydrophobicContact CD2-CZ 4Å; L148-F426 HydrophobicContact CG-CE1 4.44Å; L148-F426 HydrophobicContact CG-CZ 4.34Å; F402-F426 HydrophobicContact CB-CD1 3.41Å; F402-F426 VanDerWaalsContact CB-CD1 3.41Å; F402-F426 HydrophobicContact CB-CD2 4.37Å; F402-F426 HydrophobicContact CB-CE1 3.54Å; F402-F426 HydrophobicContact CB-CE2 4.49Å; F402-F426 HydrophobicContact CB-CG 3.86Å; F402-F426 HydrophobicContact CB-CZ 4.11Å; F402-F426 HydrophobicContact CD1-CB 3.52Å; F402-F426 AromaticContact CD1-CD1 3.99Å; F402-F426 HydrophobicContact CD1-CD1 3.99Å; F402-F426 HydrophobicContact CD1-CD2 4.02Å; F402-F426 AromaticContact CD1-CG 3.56Å; F402-F426 HydrophobicContact CD1-CG 3.56Å; F402-F426 HydrophobicContact CD2-CD1 4.19Å; F402-F426 AromaticContact CD2-CD2 3.56Å; F402-F426 HydrophobicContact CD2-CD2 3.56Å; F402-F426 HydrophobicContact CD2-CE1 4.24Å; F402-F426 AromaticContact CD2-CE2 3.66Å; F402-F426 HydrophobicContact CD2-CE2 3.66Å; F402-F426 AromaticContact CD2-CG 3.85Å; F402-F426 HydrophobicContact CD2-CG 3.85Å; F402-F426 HydrophobicContact CD2-CZ 4.01Å; F402-F426 HydrophobicContact CE1-CB 3.77Å; F402-F426 HydrophobicContact CE1-CD2 4.19Å; F402-F426 HydrophobicContact CE1-CG 4.04Å; F402-F426 AromaticContact CE2-CD2 3.75Å; F402-F426 HydrophobicContact CE2-CD2 3.75Å; F402-F426 HydrophobicContact CE2-CE2 4.06Å; F402-F426 HydrophobicContact CE2-CG 4.3Å; F402-F426 HydrophobicContact CG-CB 3.98Å; F402-F426 AromaticContact CG-CD1 3.59Å; F402-F426 HydrophobicContact CG-CD1 3.59Å; F402-F426 AromaticContact CG-CD2 3.7Å; F402-F426 HydrophobicContact CG-CD2 3.7Å; F402-F426 AromaticContact CG-CE1 3.95Å; F402-F426 HydrophobicContact CG-CE1 3.95Å; F402-F426 HydrophobicContact CG-CE2 4.08Å; F402-F426 AromaticContact CG-CG 3.45Å; F402-F426 HydrophobicContact CG-CG 3.45Å; F402-F426 VanDerWaalsContact CG-CG 3.45Å; F402-F426 HydrophobicContact CG-CZ 4.2Å; F402-F426 HydrophobicContact CZ-CB 4.42Å; F402-F426 HydrophobicContact CZ-CD2 4.06Å; F402-F426 HydrophobicContact CZ-CG 4.38Å; A422-F426 WeakPolarHBondContact O-CB 3.39Å; A422-F426 PolarHBondContact O-N 3.36Å; R424-F426 PolarHBondContact O-N 3.36Å; F426-I428 VanDerWaalsContact C-N 3.32Å; F426-I428 PolarHBondContact O-N 2.87Å; F426-F429 HydrophobicContact CD2-CD1 4.16Å; F426-F429 AromaticContact CE2-CD1 3.94Å; F426-F429 HydrophobicContact CE2-CD1 3.94Å; F426-F429 HydrophobicContact CE2-CE1 4.37Å; F426-F429 WeakPolarHBondContact O-CB 3.43Å; F426-F429 PolarHBondContact O-N 2.95Å; F426-L430 HydrophobicContact CD1-CD1 3.97Å; F426-L430 HydrophobicContact CD1-CG 4.23Å; F426-L430 HydrophobicContact CE1-CD1 3.4Å; F426-L430 HydrophobicContact CE1-CD2 4.19Å; F426-L430 HydrophobicContact CE1-CG 3.71Å; F426-L430 HydrophobicContact CE2-CG 4.44Å; F426-L430 HydrophobicContact CZ-CD1 3.95Å; F426-L430 HydrophobicContact CZ-CD2 3.85Å; F426-L430 HydrophobicContact CZ-CG 3.8Å; F426-L430 PolarHBondContact O-N 2.95Å
427	I	86.6	Confident	85.2	Confident	16 Å²	16	49.5 Å²	49.5	8%	0.082	26%	0.258	C	S	.	.	H	α-helix	trans	-59.6	-43.9	173.4	-69.3	162.3	0	0	0	110.9	T190 F395 G423 R424 V425 F429 L430 I431	T190-I427 HydrophobicContact CG2-CD1 4.08Å; F395-I427 HydrophobicContact CB-CD1 3.96Å; F395-I427 HydrophobicContact CB-CG1 4.03Å; F395-I427 HydrophobicContact CB-CG2 4.02Å; F395-I427 HydrophobicContact CD1-CG2 4.02Å; F395-I427 HydrophobicContact CD2-CG2 3.86Å; F395-I427 HydrophobicContact CE1-CG2 4.48Å; F395-I427 HydrophobicContact CE2-CG2 4.32Å; F395-I427 HydrophobicContact CG-CG2 3.7Å; G423-I427 WeakPolarHBondContact O-CG1 3.29Å; G423-I427 PolarHBondContact O-N 2.89Å; R424-I427 PolarHBondContact O-N 2.95Å; V425-I427 PolarHBondContact O-N 2.96Å; I427-F429 VanDerWaalsContact C-N 3.29Å; I427-F429 PolarHBondContact O-N 3.4Å; I427-L430 PolarHBondContact O-N 3.31Å; I427-I431 HydrophobicContact CG2-CD1 3.86Å; I427-I431 HydrophobicContact CG2-CG1 4.4Å; I427-I431 WeakPolarHBondContact O-CG1 3.49Å; I427-I431 PolarHBondContact O-N 3.06Å
428	I	86.9	Confident	85.8	Confident	110 Å²	110	43.7 Å²	43.7	56%	0.564	24%	0.236	S	C	*	.	H	α-helix	trans	-60.6	-42.7	177.6	-62.5	171.5	0	0	0	110.3	R424 V425 F426 I431 C432	R424-I428 PolarHBondContact O-N 2.95Å; V425-I428 PolarHBondContact O-N 3.24Å; F426-I428 VanDerWaalsContact C-N 3.32Å; F426-I428 PolarHBondContact O-N 2.87Å; I428-I431 PolarHBondContact O-N 3Å; I428-C432 PolarHBondContact O-N 3.25Å; I428-C432 VanDerWaalsContact O-N 3.08Å; I428-C432 PolarHBondContact O-SG 2.83Å; I428-C432 VanDerWaalsContact O-SG 3.36Å
429	F	90	Very high	86	Confident	120 Å²	120	45 Å²	45	53%	0.526	25%	0.247	S	C	.	.	H	α-helix	trans	-59.2	-47.3	174.9	170.6	-99.4	0	0	0	112.2	V425 F426 I427 I431 C432 V433	V425-F429 PolarHBondContact O-N 3.34Å; V425-F429 VanDerWaalsContact O-N 3.14Å; F426-F429 HydrophobicContact CD2-CD1 4.16Å; F426-F429 AromaticContact CE2-CD1 3.94Å; F426-F429 HydrophobicContact CE2-CD1 3.94Å; F426-F429 HydrophobicContact CE2-CE1 4.37Å; F426-F429 WeakPolarHBondContact O-CB 3.43Å; F426-F429 PolarHBondContact O-N 2.95Å; I427-F429 VanDerWaalsContact C-N 3.29Å; I427-F429 PolarHBondContact O-N 3.4Å; F429-I431 VanDerWaalsContact C-N 3.34Å; F429-I431 PolarHBondContact O-N 3.2Å; F429-C432 WeakPolarHBondContact O-CB 3.49Å; F429-C432 PolarHBondContact O-N 2.89Å; F429-V433 HydrophobicContact CE1-CG2 4.09Å; F429-V433 HydrophobicContact CE2-CG2 4.05Å; F429-V433 HydrophobicContact CZ-CG2 3.81Å; F429-V433 WeakPolarHBondContact O-CG2 3.44Å; F429-V433 PolarHBondContact O-N 2.9Å; F429-V433 VanDerWaalsContact O-N 3.1Å
430	L	88.5	Confident	86.3	Confident	7 Å²	7	48.4 Å²	48.4	4%	0.037	26%	0.264	C	S	.	.	H	α-helix	trans	-59.8	-43.3	176.9	-75.4	-179.7	0	0	0	112.4	A152 I156 A398 F426 I427 C432 V433 S434	A152-L430 HydrophobicContact CB-CD2 4.1Å; I156-L430 HydrophobicContact CD1-CB 4.39Å; I156-L430 HydrophobicContact CD1-CD1 4.45Å; A398-L430 HydrophobicContact CB-CD1 3.59Å; F426-L430 HydrophobicContact CD1-CD1 3.97Å; F426-L430 HydrophobicContact CD1-CG 4.23Å; F426-L430 HydrophobicContact CE1-CD1 3.4Å; F426-L430 HydrophobicContact CE1-CD2 4.19Å; F426-L430 HydrophobicContact CE1-CG 3.71Å; F426-L430 HydrophobicContact CE2-CG 4.44Å; F426-L430 HydrophobicContact CZ-CD1 3.95Å; F426-L430 HydrophobicContact CZ-CD2 3.85Å; F426-L430 HydrophobicContact CZ-CG 3.8Å; F426-L430 PolarHBondContact O-N 2.95Å; I427-L430 PolarHBondContact O-N 3.31Å; L430-C432 VanDerWaalsContact C-N 3.33Å; L430-C432 PolarHBondContact O-N 3.45Å; L430-V433 PolarHBondContact O-N 3.35Å; L430-S434 PolarHBondContact O-N 3.4Å; L430-S434 PolarHBondContact O-OG 3.48Å
431	I	87.1	Confident	86.7	Confident	22 Å²	22	47 Å²	47	11%	0.113	26%	0.257	C	S	.	.	H	α-helix	trans	-58	-46.4	176.8	-70.9	168.3	0	0	0	110.6	L183 F395 I427 I428 F429 V433 S434 I435	L183-I431 HydrophobicContact CD1-CG2 3.67Å; L183-I431 HydrophobicContact CD2-CD1 4.45Å; L183-I431 HydrophobicContact CD2-CG1 4.41Å; L183-I431 HydrophobicContact CD2-CG2 3.94Å; L183-I431 HydrophobicContact CG-CG2 4.38Å; F395-I431 HydrophobicContact CE1-CD1 4.44Å; F395-I431 HydrophobicContact CE1-CG1 3.91Å; F395-I431 HydrophobicContact CE2-CD1 3.86Å; F395-I431 HydrophobicContact CE2-CG1 4.16Å; F395-I431 HydrophobicContact CZ-CD1 3.74Å; F395-I431 HydrophobicContact CZ-CG1 3.5Å; F395-I431 VanDerWaalsContact CZ-CG1 3.5Å; I427-I431 HydrophobicContact CG2-CD1 3.86Å; I427-I431 HydrophobicContact CG2-CG1 4.4Å; I427-I431 WeakPolarHBondContact O-CG1 3.49Å; I427-I431 PolarHBondContact O-N 3.06Å; I428-I431 PolarHBondContact O-N 3Å; F429-I431 VanDerWaalsContact C-N 3.34Å; F429-I431 PolarHBondContact O-N 3.2Å; I431-V433 VanDerWaalsContact C-N 3.34Å; I431-V433 PolarHBondContact O-N 3.46Å; I431-S434 PolarHBondContact O-N 3.23Å; I431-I435 HydrophobicContact CG2-CD1 3.83Å; I431-I435 HydrophobicContact CG2-CG1 4.35Å; I431-I435 VanDerWaalsContact O-CG1 3.29Å; I431-I435 WeakPolarHBondContact O-CG1 3.25Å; I431-I435 PolarHBondContact O-N 3.12Å
432	C	89.2	Confident	86.6	Confident	76 Å²	76	46 Å²	46	51%	0.514	25%	0.25	S	S	.	.	H	α-helix	trans	-59.9	-43.3	178.1	-70	0	0	0	0	112.3	I428 F429 L430 I435 A436	I428-C432 PolarHBondContact O-N 3.25Å; I428-C432 VanDerWaalsContact O-N 3.08Å; I428-C432 PolarHBondContact O-SG 2.83Å; I428-C432 VanDerWaalsContact O-SG 3.36Å; F429-C432 WeakPolarHBondContact O-CB 3.49Å; F429-C432 PolarHBondContact O-N 2.89Å; L430-C432 VanDerWaalsContact C-N 3.33Å; L430-C432 PolarHBondContact O-N 3.45Å; C432-I435 PolarHBondContact O-N 3.34Å; C432-A436 PolarHBondContact O-N 3.01Å; C432-A436 VanDerWaalsContact O-N 3.12Å
433	V	90.8	Very high	86.2	Confident	40 Å²	40	50.1 Å²	50.1	24%	0.242	28%	0.279	C	S	.	.	H	α-helix	trans	-63.9	-44.6	177	174.4	0	0	0	0	111	A152 F153 F429 L430 I431 I435 A436 W437	A152-V433 HydrophobicContact CB-CG1 4.39Å; F153-V433 HydrophobicContact CE1-CG1 4.17Å; F153-V433 HydrophobicContact CZ-CG1 4.46Å; F429-V433 HydrophobicContact CE1-CG2 4.09Å; F429-V433 HydrophobicContact CE2-CG2 4.05Å; F429-V433 HydrophobicContact CZ-CG2 3.81Å; F429-V433 WeakPolarHBondContact O-CG2 3.44Å; F429-V433 PolarHBondContact O-N 2.9Å; F429-V433 VanDerWaalsContact O-N 3.1Å; L430-V433 PolarHBondContact O-N 3.35Å; I431-V433 VanDerWaalsContact C-N 3.34Å; I431-V433 PolarHBondContact O-N 3.46Å; V433-I435 PolarHBondContact O-N 2.99Å; V433-A436 WeakPolarHBondContact O-CB 3.5Å; V433-A436 PolarHBondContact O-N 3.48Å; V433-W437 PolarHBondContact O-N 3.46Å; V433-W437 VanDerWaalsContact O-N 3.16Å
434	S	89.2	Confident	85.8	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-66.4	-37.4	179.3	-63.1	0	0	0	0	112.8	A152 I156 L430 I431 A436 W437 I438	A152-S434 PolarHBondContact O-OG 2.82Å; I156-S434 WeakPolarHBondContact CB-OG 3.1Å; I156-S434 VanDerWaalsContact CG2-OG 3.29Å; I156-S434 WeakPolarHBondContact CG2-OG 3.31Å; L430-S434 PolarHBondContact O-N 3.4Å; L430-S434 PolarHBondContact O-OG 3.48Å; I431-S434 PolarHBondContact O-N 3.23Å; S434-A436 VanDerWaalsContact C-N 3.34Å; S434-W437 WeakPolarHBondContact O-CB 3.35Å; S434-W437 PolarHBondContact O-N 2.85Å; S434-W437 VanDerWaalsContact O-N 3.15Å; S434-I438 PolarHBondContact O-N 3.39Å
435	I	87.8	Confident	85.3	Confident	62 Å²	62	49.1 Å²	49.1	32%	0.318	28%	0.279	S	S	.	.	H	α-helix	trans	-62	-43.7	173.1	-67.3	167.8	0	0	0	110.6	V179 L183 I431 C432 V433 W437 I438	V179-I435 HydrophobicContact CG1-CG1 4.36Å; L183-I435 HydrophobicContact CD1-CD1 3.5Å; L183-I435 HydrophobicContact CD1-CG1 3.9Å; I431-I435 HydrophobicContact CG2-CD1 3.83Å; I431-I435 HydrophobicContact CG2-CG1 4.35Å; I431-I435 VanDerWaalsContact O-CG1 3.29Å; I431-I435 WeakPolarHBondContact O-CG1 3.25Å; I431-I435 PolarHBondContact O-N 3.12Å; C432-I435 PolarHBondContact O-N 3.34Å; V433-I435 PolarHBondContact O-N 2.99Å; I435-W437 PolarHBondContact O-N 2.95Å; I435-I438 WeakPolarHBondContact O-CB 3.42Å; I435-I438 PolarHBondContact O-N 3.28Å
436	A	89.9	Confident	84.5	Confident	75 Å²	75	46.5 Å²	46.5	62%	0.62	26%	0.264	S	S	*	.	H	α-helix	trans	-62.4	-23.6	177.5	0	0	0	0	0	112.6	C432 V433 S434 P439	C432-A436 PolarHBondContact O-N 3.01Å; C432-A436 VanDerWaalsContact O-N 3.12Å; V433-A436 WeakPolarHBondContact O-CB 3.5Å; V433-A436 PolarHBondContact O-N 3.48Å; S434-A436 VanDerWaalsContact C-N 3.34Å; A436-P439 WeakPolarHBondContact O-CD 3.49Å
437	W	89	Confident	83.8	Confident	62 Å²	62	45.5 Å²	45.5	24%	0.235	26%	0.261	C	S	.	.	H	α-helix	trans	-85.5	-15.6	178.1	-161.3	-105.2	0	0	0	114.5	F153 V433 S434 I435 P439 M440 V441 F501	F153-W437 HydrophobicContact CD1-CB 4.41Å; F153-W437 AromaticContact CD1-CD2 3.5Å; F153-W437 HydrophobicContact CD1-CD2 3.5Å; F153-W437 AromaticContact CD1-CE2 3.8Å; F153-W437 AromaticContact CD1-CE3 3.73Å; F153-W437 HydrophobicContact CD1-CE3 3.73Å; F153-W437 AromaticContact CD1-CG 3.81Å; F153-W437 HydrophobicContact CD1-CG 3.81Å; F153-W437 HydrophobicContact CD1-CH2 4.46Å; F153-W437 HydrophobicContact CD1-CZ2 4.29Å; F153-W437 HydrophobicContact CD1-CZ3 4.21Å; F153-W437 AromaticContact CE1-CD2 3.9Å; F153-W437 HydrophobicContact CE1-CD2 3.9Å; F153-W437 AromaticContact CE1-CE3 3.61Å; F153-W437 HydrophobicContact CE1-CE3 3.61Å; F153-W437 HydrophobicContact CE1-CG 4.42Å; F153-W437 AromaticContact CE1-CZ3 3.96Å; F153-W437 HydrophobicContact CE1-CZ3 3.96Å; V433-W437 PolarHBondContact O-N 3.46Å; V433-W437 VanDerWaalsContact O-N 3.16Å; S434-W437 WeakPolarHBondContact O-CB 3.35Å; S434-W437 PolarHBondContact O-N 2.85Å; S434-W437 VanDerWaalsContact O-N 3.15Å; I435-W437 PolarHBondContact O-N 2.95Å; W437-P439 VanDerWaalsContact C-CD 3.44Å; W437-M440 HydrophobicContact CD2-CB 4.06Å; W437-M440 HydrophobicContact CD2-CG 4.2Å; W437-M440 HydrophobicContact CE3-CB 4.49Å; W437-M440 HydrophobicContact CE3-CG 4.12Å; W437-M440 HydrophobicContact CG-CB 4.43Å; W437-M440 HydrophobicContact CH2-CG 4.41Å; W437-M440 HydrophobicContact CZ2-CB 4.24Å; W437-M440 HydrophobicContact CZ2-CG 4.47Å; W437-M440 HydrophobicContact CZ3-CG 4.23Å; W437-M440 WeakPolarHBondContact O-CB 3.2Å; W437-M440 PolarHBondContact O-N 3.47Å; W437-V441 PolarHBondContact O-N 3.41Å; W437-F501 HydrophobicContact CZ2-CZ 4.3Å
438	I	85.8	Confident	83.7	Confident	2 Å²	2	47.6 Å²	47.6	1%	0.01	27%	0.271	C	S	.	.	H	α-helix	trans	-52.3	-43.6	-178.4	-67.1	173.1	0	0	0	113.4	I160 F161 V179 S434 I435 M440 V441 Q442	I160-I438 HydrophobicContact CG2-CD1 3.77Å; F161-I438 HydrophobicContact CD2-CG2 4.15Å; V179-I438 HydrophobicContact CG1-CD1 4.3Å; V179-I438 HydrophobicContact CG2-CD1 4.09Å; S434-I438 PolarHBondContact O-N 3.39Å; I435-I438 WeakPolarHBondContact O-CB 3.42Å; I435-I438 PolarHBondContact O-N 3.28Å; I438-M440 PolarHBondContact O-N 3.34Å; I438-V441 WeakPolarHBondContact O-CB 3.26Å; I438-V441 PolarHBondContact O-N 2.75Å; I438-V441 VanDerWaalsContact O-N 3.13Å; I438-Q442 HydrophobicContact CG2-CG 4.35Å; I438-Q442 PolarHBondContact O-N 2.91Å
439	P	84.3	Confident	83.7	Confident	63 Å²	63	42.4 Å²	42.4	41%	0.409	24%	0.244	S	C	.	.	H	α-helix	trans	-60.1	-33.6	178.1	-24.6	35.6	0	0	0	113.2	A436 W437 Q442 S443	A436-P439 WeakPolarHBondContact O-CD 3.49Å; W437-P439 VanDerWaalsContact C-CD 3.44Å; P439-Q442 PolarHBondContact O-N 2.89Å; P439-S443 PolarHBondContact O-N 3.34Å; P439-S443 VanDerWaalsContact O-N 3.13Å
440	M	84.1	Confident	83.7	Confident	78 Å²	78	36.8 Å²	36.8	38%	0.384	22%	0.219	S	C	.	.	H	α-helix	trans	-67.8	-43	176.1	-64.6	-54.7	-56.2	0	0	111.1	W437 I438 Q442 S443 A444 F501	W437-M440 HydrophobicContact CD2-CB 4.06Å; W437-M440 HydrophobicContact CD2-CG 4.2Å; W437-M440 HydrophobicContact CE3-CB 4.49Å; W437-M440 HydrophobicContact CE3-CG 4.12Å; W437-M440 HydrophobicContact CG-CB 4.43Å; W437-M440 HydrophobicContact CH2-CG 4.41Å; W437-M440 HydrophobicContact CZ2-CB 4.24Å; W437-M440 HydrophobicContact CZ2-CG 4.47Å; W437-M440 HydrophobicContact CZ3-CG 4.23Å; W437-M440 WeakPolarHBondContact O-CB 3.2Å; W437-M440 PolarHBondContact O-N 3.47Å; I438-M440 PolarHBondContact O-N 3.34Å; M440-Q442 VanDerWaalsContact C-N 3.32Å; M440-Q442 PolarHBondContact O-N 3.39Å; M440-S443 PolarHBondContact O-N 3.43Å; M440-A444 VanDerWaalsContact O-CB 3.29Å; M440-A444 WeakPolarHBondContact O-CB 3.19Å; M440-A444 PolarHBondContact O-N 2.98Å; M440-F501 HydrophobicContact CE-CD1 4.34Å
441	V	83.7	Confident	83.7	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-60	-43.8	174.7	179.8	0	0	0	0	110.8	F161 W437 I438 S443 A444 Q445 L449 Y452	F161-V441 HydrophobicContact CB-CG1 4.39Å; F161-V441 HydrophobicContact CD1-CG1 4.03Å; F161-V441 HydrophobicContact CG-CG1 4.14Å; W437-V441 PolarHBondContact O-N 3.41Å; I438-V441 WeakPolarHBondContact O-CB 3.26Å; I438-V441 PolarHBondContact O-N 2.75Å; I438-V441 VanDerWaalsContact O-N 3.13Å; V441-S443 VanDerWaalsContact C-N 3.3Å; V441-S443 PolarHBondContact O-N 3.46Å; V441-A444 PolarHBondContact O-N 2.78Å; V441-Q445 WeakPolarHBondContact O-CB 3.3Å; V441-Q445 WeakPolarHBondContact O-CG 3.39Å; V441-Q445 PolarHBondContact O-N 3.34Å; V441-Q445 VanDerWaalsContact O-N 3.11Å; V441-L449 HydrophobicContact CG1-CD1 3.84Å; V441-Y452 HydrophobicContact CB-CE1 4.37Å; V441-Y452 HydrophobicContact CG1-CD1 4.43Å; V441-Y452 HydrophobicContact CG1-CE1 3.99Å; V441-Y452 HydrophobicContact CG2-CE1 4.13Å
442	Q	81	Confident	83.7	Confident	60 Å²	60	37.3 Å²	37.3	28%	0.28	22%	0.222	S	C	.	.	H	α-helix	trans	-60.3	-38.5	178.6	-75	-177.2	-44.9	0	0	113	F161 I438 P439 M440	F161-Q442 HydrophobicContact CD2-CG 3.99Å; F161-Q442 HydrophobicContact CE2-CG 3.44Å; F161-Q442 VanDerWaalsContact CE2-CG 3.44Å; F161-Q442 HydrophobicContact CZ-CG 4.15Å; I438-Q442 HydrophobicContact CG2-CG 4.35Å; I438-Q442 PolarHBondContact O-N 2.91Å; P439-Q442 PolarHBondContact O-N 2.89Å; M440-Q442 VanDerWaalsContact C-N 3.32Å; M440-Q442 PolarHBondContact O-N 3.39Å
443	S	76.9	Confident	83.8	Confident	99 Å²	99	34.2 Å²	34.2	69%	0.692	20%	0.2	S	C	*	.	H	α-helix	trans	-78.4	-30.8	-179.6	-169.5	0	0	0	0	113.3	P439 M440 V441	P439-S443 PolarHBondContact O-N 3.34Å; P439-S443 VanDerWaalsContact O-N 3.13Å; M440-S443 PolarHBondContact O-N 3.43Å; V441-S443 VanDerWaalsContact C-N 3.3Å; V441-S443 PolarHBondContact O-N 3.46Å
444	A	73.9	Confident	83.8	Confident	15 Å²	15	33.6 Å²	33.6	12%	0.124	19%	0.194	C	C	.	.	H	α-helix	trans	-97.8	-21.2	-168.8	0	0	0	0	0	114.6	M440 V441 S446 Y452 F501	M440-A444 VanDerWaalsContact O-CB 3.29Å; M440-A444 WeakPolarHBondContact O-CB 3.19Å; M440-A444 PolarHBondContact O-N 2.98Å; V441-A444 PolarHBondContact O-N 2.78Å; A444-S446 PolarHBondContact O-N 3.23Å; A444-Y452 HydrophobicContact CB-CD2 3.84Å; A444-Y452 HydrophobicContact CB-CE2 3.36Å; A444-F501 HydrophobicContact CB-CD1 4.32Å; A444-F501 HydrophobicContact CB-CE1 3.77Å
445	Q	72.2	Confident	83.9	Confident	8 Å²	8	33.9 Å²	33.9	4%	0.037	20%	0.196	C	C	.	.	S	Bend	trans	-69.8	-11.3	-174.5	66.2	171.7	-29.8	0	0	115.4	F161 N360 V441 G447 Q448 L449 Y452	F161-Q445 VanDerWaalsContact CE1-OE1 3.25Å; N360-Q445 PolarHBondContact ND2-OE1 3.42Å; V441-Q445 WeakPolarHBondContact O-CB 3.3Å; V441-Q445 WeakPolarHBondContact O-CG 3.39Å; V441-Q445 PolarHBondContact O-N 3.34Å; V441-Q445 VanDerWaalsContact O-N 3.11Å; Q445-G447 PolarHBondContact O-N 2.79Å; Q445-Q448 CarbonylContact O-C 3.53Å; Q445-Q448 PolarHBondContact O-N 2.97Å; Q445-L449 HydrophobicContact CB-CD1 4.31Å; Q445-Y452 HydrophobicContact CB-CG 4.33Å
446	S	70	Confident	84	Confident	37 Å²	37	31.3 Å²	31.3	26%	0.259	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	41.7	32.3	179.2	-64.6	0	0	0	0	116.1	A444 T505	A444-S446 PolarHBondContact O-N 3.23Å; S446-T505 PolarHBondContact OG-OG1 3.44Å
447	G	74.1	Confident	84.1	Confident	4 Å²	4	28.2 Å²	28.2	4%	0.041	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	90	-15.3	-179.1	0	0	0	0	0	115.6	T359 N360 Q445	T359-G447 PolarHBondContact OG1-O 2.92Å; N360-G447 PolarHBondContact ND2-O 2.97Å; N360-G447 VanDerWaalsContact ND2-O 3.17Å; N360-G447 PolarHBondContact OD1-O 3.26Å; Q445-G447 PolarHBondContact O-N 2.79Å
448	Q	83.6	Confident	84.3	Confident	60 Å²	60	25.3 Å²	25.3	28%	0.28	15%	0.145	S	C	.	.			trans	-119.1	89	179.2	-69.4	174.7	-100.3	0	0	110.6	A92 Q445 F450 D451 Y452	A92-Q448 HydrophobicContact CB-CG 4.27Å; Q445-Q448 CarbonylContact O-C 3.53Å; Q445-Q448 PolarHBondContact O-N 2.97Å; Q448-F450 VanDerWaalsContact C-N 3.27Å; Q448-F450 PolarHBondContact O-N 2.98Å; Q448-D451 HydrophobicContact CB-CB 4.25Å; Q448-D451 WeakPolarHBondContact CB-OD2 3.07Å; Q448-D451 PolarHBondContact NE2-OD2 3.15Å; Q448-D451 PolarHBondContact O-N 3.19Å; Q448-Y452 PolarHBondContact O-N 3.03Å
449	L	86.4	Confident	84.5	Confident	0 Å²	0	25.4 Å²	25.4	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-61	-37.4	-174.9	179.8	60.7	0	0	0	112.4	F161 N360 V441 Q445 Y452 I453	F161-L449 HydrophobicContact CD1-CD1 3.93Å; F161-L449 HydrophobicContact CD1-CD2 3.86Å; F161-L449 HydrophobicContact CE1-CD1 4.35Å; F161-L449 HydrophobicContact CE1-CD2 4.3Å; N360-L449 WeakPolarHBondContact OD1-CB 3.36Å; N360-L449 PolarHBondContact OD1-N 3.33Å; N360-L449 VanDerWaalsContact OD1-N 3.13Å; V441-L449 HydrophobicContact CG1-CD1 3.84Å; Q445-L449 HydrophobicContact CB-CD1 4.31Å; L449-Y452 HydrophobicContact CD1-CD1 4.39Å; L449-I453 HydrophobicContact CD1-CD1 4.08Å; L449-I453 HydrophobicContact CD1-CG1 4.39Å; L449-I453 HydrophobicContact CG-CD1 3.86Å; L449-I453 WeakPolarHBondContact O-CD1 3.14Å; L449-I453 VanDerWaalsContact O-CG1 3.29Å; L449-I453 WeakPolarHBondContact O-CG1 3.33Å; L449-I453 PolarHBondContact O-N 3.31Å
450	F	90.1	Very high	84.9	Confident	2 Å²	2	23.2 Å²	23.2	1%	0.009	13%	0.13	C	C	.	.	H	α-helix	trans	-65.9	-46.5	-177	-164.7	-93.1	0	0	0	111.5	V81 L86 I97 F100 Q448 Y452 I453 Q454	V81-F450 HydrophobicContact CG1-CD2 4.03Å; L86-F450 HydrophobicContact CB-CD2 4.1Å; L86-F450 HydrophobicContact CB-CE2 4.19Å; L86-F450 HydrophobicContact CD1-CD1 4.31Å; L86-F450 HydrophobicContact CD1-CD2 4.31Å; L86-F450 HydrophobicContact CD1-CE1 3.87Å; L86-F450 HydrophobicContact CD1-CE2 3.89Å; L86-F450 HydrophobicContact CD1-CZ 3.64Å; I97-F450 HydrophobicContact CD1-CD1 3.78Å; I97-F450 HydrophobicContact CD1-CE1 3.93Å; I97-F450 HydrophobicContact CG1-CD1 4.15Å; I97-F450 HydrophobicContact CG1-CE1 4.18Å; F100-F450 HydrophobicContact CB-CE1 4.31Å; F100-F450 HydrophobicContact CB-CZ 4.33Å; F100-F450 AromaticContact CD1-CE1 3.89Å; F100-F450 HydrophobicContact CD1-CE1 3.89Å; F100-F450 HydrophobicContact CD1-CZ 4.29Å; F100-F450 AromaticContact CD2-CE1 3.99Å; F100-F450 HydrophobicContact CD2-CE1 3.99Å; F100-F450 HydrophobicContact CE1-CE1 4.14Å; F100-F450 HydrophobicContact CE2-CE1 4.24Å; F100-F450 AromaticContact CG-CE1 3.8Å; F100-F450 HydrophobicContact CG-CE1 3.8Å; F100-F450 HydrophobicContact CG-CZ 4.25Å; F100-F450 HydrophobicContact CZ-CE1 4.3Å; Q448-F450 VanDerWaalsContact C-N 3.27Å; Q448-F450 PolarHBondContact O-N 2.98Å; F450-Y452 VanDerWaalsContact C-N 3.3Å; F450-Y452 PolarHBondContact O-N 3.15Å; F450-I453 PolarHBondContact O-N 2.92Å; F450-I453 VanDerWaalsContact O-N 3.14Å; F450-Q454 HydrophobicContact CD1-CG 3.72Å; F450-Q454 HydrophobicContact CE1-CG 3.56Å; F450-Q454 HydrophobicContact CG-CG 4.48Å; F450-Q454 HydrophobicContact CZ-CG 4.18Å; F450-Q454 VanDerWaalsContact CZ-NE2 3.33Å; F450-Q454 VanDerWaalsContact O-CG 3.26Å; F450-Q454 WeakPolarHBondContact O-CG 3.45Å; F450-Q454 PolarHBondContact O-N 3.43Å
451	D	88.6	Confident	85.3	Confident	26 Å²	26	19.5 Å²	19.5	14%	0.139	11%	0.112	C	C	.	.	H	α-helix	trans	-63.3	-37.6	-179.1	-62.9	-48.2	0	0	0	112	T89 Q448 Q454 S455	T89-D451 WeakPolarHBondContact CG2-OD2 3.34Å; T89-D451 PolarHBondContact OG1-OD2 2.81Å; T89-D451 VanDerWaalsContact OG1-OD2 3.06Å; Q448-D451 HydrophobicContact CB-CB 4.25Å; Q448-D451 WeakPolarHBondContact CB-OD2 3.07Å; Q448-D451 PolarHBondContact NE2-OD2 3.15Å; Q448-D451 PolarHBondContact O-N 3.19Å; D451-Q454 PolarHBondContact O-N 2.82Å; D451-S455 WeakPolarHBondContact O-CB 3.19Å; D451-S455 PolarHBondContact O-N 3.32Å
452	Y	88.2	Confident	85.8	Confident	15 Å²	15	19.5 Å²	19.5	6%	0.059	11%	0.112	C	C	.	.	H	α-helix	trans	-60.6	-44.2	172.7	166.3	-101.3	0	0	0	113.2	V441 A444 Q445 Q448 L449 F450 Q454 S455 I456 F501	V441-Y452 HydrophobicContact CB-CE1 4.37Å; V441-Y452 HydrophobicContact CG1-CD1 4.43Å; V441-Y452 HydrophobicContact CG1-CE1 3.99Å; V441-Y452 HydrophobicContact CG2-CE1 4.13Å; A444-Y452 HydrophobicContact CB-CD2 3.84Å; A444-Y452 HydrophobicContact CB-CE2 3.36Å; Q445-Y452 HydrophobicContact CB-CG 4.33Å; Q448-Y452 PolarHBondContact O-N 3.03Å; L449-Y452 HydrophobicContact CD1-CD1 4.39Å; F450-Y452 VanDerWaalsContact C-N 3.3Å; F450-Y452 PolarHBondContact O-N 3.15Å; Y452-Q454 VanDerWaalsContact C-N 3.35Å; Y452-S455 PolarHBondContact O-N 2.84Å; Y452-S455 PolarHBondContact O-OG 3.44Å; Y452-I456 HydrophobicContact CD1-CD1 4.47Å; Y452-I456 HydrophobicContact CD2-CD1 4.18Å; Y452-I456 HydrophobicContact CE1-CD1 3.82Å; Y452-I456 HydrophobicContact CE2-CD1 3.47Å; Y452-I456 VanDerWaalsContact CE2-CD1 3.47Å; Y452-I456 HydrophobicContact CE2-CG1 4.32Å; Y452-I456 PolarHBondContact O-N 3.18Å; Y452-I456 WeakPolarHBondContact OH-CD1 3.43Å; Y452-F501 HydrophobicContact CE2-CE1 4.09Å; Y452-F501 HydrophobicContact CE2-CZ 4.14Å
453	I	89.8	Confident	86.5	Confident	11 Å²	11	16.7 Å²	16.7	6%	0.056	10%	0.099	C	C	.	.	H	α-helix	trans	-66.1	-44	179.1	-64.7	159.9	0	0	0	109.8	V81 A158 L449 F450 S455 I456 I457	V81-I453 HydrophobicContact CB-CD1 4.47Å; V81-I453 HydrophobicContact CG1-CD1 3.51Å; V81-I453 HydrophobicContact CG2-CD1 4.07Å; A158-I453 HydrophobicContact CB-CD1 3.31Å; A158-I453 HydrophobicContact CB-CG1 3.77Å; L449-I453 HydrophobicContact CD1-CD1 4.08Å; L449-I453 HydrophobicContact CD1-CG1 4.39Å; L449-I453 HydrophobicContact CG-CD1 3.86Å; L449-I453 WeakPolarHBondContact O-CD1 3.14Å; L449-I453 VanDerWaalsContact O-CG1 3.29Å; L449-I453 WeakPolarHBondContact O-CG1 3.33Å; L449-I453 PolarHBondContact O-N 3.31Å; F450-I453 PolarHBondContact O-N 2.92Å; F450-I453 VanDerWaalsContact O-N 3.14Å; I453-S455 VanDerWaalsContact C-N 3.35Å; I453-S455 PolarHBondContact O-N 3.12Å; I453-I456 PolarHBondContact O-N 3.25Å; I453-I457 HydrophobicContact CG2-CD1 3.77Å; I453-I457 HydrophobicContact CG2-CG1 4.47Å; I453-I457 VanDerWaalsContact O-CG1 3.3Å; I453-I457 WeakPolarHBondContact O-CG1 3.45Å; I453-I457 PolarHBondContact O-N 3.5Å
454	Q	91.5	Very high	87.4	Confident	27 Å²	27	12 Å²	12	13%	0.126	7%	0.066	C	C	.	.	H	α-helix	trans	-68.1	-33	-178.9	-61.9	-60.6	-23.4	0	0	112.3	F100 Q283 F450 D451 Y452 I457 S458 Y523	F100-Q454 HydrophobicContact CD1-CG 4.1Å; F100-Q454 HydrophobicContact CE1-CB 3.82Å; F100-Q454 VanDerWaalsContact CE1-CD 3.46Å; F100-Q454 HydrophobicContact CE1-CG 3.39Å; F100-Q454 HydrophobicContact CZ-CB 4.04Å; F100-Q454 HydrophobicContact CZ-CG 3.85Å; Q283-Q454 PolarHBondContact OE1-O 3.5Å; Q283-Q454 VanDerWaalsContact OE1-O 3.11Å; F450-Q454 HydrophobicContact CD1-CG 3.72Å; F450-Q454 HydrophobicContact CE1-CG 3.56Å; F450-Q454 HydrophobicContact CG-CG 4.48Å; F450-Q454 HydrophobicContact CZ-CG 4.18Å; F450-Q454 VanDerWaalsContact CZ-NE2 3.33Å; F450-Q454 VanDerWaalsContact O-CG 3.26Å; F450-Q454 WeakPolarHBondContact O-CG 3.45Å; F450-Q454 PolarHBondContact O-N 3.43Å; D451-Q454 PolarHBondContact O-N 2.82Å; Y452-Q454 VanDerWaalsContact C-N 3.35Å; Q454-I457 PolarHBondContact O-N 3.16Å; Q454-S458 WeakPolarHBondContact O-CB 3.32Å; Q454-S458 PolarHBondContact O-N 3.03Å; Q454-S458 PolarHBondContact O-OG 3.35Å; Q454-Y523 HydrophobicContact CB-CE2 4.16Å
455	S	90.3	Very high	88.4	Confident	5 Å²	5	11.3 Å²	11.3	4%	0.035	6%	0.06	C	C	.	.	H	α-helix	trans	-65	-45.7	174.8	74.9	0	0	0	0	111.5	D451 Y452 I453 I457 S458 Y459	D451-S455 WeakPolarHBondContact O-CB 3.19Å; D451-S455 PolarHBondContact O-N 3.32Å; Y452-S455 PolarHBondContact O-N 2.84Å; Y452-S455 PolarHBondContact O-OG 3.44Å; I453-S455 VanDerWaalsContact C-N 3.35Å; I453-S455 PolarHBondContact O-N 3.12Å; S455-I457 PolarHBondContact O-N 3.36Å; S455-S458 WeakPolarHBondContact O-CA 3.46Å; S455-S458 WeakPolarHBondContact O-CB 2.99Å; S455-S458 PolarHBondContact O-N 3.48Å; S455-S458 VanDerWaalsContact O-N 3.12Å; S455-Y459 WeakPolarHBondContact O-CD1 3.15Å; S455-Y459 VanDerWaalsContact O-CD2 3.26Å; S455-Y459 WeakPolarHBondContact O-CD2 3.4Å; S455-Y459 PolarHBondContact O-N 3.37Å
456	I	90.6	Very high	89.5	Confident	8 Å²	8	10.9 Å²	10.9	4%	0.041	6%	0.058	C	C	.	.	H	α-helix	trans	-64.4	-41.8	177.1	-61.7	172.5	0	0	0	111.3	T154 Y452 I453 S458 Y459 L460 M497 F501	T154-I456 HydrophobicContact CG2-CB 4.07Å; T154-I456 HydrophobicContact CG2-CG2 3.42Å; T154-I456 VanDerWaalsContact CG2-CG2 3.42Å; Y452-I456 HydrophobicContact CD1-CD1 4.47Å; Y452-I456 HydrophobicContact CD2-CD1 4.18Å; Y452-I456 HydrophobicContact CE1-CD1 3.82Å; Y452-I456 HydrophobicContact CE2-CD1 3.47Å; Y452-I456 VanDerWaalsContact CE2-CD1 3.47Å; Y452-I456 HydrophobicContact CE2-CG1 4.32Å; Y452-I456 PolarHBondContact O-N 3.18Å; Y452-I456 WeakPolarHBondContact OH-CD1 3.43Å; I453-I456 PolarHBondContact O-N 3.25Å; I456-S458 VanDerWaalsContact C-N 3.26Å; I456-S458 PolarHBondContact O-N 3.38Å; I456-Y459 PolarHBondContact O-N 2.95Å; I456-Y459 VanDerWaalsContact O-N 3.08Å; I456-L460 HydrophobicContact CG2-CD1 3.87Å; I456-L460 HydrophobicContact CG2-CG 4.48Å; I456-L460 PolarHBondContact O-N 2.94Å; I456-L460 VanDerWaalsContact O-N 3.15Å; I456-M497 HydrophobicContact CG2-SD 4.26Å; I456-F501 HydrophobicContact CD1-CZ 4.15Å
457	I	91.5	Very high	90.7	Very high	11 Å²	11	9.2 Å²	9.2	6%	0.056	5%	0.046	C	C	.	.	H	α-helix	trans	-58.4	-44.1	174.1	-70	169.9	0	0	0	109.6	Q283 W286 I453 Q454 S455 Y459 L460 A461 P462	Q283-I457 HydrophobicContact CB-CG2 4.44Å; Q283-I457 HydrophobicContact CG-CG2 4.25Å; W286-I457 HydrophobicContact CE3-CG2 3.82Å; W286-I457 HydrophobicContact CZ3-CD1 4.19Å; W286-I457 HydrophobicContact CZ3-CG1 4.2Å; W286-I457 HydrophobicContact CZ3-CG2 3.72Å; I453-I457 HydrophobicContact CG2-CD1 3.77Å; I453-I457 HydrophobicContact CG2-CG1 4.47Å; I453-I457 VanDerWaalsContact O-CG1 3.3Å; I453-I457 WeakPolarHBondContact O-CG1 3.45Å; I453-I457 PolarHBondContact O-N 3.5Å; Q454-I457 PolarHBondContact O-N 3.16Å; S455-I457 PolarHBondContact O-N 3.36Å; I457-Y459 PolarHBondContact O-N 2.98Å; I457-L460 PolarHBondContact O-N 3.24Å; I457-A461 HydrophobicContact CG2-CB 3.81Å; I457-A461 WeakPolarHBondContact O-CB 3.29Å; I457-A461 PolarHBondContact O-N 3.27Å; I457-P462 WeakPolarHBondContact O-CD 3.26Å
458	S	92.9	Very high	91.6	Very high	1 Å²	1	9 Å²	9	1%	0.007	4%	0.044	C	C	.	.	H	α-helix	trans	-63.9	-21.9	177.3	-63.7	0	0	0	0	114.1	Q283 Q454 S455 I456 P462 Y523	Q283-S458 PolarHBondContact NE2-OG 3.12Å; Q283-S458 PolarHBondContact OE1-OG 3Å; Q454-S458 WeakPolarHBondContact O-CB 3.32Å; Q454-S458 PolarHBondContact O-N 3.03Å; Q454-S458 PolarHBondContact O-OG 3.35Å; S455-S458 WeakPolarHBondContact O-CA 3.46Å; S455-S458 WeakPolarHBondContact O-CB 2.99Å; S455-S458 PolarHBondContact O-N 3.48Å; S455-S458 VanDerWaalsContact O-N 3.12Å; I456-S458 VanDerWaalsContact C-N 3.26Å; I456-S458 PolarHBondContact O-N 3.38Å; S458-P462 VanDerWaalsContact O-CD 3.32Å; S458-P462 WeakPolarHBondContact O-CD 3.35Å; S458-P462 WeakPolarHBondContact O-CG 3.42Å; S458-Y523 WeakPolarHBondContact OG-CD2 3.46Å
459	Y	91.8	Very high	92.1	Very high	4 Å²	4	10 Å²	10	2%	0.016	5%	0.047	C	C	.	.	H	α-helix	trans	-85.1	-31.3	176.9	-56.8	-24.4	0	0	0	112.8	S455 I456 I457 G493 R496 M497 E500 Y523 F526 L530	S455-Y459 WeakPolarHBondContact O-CD1 3.15Å; S455-Y459 VanDerWaalsContact O-CD2 3.26Å; S455-Y459 WeakPolarHBondContact O-CD2 3.4Å; S455-Y459 PolarHBondContact O-N 3.37Å; I456-Y459 PolarHBondContact O-N 2.95Å; I456-Y459 VanDerWaalsContact O-N 3.08Å; I457-Y459 PolarHBondContact O-N 2.98Å; Y459-G493 WeakPolarHBondContact O-CA 3.35Å; Y459-R496 HydrophobicContact CD1-CG 3.91Å; Y459-R496 HydrophobicContact CE1-CG 3.75Å; Y459-R496 HydrophobicContact CE2-CG 4.35Å; Y459-R496 HydrophobicContact CG-CG 4.31Å; Y459-M497 HydrophobicContact CD2-CB 3.99Å; Y459-M497 HydrophobicContact CD2-CG 4.32Å; Y459-E500 WeakPolarHBondContact CE2-OE2 3.17Å; Y459-E500 VanDerWaalsContact CZ-OE2 3.25Å; Y459-E500 PolarHBondContact OH-OE2 3.02Å; Y459-Y523 WeakPolarHBondContact OH-CB 3.19Å; Y459-F526 AromaticContact CD1-CD1 3.52Å; Y459-F526 HydrophobicContact CD1-CD1 3.52Å; Y459-F526 AromaticContact CD1-CE1 3.77Å; Y459-F526 HydrophobicContact CD1-CE1 3.77Å; Y459-F526 HydrophobicContact CD1-CG 4.43Å; Y459-F526 AromaticContact CE1-CD1 3.93Å; Y459-F526 HydrophobicContact CE1-CD1 3.93Å; Y459-F526 HydrophobicContact CE1-CE1 4.47Å; Y459-F526 HydrophobicContact CE1-CG 4.42Å; Y459-L530 WeakPolarHBondContact O-CD2 3.37Å
460	L	92	Very high	92.5	Very high	17 Å²	17	10.5 Å²	10.5	9%	0.089	5%	0.05	C	C	.	.	H	α-helix	trans	-114.5	-27.8	-168.6	-60.5	178.6	0	0	0	114.4	L150 I456 I457 L490 L494 M497	L150-L460 HydrophobicContact CD2-CB 3.61Å; L150-L460 HydrophobicContact CD2-CD1 3.57Å; L150-L460 HydrophobicContact CD2-CG 4.25Å; I456-L460 HydrophobicContact CG2-CD1 3.87Å; I456-L460 HydrophobicContact CG2-CG 4.48Å; I456-L460 PolarHBondContact O-N 2.94Å; I456-L460 VanDerWaalsContact O-N 3.15Å; I457-L460 PolarHBondContact O-N 3.24Å; L460-L490 HydrophobicContact CD2-CD1 3.78Å; L460-L494 HydrophobicContact CD2-CD2 3.88Å; L460-L494 HydrophobicContact CD2-CG 4.17Å; L460-M497 HydrophobicContact CD1-SD 4.1Å
461	A	92.3	Very high	92.5	Very high	0 Å²	0	10.4 Å²	10.4	0%	0	5%	0.05	C	C	.	.	S	Bend	trans	-80.1	-34.5	-176.9	0	0	0	0	0	115.9	W286 I457 P463 I464 A465	W286-A461 HydrophobicContact CB-CB 3.96Å; W286-A461 HydrophobicContact CD2-CB 3.47Å; W286-A461 VanDerWaalsContact CD2-CB 3.47Å; W286-A461 HydrophobicContact CE3-CB 3.77Å; W286-A461 HydrophobicContact CG-CB 3.55Å; W286-A461 HydrophobicContact CZ3-CB 4.48Å; I457-A461 HydrophobicContact CG2-CB 3.81Å; I457-A461 WeakPolarHBondContact O-CB 3.29Å; I457-A461 PolarHBondContact O-N 3.27Å; A461-P463 VanDerWaalsContact C-CD 3.44Å; A461-I464 WeakPolarHBondContact O-CB 2.96Å; A461-I464 PolarHBondContact O-N 3Å; A461-A465 PolarHBondContact O-N 3.44Å
462	P	95.2	Very high	92.6	Very high	0 Å²	0	9.1 Å²	9.1	0%	0	4%	0.043	C	C	.	.	H	α-helix	trans	-55.7	-38	-174.9	-27.1	34.1	0	0	0	116	I282 I457 S458 I464 A465 A466 L530 F531	I282-P462 HydrophobicContact CG2-CB 3.94Å; I282-P462 HydrophobicContact CG2-CG 4.24Å; I457-P462 WeakPolarHBondContact O-CD 3.26Å; S458-P462 VanDerWaalsContact O-CD 3.32Å; S458-P462 WeakPolarHBondContact O-CD 3.35Å; S458-P462 WeakPolarHBondContact O-CG 3.42Å; P462-I464 VanDerWaalsContact C-N 3.29Å; P462-I464 PolarHBondContact O-N 3.03Å; P462-A465 WeakPolarHBondContact O-CB 3.5Å; P462-A465 PolarHBondContact O-N 3.41Å; P462-A466 WeakPolarHBondContact O-CB 3.32Å; P462-A466 PolarHBondContact O-N 2.71Å; P462-L530 HydrophobicContact CB-CB 4.24Å; P462-L530 HydrophobicContact CB-CD2 4.19Å; P462-L530 HydrophobicContact CB-CG 4.2Å; P462-L530 HydrophobicContact CG-CD2 4.17Å; P462-F531 HydrophobicContact CB-CB 4.09Å
463	P	95.3	Very high	92.8	Very high	1 Å²	1	12.3 Å²	12.3	1%	0.006	6%	0.057	C	C	.	.	H	α-helix	trans	-62.6	-35.7	175.5	-22.4	34.1	0	0	0	112.8	A461 A466 V467 L530	A461-P463 VanDerWaalsContact C-CD 3.44Å; P463-A466 PolarHBondContact O-N 3.24Å; P463-V467 PolarHBondContact O-N 2.87Å; P463-V467 VanDerWaalsContact O-N 3.16Å; P463-L530 HydrophobicContact CG-CD1 4.44Å; P463-L530 HydrophobicContact CG-CD2 3.97Å; P463-L530 HydrophobicContact CG-CG 4.04Å
464	I	94.4	Very high	92.8	Very high	0 Å²	0	14 Å²	14	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-68.3	-47.6	175.3	-56.5	172.5	0	0	0	109.6	H143 L146 L150 A290 A461 P462 A466 V467 F468	H143-I464 WeakPolarHBondContact NE2-CG2 3.45Å; L146-I464 HydrophobicContact CD2-CD1 3.69Å; L146-I464 HydrophobicContact CD2-CG1 3.86Å; L146-I464 HydrophobicContact CG-CD1 4.06Å; L150-I464 HydrophobicContact CD1-CD1 3.83Å; A290-I464 HydrophobicContact CB-CG2 4.28Å; A461-I464 WeakPolarHBondContact O-CB 2.96Å; A461-I464 PolarHBondContact O-N 3Å; P462-I464 VanDerWaalsContact C-N 3.29Å; P462-I464 PolarHBondContact O-N 3.03Å; I464-A466 VanDerWaalsContact C-N 3.25Å; I464-A466 PolarHBondContact O-N 3.41Å; I464-V467 PolarHBondContact O-N 3.14Å; I464-V467 VanDerWaalsContact O-N 3.16Å; I464-F468 HydrophobicContact CG2-CD2 3.85Å; I464-F468 HydrophobicContact CG2-CE2 3.96Å; I464-F468 WeakPolarHBondContact O-CD2 3.48Å; I464-F468 PolarHBondContact O-N 3.29Å
465	A	94.9	Very high	92.7	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-54.8	-43.3	175.7	0	0	0	0	0	111.6	I282 T285 W286 A461 P462 F468 F469 F531	I282-A465 HydrophobicContact CG2-CB 4.13Å; T285-A465 HydrophobicContact CG2-CB 4.5Å; W286-A465 HydrophobicContact CB-CB 4.08Å; A461-A465 PolarHBondContact O-N 3.44Å; P462-A465 WeakPolarHBondContact O-CB 3.5Å; P462-A465 PolarHBondContact O-N 3.41Å; A465-F468 PolarHBondContact O-N 2.98Å; A465-F469 WeakPolarHBondContact O-CB 3.28Å; A465-F469 PolarHBondContact O-N 3.44Å; A465-F531 HydrophobicContact CB-CD2 4.24Å; A465-F531 HydrophobicContact CB-CE2 4.21Å
466	A	96.4	Very high	92.7	Very high	0 Å²	0	21 Å²	21	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-60.3	-45.9	178	0	0	0	0	0	112.1	P462 P463 I464 L470 F531 I538	P462-A466 WeakPolarHBondContact O-CB 3.32Å; P462-A466 PolarHBondContact O-N 2.71Å; P463-A466 PolarHBondContact O-N 3.24Å; I464-A466 VanDerWaalsContact C-N 3.25Å; I464-A466 PolarHBondContact O-N 3.41Å; A466-L470 VanDerWaalsContact O-CB 3.29Å; A466-L470 WeakPolarHBondContact O-CB 3.35Å; A466-L470 VanDerWaalsContact O-CG 3.3Å; A466-L470 WeakPolarHBondContact O-CG 3.36Å; A466-L470 PolarHBondContact O-N 3.25Å; A466-F531 VanDerWaalsContact CA-CE2 3.43Å; A466-F531 HydrophobicContact CB-CD2 3.8Å; A466-F531 HydrophobicContact CB-CE2 3.84Å; A466-I538 HydrophobicContact CB-CD1 4.01Å
467	V	95.1	Very high	92.8	Very high	1 Å²	1	20.8 Å²	20.8	1%	0.006	10%	0.096	C	C	.	.	H	α-helix	trans	-62.5	-47.7	177	169.4	0	0	0	0	111.7	L130 F134 P463 I464 L470 A471 A482 M486 I538	L130-V467 HydrophobicContact CD1-CG1 4.45Å; L130-V467 HydrophobicContact CD2-CG1 3.86Å; F134-V467 HydrophobicContact CE2-CG1 3.93Å; P463-V467 PolarHBondContact O-N 2.87Å; P463-V467 VanDerWaalsContact O-N 3.16Å; I464-V467 PolarHBondContact O-N 3.14Å; I464-V467 VanDerWaalsContact O-N 3.16Å; V467-L470 PolarHBondContact O-N 3.13Å; V467-A471 WeakPolarHBondContact O-CA 3.35Å; V467-A471 WeakPolarHBondContact O-CB 3.25Å; V467-A471 PolarHBondContact O-N 2.95Å; V467-A482 HydrophobicContact CG1-CB 4.18Å; V467-A482 HydrophobicContact CG2-CB 4.23Å; V467-M486 HydrophobicContact CB-CG 4.36Å; V467-M486 HydrophobicContact CB-SD 4.35Å; V467-M486 HydrophobicContact CG2-CG 3.36Å; V467-M486 HydrophobicContact CG2-SD 3.85Å; V467-I538 HydrophobicContact CG2-CD1 3.59Å; V467-I538 HydrophobicContact CG2-CG1 4.4Å
468	F	93.1	Very high	92.9	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-66.9	-41.3	-179	-86	-92.4	0	0	0	112.7	F119 M126 Y129 L130 H143 A290 I464 A465 A471 I472	F119-F468 HydrophobicContact CE1-CD1 4.33Å; F119-F468 HydrophobicContact CE1-CE1 4.32Å; F119-F468 AromaticContact CZ-CD1 3.97Å; F119-F468 HydrophobicContact CZ-CD1 3.97Å; F119-F468 HydrophobicContact CZ-CE1 4.17Å; M126-F468 HydrophobicContact CB-CE1 4.22Å; M126-F468 HydrophobicContact CB-CZ 3.85Å; M126-F468 HydrophobicContact SD-CE1 4.38Å; Y129-F468 HydrophobicContact CD1-CD1 4.2Å; Y129-F468 AromaticContact CD1-CE1 3.66Å; Y129-F468 HydrophobicContact CD1-CE1 3.66Å; Y129-F468 HydrophobicContact CD1-CZ 4.49Å; Y129-F468 HydrophobicContact CE1-CD1 4.14Å; Y129-F468 HydrophobicContact CE1-CE1 4.08Å; L130-F468 HydrophobicContact CD1-CE2 3.76Å; L130-F468 HydrophobicContact CD1-CZ 3.87Å; L130-F468 HydrophobicContact CD2-CD2 4.44Å; L130-F468 HydrophobicContact CD2-CE1 4.13Å; L130-F468 HydrophobicContact CD2-CE2 4.01Å; L130-F468 HydrophobicContact CD2-CZ 3.83Å; L130-F468 HydrophobicContact CG-CE1 4.35Å; L130-F468 HydrophobicContact CG-CE2 4.05Å; L130-F468 HydrophobicContact CG-CZ 3.71Å; H143-F468 AromaticContact CD2-CE2 3.95Å; H143-F468 AromaticContact NE2-CE2 3.46Å; H143-F468 WeakPolarHBondContact NE2-CE2 3.14Å; A290-F468 HydrophobicContact CB-CB 4.18Å; A290-F468 HydrophobicContact CB-CD1 4.14Å; A290-F468 HydrophobicContact CB-CD2 3.62Å; A290-F468 HydrophobicContact CB-CE1 4.47Å; A290-F468 HydrophobicContact CB-CE2 4Å; A290-F468 HydrophobicContact CB-CG 3.7Å; A290-F468 HydrophobicContact CB-CZ 4.43Å; I464-F468 HydrophobicContact CG2-CD2 3.85Å; I464-F468 HydrophobicContact CG2-CE2 3.96Å; I464-F468 WeakPolarHBondContact O-CD2 3.48Å; I464-F468 PolarHBondContact O-N 3.29Å; A465-F468 PolarHBondContact O-N 2.98Å; F468-A471 PolarHBondContact O-N 3.03Å; F468-I472 WeakPolarHBondContact O-CG1 3.38Å; F468-I472 PolarHBondContact O-N 3.14Å
469	F	93.9	Very high	92.8	Very high	80 Å²	80	22.1 Å²	22.1	35%	0.351	10%	0.102	S	C	.	.	H	α-helix	trans	-57.9	-52.7	174.6	179.8	-99.5	0	0	0	110.8	A465 A471 I472 F473 F531	A465-F469 WeakPolarHBondContact O-CB 3.28Å; A465-F469 PolarHBondContact O-N 3.44Å; F469-A471 PolarHBondContact O-N 3.11Å; F469-I472 PolarHBondContact O-N 2.92Å; F469-F473 AromaticContact CD2-CD2 3.73Å; F469-F473 HydrophobicContact CD2-CD2 3.73Å; F469-F473 AromaticContact CD2-CE2 3.74Å; F469-F473 HydrophobicContact CD2-CE2 3.74Å; F469-F473 HydrophobicContact CE1-CD2 4.48Å; F469-F473 AromaticContact CE2-CD2 3.6Å; F469-F473 HydrophobicContact CE2-CD2 3.6Å; F469-F473 AromaticContact CE2-CE2 3.56Å; F469-F473 HydrophobicContact CE2-CE2 3.56Å; F469-F473 HydrophobicContact CG-CD2 4.23Å; F469-F473 HydrophobicContact CZ-CD2 4Å; F469-F473 HydrophobicContact CZ-CE2 4.34Å; F469-F473 VanDerWaalsContact O-CD2 3.25Å; F469-F473 WeakPolarHBondContact O-CD2 3.29Å; F469-F473 PolarHBondContact O-N 3.31Å; F469-F473 VanDerWaalsContact O-N 3.15Å; F469-F531 HydrophobicContact CB-CZ 4.44Å; F469-F531 HydrophobicContact CD1-CZ 4.13Å; F469-F531 HydrophobicContact CG-CZ 4.3Å
470	L	94.4	Very high	92.8	Very high	11 Å²	11	23.8 Å²	23.8	6%	0.058	11%	0.113	C	C	.	.	H	α-helix	trans	-70.2	-32.3	-179.5	-69.8	178.1	0	0	0	113.1	A466 V467 I472 C474 V477 C535 I538 V539	A466-L470 VanDerWaalsContact O-CB 3.29Å; A466-L470 WeakPolarHBondContact O-CB 3.35Å; A466-L470 VanDerWaalsContact O-CG 3.3Å; A466-L470 WeakPolarHBondContact O-CG 3.36Å; A466-L470 PolarHBondContact O-N 3.25Å; V467-L470 PolarHBondContact O-N 3.13Å; L470-I472 PolarHBondContact O-N 2.82Å; L470-C474 HydrophobicContact CD2-CB 4.37Å; L470-C474 VanDerWaalsContact CD2-SG 3.6Å; L470-C474 WeakPolarHBondContact O-CA 3.41Å; L470-C474 VanDerWaalsContact O-CB 3.29Å; L470-C474 WeakPolarHBondContact O-CB 3.47Å; L470-C474 PolarHBondContact O-N 2.66Å; L470-V477 HydrophobicContact CB-CG2 4.15Å; L470-C535 HydrophobicContact CD1-CB 4.09Å; L470-I538 HydrophobicContact CD1-CB 3.8Å; L470-I538 HydrophobicContact CD1-CD1 3.95Å; L470-I538 HydrophobicContact CD1-CG1 4.48Å; L470-I538 HydrophobicContact CD1-CG2 3.63Å; L470-V539 HydrophobicContact CD1-CG2 4.04Å; L470-V539 HydrophobicContact CD2-CG2 4.31Å
471	A	91.1	Very high	92.9	Very high	0 Å²	0	23 Å²	23	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-57.9	-39	176.3	0	0	0	0	0	111.8	Y129 R133 F134 V467 F468 F469	Y129-A471 HydrophobicContact CE1-CB 4.2Å; R133-A471 HydrophobicContact CG-CB 4.18Å; R133-A471 PolarHBondContact NE-O 3.2Å; F134-A471 HydrophobicContact CE2-CB 3.95Å; F134-A471 HydrophobicContact CZ-CB 3.62Å; V467-A471 WeakPolarHBondContact O-CA 3.35Å; V467-A471 WeakPolarHBondContact O-CB 3.25Å; V467-A471 PolarHBondContact O-N 2.95Å; F468-A471 PolarHBondContact O-N 3.03Å; F469-A471 PolarHBondContact O-N 3.11Å
472	I	90	Very high	93	Very high	0 Å²	0	23 Å²	23	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-82.5	-46.2	-176.9	-67.4	170.4	0	0	0	111.4	V114 F115 P118 F119 Y129 F468 F469 L470 W558	V114-I472 HydrophobicContact CG1-CG2 4.29Å; F115-I472 HydrophobicContact CB-CD1 4.24Å; F115-I472 HydrophobicContact CD1-CD1 3.05Å; F115-I472 HydrophobicContact CE1-CD1 3.41Å; F115-I472 VanDerWaalsContact CE1-CD1 3.41Å; F115-I472 HydrophobicContact CG-CD1 3.72Å; F115-I472 HydrophobicContact CZ-CD1 4.29Å; P118-I472 HydrophobicContact CG-CD1 4.23Å; P118-I472 HydrophobicContact CG-CG1 4.08Å; F119-I472 HydrophobicContact CE1-CD1 4.47Å; F119-I472 HydrophobicContact CZ-CD1 4.26Å; Y129-I472 WeakPolarHBondContact OH-CG1 3.46Å; F468-I472 WeakPolarHBondContact O-CG1 3.38Å; F468-I472 PolarHBondContact O-N 3.14Å; F469-I472 PolarHBondContact O-N 2.92Å; L470-I472 PolarHBondContact O-N 2.82Å; I472-W558 HydrophobicContact CG2-CB 4.09Å; I472-W558 WeakPolarHBondContact O-CB 3.4Å; I472-W558 PolarHBondContact O-N 2.97Å
473	F	91.7	Very high	92.9	Very high	82 Å²	82	25.5 Å²	25.5	36%	0.36	12%	0.12	S	C	.	.	H	α-helix	trans	-91.1	-24	-171.3	-67.6	-67.4	0	0	0	114.1	V114 F469 W558	V114-F473 HydrophobicContact CG1-CE1 4.01Å; V114-F473 HydrophobicContact CG1-CE2 4.28Å; V114-F473 HydrophobicContact CG1-CZ 3.5Å; F469-F473 AromaticContact CD2-CD2 3.73Å; F469-F473 HydrophobicContact CD2-CD2 3.73Å; F469-F473 AromaticContact CD2-CE2 3.74Å; F469-F473 HydrophobicContact CD2-CE2 3.74Å; F469-F473 HydrophobicContact CE1-CD2 4.48Å; F469-F473 AromaticContact CE2-CD2 3.6Å; F469-F473 HydrophobicContact CE2-CD2 3.6Å; F469-F473 AromaticContact CE2-CE2 3.56Å; F469-F473 HydrophobicContact CE2-CE2 3.56Å; F469-F473 HydrophobicContact CG-CD2 4.23Å; F469-F473 HydrophobicContact CZ-CD2 4Å; F469-F473 HydrophobicContact CZ-CE2 4.34Å; F469-F473 VanDerWaalsContact O-CD2 3.25Å; F469-F473 WeakPolarHBondContact O-CD2 3.29Å; F469-F473 PolarHBondContact O-N 3.31Å; F469-F473 VanDerWaalsContact O-N 3.15Å; F473-W558 HydrophobicContact CD1-CB 4.24Å; F473-W558 HydrophobicContact CD1-CG 4.37Å; F473-W558 HydrophobicContact CE1-CG 4.34Å
474	C	91.3	Very high	92.9	Very high	45 Å²	45	31.4 Å²	31.4	30%	0.304	14%	0.143	S	C	.	.			trans	-115.9	106.6	-174.8	-62	0	0	0	0	111.8	R133 L470 R476 V477	R133-C474 PolarHBondContact NH2-O 3.05Å; L470-C474 HydrophobicContact CD2-CB 4.37Å; L470-C474 VanDerWaalsContact CD2-SG 3.6Å; L470-C474 WeakPolarHBondContact O-CA 3.41Å; L470-C474 VanDerWaalsContact O-CB 3.29Å; L470-C474 WeakPolarHBondContact O-CB 3.47Å; L470-C474 PolarHBondContact O-N 2.66Å; C474-R476 PolarHBondContact O-N 3.49Å; C474-V477 HydrophobicContact CB-CG2 3.71Å; C474-V477 PolarHBondContact O-N 2.86Å
475	K	89	Confident	92.9	Very high	99 Å²	99	31.4 Å²	31.4	43%	0.43	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-27.7	176.5	70.4	174.1	-170	164.9	0	113.9	R133 V477 D550 L553	R133-K475 PolarHBondContact NH2-O 2.99Å; K475-V477 PolarHBondContact O-N 3.45Å; K475-D550 IonicContact NZ-OD1 2.65Å; K475-D550 IonicContact NZ-OD2 3.56Å; K475-D550 PolarHBondContact NZ-OD2 2.93Å; K475-L553 HydrophobicContact CB-CD1 4.33Å
476	R	90.4	Very high	92.8	Very high	81 Å²	81	31.4 Å²	31.4	31%	0.306	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-19.2	-175.8	-173.5	59.8	-177	101.6	-5.1	113.8	C474 S542 L543 T545 P547	C474-R476 PolarHBondContact O-N 3.49Å; R476-S542 PolarHBondContact NH1-O 3.4Å; R476-S542 PolarHBondContact NH2-O 2.93Å; R476-L543 HydrophobicContact CG-CD2 3.81Å; R476-L543 PolarHBondContact NH2-O 2.87Å; R476-T545 PolarHBondContact NH1-O 3.18Å; R476-T545 VanDerWaalsContact NH1-O 3.11Å; R476-T545 PolarHBondContact NH2-O 3.12Å; R476-P547 VanDerWaalsContact NH1-CA 3.29Å
477	V	93	Very high	92.7	Very high	3 Å²	3	33.2 Å²	33.2	2%	0.018	15%	0.154	C	C	.	.			trans	-71.7	136.2	-175.9	-177.1	0	0	0	0	111	R133 F134 L470 C474 K475 I538 S542	R133-V477 PolarHBondContact NH1-O 2.94Å; R133-V477 VanDerWaalsContact NH1-O 3.12Å; R133-V477 PolarHBondContact NH2-O 2.85Å; R133-V477 VanDerWaalsContact NH2-O 3.14Å; F134-V477 HydrophobicContact CE1-CB 3.97Å; F134-V477 HydrophobicContact CE1-CG1 3.56Å; F134-V477 WeakPolarHBondContact CE1-O 3.37Å; F134-V477 HydrophobicContact CZ-CB 4.43Å; F134-V477 HydrophobicContact CZ-CG1 3.75Å; L470-V477 HydrophobicContact CB-CG2 4.15Å; C474-V477 HydrophobicContact CB-CG2 3.71Å; C474-V477 PolarHBondContact O-N 2.86Å; K475-V477 PolarHBondContact O-N 3.45Å; V477-I538 HydrophobicContact CB-CG2 4.5Å; V477-I538 HydrophobicContact CG1-CG2 3.48Å; V477-I538 VanDerWaalsContact CG1-CG2 3.48Å; V477-I538 HydrophobicContact CG2-CG2 4.17Å; V477-S542 WeakPolarHBondContact CA-OG 3.3Å
478	N	92.1	Very high	92.8	Very high	4 Å²	4	36.4 Å²	36.4	2%	0.021	17%	0.17	C	C	.	.			trans	-129.3	175.2	-178.1	58.9	26.6	0	0	0	112.3	P480 G481 A482 S542 T545 K546 I548	N478-P480 WeakPolarHBondContact OD1-CD 3.49Å; N478-G481 PolarHBondContact O-N 3.42Å; N478-G481 PolarHBondContact OD1-N 3.2Å; N478-A482 PolarHBondContact O-N 3.17Å; N478-A482 VanDerWaalsContact O-N 3.08Å; N478-S542 PolarHBondContact N-OG 2.88Å; N478-S542 PolarHBondContact ND2-O 2.88Å; N478-S542 WeakPolarHBondContact OD1-CA 3.36Å; N478-S542 PolarHBondContact OD1-OG 2.9Å; N478-T545 PolarHBondContact ND2-OG1 3.25Å; N478-T545 PolarHBondContact OD1-OG1 3.36Å; N478-K546 PolarHBondContact ND2-O 3.41Å; N478-I548 HydrophobicContact CB-CD1 4.01Å; N478-I548 HydrophobicContact CB-CG1 4.11Å
479	E	92.1	Very high	92.9	Very high	36 Å²	36	36.4 Å²	36.4	17%	0.168	17%	0.171	C	C	.	.	H	α-helix	trans	-57.7	-47.4	-175.1	-169.7	-84.8	173.9	0	0	113.9	F134 I139 G481 A482 F483	F134-E479 HydrophobicContact CB-CB 3.92Å; F134-E479 HydrophobicContact CB-CG 4.42Å; I139-E479 HydrophobicContact CB-CG 4.42Å; I139-E479 HydrophobicContact CG2-CG 4.45Å; E479-G481 VanDerWaalsContact C-N 3.33Å; E479-G481 PolarHBondContact O-N 3.27Å; E479-A482 PolarHBondContact O-N 3.41Å; E479-F483 WeakPolarHBondContact O-CB 3.37Å; E479-F483 PolarHBondContact O-N 2.65Å
480	P	92.2	Very high	92.9	Very high	40 Å²	40	34 Å²	34	26%	0.26	16%	0.161	S	C	.	.	H	α-helix	trans	-62	-41.6	-179.7	-25.7	35.4	0	0	0	112.3	N478 F483 Y484 V541 T545	N478-P480 WeakPolarHBondContact OD1-CD 3.49Å; P480-F483 PolarHBondContact O-N 3.18Å; P480-Y484 HydrophobicContact CB-CD2 4.45Å; P480-Y484 WeakPolarHBondContact O-CD2 3.19Å; P480-Y484 PolarHBondContact O-N 3.2Å; P480-V541 HydrophobicContact CB-CG1 4.25Å; P480-T545 HydrophobicContact CB-CG2 4.33Å
481	G	93.4	Very high	92.9	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-62.1	-45.9	177.5	0	0	0	0	0	112.3	N478 E479 G485 I538	N478-G481 PolarHBondContact O-N 3.42Å; N478-G481 PolarHBondContact OD1-N 3.2Å; E479-G481 VanDerWaalsContact C-N 3.33Å; E479-G481 PolarHBondContact O-N 3.27Å; G481-G485 PolarHBondContact O-N 3.04Å; G481-I538 WeakPolarHBondContact O-CA 3.34Å; G481-I538 WeakPolarHBondContact O-CG1 3.16Å
482	A	93.8	Very high	93.1	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-63.5	-42.9	176.4	0	0	0	0	0	112.2	F134 I139 V467 N478 E479 M486	F134-A482 HydrophobicContact CD2-CB 4.15Å; F134-A482 HydrophobicContact CE2-CB 3.92Å; F134-A482 HydrophobicContact CZ-CB 4.23Å; I139-A482 HydrophobicContact CD1-CB 3.52Å; V467-A482 HydrophobicContact CG1-CB 4.18Å; V467-A482 HydrophobicContact CG2-CB 4.23Å; N478-A482 PolarHBondContact O-N 3.17Å; N478-A482 VanDerWaalsContact O-N 3.08Å; E479-A482 PolarHBondContact O-N 3.41Å; A482-M486 WeakPolarHBondContact O-CG 3.42Å; A482-M486 PolarHBondContact O-N 3.37Å
483	F	93.8	Very high	93.2	Very high	52 Å²	52	41.6 Å²	41.6	23%	0.228	20%	0.201	C	C	.	.	H	α-helix	trans	-64.3	-52.4	179.9	178.9	-98.2	0	0	0	112.9	Y142 E479 P480 G485 M486 T487	Y142-F483 HydrophobicContact CD2-CE2 4.3Å; E479-F483 WeakPolarHBondContact O-CB 3.37Å; E479-F483 PolarHBondContact O-N 2.65Å; P480-F483 PolarHBondContact O-N 3.18Å; F483-G485 VanDerWaalsContact C-N 3.34Å; F483-M486 PolarHBondContact O-N 2.68Å; F483-T487 WeakPolarHBondContact O-CB 3.49Å; F483-T487 PolarHBondContact O-N 3.35Å; F483-T487 PolarHBondContact O-OG1 3.13Å
484	Y	94.1	Very high	93.3	Very high	125 Å²	125	40.2 Å²	40.2	49%	0.49	20%	0.197	S	C	.	.	H	α-helix	trans	-68.1	-36	179.6	-74.2	-65.9	0	0	0	111.9	P480 T487 I488 V541	P480-Y484 HydrophobicContact CB-CD2 4.45Å; P480-Y484 WeakPolarHBondContact O-CD2 3.19Å; P480-Y484 PolarHBondContact O-N 3.2Å; Y484-T487 PolarHBondContact O-N 3.22Å; Y484-I488 WeakPolarHBondContact O-CB 3.23Å; Y484-I488 WeakPolarHBondContact O-CG1 3.32Å; Y484-I488 PolarHBondContact O-N 2.9Å; Y484-V541 HydrophobicContact CD2-CG1 4.21Å
485	G	94.8	Very high	93.3	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-57.4	-51.3	173.8	0	0	0	0	0	113.1	G481 F483 G489	G481-G485 PolarHBondContact O-N 3.04Å; F483-G485 VanDerWaalsContact C-N 3.34Å; G485-G489 PolarHBondContact O-N 3.41Å
486	M	93.3	Very high	93.3	Very high	1 Å²	1	37.1 Å²	37.1	1%	0.005	19%	0.186	C	C	.	.	H	α-helix	trans	-66	-40.7	176.1	-66.5	-176	-58	0	0	112.3	I139 Y142 V467 A482 F483 G489 L490	I139-M486 HydrophobicContact CD1-CE 4.08Å; I139-M486 HydrophobicContact CG1-CE 3.63Å; Y142-M486 HydrophobicContact CD1-CB 4.41Å; Y142-M486 HydrophobicContact CD1-CE 3.46Å; Y142-M486 VanDerWaalsContact CD1-CE 3.46Å; Y142-M486 HydrophobicContact CD1-SD 4.13Å; Y142-M486 HydrophobicContact CE1-CB 3.56Å; Y142-M486 HydrophobicContact CE1-CE 3.74Å; Y142-M486 HydrophobicContact CE1-CG 4.36Å; Y142-M486 HydrophobicContact CE1-SD 3.99Å; Y142-M486 HydrophobicContact CG-CE 4.45Å; Y142-M486 PolarHBondContact OH-O 2.77Å; V467-M486 HydrophobicContact CB-CG 4.36Å; V467-M486 HydrophobicContact CB-SD 4.35Å; V467-M486 HydrophobicContact CG2-CG 3.36Å; V467-M486 HydrophobicContact CG2-SD 3.85Å; A482-M486 WeakPolarHBondContact O-CG 3.42Å; A482-M486 PolarHBondContact O-N 3.37Å; F483-M486 PolarHBondContact O-N 2.68Å; M486-G489 PolarHBondContact O-N 2.79Å; M486-L490 VanDerWaalsContact O-CB 3.23Å; M486-L490 WeakPolarHBondContact O-CB 3.35Å; M486-L490 PolarHBondContact O-N 2.98Å
487	T	94.6	Very high	93.2	Very high	37 Å²	37	34.8 Å²	34.8	23%	0.227	18%	0.179	C	C	.	.	H	α-helix	trans	-64.6	-48.7	-177.5	-57.3	0	0	0	0	111.4	F483 Y484 L490 L491	F483-T487 WeakPolarHBondContact O-CB 3.49Å; F483-T487 PolarHBondContact O-N 3.35Å; F483-T487 PolarHBondContact O-OG1 3.13Å; Y484-T487 PolarHBondContact O-N 3.22Å; T487-L490 PolarHBondContact O-N 2.85Å; T487-L491 HydrophobicContact CG2-CD1 4.42Å; T487-L491 WeakPolarHBondContact O-CG 3.47Å; T487-L491 PolarHBondContact O-N 3.05Å
488	I	95.8	Very high	93	Very high	68 Å²	68	38.9 Å²	38.9	35%	0.349	20%	0.2	S	C	.	.	H	α-helix	trans	-65.2	-43.5	178	-69	168.1	0	0	0	110.1	Y484 L490 L491 I492 V537	Y484-I488 WeakPolarHBondContact O-CB 3.23Å; Y484-I488 WeakPolarHBondContact O-CG1 3.32Å; Y484-I488 PolarHBondContact O-N 2.9Å; I488-L490 PolarHBondContact O-N 3.48Å; I488-L491 PolarHBondContact O-N 2.89Å; I488-I492 HydrophobicContact CG2-CD1 3.86Å; I488-I492 WeakPolarHBondContact O-CG1 3.46Å; I488-I492 PolarHBondContact O-N 3.11Å; I488-V537 HydrophobicContact CD1-CG1 3.89Å
489	G	95.4	Very high	92.7	Very high	1 Å²	1	39.9 Å²	39.9	1%	0.01	21%	0.207	C	C	.	.	H	α-helix	trans	-58.5	-45.3	174.8	0	0	0	0	0	112.4	G485 M486 L491 I492 G493 L530	G485-G489 PolarHBondContact O-N 3.41Å; M486-G489 PolarHBondContact O-N 2.79Å; G489-L491 VanDerWaalsContact C-N 3.35Å; G489-L491 PolarHBondContact O-N 3.36Å; G489-I492 PolarHBondContact O-N 3.14Å; G489-G493 PolarHBondContact O-N 2.97Å; G489-L530 WeakPolarHBondContact O-CD1 3.38Å
490	L	93.9	Very high	92.2	Very high	30 Å²	30	39.4 Å²	39.4	16%	0.157	20%	0.204	C	C	.	.	H	α-helix	trans	-62.5	-41.2	177.4	-178.6	63.5	0	0	0	111.7	Y142 L146 L460 M486 T487 I488 G493 L494	Y142-L490 HydrophobicContact CE2-CD2 4.44Å; Y142-L490 WeakPolarHBondContact OH-CB 3.2Å; Y142-L490 VanDerWaalsContact OH-CD2 3.23Å; Y142-L490 WeakPolarHBondContact OH-CD2 3.27Å; L146-L490 HydrophobicContact CD1-CD1 3.66Å; L146-L490 HydrophobicContact CD1-CD2 4.09Å; L460-L490 HydrophobicContact CD2-CD1 3.78Å; M486-L490 VanDerWaalsContact O-CB 3.23Å; M486-L490 WeakPolarHBondContact O-CB 3.35Å; M486-L490 PolarHBondContact O-N 2.98Å; T487-L490 PolarHBondContact O-N 2.85Å; I488-L490 PolarHBondContact O-N 3.48Å; L490-G493 PolarHBondContact O-N 2.72Å; L490-L494 HydrophobicContact CD1-CD1 4.11Å; L490-L494 HydrophobicContact CD1-CG 4.02Å; L490-L494 HydrophobicContact CD2-CD1 4.41Å; L490-L494 HydrophobicContact CG-CD1 3.86Å; L490-L494 HydrophobicContact CG-CG 4.21Å; L490-L494 VanDerWaalsContact O-CB 3.3Å; L490-L494 WeakPolarHBondContact O-CB 3.07Å; L490-L494 VanDerWaalsContact O-CG 3.26Å; L490-L494 WeakPolarHBondContact O-CG 3.4Å; L490-L494 PolarHBondContact O-N 3.4Å
491	L	95.2	Very high	91.8	Very high	110 Å²	110	40.4 Å²	40.4	58%	0.576	20%	0.204	S	C	*	.	H	α-helix	trans	-63.7	-41.2	177.6	-71	173.1	0	0	0	112.2	T487 I488 G489 S495	T487-L491 HydrophobicContact CG2-CD1 4.42Å; T487-L491 WeakPolarHBondContact O-CG 3.47Å; T487-L491 PolarHBondContact O-N 3.05Å; I488-L491 PolarHBondContact O-N 2.89Å; G489-L491 VanDerWaalsContact C-N 3.35Å; G489-L491 PolarHBondContact O-N 3.36Å; L491-S495 WeakPolarHBondContact O-CB 3.46Å; L491-S495 PolarHBondContact O-N 2.94Å
492	I	94.8	Very high	91.3	Very high	59 Å²	59	46.3 Å²	46.3	30%	0.303	24%	0.235	S	C	.	.	H	α-helix	trans	-67.7	-40.9	175.7	-63.5	167.3	0	0	0	110.7	I488 G489 S495 R496 F526 L530 V533	I488-I492 HydrophobicContact CG2-CD1 3.86Å; I488-I492 WeakPolarHBondContact O-CG1 3.46Å; I488-I492 PolarHBondContact O-N 3.11Å; G489-I492 PolarHBondContact O-N 3.14Å; I492-S495 PolarHBondContact O-N 3.12Å; I492-S495 PolarHBondContact O-OG 3.4Å; I492-R496 PolarHBondContact O-N 2.98Å; I492-F526 HydrophobicContact CG2-CE2 4.38Å; I492-F526 HydrophobicContact CG2-CZ 3.98Å; I492-L530 HydrophobicContact CB-CD1 3.82Å; I492-L530 HydrophobicContact CG2-CD1 3.77Å; I492-V533 HydrophobicContact CD1-CG1 3.89Å
493	G	93.4	Very high	90.7	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-62.4	-48.1	175.4	0	0	0	0	0	113	Y459 G489 L490 S495 R496 M497	Y459-G493 WeakPolarHBondContact O-CA 3.35Å; G489-G493 PolarHBondContact O-N 2.97Å; L490-G493 PolarHBondContact O-N 2.72Å; G493-S495 VanDerWaalsContact C-N 3.34Å; G493-S495 PolarHBondContact O-N 3.38Å; G493-R496 PolarHBondContact O-N 2.85Å; G493-M497 WeakPolarHBondContact O-CB 3.42Å; G493-M497 PolarHBondContact O-N 3.34Å
494	L	92.5	Very high	89.6	Confident	54 Å²	54	50.7 Å²	50.7	28%	0.283	26%	0.26	S	S	.	.	H	α-helix	trans	-64.1	-37.5	177.9	-74.8	174.1	0	0	0	112	L460 L490 M497 I498	L460-L494 HydrophobicContact CD2-CD2 3.88Å; L460-L494 HydrophobicContact CD2-CG 4.17Å; L490-L494 HydrophobicContact CD1-CD1 4.11Å; L490-L494 HydrophobicContact CD1-CG 4.02Å; L490-L494 HydrophobicContact CD2-CD1 4.41Å; L490-L494 HydrophobicContact CG-CD1 3.86Å; L490-L494 HydrophobicContact CG-CG 4.21Å; L490-L494 VanDerWaalsContact O-CB 3.3Å; L490-L494 WeakPolarHBondContact O-CB 3.07Å; L490-L494 VanDerWaalsContact O-CG 3.26Å; L490-L494 WeakPolarHBondContact O-CG 3.4Å; L490-L494 PolarHBondContact O-N 3.4Å; L494-M497 HydrophobicContact CD2-CE 3.64Å; L494-M497 HydrophobicContact CD2-SD 4.49Å; L494-M497 PolarHBondContact O-N 3.37Å; L494-I498 HydrophobicContact CB-CD1 4.46Å; L494-I498 VanDerWaalsContact O-CB 3.3Å; L494-I498 WeakPolarHBondContact O-CB 3.29Å; L494-I498 WeakPolarHBondContact O-CD1 3.42Å; L494-I498 WeakPolarHBondContact O-CG1 3.42Å; L494-I498 PolarHBondContact O-N 3.22Å
495	S	91.6	Very high	88.2	Confident	67 Å²	67	47.6 Å²	47.6	47%	0.469	25%	0.254	S	S	.	.	H	α-helix	trans	-62	-45.9	176.9	70.7	0	0	0	0	111	L491 I492 G493 M497 I498 T499	L491-S495 WeakPolarHBondContact O-CB 3.46Å; L491-S495 PolarHBondContact O-N 2.94Å; I492-S495 PolarHBondContact O-N 3.12Å; I492-S495 PolarHBondContact O-OG 3.4Å; G493-S495 VanDerWaalsContact C-N 3.34Å; G493-S495 PolarHBondContact O-N 3.38Å; S495-M497 PolarHBondContact O-N 2.92Å; S495-I498 PolarHBondContact O-N 3.41Å; S495-T499 WeakPolarHBondContact O-CB 3.45Å; S495-T499 PolarHBondContact O-N 2.85Å; S495-T499 PolarHBondContact O-OG1 3.47Å
496	R	89.2	Confident	86.8	Confident	12 Å²	12	48.6 Å²	48.6	5%	0.045	26%	0.264	C	S	.	.	H	α-helix	trans	-60.1	-47.1	174.7	179.4	64.2	176.5	102.2	-0.7	112.3	Y459 I492 G493 T499 E500 I518 C519 F526	Y459-R496 HydrophobicContact CD1-CG 3.91Å; Y459-R496 HydrophobicContact CE1-CG 3.75Å; Y459-R496 HydrophobicContact CE2-CG 4.35Å; Y459-R496 HydrophobicContact CG-CG 4.31Å; I492-R496 PolarHBondContact O-N 2.98Å; G493-R496 PolarHBondContact O-N 2.85Å; R496-T499 PolarHBondContact O-N 3.44Å; R496-E500 IonicContact CZ-OE2 3.33Å; R496-E500 IonicContact NH1-OE2 2.94Å; R496-E500 PolarHBondContact NH1-OE2 3.21Å; R496-E500 IonicContact NH2-OE2 3.44Å; R496-E500 PolarHBondContact NH2-OE2 2.84Å; R496-E500 PolarHBondContact O-N 3.19Å; R496-I518 WeakPolarHBondContact CD-O 3.3Å; R496-I518 VanDerWaalsContact CZ-O 3.31Å; R496-I518 PolarHBondContact NE-O 2.89Å; R496-C519 PolarHBondContact NH1-SG 3.3Å; R496-F526 HydrophobicContact CB-CE1 3.86Å; R496-F526 HydrophobicContact CB-CE2 3.79Å; R496-F526 HydrophobicContact CB-CZ 3.38Å; R496-F526 HydrophobicContact CG-CD1 4.24Å; R496-F526 HydrophobicContact CG-CD2 4.17Å; R496-F526 HydrophobicContact CG-CE1 3.96Å; R496-F526 HydrophobicContact CG-CE2 3.91Å; R496-F526 HydrophobicContact CG-CG 4.32Å; R496-F526 HydrophobicContact CG-CZ 3.78Å
497	M	88.6	Confident	85.6	Confident	32 Å²	32	51.2 Å²	51.2	16%	0.158	28%	0.278	C	S	.	.	H	α-helix	trans	-61.6	-47.4	-179.9	-173.6	-171	79.6	0	0	111.7	I456 Y459 L460 G493 L494 S495 E500 F501	I456-M497 HydrophobicContact CG2-SD 4.26Å; Y459-M497 HydrophobicContact CD2-CB 3.99Å; Y459-M497 HydrophobicContact CD2-CG 4.32Å; L460-M497 HydrophobicContact CD1-SD 4.1Å; G493-M497 WeakPolarHBondContact O-CB 3.42Å; G493-M497 PolarHBondContact O-N 3.34Å; L494-M497 HydrophobicContact CD2-CE 3.64Å; L494-M497 HydrophobicContact CD2-SD 4.49Å; L494-M497 PolarHBondContact O-N 3.37Å; S495-M497 PolarHBondContact O-N 2.92Å; M497-E500 PolarHBondContact O-N 3.28Å; M497-F501 HydrophobicContact CE-CE2 4.33Å; M497-F501 HydrophobicContact CG-CD2 3.82Å; M497-F501 HydrophobicContact CG-CE2 3.51Å; M497-F501 WeakPolarHBondContact O-CD2 3.25Å; M497-F501 PolarHBondContact O-N 3.23Å; M497-F501 HydrophobicContact SD-CE2 4.05Å
498	I	88.7	Confident	84.4	Confident	88 Å²	88	52.8 Å²	52.8	45%	0.451	29%	0.29	S	S	.	.	H	α-helix	trans	-64	-43.3	179.4	-69.4	165.4	0	0	0	110.4	L494 S495 E500 F501 I502	L494-I498 HydrophobicContact CB-CD1 4.46Å; L494-I498 VanDerWaalsContact O-CB 3.3Å; L494-I498 WeakPolarHBondContact O-CB 3.29Å; L494-I498 WeakPolarHBondContact O-CD1 3.42Å; L494-I498 WeakPolarHBondContact O-CG1 3.42Å; L494-I498 PolarHBondContact O-N 3.22Å; S495-I498 PolarHBondContact O-N 3.41Å; I498-E500 VanDerWaalsContact C-N 3.34Å; I498-E500 PolarHBondContact O-N 3.4Å; I498-F501 PolarHBondContact O-N 3.45Å; I498-I502 HydrophobicContact CG2-CD1 3.6Å; I498-I502 HydrophobicContact CG2-CG1 4.31Å; I498-I502 VanDerWaalsContact O-CG1 3.26Å; I498-I502 WeakPolarHBondContact O-CG1 3.43Å; I498-I502 PolarHBondContact O-N 3.15Å
499	T	86.1	Confident	83.1	Confident	26 Å²	26	53 Å²	53	16%	0.16	29%	0.294	C	S	.	.	H	α-helix	trans	-60.1	-44.5	176.1	-57.9	0	0	0	0	111.3	S495 R496 F501 I502 Y503 I518	S495-T499 WeakPolarHBondContact O-CB 3.45Å; S495-T499 PolarHBondContact O-N 2.85Å; S495-T499 PolarHBondContact O-OG1 3.47Å; R496-T499 PolarHBondContact O-N 3.44Å; T499-F501 VanDerWaalsContact C-N 3.33Å; T499-F501 PolarHBondContact O-N 3.08Å; T499-I502 PolarHBondContact O-N 2.94Å; T499-Y503 HydrophobicContact CG2-CD2 3.55Å; T499-Y503 HydrophobicContact CG2-CE2 3.74Å; T499-Y503 VanDerWaalsContact O-CD2 3.31Å; T499-Y503 WeakPolarHBondContact O-CD2 3.33Å; T499-Y503 PolarHBondContact O-N 2.95Å; T499-I518 HydrophobicContact CG2-CB 4.37Å; T499-I518 HydrophobicContact CG2-CD1 4.25Å; T499-I518 HydrophobicContact CG2-CG2 3.73Å
500	E	82.1	Confident	81.9	Confident	26 Å²	26	58 Å²	58	12%	0.121	32%	0.321	C	S	.	.	H	α-helix	trans	-62.6	-38.5	177.8	-168	164	139.9	0	0	112.9	Y459 R496 M497 I498 G504 T505	Y459-E500 WeakPolarHBondContact CE2-OE2 3.17Å; Y459-E500 VanDerWaalsContact CZ-OE2 3.25Å; Y459-E500 PolarHBondContact OH-OE2 3.02Å; R496-E500 IonicContact CZ-OE2 3.33Å; R496-E500 IonicContact NH1-OE2 2.94Å; R496-E500 PolarHBondContact NH1-OE2 3.21Å; R496-E500 IonicContact NH2-OE2 3.44Å; R496-E500 PolarHBondContact NH2-OE2 2.84Å; R496-E500 PolarHBondContact O-N 3.19Å; M497-E500 PolarHBondContact O-N 3.28Å; I498-E500 VanDerWaalsContact C-N 3.34Å; I498-E500 PolarHBondContact O-N 3.4Å; E500-G504 CarbonylContact O-C 3.56Å; E500-G504 VanDerWaalsContact O-CA 3.23Å; E500-G504 WeakPolarHBondContact O-CA 3.12Å; E500-G504 PolarHBondContact O-N 3.49Å; E500-T505 HydrophobicContact CG-CG2 3.78Å; E500-T505 WeakPolarHBondContact OE1-CG2 3.31Å
501	F	82.8	Confident	80.7	Confident	60 Å²	60	61.6 Å²	61.6	26%	0.263	35%	0.346	S	S	.	.	H	α-helix	trans	-69	-34.2	175.2	-79.2	-60.3	0	0	0	113.6	W437 M440 A444 Y452 I456 M497 I498 T499	W437-F501 HydrophobicContact CZ2-CZ 4.3Å; M440-F501 HydrophobicContact CE-CD1 4.34Å; A444-F501 HydrophobicContact CB-CD1 4.32Å; A444-F501 HydrophobicContact CB-CE1 3.77Å; Y452-F501 HydrophobicContact CE2-CE1 4.09Å; Y452-F501 HydrophobicContact CE2-CZ 4.14Å; I456-F501 HydrophobicContact CD1-CZ 4.15Å; M497-F501 HydrophobicContact CE-CE2 4.33Å; M497-F501 HydrophobicContact CG-CD2 3.82Å; M497-F501 HydrophobicContact CG-CE2 3.51Å; M497-F501 WeakPolarHBondContact O-CD2 3.25Å; M497-F501 PolarHBondContact O-N 3.23Å; M497-F501 HydrophobicContact SD-CE2 4.05Å; I498-F501 PolarHBondContact O-N 3.45Å; T499-F501 VanDerWaalsContact C-N 3.33Å; T499-F501 PolarHBondContact O-N 3.08Å
502	I	83.9	Confident	79.5	Confident	125 Å²	125	59 Å²	59	64%	0.641	34%	0.337	S	S	*	.	H	α-helix	trans	-71.9	-46.9	179.6	-67.9	165.3	0	0	0	110.8	I498 T499	I498-I502 HydrophobicContact CG2-CD1 3.6Å; I498-I502 HydrophobicContact CG2-CG1 4.31Å; I498-I502 VanDerWaalsContact O-CG1 3.26Å; I498-I502 WeakPolarHBondContact O-CG1 3.43Å; I498-I502 PolarHBondContact O-N 3.15Å; T499-I502 PolarHBondContact O-N 2.94Å
503	Y	80.1	Confident	78.3	Confident	114 Å²	114	63 Å²	63	45%	0.447	36%	0.359	S	S	.	.	H	α-helix	trans	-85.4	-17	-177.4	-70.3	-80.6	0	0	0	113.4	T499 C514	T499-Y503 HydrophobicContact CG2-CD2 3.55Å; T499-Y503 HydrophobicContact CG2-CE2 3.74Å; T499-Y503 VanDerWaalsContact O-CD2 3.31Å; T499-Y503 WeakPolarHBondContact O-CD2 3.33Å; T499-Y503 PolarHBondContact O-N 2.95Å; Y503-C514 HydrophobicContact CG-CB 4.02Å
504	G	71.4	Confident	77.4	Confident	30 Å²	30	63.7 Å²	63.7	31%	0.309	36%	0.363	S	S	.	.			trans	74	157.9	-173.3	0	0	0	0	0	112.6	E500 G506	E500-G504 CarbonylContact O-C 3.56Å; E500-G504 VanDerWaalsContact O-CA 3.23Å; E500-G504 WeakPolarHBondContact O-CA 3.12Å; E500-G504 PolarHBondContact O-N 3.49Å; G504-G506 PolarHBondContact O-N 3Å
505	T	65.1	Low	76.7	Confident	60 Å²	60	63.7 Å²	63.7	37%	0.368	37%	0.367	S	S	.	.			trans	-78.1	0.8	178.4	44.1	0	0	0	0	113.3	S446 E500	S446-T505 PolarHBondContact OG-OG1 3.44Å; E500-T505 HydrophobicContact CG-CG2 3.78Å; E500-T505 WeakPolarHBondContact OE1-CG2 3.31Å
506	G	65.4	Low	75.8	Confident	20 Å²	20	66.2 Å²	66.2	21%	0.206	38%	0.379	C	S	.	.			trans	67.7	163	-172.6	0	0	0	0	0	111.8	G504 N510	G504-G506 PolarHBondContact O-N 3Å; G506-N510 CarbonylContact C-O 3.09Å; G506-N510 WeakPolarHBondContact CA-O 3.42Å
507	N	68.2	Low	75	Confident	56 Å²	56	72.8 Å²	72.8	30%	0.299	41%	0.414	S	S	.	.			trans	-142.9	170.3	168.2	61.6	45.9	0	0	0	109.4	V356 V509 N510	V356-N507 HydrophobicContact CG1-CB 4.34Å; N507-V509 PolarHBondContact O-N 2.97Å; N507-V509 WeakPolarHBondContact OD1-CA 3.34Å; N507-V509 WeakPolarHBondContact OD1-CB 3.37Å; N507-V509 PolarHBondContact OD1-N 2.78Å; N507-N510 PolarHBondContact N-O 2.9Å; N507-N510 CarbonylContact O-C 3.49Å; N507-N510 PolarHBondContact O-N 3.35Å; N507-N510 VanDerWaalsContact O-N 3.16Å; N507-N510 VanDerWaalsContact O-O 3.05Å; N507-N510 PolarHBondContact OD1-N 3.45Å
508	C	69	Low	74.2	Confident	70 Å²	70	74.6 Å²	74.6	47%	0.473	42%	0.424	S	S	.	.	S	Bend	trans	-58.8	-17.9	-179.6	-76	0	0	0	0	114.9	I248 C252	I248-C508 HydrophobicContact CG2-CB 3.94Å; C252-C508 HydrophobicContact CB-CB 3.7Å; C252-C508 WeakPolarHBondContact CB-SG 3.49Å; C252-C508 WeakPolarHBondContact SG-CB 3.02Å; C252-C508 CovalentContact SG-SG 2.02Å; C252-C508 PolarHBondContact SG-SG 3.01Å
509	V	68.1	Low	73.4	Confident	73 Å²	73	71.8 Å²	71.8	44%	0.442	41%	0.412	S	S	.	.	S	Bend	trans	-94.7	-37.3	178.7	-177.5	0	0	0	0	111.2	I248 P345 N507	I248-V509 HydrophobicContact CD1-CG2 4.16Å; P345-V509 HydrophobicContact CG-CG2 4.07Å; N507-V509 PolarHBondContact O-N 2.97Å; N507-V509 WeakPolarHBondContact OD1-CA 3.34Å; N507-V509 WeakPolarHBondContact OD1-CB 3.37Å; N507-V509 PolarHBondContact OD1-N 2.78Å
510	N	70.1	Confident	72.9	Confident	107 Å²	107	73.3 Å²	73.3	57%	0.572	43%	0.432	S	S	*	.	S	Bend	trans	-132.7	94.2	-177.3	-66	-33.4	0	0	0	108.4	G506 N507	G506-N510 CarbonylContact C-O 3.09Å; G506-N510 WeakPolarHBondContact CA-O 3.42Å; N507-N510 PolarHBondContact N-O 2.9Å; N507-N510 CarbonylContact O-C 3.49Å; N507-N510 PolarHBondContact O-N 3.35Å; N507-N510 VanDerWaalsContact O-N 3.16Å; N507-N510 VanDerWaalsContact O-O 3.05Å; N507-N510 PolarHBondContact OD1-N 3.45Å
511	P	69.1	Low	73.1	Confident	105 Å²	105	74.4 Å²	74.4	68%	0.682	44%	0.441	S	S	*	.			trans	-59.6	153.9	177	24.1	-32.1	0	0	0	111
512	S	70.3	Confident	73.5	Confident	55 Å²	55	73.7 Å²	73.7	39%	0.385	44%	0.438	S	S	.	.			trans	-71	131.2	-179.9	61	0	0	0	0	111.2	C514	S512-C514 PolarHBondContact O-N 3.35Å
513	D	69.3	Low	73.8	Confident	144 Å²	144	68.8 Å²	68.8	77%	0.77	41%	0.412	S	S	*	.			trans	-83.1	15.6	171.8	-72.8	-30	0	0	0	113
514	C	74.6	Confident	74.4	Confident	13 Å²	13	63.4 Å²	63.4	9%	0.088	39%	0.391	C	S	.	.			trans	-71.2	135.2	-175.2	-170.1	0	0	0	0	111.7	Y503 S512 T516 C519	Y503-C514 HydrophobicContact CG-CB 4.02Å; S512-C514 PolarHBondContact O-N 3.35Å; C514-T516 PolarHBondContact O-N 2.97Å; C514-C519 HydrophobicContact CB-CB 3.38Å; C514-C519 WeakPolarHBondContact CB-SG 3.37Å; C514-C519 WeakPolarHBondContact SG-CB 3.24Å; C514-C519 CovalentContact SG-SG 2Å; C514-C519 PolarHBondContact SG-SG 3.23Å
515	P	77.1	Confident	75.5	Confident	54 Å²	54	64.7 Å²	64.7	35%	0.351	39%	0.387	S	S	.	.			trans	-53.6	130.3	177	-26.9	33.9	0	0	0	112.7	I517 I518 C519	P515-I517 PolarHBondContact O-N 3Å; P515-I517 VanDerWaalsContact O-N 3.11Å; P515-I518 PolarHBondContact O-N 3.27Å; P515-C519 PolarHBondContact O-N 3.17Å
516	T	73.5	Confident	76.8	Confident	120 Å²	120	63 Å²	63	74%	0.736	37%	0.374	S	S	*	.	H	α-helix	trans	-57.9	-28.5	-177.8	52	0	0	0	0	113.5	C514 I518 G520	C514-T516 PolarHBondContact O-N 2.97Å; T516-I518 VanDerWaalsContact C-N 3.31Å; T516-I518 PolarHBondContact O-N 3.13Å; T516-G520 WeakPolarHBondContact O-CA 3.49Å; T516-G520 PolarHBondContact O-N 2.98Å
517	I	71.8	Confident	78.2	Confident	151 Å²	151	62.2 Å²	62.2	77%	0.774	37%	0.366	S	S	*	.	H	α-helix	trans	-66	-34.1	177	-62.6	170.7	0	0	0	111.8	P515	P515-I517 PolarHBondContact O-N 3Å; P515-I517 VanDerWaalsContact O-N 3.11Å
518	I	72	Confident	79.5	Confident	70 Å²	70	61.5 Å²	61.5	36%	0.359	36%	0.362	S	S	.	.	H	α-helix	trans	-98.1	-47.7	-176.1	-55.2	173.3	0	0	0	110.6	R496 T499 P515 T516	R496-I518 WeakPolarHBondContact CD-O 3.3Å; R496-I518 VanDerWaalsContact CZ-O 3.31Å; R496-I518 PolarHBondContact NE-O 2.89Å; T499-I518 HydrophobicContact CG2-CB 4.37Å; T499-I518 HydrophobicContact CG2-CD1 4.25Å; T499-I518 HydrophobicContact CG2-CG2 3.73Å; P515-I518 PolarHBondContact O-N 3.27Å; T516-I518 VanDerWaalsContact C-N 3.31Å; T516-I518 PolarHBondContact O-N 3.13Å
519	C	70.8	Confident	80.8	Confident	29 Å²	29	62.5 Å²	62.5	20%	0.196	36%	0.361	C	S	.	.	H	α-helix	trans	-97.1	-12.8	-175.9	-70	0	0	0	0	115.2	R496 C514 P515 V521	R496-C519 PolarHBondContact NH1-SG 3.3Å; C514-C519 HydrophobicContact CB-CB 3.38Å; C514-C519 WeakPolarHBondContact CB-SG 3.37Å; C514-C519 WeakPolarHBondContact SG-CB 3.24Å; C514-C519 CovalentContact SG-SG 2Å; C514-C519 PolarHBondContact SG-SG 3.23Å; P515-C519 PolarHBondContact O-N 3.17Å; C519-V521 PolarHBondContact O-N 2.96Å
520	G	76.5	Confident	82.1	Confident	58 Å²	58	59.1 Å²	59.1	60%	0.598	34%	0.341	S	S	*	.	S	Bend	trans	-75.4	-10.6	-180	0	0	0	0	0	113.9	T516	T516-G520 WeakPolarHBondContact O-CA 3.49Å; T516-G520 PolarHBondContact O-N 2.98Å
521	V	86.8	Confident	83.4	Confident	49 Å²	49	55.7 Å²	55.7	30%	0.297	32%	0.321	S	S	.	.	S	Bend	trans	-88.4	120.9	173.5	-176.1	0	0	0	0	109.4	C519 F526 I529	C519-V521 PolarHBondContact O-N 2.96Å; V521-F526 HydrophobicContact CG1-CB 4.36Å; V521-I529 HydrophobicContact CG1-CD1 4.36Å
522	H	90	Very high	84.7	Confident	45 Å²	45	54.2 Å²	54.2	21%	0.208	31%	0.31	C	S	.	.			trans	-54.8	140.5	175.3	-167.9	-95.5	0	0	0	111.5	D270 L524 Y525 F526	D270-H522 PolarHBondContact O-CE1 3.03Å; D270-H522 PolarHBondContact O-NE2 3.14Å; H522-L524 PolarHBondContact ND1-N 3.45Å; H522-L524 PolarHBondContact O-N 3.47Å; H522-L524 VanDerWaalsContact O-N 3.12Å; H522-Y525 HydrophobicContact CB-CD2 3.9Å; H522-Y525 WeakPolarHBondContact O-CB 3.49Å; H522-Y525 PolarHBondContact O-N 3.37Å; H522-F526 PolarHBondContact O-N 3.2Å
523	Y	90.9	Very high	86	Confident	22 Å²	22	54.1 Å²	54.1	9%	0.086	31%	0.307	C	S	.	.	H	α-helix	trans	-58.6	-32.4	-172.3	66.3	-96	0	0	0	113.2	Q454 S458 Y459 F526 G527	Q454-Y523 HydrophobicContact CB-CE2 4.16Å; S458-Y523 WeakPolarHBondContact OG-CD2 3.46Å; Y459-Y523 WeakPolarHBondContact OH-CB 3.19Å; Y523-F526 PolarHBondContact O-N 3.05Å; Y523-G527 PolarHBondContact O-N 2.79Å
524	L	92.6	Very high	87.3	Confident	1 Å²	1	47.3 Å²	47.3	1%	0.005	27%	0.271	C	S	.	.	H	α-helix	trans	-66.2	-40.1	174.8	-63.2	177.4	0	0	0	113	L271 L280 H522 G527 I528	L271-L524 HydrophobicContact CD2-CD1 4.11Å; L280-L524 HydrophobicContact CD2-CD1 4.14Å; L280-L524 HydrophobicContact CD2-CD2 3.47Å; L280-L524 VanDerWaalsContact CD2-CD2 3.47Å; L280-L524 HydrophobicContact CD2-CG 4.48Å; L280-L524 HydrophobicContact CG-CD1 4.43Å; L280-L524 HydrophobicContact CG-CD2 4.28Å; H522-L524 PolarHBondContact ND1-N 3.45Å; H522-L524 PolarHBondContact O-N 3.47Å; H522-L524 VanDerWaalsContact O-N 3.12Å; L524-G527 PolarHBondContact O-N 3.48Å; L524-I528 WeakPolarHBondContact O-CG1 3.45Å; L524-I528 PolarHBondContact O-N 3.23Å
525	Y	93.9	Very high	88.4	Confident	57 Å²	57	47.7 Å²	47.7	22%	0.224	27%	0.273	C	S	.	.	H	α-helix	trans	-69.4	-40.1	175.1	-68.1	-35.5	0	0	0	111.5	P266 P272 P274 H522 G527 I528 I529	P266-Y525 WeakPolarHBondContact O-CE2 3.39Å; P266-Y525 PolarHBondContact O-OH 3.43Å; P272-Y525 HydrophobicContact CB-CE2 4.17Å; P272-Y525 WeakPolarHBondContact CB-OH 3.11Å; P272-Y525 HydrophobicContact CG-CE1 4.35Å; P272-Y525 HydrophobicContact CG-CE2 3.83Å; P274-Y525 HydrophobicContact CB-CE1 3.97Å; P274-Y525 VanDerWaalsContact CD-OH 3.28Å; P274-Y525 WeakPolarHBondContact CD-OH 3.11Å; P274-Y525 HydrophobicContact CG-CE1 4.13Å; P274-Y525 VanDerWaalsContact CG-OH 3.31Å; P274-Y525 WeakPolarHBondContact CG-OH 3.43Å; H522-Y525 HydrophobicContact CB-CD2 3.9Å; H522-Y525 WeakPolarHBondContact O-CB 3.49Å; H522-Y525 PolarHBondContact O-N 3.37Å; Y525-G527 VanDerWaalsContact C-N 3.25Å; Y525-G527 PolarHBondContact O-N 3.22Å; Y525-I528 HydrophobicContact CD1-CD1 4.12Å; Y525-I528 WeakPolarHBondContact O-CB 3.45Å; Y525-I528 PolarHBondContact O-N 2.86Å; Y525-I528 VanDerWaalsContact O-N 3.13Å; Y525-I529 WeakPolarHBondContact O-CG1 3.4Å; Y525-I529 PolarHBondContact O-N 3.25Å
526	F	93.4	Very high	89.3	Confident	25 Å²	25	49.7 Å²	49.7	11%	0.11	28%	0.284	C	S	.	.	H	α-helix	trans	-57.6	-42	172	-177.1	-91.6	0	0	0	111.4	Y459 I492 R496 V521 H522 Y523 I528 I529 L530	Y459-F526 AromaticContact CD1-CD1 3.52Å; Y459-F526 HydrophobicContact CD1-CD1 3.52Å; Y459-F526 AromaticContact CD1-CE1 3.77Å; Y459-F526 HydrophobicContact CD1-CE1 3.77Å; Y459-F526 HydrophobicContact CD1-CG 4.43Å; Y459-F526 AromaticContact CE1-CD1 3.93Å; Y459-F526 HydrophobicContact CE1-CD1 3.93Å; Y459-F526 HydrophobicContact CE1-CE1 4.47Å; Y459-F526 HydrophobicContact CE1-CG 4.42Å; I492-F526 HydrophobicContact CG2-CE2 4.38Å; I492-F526 HydrophobicContact CG2-CZ 3.98Å; R496-F526 HydrophobicContact CB-CE1 3.86Å; R496-F526 HydrophobicContact CB-CE2 3.79Å; R496-F526 HydrophobicContact CB-CZ 3.38Å; R496-F526 HydrophobicContact CG-CD1 4.24Å; R496-F526 HydrophobicContact CG-CD2 4.17Å; R496-F526 HydrophobicContact CG-CE1 3.96Å; R496-F526 HydrophobicContact CG-CE2 3.91Å; R496-F526 HydrophobicContact CG-CG 4.32Å; R496-F526 HydrophobicContact CG-CZ 3.78Å; V521-F526 HydrophobicContact CG1-CB 4.36Å; H522-F526 PolarHBondContact O-N 3.2Å; Y523-F526 PolarHBondContact O-N 3.05Å; F526-I528 VanDerWaalsContact C-N 3.33Å; F526-I528 PolarHBondContact O-N 2.89Å; F526-I529 PolarHBondContact O-N 2.86Å; F526-L530 HydrophobicContact CE1-CB 4.38Å; F526-L530 HydrophobicContact CE1-CD2 3.99Å; F526-L530 VanDerWaalsContact O-CB 3.29Å; F526-L530 WeakPolarHBondContact O-CB 3.35Å; F526-L530 PolarHBondContact O-N 3.43Å
527	G	94.3	Very high	90.4	Very high	3 Å²	3	45.5 Å²	45.5	3%	0.031	26%	0.259	C	S	.	.	H	α-helix	trans	-58.5	-40.6	174.5	0	0	0	0	0	113.5	Y523 L524 Y525 L530 F531	Y523-G527 PolarHBondContact O-N 2.79Å; L524-G527 PolarHBondContact O-N 3.48Å; Y525-G527 VanDerWaalsContact C-N 3.25Å; Y525-G527 PolarHBondContact O-N 3.22Å; G527-L530 PolarHBondContact O-N 3.04Å; G527-F531 WeakPolarHBondContact O-CB 3.45Å; G527-F531 PolarHBondContact O-N 2.79Å
528	I	95.7	Very high	91.6	Very high	41 Å²	41	38.3 Å²	38.3	21%	0.21	22%	0.222	C	C	.	.	H	α-helix	trans	-65	-46.4	175.3	-62.9	165.7	0	0	0	111.2	F278 I282 L524 Y525 F526 L530 F531 T532	F278-I528 HydrophobicContact CB-CD1 3.65Å; F278-I528 HydrophobicContact CB-CG1 4.1Å; I282-I528 HydrophobicContact CD1-CB 4.28Å; I282-I528 HydrophobicContact CD1-CG1 3.9Å; L524-I528 WeakPolarHBondContact O-CG1 3.45Å; L524-I528 PolarHBondContact O-N 3.23Å; Y525-I528 HydrophobicContact CD1-CD1 4.12Å; Y525-I528 WeakPolarHBondContact O-CB 3.45Å; Y525-I528 PolarHBondContact O-N 2.86Å; Y525-I528 VanDerWaalsContact O-N 3.13Å; F526-I528 VanDerWaalsContact C-N 3.33Å; F526-I528 PolarHBondContact O-N 2.89Å; I528-L530 VanDerWaalsContact C-N 3.33Å; I528-L530 PolarHBondContact O-N 2.9Å; I528-F531 PolarHBondContact O-N 2.93Å; I528-T532 WeakPolarHBondContact O-CB 3.49Å; I528-T532 PolarHBondContact O-N 2.99Å; I528-T532 PolarHBondContact O-OG1 3.4Å
529	I	95.4	Very high	92.8	Very high	91 Å²	91	37.6 Å²	37.6	47%	0.467	22%	0.22	S	C	.	.	H	α-helix	trans	-60.2	-48.1	178.1	-66.7	165.5	0	0	0	109.2	V521 Y525 F526 F531 T532 V533	V521-I529 HydrophobicContact CG1-CD1 4.36Å; Y525-I529 WeakPolarHBondContact O-CG1 3.4Å; Y525-I529 PolarHBondContact O-N 3.25Å; F526-I529 PolarHBondContact O-N 2.86Å; I529-F531 PolarHBondContact O-N 2.91Å; I529-T532 PolarHBondContact O-N 3.48Å; I529-V533 HydrophobicContact CG2-CG2 4.31Å; I529-V533 WeakPolarHBondContact O-CB 3.16Å; I529-V533 VanDerWaalsContact O-CG2 3.32Å; I529-V533 WeakPolarHBondContact O-CG2 3.36Å; I529-V533 PolarHBondContact O-N 3Å
530	L	96.1	Very high	94	Very high	2 Å²	2	37.6 Å²	37.6	1%	0.01	23%	0.226	C	C	.	.	H	α-helix	trans	-63.3	-42.6	-178.4	-174	59.8	0	0	0	112.3	Y459 P462 P463 G489 I492 F526 G527 I528 S534	Y459-L530 WeakPolarHBondContact O-CD2 3.37Å; P462-L530 HydrophobicContact CB-CB 4.24Å; P462-L530 HydrophobicContact CB-CD2 4.19Å; P462-L530 HydrophobicContact CB-CG 4.2Å; P462-L530 HydrophobicContact CG-CD2 4.17Å; P463-L530 HydrophobicContact CG-CD1 4.44Å; P463-L530 HydrophobicContact CG-CD2 3.97Å; P463-L530 HydrophobicContact CG-CG 4.04Å; G489-L530 WeakPolarHBondContact O-CD1 3.38Å; I492-L530 HydrophobicContact CB-CD1 3.82Å; I492-L530 HydrophobicContact CG2-CD1 3.77Å; F526-L530 HydrophobicContact CE1-CB 4.38Å; F526-L530 HydrophobicContact CE1-CD2 3.99Å; F526-L530 VanDerWaalsContact O-CB 3.29Å; F526-L530 WeakPolarHBondContact O-CB 3.35Å; F526-L530 PolarHBondContact O-N 3.43Å; G527-L530 PolarHBondContact O-N 3.04Å; I528-L530 VanDerWaalsContact C-N 3.33Å; I528-L530 PolarHBondContact O-N 2.9Å; L530-S534 VanDerWaalsContact O-CB 3.28Å; L530-S534 WeakPolarHBondContact O-CB 3.32Å; L530-S534 PolarHBondContact O-N 3.23Å; L530-S534 PolarHBondContact O-OG 3.38Å
531	F	96.9	Very high	94.9	Very high	35 Å²	35	36.7 Å²	36.7	15%	0.154	21%	0.209	C	C	.	.	H	α-helix	trans	-59.6	-46	173.2	179.6	-95	0	0	0	111.6	I282 P462 A465 A466 F469 G527 I528 I529 S534 C535	I282-F531 HydrophobicContact CD1-CB 3.72Å; I282-F531 HydrophobicContact CD1-CD1 4.08Å; I282-F531 HydrophobicContact CD1-CD2 4.44Å; I282-F531 HydrophobicContact CD1-CG 3.84Å; I282-F531 HydrophobicContact CG1-CB 4.31Å; I282-F531 HydrophobicContact CG1-CD1 4.34Å; I282-F531 HydrophobicContact CG1-CD2 4.15Å; I282-F531 HydrophobicContact CG1-CG 4.02Å; I282-F531 HydrophobicContact CG2-CB 4.05Å; I282-F531 HydrophobicContact CG2-CD2 3.72Å; I282-F531 HydrophobicContact CG2-CE2 4.49Å; I282-F531 HydrophobicContact CG2-CG 4.09Å; P462-F531 HydrophobicContact CB-CB 4.09Å; A465-F531 HydrophobicContact CB-CD2 4.24Å; A465-F531 HydrophobicContact CB-CE2 4.21Å; A466-F531 VanDerWaalsContact CA-CE2 3.43Å; A466-F531 HydrophobicContact CB-CD2 3.8Å; A466-F531 HydrophobicContact CB-CE2 3.84Å; F469-F531 HydrophobicContact CB-CZ 4.44Å; F469-F531 HydrophobicContact CD1-CZ 4.13Å; F469-F531 HydrophobicContact CG-CZ 4.3Å; G527-F531 WeakPolarHBondContact O-CB 3.45Å; G527-F531 PolarHBondContact O-N 2.79Å; I528-F531 PolarHBondContact O-N 2.93Å; I529-F531 PolarHBondContact O-N 2.91Å; F531-S534 PolarHBondContact O-N 2.89Å; F531-C535 WeakPolarHBondContact O-CB 3.5Å; F531-C535 PolarHBondContact O-N 3.36Å; F531-C535 PolarHBondContact O-SG 3.44Å; F531-C535 VanDerWaalsContact O-SG 3.41Å
532	T	96.9	Very high	95.3	Very high	73 Å²	73	34.4 Å²	34.4	45%	0.448	20%	0.195	S	C	.	.	H	α-helix	trans	-66.4	-43.8	-177.9	-55.8	0	0	0	0	111.6	I528 I529 C535 T536	I528-T532 WeakPolarHBondContact O-CB 3.49Å; I528-T532 PolarHBondContact O-N 2.99Å; I528-T532 PolarHBondContact O-OG1 3.4Å; I529-T532 PolarHBondContact O-N 3.48Å; T532-C535 PolarHBondContact O-N 3.06Å; T532-T536 WeakPolarHBondContact O-CB 3.36Å; T532-T536 PolarHBondContact O-N 3.33Å; T532-T536 PolarHBondContact O-OG1 3.33Å
533	V	96.9	Very high	95.5	Very high	54 Å²	54	37.1 Å²	37.1	33%	0.327	21%	0.21	S	C	.	.	H	α-helix	trans	-61.1	-46.6	174.5	170.5	0	0	0	0	110.1	I492 I529 C535 T536 V537	I492-V533 HydrophobicContact CD1-CG1 3.89Å; I529-V533 HydrophobicContact CG2-CG2 4.31Å; I529-V533 WeakPolarHBondContact O-CB 3.16Å; I529-V533 VanDerWaalsContact O-CG2 3.32Å; I529-V533 WeakPolarHBondContact O-CG2 3.36Å; I529-V533 PolarHBondContact O-N 3Å; V533-C535 PolarHBondContact O-N 3.44Å; V533-T536 PolarHBondContact O-N 2.76Å; V533-V537 HydrophobicContact CG1-CG2 4.49Å; V533-V537 WeakPolarHBondContact O-CG2 3.29Å; V533-V537 PolarHBondContact O-N 3.18Å
534	S	97.1	Very high	95.7	Very high	1 Å²	1	43.3 Å²	43.3	1%	0.007	24%	0.243	C	C	.	.	H	α-helix	trans	-59.7	-48.4	177.9	-58.3	0	0	0	0	111	L530 F531 T536 V537 I538	L530-S534 VanDerWaalsContact O-CB 3.28Å; L530-S534 WeakPolarHBondContact O-CB 3.32Å; L530-S534 PolarHBondContact O-N 3.23Å; L530-S534 PolarHBondContact O-OG 3.38Å; F531-S534 PolarHBondContact O-N 2.89Å; S534-T536 VanDerWaalsContact C-N 3.32Å; S534-T536 PolarHBondContact O-N 3.03Å; S534-V537 PolarHBondContact O-N 2.94Å; S534-I538 WeakPolarHBondContact O-CB 3.26Å; S534-I538 WeakPolarHBondContact O-CD1 3.43Å; S534-I538 WeakPolarHBondContact O-CG1 3.1Å; S534-I538 PolarHBondContact O-N 3.13Å
535	C	97.3	Very high	95.6	Very high	20 Å²	20	45.3 Å²	45.3	14%	0.135	26%	0.255	C	S	.	.	H	α-helix	trans	-57.5	-43.6	176	-78.3	0	0	0	0	112.5	L470 F531 T532 V533 I538 V539	L470-C535 HydrophobicContact CD1-CB 4.09Å; F531-C535 WeakPolarHBondContact O-CB 3.5Å; F531-C535 PolarHBondContact O-N 3.36Å; F531-C535 PolarHBondContact O-SG 3.44Å; F531-C535 VanDerWaalsContact O-SG 3.41Å; T532-C535 PolarHBondContact O-N 3.06Å; V533-C535 PolarHBondContact O-N 3.44Å; C535-I538 PolarHBondContact O-N 3.44Å; C535-V539 WeakPolarHBondContact O-CB 3.33Å; C535-V539 WeakPolarHBondContact O-CG2 3.33Å; C535-V539 PolarHBondContact O-N 3Å
536	T	97	Very high	95.4	Very high	96 Å²	96	51.4 Å²	51.4	59%	0.589	28%	0.283	S	S	*	.	H	α-helix	trans	-63.5	-44.8	-180	-56.4	0	0	0	0	111.3	T532 V533 S534 G540	T532-T536 WeakPolarHBondContact O-CB 3.36Å; T532-T536 PolarHBondContact O-N 3.33Å; T532-T536 PolarHBondContact O-OG1 3.33Å; V533-T536 PolarHBondContact O-N 2.76Å; S534-T536 VanDerWaalsContact C-N 3.32Å; S534-T536 PolarHBondContact O-N 3.03Å; T536-G540 PolarHBondContact O-N 3.19Å
537	V	97	Very high	95.2	Very high	32 Å²	32	54.3 Å²	54.3	19%	0.194	31%	0.305	C	S	.	.	H	α-helix	trans	-63.9	-46.7	176.1	172.8	0	0	0	0	110.9	I488 V533 S534 V539 G540 V541	I488-V537 HydrophobicContact CD1-CG1 3.89Å; V533-V537 HydrophobicContact CG1-CG2 4.49Å; V533-V537 WeakPolarHBondContact O-CG2 3.29Å; V533-V537 PolarHBondContact O-N 3.18Å; S534-V537 PolarHBondContact O-N 2.94Å; V537-V539 PolarHBondContact O-N 2.79Å; V537-G540 PolarHBondContact O-N 2.97Å; V537-V541 HydrophobicContact CG1-CG2 4.28Å; V537-V541 WeakPolarHBondContact O-CB 3.37Å; V537-V541 WeakPolarHBondContact O-CG2 3.29Å; V537-V541 PolarHBondContact O-N 3.13Å
538	I	96.6	Very high	94.8	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-57.8	-51	-179.8	-67.3	161.9	0	0	0	110.1	A466 V467 L470 V477 G481 S534 C535 S542	A466-I538 HydrophobicContact CB-CD1 4.01Å; V467-I538 HydrophobicContact CG2-CD1 3.59Å; V467-I538 HydrophobicContact CG2-CG1 4.4Å; L470-I538 HydrophobicContact CD1-CB 3.8Å; L470-I538 HydrophobicContact CD1-CD1 3.95Å; L470-I538 HydrophobicContact CD1-CG1 4.48Å; L470-I538 HydrophobicContact CD1-CG2 3.63Å; V477-I538 HydrophobicContact CB-CG2 4.5Å; V477-I538 HydrophobicContact CG1-CG2 3.48Å; V477-I538 VanDerWaalsContact CG1-CG2 3.48Å; V477-I538 HydrophobicContact CG2-CG2 4.17Å; G481-I538 WeakPolarHBondContact O-CA 3.34Å; G481-I538 WeakPolarHBondContact O-CG1 3.16Å; S534-I538 WeakPolarHBondContact O-CB 3.26Å; S534-I538 WeakPolarHBondContact O-CD1 3.43Å; S534-I538 WeakPolarHBondContact O-CG1 3.1Å; S534-I538 PolarHBondContact O-N 3.13Å; C535-I538 PolarHBondContact O-N 3.44Å; I538-S542 WeakPolarHBondContact O-CB 3.34Å; I538-S542 PolarHBondContact O-N 3.39Å; I538-S542 PolarHBondContact O-OG 3.03Å
539	V	96.4	Very high	94.2	Very high	55 Å²	55	59.2 Å²	59.2	33%	0.333	33%	0.326	S	S	.	.	H	α-helix	trans	-67.9	-46.1	-178.7	173.8	0	0	0	0	110.7	L470 C535 V537 V541 S542 L543	L470-V539 HydrophobicContact CD1-CG2 4.04Å; L470-V539 HydrophobicContact CD2-CG2 4.31Å; C535-V539 WeakPolarHBondContact O-CB 3.33Å; C535-V539 WeakPolarHBondContact O-CG2 3.33Å; C535-V539 PolarHBondContact O-N 3Å; V537-V539 PolarHBondContact O-N 2.79Å; V539-V541 PolarHBondContact O-N 2.96Å; V539-S542 PolarHBondContact O-N 2.78Å; V539-L543 HydrophobicContact CG1-CD1 3.76Å; V539-L543 HydrophobicContact CG1-CG 4.19Å; V539-L543 WeakPolarHBondContact O-CB 3.26Å; V539-L543 VanDerWaalsContact O-CG 3.26Å; V539-L543 WeakPolarHBondContact O-CG 3.3Å; V539-L543 PolarHBondContact O-N 3.06Å
540	G	96.1	Very high	93.7	Very high	30 Å²	30	58 Å²	58	31%	0.309	32%	0.321	S	S	.	.	H	α-helix	trans	-58.3	-50.4	-179.4	0	0	0	0	0	112.6	T536 V537 L543 I544	T536-G540 PolarHBondContact O-N 3.19Å; V537-G540 PolarHBondContact O-N 2.97Å; G540-L543 PolarHBondContact O-N 2.73Å; G540-I544 WeakPolarHBondContact O-CD1 3.44Å; G540-I544 WeakPolarHBondContact O-CG1 3.41Å; G540-I544 PolarHBondContact O-N 3.38Å
541	V	95.7	Very high	92.9	Very high	39 Å²	39	62.4 Å²	62.4	24%	0.236	34%	0.34	C	S	.	.	H	α-helix	trans	-66.6	-39.6	177.4	174.9	0	0	0	0	111.1	P480 Y484 V537 V539 L543 I544 T545	P480-V541 HydrophobicContact CB-CG1 4.25Å; Y484-V541 HydrophobicContact CD2-CG1 4.21Å; V537-V541 HydrophobicContact CG1-CG2 4.28Å; V537-V541 WeakPolarHBondContact O-CB 3.37Å; V537-V541 WeakPolarHBondContact O-CG2 3.29Å; V537-V541 PolarHBondContact O-N 3.13Å; V539-V541 PolarHBondContact O-N 2.96Å; V541-L543 VanDerWaalsContact C-N 3.31Å; V541-L543 PolarHBondContact O-N 3.39Å; V541-I544 PolarHBondContact O-N 3.24Å; V541-T545 HydrophobicContact CG1-CG2 4.39Å; V541-T545 WeakPolarHBondContact O-CG2 3.29Å; V541-T545 PolarHBondContact O-N 3.44Å; V541-T545 VanDerWaalsContact O-N 3.12Å; V541-T545 PolarHBondContact O-OG1 3.49Å
542	S	94.8	Very high	92.2	Very high	1 Å²	1	62.3 Å²	62.3	1%	0.007	34%	0.34	C	S	.	.	H	α-helix	trans	-63.4	-35.9	178	-62.6	0	0	0	0	112.5	R476 V477 N478 I538 V539 I544 T545	R476-S542 PolarHBondContact NH1-O 3.4Å; R476-S542 PolarHBondContact NH2-O 2.93Å; V477-S542 WeakPolarHBondContact CA-OG 3.3Å; N478-S542 PolarHBondContact N-OG 2.88Å; N478-S542 PolarHBondContact ND2-O 2.88Å; N478-S542 WeakPolarHBondContact OD1-CA 3.36Å; N478-S542 PolarHBondContact OD1-OG 2.9Å; I538-S542 WeakPolarHBondContact O-CB 3.34Å; I538-S542 PolarHBondContact O-N 3.39Å; I538-S542 PolarHBondContact O-OG 3.03Å; V539-S542 PolarHBondContact O-N 2.78Å; S542-I544 VanDerWaalsContact C-N 3.35Å; S542-T545 WeakPolarHBondContact CA-OG1 3.45Å; S542-T545 PolarHBondContact O-N 3.4Å; S542-T545 VanDerWaalsContact O-O 3.12Å; S542-T545 PolarHBondContact O-OG1 2.96Å
543	L	94	Very high	91.4	Very high	101 Å²	101	58.8 Å²	58.8	53%	0.529	32%	0.319	S	S	.	.	H	α-helix	trans	-68.7	-32.5	178.5	-74.7	171.8	0	0	0	113	R476 V539 G540 V541	R476-L543 HydrophobicContact CG-CD2 3.81Å; R476-L543 PolarHBondContact NH2-O 2.87Å; V539-L543 HydrophobicContact CG1-CD1 3.76Å; V539-L543 HydrophobicContact CG1-CG 4.19Å; V539-L543 WeakPolarHBondContact O-CB 3.26Å; V539-L543 VanDerWaalsContact O-CG 3.26Å; V539-L543 WeakPolarHBondContact O-CG 3.3Å; V539-L543 PolarHBondContact O-N 3.06Å; G540-L543 PolarHBondContact O-N 2.73Å; V541-L543 VanDerWaalsContact C-N 3.31Å; V541-L543 PolarHBondContact O-N 3.39Å
544	I	95.3	Very high	90.7	Very high	152 Å²	152	56.8 Å²	56.8	78%	0.779	31%	0.305	S	S	*	.	H	α-helix	trans	-82.6	-22.8	-179.7	-60.7	165.3	0	0	0	111.5	G540 V541 S542	G540-I544 WeakPolarHBondContact O-CD1 3.44Å; G540-I544 WeakPolarHBondContact O-CG1 3.41Å; G540-I544 PolarHBondContact O-N 3.38Å; V541-I544 PolarHBondContact O-N 3.24Å; S542-I544 VanDerWaalsContact C-N 3.35Å
545	T	91.8	Very high	89.8	Confident	43 Å²	43	61.2 Å²	61.2	26%	0.264	32%	0.322	S	S	.	.	S	Bend	trans	-98.3	164.3	-178.7	48.1	0	0	0	0	112.3	R476 N478 P480 V541 S542	R476-T545 PolarHBondContact NH1-O 3.18Å; R476-T545 VanDerWaalsContact NH1-O 3.11Å; R476-T545 PolarHBondContact NH2-O 3.12Å; N478-T545 PolarHBondContact ND2-OG1 3.25Å; N478-T545 PolarHBondContact OD1-OG1 3.36Å; P480-T545 HydrophobicContact CB-CG2 4.33Å; V541-T545 HydrophobicContact CG1-CG2 4.39Å; V541-T545 WeakPolarHBondContact O-CG2 3.29Å; V541-T545 PolarHBondContact O-N 3.44Å; V541-T545 VanDerWaalsContact O-N 3.12Å; V541-T545 PolarHBondContact O-OG1 3.49Å; S542-T545 WeakPolarHBondContact CA-OG1 3.45Å; S542-T545 PolarHBondContact O-N 3.4Å; S542-T545 VanDerWaalsContact O-O 3.12Å; S542-T545 PolarHBondContact O-OG1 2.96Å
546	K	88	Confident	89.1	Confident	185 Å²	185	60.3 Å²	60.3	80%	0.804	32%	0.316	S	S	*	.	P	Polyproline II helix	trans	-59.7	135.5	-175	-68.3	-175.8	179.3	-179.1	0	111.4	N478	N478-K546 PolarHBondContact ND2-O 3.41Å
547	P	89	Confident	88.5	Confident	87 Å²	87	55.8 Å²	55.8	57%	0.565	29%	0.288	S	S	*	.	P	Polyproline II helix	trans	-70.7	151.6	175.1	29.2	-33.4	0	0	0	111.3	R476	R476-P547 VanDerWaalsContact NH1-CA 3.29Å
548	I	86.7	Confident	87.8	Confident	31 Å²	31	58 Å²	58	16%	0.159	29%	0.293	C	S	.	.	P	Polyproline II helix	trans	-83.3	134.7	169.7	-58.9	171.1	0	0	0	107.8	F134 N478 H552 L553 I570	F134-I548 HydrophobicContact CD1-CD1 4.41Å; N478-I548 HydrophobicContact CB-CD1 4.01Å; N478-I548 HydrophobicContact CB-CG1 4.11Å; I548-H552 HydrophobicContact CG2-CB 3.96Å; I548-L553 HydrophobicContact CB-CD1 4.37Å; I548-L553 HydrophobicContact CG2-CD1 4.27Å; I548-L553 HydrophobicContact CG2-CD2 3.95Å; I548-L553 HydrophobicContact CG2-CG 3.98Å; I548-I570 HydrophobicContact CG2-CD1 4.18Å
549	E	84.3	Confident	87.2	Confident	115 Å²	115	62.3 Å²	62.3	54%	0.537	32%	0.324	S	S	.	.	P	Polyproline II helix	trans	-68.9	143.8	177	-65.8	179.6	-165	0	0	111.9	K551 H552	E549-K551 HydrophobicContact CB-CD 4.46Å; E549-K551 HydrophobicContact CB-CG 4.13Å; E549-K551 PolarHBondContact O-N 3.49Å; E549-K551 VanDerWaalsContact O-N 3.13Å; E549-K551 WeakPolarHBondContact OE2-CD 3.17Å; E549-K551 WeakPolarHBondContact OE2-CE 3.3Å; E549-K551 IonicContact OE2-NZ 3.12Å; E549-K551 PolarHBondContact OE2-NZ 2.82Å; E549-H552 PolarHBondContact O-N 3.46Å; E549-H552 VanDerWaalsContact O-N 3.09Å
550	D	82.9	Confident	86.5	Confident	65 Å²	65	61.1 Å²	61.1	35%	0.348	32%	0.315	S	S	.	.	G	3₁₀ helix	trans	-60.7	-28.4	-173.3	-75.2	-10.6	0	0	0	112.6	K475 H552 L553 H554 L560	K475-D550 IonicContact NZ-OD1 2.65Å; K475-D550 IonicContact NZ-OD2 3.56Å; K475-D550 PolarHBondContact NZ-OD2 2.93Å; D550-H552 PolarHBondContact O-N 2.9Å; D550-H552 VanDerWaalsContact O-N 3.09Å; D550-L553 PolarHBondContact O-N 2.87Å; D550-H554 PolarHBondContact O-CD2 3.09Å; D550-H554 PolarHBondContact O-NE2 3.13Å; D550-L560 HydrophobicContact CB-CD1 4.17Å
551	K	79.6	Confident	85.6	Confident	95 Å²	95	63.6 Å²	63.6	41%	0.413	32%	0.315	S	S	.	.	G	3₁₀ helix	trans	-56.2	-26.4	176.4	73.2	-170.9	-171.8	-159.5	0	114.2	E549 V568	E549-K551 HydrophobicContact CB-CD 4.46Å; E549-K551 HydrophobicContact CB-CG 4.13Å; E549-K551 PolarHBondContact O-N 3.49Å; E549-K551 VanDerWaalsContact O-N 3.13Å; E549-K551 WeakPolarHBondContact OE2-CD 3.17Å; E549-K551 WeakPolarHBondContact OE2-CE 3.3Å; E549-K551 IonicContact OE2-NZ 3.12Å; E549-K551 PolarHBondContact OE2-NZ 2.82Å; K551-V568 PolarHBondContact O-N 3.11Å
552	H	82.6	Confident	84.7	Confident	33 Å²	33	67.7 Å²	67.7	15%	0.153	34%	0.336	C	S	.	.	G	3₁₀ helix	trans	-88.3	-16	178.8	-63.5	-58.7	0	0	0	113.2	I548 E549 D550 V568 I570	I548-H552 HydrophobicContact CG2-CB 3.96Å; E549-H552 PolarHBondContact O-N 3.46Å; E549-H552 VanDerWaalsContact O-N 3.09Å; D550-H552 PolarHBondContact O-N 2.9Å; D550-H552 VanDerWaalsContact O-N 3.09Å; H552-V568 WeakPolarHBondContact CA-O 3.43Å; H552-V568 PolarHBondContact ND1-O 3.33Å; H552-I570 HydrophobicContact CB-CD1 4.09Å; H552-I570 HydrophobicContact CB-CG1 3.62Å
553	L	81.3	Confident	83.7	Confident	0 Å²	0	68.8 Å²	68.8	0%	0	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.1	1.1	-170	-60.9	179.5	0	0	0	113.6	R133 K475 I548 D550 R555 L556 L560	R133-L553 VanDerWaalsContact NH1-CD2 3.27Å; K475-L553 HydrophobicContact CB-CD1 4.33Å; I548-L553 HydrophobicContact CB-CD1 4.37Å; I548-L553 HydrophobicContact CG2-CD1 4.27Å; I548-L553 HydrophobicContact CG2-CD2 3.95Å; I548-L553 HydrophobicContact CG2-CG 3.98Å; D550-L553 PolarHBondContact O-N 2.87Å; L553-R555 PolarHBondContact O-N 2.84Å; L553-L556 PolarHBondContact O-N 3.45Å; L553-L560 HydrophobicContact CB-CD1 3.64Å
554	H	80.4	Confident	82.6	Confident	11 Å²	11	70.1 Å²	70.1	5%	0.051	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54	127.7	177.9	-67.7	173.2	0	0	0	111.1	D550 L556 E565 R567	D550-H554 PolarHBondContact O-CD2 3.09Å; D550-H554 PolarHBondContact O-NE2 3.13Å; H554-L556 PolarHBondContact O-N 2.92Å; H554-L556 VanDerWaalsContact O-N 3.12Å; H554-E565 IonicContact CE1-OE2 2.69Å; H554-E565 PolarHBondContact CE1-OE2 3.36Å; H554-E565 IonicContact NE2-OE2 3.64Å; H554-R567 HydrophobicContact CB-CB 4.16Å; H554-R567 HydrophobicContact CB-CG 4.38Å; H554-R567 WeakPolarHBondContact O-CD 3.47Å
555	R	78.4	Confident	81.6	Confident	94 Å²	94	68.7 Å²	68.7	36%	0.355	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.4	11.6	-179	-49.9	178.9	-169.9	162.8	9.2	115.8	P118 L553 L560 S563 T564	P118-R555 WeakPolarHBondContact CA-O 3.47Å; L553-R555 PolarHBondContact O-N 2.84Å; R555-L560 PolarHBondContact N-O 3.06Å; R555-L560 VanDerWaalsContact N-O 3.08Å; R555-S563 PolarHBondContact NE-O 3.31Å; R555-S563 PolarHBondContact NH2-O 3.43Å; R555-T564 PolarHBondContact NH2-O 3.47Å
556	L	82.8	Confident	80.7	Confident	1 Å²	1	75.2 Å²	75.2	1%	0.005	37%	0.373	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.2	-16.3	175.9	-67.8	172.6	0	0	0	113.3	P118 A121 Y129 K132 L553 H554	P118-L556 WeakPolarHBondContact CB-O 3.48Å; A121-L556 HydrophobicContact CB-CD2 3.95Å; Y129-L556 HydrophobicContact CD2-CD2 4.11Å; Y129-L556 HydrophobicContact CE2-CD2 4.02Å; Y129-L556 PolarHBondContact OH-O 3.17Å; Y129-L556 VanDerWaalsContact OH-O 3.06Å; K132-L556 HydrophobicContact CB-CD1 4.17Å; K132-L556 HydrophobicContact CB-CD2 4.34Å; K132-L556 WeakPolarHBondContact O-CD1 3.22Å; L553-L556 PolarHBondContact O-N 3.45Å; H554-L556 PolarHBondContact O-N 2.92Å; H554-L556 VanDerWaalsContact O-N 3.12Å
557	C	84.6	Confident	80.3	Confident	2 Å²	2	69 Å²	69	1%	0.014	35%	0.345	C	S	.	.	S	Bend	trans	-123.1	152.9	178.3	-60.2	0	0	0	0	110.7	R133 S559 L560 R561	R133-C557 PolarHBondContact NE-SG 3.28Å; C557-S559 PolarHBondContact O-N 2.99Å; C557-L560 CarbonylContact O-C 3.58Å; C557-L560 PolarHBondContact O-N 3.36Å; C557-L560 VanDerWaalsContact O-N 3.1Å; C557-R561 PolarHBondContact O-N 3.25Å; C557-R561 VanDerWaalsContact O-N 3.13Å
558	W	83.1	Confident	79.7	Confident	77 Å²	77	68.7 Å²	68.7	29%	0.292	34%	0.341	S	S	.	.	G	3₁₀ helix	trans	-56.7	-38.2	177.8	-173.1	-108.1	0	0	0	112.9	W113 V114 Y117 I472 F473 L560 R561	W113-W558 WeakPolarHBondContact O-CH2 2.97Å; W113-W558 WeakPolarHBondContact O-CZ3 3.38Å; V114-W558 HydrophobicContact CB-CZ3 4.28Å; V114-W558 HydrophobicContact CG1-CE3 4.14Å; V114-W558 HydrophobicContact CG1-CZ3 4.22Å; V114-W558 HydrophobicContact CG2-CH2 4.3Å; V114-W558 HydrophobicContact CG2-CZ3 4.35Å; Y117-W558 HydrophobicContact CD2-CZ3 4.16Å; I472-W558 HydrophobicContact CG2-CB 4.09Å; I472-W558 WeakPolarHBondContact O-CB 3.4Å; I472-W558 PolarHBondContact O-N 2.97Å; F473-W558 HydrophobicContact CD1-CB 4.24Å; F473-W558 HydrophobicContact CD1-CG 4.37Å; F473-W558 HydrophobicContact CE1-CG 4.34Å; W558-L560 VanDerWaalsContact C-N 3.33Å; W558-L560 PolarHBondContact O-N 3.49Å; W558-R561 WeakPolarHBondContact O-CD 3.44Å; W558-R561 WeakPolarHBondContact O-CG 2.86Å; W558-R561 PolarHBondContact O-NH1 3.48Å
559	S	83.3	Confident	79.2	Confident	92 Å²	92	70.4 Å²	70.4	64%	0.643	35%	0.348	S	S	*	.	G	3₁₀ helix	trans	-67.2	-29	179.7	-173.3	0	0	0	0	113.8	C557	C557-S559 PolarHBondContact O-N 2.99Å
560	L	81.1	Confident	78.8	Confident	29 Å²	29	67.8 Å²	67.8	15%	0.152	34%	0.338	C	S	.	.	G	3₁₀ helix	trans	-113.8	17.6	-173.6	-68.1	166.7	0	0	0	111.7	D550 L553 R555 C557 W558 N562 S563	D550-L560 HydrophobicContact CB-CD1 4.17Å; L553-L560 HydrophobicContact CB-CD1 3.64Å; R555-L560 PolarHBondContact N-O 3.06Å; R555-L560 VanDerWaalsContact N-O 3.08Å; C557-L560 CarbonylContact O-C 3.58Å; C557-L560 PolarHBondContact O-N 3.36Å; C557-L560 VanDerWaalsContact O-N 3.1Å; W558-L560 VanDerWaalsContact C-N 3.33Å; W558-L560 PolarHBondContact O-N 3.49Å; L560-N562 VanDerWaalsContact C-N 3.33Å; L560-N562 PolarHBondContact O-N 2.84Å; L560-S563 PolarHBondContact O-N 3.33Å
561	R	77.8	Confident	78	Confident	82 Å²	82	68.7 Å²	68.7	31%	0.309	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-33.3	-173.6	72.8	-177.9	-178.9	-93.3	7.6	113.8	C557 W558	C557-R561 PolarHBondContact O-N 3.25Å; C557-R561 VanDerWaalsContact O-N 3.13Å; W558-R561 WeakPolarHBondContact O-CD 3.44Å; W558-R561 WeakPolarHBondContact O-CG 2.86Å; W558-R561 PolarHBondContact O-NH1 3.48Å
562	N	76	Confident	77	Confident	125 Å²	125	68.2 Å²	68.2	67%	0.668	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.6	6.2	-177.7	-69.6	-13.1	0	0	0	113	L560 T564	L560-N562 VanDerWaalsContact C-N 3.33Å; L560-N562 PolarHBondContact O-N 2.84Å; N562-T564 PolarHBondContact O-N 2.86Å
563	S	75.6	Confident	75.7	Confident	24 Å²	24	67.7 Å²	67.7	17%	0.168	34%	0.343	C	S	.	.			trans	-65.7	124.1	-179.8	-173.9	0	0	0	0	110.6	R555 L560 E565	R555-S563 PolarHBondContact NE-O 3.31Å; R555-S563 PolarHBondContact NH2-O 3.43Å; L560-S563 PolarHBondContact O-N 3.33Å; S563-E565 VanDerWaalsContact C-N 3.33Å; S563-E565 PolarHBondContact OG-N 3.07Å
564	T	69.7	Low	74.2	Confident	129 Å²	129	69.9 Å²	69.9	79%	0.791	36%	0.355	S	S	*	.			trans	-84.2	-12.7	175.7	51.6	0	0	0	0	112.4	R555 N562	R555-T564 PolarHBondContact NH2-O 3.47Å; N562-T564 PolarHBondContact O-N 2.86Å
565	E	74.6	Confident	72.6	Confident	123 Å²	123	73.1 Å²	73.1	58%	0.575	37%	0.366	S	S	*	.	S	Bend	trans	-65.4	149.6	179.7	-65.3	-179.5	-170.1	0	0	111.8	H554 S563	H554-E565 IonicContact CE1-OE2 2.69Å; H554-E565 PolarHBondContact CE1-OE2 3.36Å; H554-E565 IonicContact NE2-OE2 3.64Å; S563-E565 VanDerWaalsContact C-N 3.33Å; S563-E565 PolarHBondContact OG-N 3.07Å
566	E	73.2	Confident	70.8	Confident	179 Å²	179	71.9 Å²	71.9	84%	0.836	37%	0.37	S	S	*	.	P	Polyproline II helix	trans	-67.1	134.1	177.1	-168.7	168.4	-166.6	0	0	110.1
567	R	78.6	Confident	68.5	Low	56 Å²	56	76.3 Å²	76.3	21%	0.211	39%	0.393	C	S	.	.	P	Polyproline II helix	trans	-83.7	122.3	179.3	-178.1	-174	69.4	-167	-0.5	108.9	H554 E569	H554-R567 HydrophobicContact CB-CB 4.16Å; H554-R567 HydrophobicContact CB-CG 4.38Å; H554-R567 WeakPolarHBondContact O-CD 3.47Å; R567-E569 IonicContact CZ-OE1 2.68Å; R567-E569 IonicContact NE-OE1 3.83Å; R567-E569 IonicContact NH2-OE1 3.29Å; R567-E569 PolarHBondContact NH2-OE1 2.91Å
568	V	78.2	Confident	66.3	Low	79 Å²	79	81.5 Å²	81.5	48%	0.479	41%	0.414	S	S	.	.	P	Polyproline II helix	trans	-83.6	116.6	168	-176	0	0	0	0	108.3	K551 H552	K551-V568 PolarHBondContact O-N 3.11Å; H552-V568 WeakPolarHBondContact CA-O 3.43Å; H552-V568 PolarHBondContact ND1-O 3.33Å
569	E	74.6	Confident	64.2	Low	67 Å²	67	83.8 Å²	83.8	31%	0.313	43%	0.427	S	S	.	.	P	Polyproline II helix	trans	-68.6	141.2	179	-57.4	-164.7	153.9	0	0	110.9	R567 E571	R567-E569 IonicContact CZ-OE1 2.68Å; R567-E569 IonicContact NE-OE1 3.83Å; R567-E569 IonicContact NH2-OE1 3.29Å; R567-E569 PolarHBondContact NH2-OE1 2.91Å; E569-E571 VanDerWaalsContact C-N 3.33Å
570	I	75.9	Confident	61.9	Low	61 Å²	61	87.7 Å²	87.7	31%	0.313	44%	0.436	S	S	.	.	S	Bend	trans	-66.8	-40.2	178.8	-59.5	173.6	0	0	0	110.1	I548 H552	I548-I570 HydrophobicContact CG2-CD1 4.18Å; H552-I570 HydrophobicContact CB-CD1 4.09Å; H552-I570 HydrophobicContact CB-CG1 3.62Å
571	E	67.3	Low	59.6	Low	84 Å²	84	92.7 Å²	92.7	39%	0.393	46%	0.462	S	S	.	.	S	Bend	trans	-141.9	132.9	173.7	-69.5	176.1	-176.8	0	0	107.1	G136 E569	G136-E571 PolarHBondContact N-OE1 3.36Å; E569-E571 VanDerWaalsContact C-N 3.33Å
572	T	58.2	Low	57.6	Low	85 Å²	85	94.8 Å²	94.8	52%	0.521	48%	0.475	S	S	.	.			trans	-64.3	147	169.6	42.3	0	0	0	0	109.9	K131	K131-T572 PolarHBondContact NZ-O 3.46Å
573	D	55.4	Low	55.4	Low	22 Å²	22	94.5 Å²	94.5	12%	0.118	47%	0.472	C	S	.	.			trans	-70	136.9	176.5	-92.3	-37.9	0	0	0	110.6	K131 K132 R140 W575 T576	K131-D573 IonicContact NZ-OD1 2.77Å; K131-D573 PolarHBondContact NZ-OD1 2.84Å; K132-D573 WeakPolarHBondContact CE-OD2 3.36Å; K132-D573 IonicContact NZ-OD2 2.76Å; R140-D573 IonicContact NH1-OD1 3.21Å; R140-D573 PolarHBondContact NH1-OD1 3.36Å; D573-W575 PolarHBondContact O-N 2.99Å; D573-T576 PolarHBondContact O-N 3.04Å; D573-T576 VanDerWaalsContact O-N 3.09Å; D573-T576 PolarHBondContact O-OG1 3.26Å
574	D	49.2	Very low	53.3	Low	45 Å²	45	102.2 Å²	102.2	24%	0.241	51%	0.505	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-11.6	-176.2	-57.3	42.9	0	0	0	113.2	K131 K137 K409 Y578	K131-D574 IonicContact NZ-OD1 3.96Å; K137-D574 IonicContact NZ-OD1 2.6Å; K137-D574 IonicContact NZ-OD2 2.66Å; K137-D574 PolarHBondContact NZ-OD2 3.33Å; K409-D574 IonicContact NZ-OD1 3.67Å; K409-D574 PolarHBondContact NZ-OD1 2.81Å; K409-D574 IonicContact NZ-OD2 2.91Å; K409-D574 PolarHBondContact NZ-OD2 2.97Å; D574-Y578 WeakPolarHBondContact O-CD2 3.4Å
575	W	47.5	Very low	51.5	Low	79 Å²	79	102 Å²	102	30%	0.299	50%	0.503	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.4	-34	178.2	-68.5	85.9	0	0	0	113.8	T408 P412 A414 L419 D573 N577 Y578	T408-W575 HydrophobicContact CG2-CH2 3.83Å; T408-W575 HydrophobicContact CG2-CZ2 2.92Å; P412-W575 WeakPolarHBondContact O-CH2 2.82Å; A414-W575 HydrophobicContact CB-CH2 4.45Å; L419-W575 HydrophobicContact CD1-CH2 4.33Å; D573-W575 PolarHBondContact O-N 2.99Å; W575-N577 VanDerWaalsContact C-N 3.32Å; W575-N577 PolarHBondContact O-N 3.27Å; W575-Y578 PolarHBondContact O-N 3.13Å
576	T	40.5	Very low	49.4	Very low	69 Å²	69	105.2 Å²	105.2	42%	0.423	52%	0.518	S	S	.	.	H	α-helix	trans	-71.1	-25.8	-177	33.5	0	0	0	0	113.2	D573 Y578	D573-T576 PolarHBondContact O-N 3.04Å; D573-T576 VanDerWaalsContact O-N 3.09Å; D573-T576 PolarHBondContact O-OG1 3.26Å; T576-Y578 PolarHBondContact O-N 3.45Å
577	N	34.6	Very low	47.5	Very low	94 Å²	94	103 Å²	103	50%	0.503	51%	0.508	S	S	.	.	H	α-helix	trans	-69.9	-16.1	178.5	-90.5	16.4	0	0	0	113.8	W575	W575-N577 VanDerWaalsContact C-N 3.32Å; W575-N577 PolarHBondContact O-N 3.27Å
578	Y	39	Very low	45.4	Very low	111 Å²	111	106.6 Å²	106.6	44%	0.435	54%	0.538	S	S	.	.	H	α-helix	trans	-111.6	-13.7	-172.9	-66.8	-81.7	0	0	0	114.1	D574 W575 T576 E580 D581 E582	D574-Y578 WeakPolarHBondContact O-CD2 3.4Å; W575-Y578 PolarHBondContact O-N 3.13Å; T576-Y578 PolarHBondContact O-N 3.45Å; Y578-E580 PolarHBondContact O-N 3.24Å; Y578-D581 PolarHBondContact O-N 3.42Å; Y578-E582 PolarHBondContact O-N 3.42Å; Y578-E582 VanDerWaalsContact O-N 3.12Å
579	E	37.6	Very low	43.7	Very low	124 Å²	124	108.6 Å²	108.6	58%	0.579	54%	0.543	S	S	*	.	H	α-helix	trans	-66.4	-26.7	168.6	-80.4	-177	158.3	0	0	112	M583	E579-M583 VanDerWaalsContact O-CE 3.27Å; E579-M583 WeakPolarHBondContact O-CE 3.32Å
580	E	36.3	Very low	42.3	Very low	175 Å²	175	114.3 Å²	114.3	82%	0.818	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.2	-27.7	173.7	-73.2	-174.9	165.7	0	0	113	Y578	Y578-E580 PolarHBondContact O-N 3.24Å
581	D	31.5	Very low	40.8	Very low	133 Å²	133	120 Å²	120	71%	0.711	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.5	-20.1	-170.4	-81.2	-24.1	0	0	0	115.7	Y578	Y578-D581 PolarHBondContact O-N 3.42Å
582	E	35.1	Very low	40.3	Very low	126 Å²	126	118.2 Å²	118.2	59%	0.589	59%	0.59	S	S	*	*			trans	-110.5	12.4	-173.1	-82.4	-170.8	176.8	0	0	116.1	Y578 E584	Y578-E582 PolarHBondContact O-N 3.42Å; Y578-E582 VanDerWaalsContact O-N 3.12Å; E582-E584 PolarHBondContact O-N 3.46Å
583	M	31.2	Very low	40.7	Very low	120 Å²	120	116.6 Å²	116.6	59%	0.591	59%	0.59	S	S	*	*			trans	-79	22.5	-177.2	-110.5	-166.5	-72.4	0	0	116.4	E579 K612	E579-M583 VanDerWaalsContact O-CE 3.27Å; E579-M583 WeakPolarHBondContact O-CE 3.32Å; M583-K612 HydrophobicContact SD-CD 4.18Å; M583-K612 VanDerWaalsContact SD-CE 3.59Å; M583-K612 PolarHBondContact SD-NZ 3.21Å
584	E	31.9	Very low	41.3	Very low	186 Å²	186	124 Å²	124	87%	0.869	62%	0.622	S	S	*	*			trans	-136.2	65.9	174.2	-72.2	-166.6	164.9	0	0	113.1	E582	E582-E584 PolarHBondContact O-N 3.46Å
585	V	31.2	Very low	41.8	Very low	123 Å²	123	127 Å²	127	75%	0.745	65%	0.645	S	S	*	*			trans	-142.2	92.3	152.3	-168.6	0	0	0	0	109.7	E587	V585-E587 HydrophobicContact CG1-CG 4.25Å; V585-E587 PolarHBondContact O-N 3.46Å
586	E	31	Very low	42.7	Very low	191 Å²	191	129.2 Å²	129.2	89%	0.893	66%	0.657	S	S	*	*			trans	-75	100.2	162	-76.8	-170.8	152.6	0	0	108.6
587	E	33	Very low	43.9	Very low	132 Å²	132	131.5 Å²	131.5	62%	0.617	66%	0.661	S	S	*	*			trans	-81.1	133.2	161.2	-81.9	-177.5	155.2	0	0	109.4	V585 E589	V585-E587 HydrophobicContact CG1-CG 4.25Å; V585-E587 PolarHBondContact O-N 3.46Å; E587-E589 PolarHBondContact O-N 3.5Å
588	P	34.7	Very low	45.2	Very low	132 Å²	132	129.4 Å²	129.4	86%	0.857	66%	0.657	S	S	*	*			trans	-72.6	110.4	174	28.1	-29.8	0	0	0	109.4
589	E	41.6	Very low	46.2	Very low	121 Å²	121	129.7 Å²	129.7	57%	0.565	67%	0.665	S	S	*	*	P	Polyproline II helix	trans	-86.8	124.7	176.5	-73.6	-168.3	177.7	0	0	111.9	E587 Q607	E587-E589 PolarHBondContact O-N 3.5Å; E589-Q607 PolarHBondContact OE1-NE2 3.44Å; E589-Q607 VanDerWaalsContact OE2-CD 3.28Å; E589-Q607 PolarHBondContact OE2-NE2 2.58Å; E589-Q607 PolarHBondContact OE2-OE1 3.33Å
590	E	44.8	Very low	47.5	Very low	188 Å²	188	125.2 Å²	125.2	88%	0.879	64%	0.644	S	S	*	*	P	Polyproline II helix	trans	-62.6	133.1	168.9	-72.7	-177.5	154.2	0	0	111.2	P592	E590-P592 WeakPolarHBondContact O-CD 3.02Å
591	E	45.6	Very low	48.6	Very low	179 Å²	179	119.8 Å²	119.8	84%	0.836	63%	0.625	S	S	*	*	P	Polyproline II helix	trans	-60.3	121.9	179.5	-73.4	-163.1	154	0	0	111.7	G593	E591-G593 PolarHBondContact O-N 3.49Å
592	P	57.3	Low	49.9	Very low	47 Å²	47	118.6 Å²	118.6	31%	0.305	61%	0.614	S	S	.	*	P	Polyproline II helix	trans	-69.2	132.6	179.5	26	-32.1	0	0	0	111.1	E590 K596 M600	E590-P592 WeakPolarHBondContact O-CD 3.02Å; P592-K596 HydrophobicContact CB-CB 4.2Å; P592-K596 HydrophobicContact CB-CD 4.04Å; P592-K596 HydrophobicContact CB-CG 4.22Å; P592-M600 HydrophobicContact CB-CE 3.97Å; P592-M600 HydrophobicContact CB-SD 3.99Å; P592-M600 HydrophobicContact CG-CE 4.32Å; P592-M600 HydrophobicContact CG-SD 3.83Å
593	G	66.5	Low	51	Low	51 Å²	51	113.6 Å²	113.6	53%	0.526	59%	0.592	S	S	.	*	P	Polyproline II helix	trans	-57.4	159.9	177.3	0	0	0	0	0	114.2	E591 C595 K596 K597	E591-G593 PolarHBondContact O-N 3.49Å; G593-C595 PolarHBondContact O-N 3.04Å; G593-K596 CarbonylContact O-C 3.59Å; G593-K596 WeakPolarHBondContact O-CA 3.28Å; G593-K596 WeakPolarHBondContact O-CB 3.27Å; G593-K596 PolarHBondContact O-N 3.24Å; G593-K597 PolarHBondContact O-N 2.94Å
594	F	67.9	Low	52.1	Low	179 Å²	179	108.4 Å²	108.4	79%	0.785	57%	0.57	S	S	*	*	H	α-helix	trans	-50.5	-46.7	-167.9	-174.5	-98.4	0	0	0	115.2	K596 K597 A598	F594-K596 VanDerWaalsContact C-N 3.35Å; F594-K596 PolarHBondContact O-N 3.02Å; F594-K597 PolarHBondContact O-N 2.86Å; F594-A598 WeakPolarHBondContact O-CB 3.41Å; F594-A598 PolarHBondContact O-N 3.21Å
595	C	59.8	Low	53.4	Low	106 Å²	106	101.3 Å²	101.3	72%	0.716	54%	0.538	S	S	*	.	H	α-helix	trans	-65.6	-36.1	176.6	-76.9	0	0	0	0	112.9	G593 L599	G593-C595 PolarHBondContact O-N 3.04Å; C595-L599 VanDerWaalsContact O-CB 3.3Å; C595-L599 WeakPolarHBondContact O-CB 3.1Å; C595-L599 PolarHBondContact O-N 3.42Å
596	K	65.8	Low	54.5	Low	127 Å²	127	99.5 Å²	99.5	55%	0.552	52%	0.521	S	S	*	.	H	α-helix	trans	-71.9	-36.6	177.3	-160.8	178.7	-177.2	-176.9	0	110.3	P592 G593 F594 L599 M600	P592-K596 HydrophobicContact CB-CB 4.2Å; P592-K596 HydrophobicContact CB-CD 4.04Å; P592-K596 HydrophobicContact CB-CG 4.22Å; G593-K596 CarbonylContact O-C 3.59Å; G593-K596 WeakPolarHBondContact O-CA 3.28Å; G593-K596 WeakPolarHBondContact O-CB 3.27Å; G593-K596 PolarHBondContact O-N 3.24Å; F594-K596 VanDerWaalsContact C-N 3.35Å; F594-K596 PolarHBondContact O-N 3.02Å; K596-L599 PolarHBondContact O-N 3.01Å; K596-M600 HydrophobicContact CD-CE 4Å; K596-M600 HydrophobicContact CG-CE 3.73Å; K596-M600 VanDerWaalsContact O-CB 3.32Å; K596-M600 WeakPolarHBondContact O-CB 3.31Å; K596-M600 WeakPolarHBondContact O-CG 3.33Å; K596-M600 PolarHBondContact O-N 3.35Å
597	K	65.3	Low	55.2	Low	117 Å²	117	97.5 Å²	97.5	51%	0.509	51%	0.512	S	S	.	.	H	α-helix	trans	-67	-42.8	173.3	-161.7	170.9	-173.3	169.5	0	112	G593 F594 M600 C601	G593-K597 PolarHBondContact O-N 2.94Å; F594-K597 PolarHBondContact O-N 2.86Å; K597-M600 PolarHBondContact O-N 3.36Å; K597-C601 VanDerWaalsContact O-CB 3.23Å; K597-C601 WeakPolarHBondContact O-CB 2.99Å; K597-C601 PolarHBondContact O-N 3.47Å
598	A	62	Low	55.6	Low	50 Å²	50	97 Å²	97	41%	0.413	51%	0.508	S	S	.	.	H	α-helix	trans	-63.5	-42	173.4	0	0	0	0	0	111.8	F594 C601 F602	F594-A598 WeakPolarHBondContact O-CB 3.41Å; F594-A598 PolarHBondContact O-N 3.21Å; A598-C601 PolarHBondContact O-N 3.17Å; A598-F602 VanDerWaalsContact O-CB 3.25Å; A598-F602 WeakPolarHBondContact O-CB 3.39Å; A598-F602 PolarHBondContact O-N 3.09Å
599	L	61	Low	55.8	Low	117 Å²	117	99.9 Å²	99.9	61%	0.613	51%	0.507	S	S	*	.	H	α-helix	trans	-68.1	-37.7	175.6	-163.8	114	0	0	0	112.2	C595 K596 C603	C595-L599 VanDerWaalsContact O-CB 3.3Å; C595-L599 WeakPolarHBondContact O-CB 3.1Å; C595-L599 PolarHBondContact O-N 3.42Å; K596-L599 PolarHBondContact O-N 3.01Å; L599-C603 WeakPolarHBondContact O-CB 3.28Å; L599-C603 PolarHBondContact O-N 3.49Å; L599-C603 PolarHBondContact O-SG 3.14Å
600	M	64.2	Low	55.8	Low	29 Å²	29	96.5 Å²	96.5	14%	0.143	50%	0.499	C	S	.	.	H	α-helix	trans	-66.3	-42.6	173.2	-75.8	169.8	-176.5	0	0	111.5	P592 K596 K597 C603 G604 L605	P592-M600 HydrophobicContact CB-CE 3.97Å; P592-M600 HydrophobicContact CB-SD 3.99Å; P592-M600 HydrophobicContact CG-CE 4.32Å; P592-M600 HydrophobicContact CG-SD 3.83Å; K596-M600 HydrophobicContact CD-CE 4Å; K596-M600 HydrophobicContact CG-CE 3.73Å; K596-M600 VanDerWaalsContact O-CB 3.32Å; K596-M600 WeakPolarHBondContact O-CB 3.31Å; K596-M600 WeakPolarHBondContact O-CG 3.33Å; K596-M600 PolarHBondContact O-N 3.35Å; K597-M600 PolarHBondContact O-N 3.36Å; M600-C603 CarbonylContact O-C 3.49Å; M600-C603 PolarHBondContact O-N 3.25Å; M600-G604 PolarHBondContact O-N 3.28Å; M600-L605 HydrophobicContact CB-CB 4.27Å; M600-L605 HydrophobicContact CG-CB 4.41Å; M600-L605 PolarHBondContact O-N 2.66Å
601	C	58.9	Low	55.8	Low	61 Å²	61	93.3 Å²	93.3	41%	0.412	49%	0.493	S	S	.	.	H	α-helix	trans	-61.4	-48.3	174.9	-172.4	0	0	0	0	111.2	K597 A598 C603 G604 E606	K597-C601 VanDerWaalsContact O-CB 3.23Å; K597-C601 WeakPolarHBondContact O-CB 2.99Å; K597-C601 PolarHBondContact O-N 3.47Å; A598-C601 PolarHBondContact O-N 3.17Å; C601-C603 VanDerWaalsContact C-N 3.29Å; C601-C603 PolarHBondContact O-N 3.17Å; C601-G604 PolarHBondContact O-N 3.33Å; C601-E606 HydrophobicContact CB-CG 4.35Å; C601-E606 WeakPolarHBondContact CB-OE1 3.37Å; C601-E606 PolarHBondContact SG-OE1 2.65Å
602	F	59.6	Low	55.6	Low	108 Å²	108	92.2 Å²	92.2	47%	0.474	49%	0.485	S	S	.	.	H	α-helix	trans	-59	-41.1	175.3	-174.4	-98.7	0	0	0	112.1	L188 T192 A598 G604	L188-F602 HydrophobicContact CD1-CE1 4.43Å; L188-F602 HydrophobicContact CD1-CZ 3.77Å; T192-F602 HydrophobicContact CG2-CD1 3.95Å; T192-F602 HydrophobicContact CG2-CD2 3.97Å; T192-F602 HydrophobicContact CG2-CE1 3.48Å; T192-F602 VanDerWaalsContact CG2-CE1 3.48Å; T192-F602 HydrophobicContact CG2-CE2 3.49Å; T192-F602 VanDerWaalsContact CG2-CE2 3.49Å; T192-F602 HydrophobicContact CG2-CG 4.18Å; T192-F602 HydrophobicContact CG2-CZ 3.23Å; A598-F602 VanDerWaalsContact O-CB 3.25Å; A598-F602 WeakPolarHBondContact O-CB 3.39Å; A598-F602 PolarHBondContact O-N 3.09Å; F602-G604 VanDerWaalsContact C-N 3.28Å; F602-G604 PolarHBondContact O-N 3.29Å
603	C	56.8	Low	55.3	Low	21 Å²	21	93.8 Å²	93.8	14%	0.142	49%	0.491	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-0	175.9	-74	0	0	0	0	113.9	R424 L599 M600 C601 L605	R424-C603 PolarHBondContact NH1-O 3.24Å; R424-C603 VanDerWaalsContact NH1-O 3.11Å; R424-C603 PolarHBondContact NH2-O 2.68Å; L599-C603 WeakPolarHBondContact O-CB 3.28Å; L599-C603 PolarHBondContact O-N 3.49Å; L599-C603 PolarHBondContact O-SG 3.14Å; M600-C603 CarbonylContact O-C 3.49Å; M600-C603 PolarHBondContact O-N 3.25Å; C601-C603 VanDerWaalsContact C-N 3.29Å; C601-C603 PolarHBondContact O-N 3.17Å; C603-L605 HydrophobicContact CB-CD1 4.01Å; C603-L605 HydrophobicContact CB-CG 3.98Å; C603-L605 PolarHBondContact O-N 2.9Å
604	G	55.6	Low	55.2	Low	12 Å²	12	94.5 Å²	94.5	12%	0.124	49%	0.485	C	S	.	.	T	Hydrogen-bonded Turn	trans	65.1	19.6	-177.6	0	0	0	0	0	115.4	M600 C601 F602 E606	M600-G604 PolarHBondContact O-N 3.28Å; C601-G604 PolarHBondContact O-N 3.33Å; F602-G604 VanDerWaalsContact C-N 3.28Å; F602-G604 PolarHBondContact O-N 3.29Å; G604-E606 VanDerWaalsContact C-N 3.28Å; G604-E606 PolarHBondContact O-N 2.91Å
605	L	58	Low	55	Low	36 Å²	36	91.1 Å²	91.1	19%	0.188	48%	0.481	C	S	.	.			trans	-88.5	19.5	-179.5	-62.4	175.4	0	0	0	113	R417 M420 M600 C603 Q607	R417-L605 HydrophobicContact CG-CD2 4.31Å; M420-L605 HydrophobicContact CB-CD2 4.37Å; M420-L605 HydrophobicContact CE-CD2 3.69Å; M420-L605 HydrophobicContact SD-CD2 4.19Å; M600-L605 HydrophobicContact CB-CB 4.27Å; M600-L605 HydrophobicContact CG-CB 4.41Å; M600-L605 PolarHBondContact O-N 2.66Å; C603-L605 HydrophobicContact CB-CD1 4.01Å; C603-L605 HydrophobicContact CB-CG 3.98Å; C603-L605 PolarHBondContact O-N 2.9Å; L605-Q607 PolarHBondContact O-N 3.23Å
606	E	54.3	Low	55.1	Low	86 Å²	86	94 Å²	94	40%	0.402	48%	0.483	S	S	.	.			trans	-68.9	125.7	179.6	-83.5	-175	171.9	0	0	111.5	C601 G604 K608	C601-E606 HydrophobicContact CB-CG 4.35Å; C601-E606 WeakPolarHBondContact CB-OE1 3.37Å; C601-E606 PolarHBondContact SG-OE1 2.65Å; G604-E606 VanDerWaalsContact C-N 3.28Å; G604-E606 PolarHBondContact O-N 2.91Å; E606-K608 PolarHBondContact O-N 2.91Å
607	Q	46.4	Very low	54.9	Low	148 Å²	148	92.4 Å²	92.4	69%	0.692	48%	0.478	S	S	*	.			trans	-69.2	90.9	164.2	-82	173	-18.7	0	0	109.6	E589 L605	E589-Q607 PolarHBondContact OE1-NE2 3.44Å; E589-Q607 VanDerWaalsContact OE2-CD 3.28Å; E589-Q607 PolarHBondContact OE2-NE2 2.58Å; E589-Q607 PolarHBondContact OE2-OE1 3.33Å; L605-Q607 PolarHBondContact O-N 3.23Å
608	K	42	Very low	54.7	Low	123 Å²	123	91.8 Å²	91.8	54%	0.535	48%	0.477	S	S	.	.			trans	-90.6	122.4	149.3	-77.3	-177.3	178.7	175.9	0	106.5	A52 E606 A610	A52-K608 HydrophobicContact CB-CB 4.23Å; A52-K608 WeakPolarHBondContact CB-O 3.22Å; E606-K608 PolarHBondContact O-N 2.91Å; K608-A610 PolarHBondContact O-N 3.23Å
609	K	38	Very low	54.7	Low	192 Å²	192	92.2 Å²	92.2	84%	0.835	48%	0.481	S	S	*	.			trans	-47.2	113.2	170.7	-82.3	-175.7	174.3	-175.2	0	107.6	V611	K609-V611 PolarHBondContact O-N 2.68Å
610	A	43	Very low	54.9	Low	49 Å²	49	91.6 Å²	91.6	41%	0.405	48%	0.475	S	S	.	.			trans	-56.4	126.5	167.5	0	0	0	0	0	106.5	T53 K608 K612	T53-A610 HydrophobicContact CG2-CB 3.67Å; K608-A610 PolarHBondContact O-N 3.23Å; A610-K612 PolarHBondContact O-N 3.05Å
611	V	42.9	Very low	54.7	Low	122 Å²	122	93.9 Å²	93.9	74%	0.739	49%	0.487	S	S	*	.			trans	-63.7	107.1	175	177.7	0	0	0	0	105.8	K609 L613	K609-V611 PolarHBondContact O-N 2.68Å; V611-L613 PolarHBondContact O-N 2.85Å; V611-L613 VanDerWaalsContact O-N 3.1Å
612	K	42.2	Very low	54.9	Low	156 Å²	156	97.5 Å²	97.5	68%	0.678	50%	0.496	S	S	*	.			trans	-63.2	111.8	174.5	-75.8	-174	177.8	-177.1	0	107.4	M583 A610	M583-K612 HydrophobicContact SD-CD 4.18Å; M583-K612 VanDerWaalsContact SD-CE 3.59Å; M583-K612 PolarHBondContact SD-NZ 3.21Å; A610-K612 PolarHBondContact O-N 3.05Å
613	L	52	Low	55.2	Low	80 Å²	80	100 Å²	100	42%	0.419	51%	0.506	S	S	.	.			trans	-71.8	145.4	170.6	-71.4	152.6	0	0	0	107.7	V611 Q617 E618 L621	V611-L613 PolarHBondContact O-N 2.85Å; V611-L613 VanDerWaalsContact O-N 3.1Å; L613-Q617 HydrophobicContact CB-CB 4.08Å; L613-Q617 HydrophobicContact CD2-CB 3.84Å; L613-E618 HydrophobicContact CB-CB 4.42Å; L613-L621 HydrophobicContact CD1-CD2 3.73Å
614	T	63	Low	55.5	Low	66 Å²	66	105.3 Å²	105.3	41%	0.405	53%	0.527	S	S	.	.			trans	-66.5	156.1	169.1	57.5	0	0	0	0	110	E616 Q617 E618	T614-E616 PolarHBondContact O-N 3.32Å; T614-E616 VanDerWaalsContact O-N 3.1Å; T614-Q617 CarbonylContact O-C 3.5Å; T614-Q617 WeakPolarHBondContact O-CA 3.36Å; T614-Q617 WeakPolarHBondContact O-CB 3.49Å; T614-Q617 PolarHBondContact O-N 3.35Å; T614-Q617 WeakPolarHBondContact OG1-CB 3.38Å; T614-Q617 WeakPolarHBondContact OG1-CG 3.34Å; T614-Q617 PolarHBondContact OG1-N 3.44Å; T614-Q617 PolarHBondContact OG1-OE1 3.38Å; T614-E618 PolarHBondContact O-N 3.19Å
615	P	63.4	Low	55.7	Low	108 Å²	108	107.1 Å²	107.1	70%	0.701	53%	0.534	S	S	*	.	H	α-helix	trans	-54.2	-34.1	178.7	-25.8	33.3	0	0	0	113	A619	P615-A619 VanDerWaalsContact O-CB 3.3Å; P615-A619 WeakPolarHBondContact O-CB 3.16Å; P615-A619 PolarHBondContact O-N 3.4Å
616	E	62.2	Low	56	Low	165 Å²	165	107 Å²	107	77%	0.771	54%	0.535	S	S	*	.	H	α-helix	trans	-67.6	-44.2	174	-66.2	-176.9	165.3	0	0	112.5	T614 E618 A619 E620	T614-E616 PolarHBondContact O-N 3.32Å; T614-E616 VanDerWaalsContact O-N 3.1Å; E616-E618 VanDerWaalsContact C-N 3.3Å; E616-E618 PolarHBondContact O-N 3.2Å; E616-A619 PolarHBondContact O-N 2.87Å; E616-E620 WeakPolarHBondContact O-CB 3.48Å; E616-E620 PolarHBondContact O-N 3.03Å
617	Q	62.6	Low	56.7	Low	95 Å²	95	106.5 Å²	106.5	44%	0.444	54%	0.535	S	S	.	.	H	α-helix	trans	-66.5	-34.7	176.3	-73.6	173.2	-14.5	0	0	111.7	L613 T614 L621	L613-Q617 HydrophobicContact CB-CB 4.08Å; L613-Q617 HydrophobicContact CD2-CB 3.84Å; T614-Q617 CarbonylContact O-C 3.5Å; T614-Q617 WeakPolarHBondContact O-CA 3.36Å; T614-Q617 WeakPolarHBondContact O-CB 3.49Å; T614-Q617 PolarHBondContact O-N 3.35Å; T614-Q617 WeakPolarHBondContact OG1-CB 3.38Å; T614-Q617 WeakPolarHBondContact OG1-CG 3.34Å; T614-Q617 PolarHBondContact OG1-N 3.44Å; T614-Q617 PolarHBondContact OG1-OE1 3.38Å; Q617-L621 WeakPolarHBondContact O-CB 3.41Å; Q617-L621 PolarHBondContact O-N 2.95Å
618	E	59.7	Low	57.8	Low	103 Å²	103	101.8 Å²	101.8	48%	0.481	52%	0.516	S	S	.	.	H	α-helix	trans	-70.6	-42.7	176.1	-170.1	171.3	-164.3	0	0	111.7	L613 T614 E616 E620 L621 K622	L613-E618 HydrophobicContact CB-CB 4.42Å; T614-E618 PolarHBondContact O-N 3.19Å; E616-E618 VanDerWaalsContact C-N 3.3Å; E616-E618 PolarHBondContact O-N 3.2Å; E618-E620 VanDerWaalsContact C-N 3.34Å; E618-E620 PolarHBondContact O-N 3.46Å; E618-L621 PolarHBondContact O-N 2.99Å; E618-K622 VanDerWaalsContact O-CB 3.24Å; E618-K622 WeakPolarHBondContact O-CB 3.08Å; E618-K622 PolarHBondContact O-N 3.33Å
619	A	63.6	Low	59.4	Low	60 Å²	60	100.9 Å²	100.9	50%	0.496	52%	0.521	S	S	.	.	H	α-helix	trans	-62.1	-41.3	171.9	0	0	0	0	0	111.7	P615 E616 K622 K623	P615-A619 VanDerWaalsContact O-CB 3.3Å; P615-A619 WeakPolarHBondContact O-CB 3.16Å; P615-A619 PolarHBondContact O-N 3.4Å; E616-A619 PolarHBondContact O-N 2.87Å; A619-K622 PolarHBondContact O-N 2.02Å; A619-K623 VanDerWaalsContact O-CB 3.29Å; A619-K623 WeakPolarHBondContact O-CB 3.08Å; A619-K623 PolarHBondContact O-N 3.31Å
620	E	64.1	Low	61.4	Low	103 Å²	103	93.2 Å²	93.2	48%	0.481	49%	0.488	S	S	.	.	H	α-helix	trans	-67.7	-39.1	176.8	-159.7	-169.1	150.2	0	0	111.8	E616 E618 K623 K624	E616-E620 WeakPolarHBondContact O-CB 3.48Å; E616-E620 PolarHBondContact O-N 3.03Å; E618-E620 VanDerWaalsContact C-N 3.34Å; E618-E620 PolarHBondContact O-N 3.46Å; E620-K623 PolarHBondContact O-N 2.05Å; E620-K624 WeakPolarHBondContact O-CG 3.37Å; E620-K624 PolarHBondContact O-N 2.54Å; E620-K624 WeakPolarHBondContact OE1-CE 3.42Å; E620-K624 IonicContact OE1-NZ 2.75Å; E620-K624 PolarHBondContact OE1-NZ 3.06Å
621	L	60.8	Low	63.5	Low	78 Å²	78	94.9 Å²	94.9	41%	0.408	49%	0.49	S	S	.	.	H	α-helix	trans	-64.8	-45.5	173.5	-172.6	64.2	0	0	0	110.9	L613 Q617 E618 K623 K624 L625	L613-L621 HydrophobicContact CD1-CD2 3.73Å; Q617-L621 WeakPolarHBondContact O-CB 3.41Å; Q617-L621 PolarHBondContact O-N 2.95Å; E618-L621 PolarHBondContact O-N 2.99Å; L621-K623 VanDerWaalsContact C-N 3.29Å; L621-K623 PolarHBondContact O-N 2.99Å; L621-K624 PolarHBondContact O-N 3.28Å; L621-L625 HydrophobicContact CD1-CD1 4.43Å; L621-L625 HydrophobicContact CG-CD1 3.94Å; L621-L625 HydrophobicContact CG-CG 4.45Å; L621-L625 WeakPolarHBondContact O-CB 3.04Å; L621-L625 WeakPolarHBondContact O-CG 3.25Å; L621-L625 PolarHBondContact O-N 3.2Å
622	K	63.3	Low	65.7	Low	137 Å²	137	93.4 Å²	93.4	60%	0.596	48%	0.483	S	S	*	.	H	α-helix	trans	-61.8	-37.7	176	-164.7	173.7	-175.7	176.6	0	111.2	E618 A619 L625 T626	E618-K622 VanDerWaalsContact O-CB 3.24Å; E618-K622 WeakPolarHBondContact O-CB 3.08Å; E618-K622 PolarHBondContact O-N 3.33Å; A619-K622 PolarHBondContact O-N 2.02Å; K622-L625 PolarHBondContact O-N 3.19Å; K622-T626 WeakPolarHBondContact O-CB 3.34Å; K622-T626 WeakPolarHBondContact O-CG2 3.48Å; K622-T626 PolarHBondContact O-N 3.12Å; K622-T626 PolarHBondContact O-OG1 3.38Å
623	K	65.5	Low	68.1	Low	159 Å²	159	92.1 Å²	92.1	69%	0.691	48%	0.478	S	S	*	.	H	α-helix	trans	-65.5	-47	172.5	-170.2	175.9	-179.9	179.2	0	111.9	A619 E620 L621 L625 T626 D627	A619-K623 VanDerWaalsContact O-CB 3.29Å; A619-K623 WeakPolarHBondContact O-CB 3.08Å; A619-K623 PolarHBondContact O-N 3.31Å; E620-K623 PolarHBondContact O-N 2.05Å; L621-K623 VanDerWaalsContact C-N 3.29Å; L621-K623 PolarHBondContact O-N 2.99Å; K623-L625 VanDerWaalsContact C-N 3.29Å; K623-L625 PolarHBondContact O-N 3.49Å; K623-T626 PolarHBondContact O-N 2.85Å; K623-T626 PolarHBondContact O-OG1 3.44Å; K623-D627 WeakPolarHBondContact O-CB 3.33Å; K623-D627 PolarHBondContact O-N 2.94Å
624	K	63	Low	69.9	Low	133 Å²	133	95.2 Å²	95.2	58%	0.578	48%	0.484	S	S	*	.	H	α-helix	trans	-61.1	-36	174.5	-78.7	174.9	-176.7	154.4	0	112.6	E620 L621	E620-K624 WeakPolarHBondContact O-CG 3.37Å; E620-K624 PolarHBondContact O-N 2.54Å; E620-K624 WeakPolarHBondContact OE1-CE 3.42Å; E620-K624 IonicContact OE1-NZ 2.75Å; E620-K624 PolarHBondContact OE1-NZ 3.06Å; L621-K624 PolarHBondContact O-N 3.28Å
625	L	59.8	Low	71.2	Confident	51 Å²	51	98.5 Å²	98.5	27%	0.267	49%	0.489	S	S	.	.	H	α-helix	trans	-76.9	-29.8	-179.4	-71.6	172.8	0	0	0	113.5	R62 L621 K622 K623	R62-L625 HydrophobicContact CB-CD2 4.02Å; R62-L625 HydrophobicContact CG-CD2 4.41Å; L621-L625 HydrophobicContact CD1-CD1 4.43Å; L621-L625 HydrophobicContact CG-CD1 3.94Å; L621-L625 HydrophobicContact CG-CG 4.45Å; L621-L625 WeakPolarHBondContact O-CB 3.04Å; L621-L625 WeakPolarHBondContact O-CG 3.25Å; L621-L625 PolarHBondContact O-N 3.2Å; K622-L625 PolarHBondContact O-N 3.19Å; K623-L625 VanDerWaalsContact C-N 3.29Å; K623-L625 PolarHBondContact O-N 3.49Å
626	T	64.1	Low	72.7	Confident	34 Å²	34	100.5 Å²	100.5	21%	0.209	49%	0.487	C	S	.	.	H	α-helix	trans	-91.7	-3.4	175.5	55.2	0	0	0	0	113.2	K622 K623 T628	K622-T626 WeakPolarHBondContact O-CB 3.34Å; K622-T626 WeakPolarHBondContact O-CG2 3.48Å; K622-T626 PolarHBondContact O-N 3.12Å; K622-T626 PolarHBondContact O-OG1 3.38Å; K623-T626 PolarHBondContact O-N 2.85Å; K623-T626 PolarHBondContact O-OG1 3.44Å; T626-T628 PolarHBondContact O-N 3.25Å
627	D	68.4	Low	74.2	Confident	74 Å²	74	95.1 Å²	95.1	40%	0.396	47%	0.465	S	S	.	.			trans	-67.5	127.9	176.3	-165.8	0.5	0	0	0	110.9	K623 T629	K623-D627 WeakPolarHBondContact O-CB 3.33Å; K623-D627 PolarHBondContact O-N 2.94Å; D627-T629 WeakPolarHBondContact OD1-CB 3.49Å; D627-T629 WeakPolarHBondContact OD1-CG2 3.14Å; D627-T629 PolarHBondContact OD1-N 3Å; D627-T629 PolarHBondContact OD1-OG1 3.3Å; D627-T629 PolarHBondContact OD2-OG1 3.1Å
628	T	70.8	Confident	75.7	Confident	49 Å²	49	91 Å²	91	30%	0.301	45%	0.446	S	S	.	.			trans	-108.2	2.5	178.4	55.3	0	0	0	0	112.1	Y117 T626	Y117-T628 HydrophobicContact CD1-CG2 4.16Å; T626-T628 PolarHBondContact O-N 3.25Å
629	T	74.8	Confident	77.4	Confident	104 Å²	104	88.6 Å²	88.6	64%	0.638	44%	0.437	S	S	*	.			trans	-64.2	143.6	176.1	64.7	0	0	0	0	110.8	D627	D627-T629 WeakPolarHBondContact OD1-CB 3.49Å; D627-T629 WeakPolarHBondContact OD1-CG2 3.14Å; D627-T629 PolarHBondContact OD1-N 3Å; D627-T629 PolarHBondContact OD1-OG1 3.3Å; D627-T629 PolarHBondContact OD2-OG1 3.1Å
630	E	80.4	Confident	78.9	Confident	32 Å²	32	89.4 Å²	89.4	15%	0.15	44%	0.436	C	S	.	.			trans	-128.7	143.4	-179.5	-65.1	-172.7	108	0	0	109.1	L304 S305 K308 R635	L304-E630 HydrophobicContact CB-CG 4.13Å; L304-E630 HydrophobicContact CD2-CG 4.07Å; L304-E630 HydrophobicContact CG-CG 4.42Å; S305-E630 WeakPolarHBondContact CA-OE1 3.5Å; S305-E630 PolarHBondContact N-OE1 3.01Å; S305-E630 WeakPolarHBondContact OG-CG 3.49Å; S305-E630 PolarHBondContact OG-OE1 3.26Å; K308-E630 WeakPolarHBondContact CD-OE1 3.23Å; K308-E630 VanDerWaalsContact NZ-CD 3.31Å; K308-E630 IonicContact NZ-OE1 2.71Å; K308-E630 PolarHBondContact NZ-OE1 3.14Å; K308-E630 IonicContact NZ-OE2 2.7Å; K308-E630 PolarHBondContact NZ-OE2 3.19Å; E630-R635 HydrophobicContact CB-CB 4.23Å
631	D	86.3	Confident	80.5	Confident	83 Å²	83	87 Å²	87	44%	0.444	43%	0.426	S	S	.	.			trans	-60.9	129.8	170	176.9	-85.3	0	0	0	110	F633 W634 R635	D631-F633 VanDerWaalsContact C-N 3.26Å; D631-F633 PolarHBondContact O-N 2.87Å; D631-F633 WeakPolarHBondContact OD1-CA 3.45Å; D631-F633 VanDerWaalsContact OD1-CB 3.25Å; D631-F633 WeakPolarHBondContact OD1-CB 3.26Å; D631-F633 PolarHBondContact OD1-N 3.03Å; D631-W634 HydrophobicContact CB-CB 4.39Å; D631-W634 PolarHBondContact O-N 3.41Å; D631-W634 PolarHBondContact OD1-N 3.28Å; D631-W634 VanDerWaalsContact OD1-N 3.15Å; D631-R635 WeakPolarHBondContact O-CB 3.16Å; D631-R635 PolarHBondContact O-N 2.84Å
632	P	89.4	Confident	82.1	Confident	92 Å²	92	83.6 Å²	83.6	60%	0.597	41%	0.409	S	S	*	.	H	α-helix	trans	-59.5	-32.4	-175	-25.4	33.6	0	0	0	114.3	K636	P632-K636 WeakPolarHBondContact O-CG 3.23Å; P632-K636 PolarHBondContact O-N 3.01Å
633	F	92.2	Very high	83.7	Confident	129 Å²	129	82.2 Å²	82.2	57%	0.566	41%	0.407	S	S	*	.	H	α-helix	trans	-70.5	-52.6	178.6	171.7	-95	0	0	0	110	D631 R635 K636 V637	D631-F633 VanDerWaalsContact C-N 3.26Å; D631-F633 PolarHBondContact O-N 2.87Å; D631-F633 WeakPolarHBondContact OD1-CA 3.45Å; D631-F633 VanDerWaalsContact OD1-CB 3.25Å; D631-F633 WeakPolarHBondContact OD1-CB 3.26Å; D631-F633 PolarHBondContact OD1-N 3.03Å; F633-R635 VanDerWaalsContact C-N 3.3Å; F633-R635 PolarHBondContact O-N 3.31Å; F633-K636 PolarHBondContact O-N 3.42Å; F633-K636 VanDerWaalsContact O-N 3.11Å; F633-V637 HydrophobicContact CD1-CG2 4.41Å; F633-V637 HydrophobicContact CE1-CG2 4.02Å; F633-V637 HydrophobicContact CE2-CG2 4.46Å; F633-V637 HydrophobicContact CZ-CG2 4.05Å; F633-V637 WeakPolarHBondContact O-CG2 3.36Å; F633-V637 PolarHBondContact O-N 2.99Å; F633-V637 VanDerWaalsContact O-N 3.1Å
634	W	90.4	Very high	85.2	Confident	144 Å²	144	78.3 Å²	78.3	55%	0.545	39%	0.393	S	S	.	.	H	α-helix	trans	-63.1	-36.5	179.7	-70.2	109.1	0	0	0	112.7	D631 K636 V637 V638	D631-W634 HydrophobicContact CB-CB 4.39Å; D631-W634 PolarHBondContact O-N 3.41Å; D631-W634 PolarHBondContact OD1-N 3.28Å; D631-W634 VanDerWaalsContact OD1-N 3.15Å; W634-K636 VanDerWaalsContact C-N 3.34Å; W634-K636 PolarHBondContact O-N 2.97Å; W634-V637 PolarHBondContact O-N 3.09Å; W634-V638 WeakPolarHBondContact O-CG2 3.35Å; W634-V638 PolarHBondContact O-N 3.28Å
635	R	91.1	Very high	86.7	Confident	136 Å²	136	72 Å²	72	51%	0.513	37%	0.366	S	S	.	.	H	α-helix	trans	-58.9	-42.2	173.7	-177.1	176.5	171.6	-166.1	-2.5	112.3	E630 D631 F633 V638 N639	E630-R635 HydrophobicContact CB-CB 4.23Å; D631-R635 WeakPolarHBondContact O-CB 3.16Å; D631-R635 PolarHBondContact O-N 2.84Å; F633-R635 VanDerWaalsContact C-N 3.3Å; F633-R635 PolarHBondContact O-N 3.31Å; R635-V638 WeakPolarHBondContact O-CG2 2.83Å; R635-N639 WeakPolarHBondContact O-CB 3.09Å; R635-N639 PolarHBondContact O-N 2.99Å; R635-N639 VanDerWaalsContact O-N 3.11Å; R635-N639 PolarHBondContact O-ND2 3.45Å
636	K	93.4	Very high	88.4	Confident	150 Å²	150	72.4 Å²	72.4	65%	0.652	37%	0.368	S	S	*	.	H	α-helix	trans	-64.9	-46	175.8	-73.8	176.4	-177	-179.1	0	111	P632 F633 W634 V638 N639 T640	P632-K636 WeakPolarHBondContact O-CG 3.23Å; P632-K636 PolarHBondContact O-N 3.01Å; F633-K636 PolarHBondContact O-N 3.42Å; F633-K636 VanDerWaalsContact O-N 3.11Å; W634-K636 VanDerWaalsContact C-N 3.34Å; W634-K636 PolarHBondContact O-N 2.97Å; K636-V638 PolarHBondContact O-N 3.46Å; K636-N639 PolarHBondContact O-N 3.5Å; K636-T640 PolarHBondContact O-N 2.93Å; K636-T640 PolarHBondContact O-OG1 2.82Å; K636-T640 VanDerWaalsContact O-OG1 3.09Å
637	V	94.9	Very high	90	Very high	52 Å²	52	74.6 Å²	74.6	32%	0.315	38%	0.383	S	S	.	.	H	α-helix	trans	-58.6	-48.3	-180	176	0	0	0	0	111.8	F633 W634 N641	F633-V637 HydrophobicContact CD1-CG2 4.41Å; F633-V637 HydrophobicContact CE1-CG2 4.02Å; F633-V637 HydrophobicContact CE2-CG2 4.46Å; F633-V637 HydrophobicContact CZ-CG2 4.05Å; F633-V637 WeakPolarHBondContact O-CG2 3.36Å; F633-V637 PolarHBondContact O-N 2.99Å; F633-V637 VanDerWaalsContact O-N 3.1Å; W634-V637 PolarHBondContact O-N 3.09Å; V637-N641 PolarHBondContact O-N 2.79Å; V637-N641 VanDerWaalsContact O-N 3.1Å; V637-N641 PolarHBondContact O-ND2 3.18Å
638	V	94.4	Very high	91.3	Very high	8 Å²	8	73.7 Å²	73.7	5%	0.048	38%	0.38	C	S	.	.	H	α-helix	trans	-67.5	-39.3	179.8	-61.5	0	0	0	0	111.8	W113 K308 A309 I312 W634 R635 K636 N641 A642	W113-V638 HydrophobicContact CZ2-CB 4.4Å; W113-V638 HydrophobicContact CZ2-CG2 4.35Å; K308-V638 HydrophobicContact CB-CB 4.23Å; K308-V638 HydrophobicContact CB-CG1 4.37Å; K308-V638 HydrophobicContact CB-CG2 4.23Å; K308-V638 HydrophobicContact CD-CG2 4.04Å; A309-V638 HydrophobicContact CB-CG1 4.18Å; I312-V638 HydrophobicContact CD1-CB 3.8Å; I312-V638 HydrophobicContact CD1-CG1 4.25Å; I312-V638 WeakPolarHBondContact CD1-O 3.27Å; W634-V638 WeakPolarHBondContact O-CG2 3.35Å; W634-V638 PolarHBondContact O-N 3.28Å; R635-V638 WeakPolarHBondContact O-CG2 2.83Å; K636-V638 PolarHBondContact O-N 3.46Å; V638-N641 PolarHBondContact O-N 2.96Å; V638-A642 WeakPolarHBondContact O-CB 3.29Å; V638-A642 PolarHBondContact O-N 3.44Å
639	N	94.4	Very high	92.4	Very high	52 Å²	52	71.4 Å²	71.4	28%	0.278	37%	0.367	S	S	.	.	H	α-helix	trans	-65.1	-44.2	177.6	-73.1	-15	0	0	0	112.1	W113 R635 K636 A642 I643	W113-N639 PolarHBondContact NE1-OD1 3Å; R635-N639 WeakPolarHBondContact O-CB 3.09Å; R635-N639 PolarHBondContact O-N 2.99Å; R635-N639 VanDerWaalsContact O-N 3.11Å; R635-N639 PolarHBondContact O-ND2 3.45Å; K636-N639 PolarHBondContact O-N 3.5Å; N639-A642 PolarHBondContact O-N 2.77Å; N639-I643 WeakPolarHBondContact O-CG1 3.06Å; N639-I643 PolarHBondContact O-N 2.87Å
640	T	95.9	Very high	93.3	Very high	78 Å²	78	71.5 Å²	71.5	48%	0.479	37%	0.367	S	S	.	.	H	α-helix	trans	-61.5	-45.3	177.2	-61.5	0	0	0	0	111.1	K636 A642 I643 I644	K636-T640 PolarHBondContact O-N 2.93Å; K636-T640 PolarHBondContact O-OG1 2.82Å; K636-T640 VanDerWaalsContact O-OG1 3.09Å; T640-A642 VanDerWaalsContact C-N 3.35Å; T640-A642 PolarHBondContact O-N 2.97Å; T640-I643 PolarHBondContact O-N 2.91Å; T640-I644 HydrophobicContact CG2-CD1 4.05Å; T640-I644 WeakPolarHBondContact O-CG1 3.13Å; T640-I644 PolarHBondContact O-N 3.2Å
641	N	96.3	Very high	94	Very high	53 Å²	53	76.3 Å²	76.3	28%	0.283	39%	0.387	S	S	.	.	H	α-helix	trans	-65.6	-36.3	177.8	-84.5	-84.5	0	0	0	112.9	I312 V637 V638 I643 I644 L645	I312-N641 HydrophobicContact CD1-CB 3.96Å; I312-N641 HydrophobicContact CG2-CB 4.09Å; V637-N641 PolarHBondContact O-N 2.79Å; V637-N641 VanDerWaalsContact O-N 3.1Å; V637-N641 PolarHBondContact O-ND2 3.18Å; V638-N641 PolarHBondContact O-N 2.96Å; N641-I643 VanDerWaalsContact C-N 3.35Å; N641-I644 PolarHBondContact O-N 2.74Å; N641-L645 WeakPolarHBondContact O-CB 3Å; N641-L645 PolarHBondContact O-N 3.48Å
642	A	95.3	Very high	94.4	Very high	6 Å²	6	73.3 Å²	73.3	5%	0.05	37%	0.371	C	S	.	.	H	α-helix	trans	-63	-41.7	174.9	0	0	0	0	0	112	V109 W113 I312 V638 N639 T640 L645 L646	V109-A642 HydrophobicContact CG1-CB 4.24Å; W113-A642 HydrophobicContact CH2-CB 3.48Å; W113-A642 VanDerWaalsContact CH2-CB 3.48Å; W113-A642 HydrophobicContact CZ2-CB 3.55Å; W113-A642 HydrophobicContact CZ3-CB 4.33Å; I312-A642 HydrophobicContact CG1-CB 4.48Å; V638-A642 WeakPolarHBondContact O-CB 3.29Å; V638-A642 PolarHBondContact O-N 3.44Å; N639-A642 PolarHBondContact O-N 2.77Å; T640-A642 VanDerWaalsContact C-N 3.35Å; T640-A642 PolarHBondContact O-N 2.97Å; A642-L645 PolarHBondContact O-N 2.02Å; A642-L646 WeakPolarHBondContact O-CB 2.93Å; A642-L646 VanDerWaalsContact O-CG 3.29Å; A642-L646 WeakPolarHBondContact O-CG 3.12Å; A642-L646 PolarHBondContact O-N 2.97Å
643	I	96.1	Very high	94.4	Very high	107 Å²	107	70.2 Å²	70.2	55%	0.549	35%	0.349	S	S	.	.	H	α-helix	trans	-62.9	-47.6	175.8	-66.5	165.9	0	0	0	110.3	N639 T640 N641 L645 L646 C647	N639-I643 WeakPolarHBondContact O-CG1 3.06Å; N639-I643 PolarHBondContact O-N 2.87Å; T640-I643 PolarHBondContact O-N 2.91Å; N641-I643 VanDerWaalsContact C-N 3.35Å; I643-L645 VanDerWaalsContact C-N 3.33Å; I643-L645 PolarHBondContact O-N 3.35Å; I643-L646 PolarHBondContact O-N 3.37Å; I643-C647 WeakPolarHBondContact O-CB 3.31Å; I643-C647 PolarHBondContact O-N 2.89Å; I643-C647 PolarHBondContact O-SG 3.05Å
644	I	96.8	Very high	94.4	Very high	78 Å²	78	66.8 Å²	66.8	40%	0.4	35%	0.35	S	S	.	.	H	α-helix	trans	-56.3	-49.2	177.5	-68	166.4	0	0	0	110.5	T640 N641 L646 C647 V648	T640-I644 HydrophobicContact CG2-CD1 4.05Å; T640-I644 WeakPolarHBondContact O-CG1 3.13Å; T640-I644 PolarHBondContact O-N 3.2Å; N641-I644 PolarHBondContact O-N 2.74Å; I644-L646 PolarHBondContact O-N 3.2Å; I644-C647 WeakPolarHBondContact O-CB 3.3Å; I644-C647 PolarHBondContact O-N 2.96Å; I644-V648 WeakPolarHBondContact O-CG2 3.29Å; I644-V648 PolarHBondContact O-N 3.24Å
645	L	96.3	Very high	94.5	Very high	0 Å²	0	67.5 Å²	67.5	0%	0	35%	0.354	C	S	.	.	H	α-helix	trans	-59.7	-44.1	179.7	177.4	63.7	0	0	0	112.2	L105 V109 Y316 L319 N641 A642 I643 V648 C649	L105-L645 HydrophobicContact CD1-CD1 3.94Å; L105-L645 HydrophobicContact CD1-CG 4.45Å; L105-L645 HydrophobicContact CD2-CD1 4.34Å; L105-L645 HydrophobicContact CD2-CD2 4.2Å; L105-L645 HydrophobicContact CD2-CG 3.96Å; L105-L645 HydrophobicContact CG-CD1 4.34Å; L105-L645 HydrophobicContact CG-CD2 4.43Å; L105-L645 HydrophobicContact CG-CG 4.4Å; V109-L645 HydrophobicContact CG2-CD2 3.85Å; Y316-L645 HydrophobicContact CD1-CD1 3.6Å; Y316-L645 HydrophobicContact CE1-CB 4.25Å; Y316-L645 HydrophobicContact CE1-CD1 3.81Å; Y316-L645 HydrophobicContact CG-CD1 4.01Å; L319-L645 HydrophobicContact CD1-CD1 4.11Å; N641-L645 WeakPolarHBondContact O-CB 3Å; N641-L645 PolarHBondContact O-N 3.48Å; A642-L645 PolarHBondContact O-N 2.02Å; I643-L645 VanDerWaalsContact C-N 3.33Å; I643-L645 PolarHBondContact O-N 3.35Å; L645-V648 PolarHBondContact O-N 3.18Å; L645-C649 WeakPolarHBondContact O-CB 2.94Å; L645-C649 PolarHBondContact O-N 2.9Å
646	L	95.4	Very high	94.5	Very high	60 Å²	60	62.7 Å²	62.7	31%	0.314	34%	0.337	S	S	.	.	H	α-helix	trans	-66.4	-39.5	177	-69.9	173.9	0	0	0	111.8	L105 V106 V109 A642 I643 I644 V648 C649 V650	L105-L646 HydrophobicContact CD2-CD2 4.49Å; V106-L646 HydrophobicContact CG1-CD2 4.3Å; V106-L646 HydrophobicContact CG2-CD2 4.21Å; V109-L646 HydrophobicContact CG1-CD1 4.44Å; A642-L646 WeakPolarHBondContact O-CB 2.93Å; A642-L646 VanDerWaalsContact O-CG 3.29Å; A642-L646 WeakPolarHBondContact O-CG 3.12Å; A642-L646 PolarHBondContact O-N 2.97Å; I643-L646 PolarHBondContact O-N 3.37Å; I644-L646 PolarHBondContact O-N 3.2Å; L646-V648 PolarHBondContact O-N 3.3Å; L646-C649 WeakPolarHBondContact O-CB 3.19Å; L646-C649 PolarHBondContact O-N 2.82Å; L646-V650 WeakPolarHBondContact O-CG2 3.46Å; L646-V650 PolarHBondContact O-N 2Å
647	C	96.4	Very high	94	Very high	79 Å²	79	57.9 Å²	57.9	53%	0.534	33%	0.329	S	S	.	.	H	α-helix	trans	-61.4	-43.1	174.4	-70.4	0	0	0	0	111.9	I643 I644 C649 V650 F651	I643-C647 WeakPolarHBondContact O-CB 3.31Å; I643-C647 PolarHBondContact O-N 2.89Å; I643-C647 PolarHBondContact O-SG 3.05Å; I644-C647 WeakPolarHBondContact O-CB 3.3Å; I644-C647 PolarHBondContact O-N 2.96Å; C647-C649 VanDerWaalsContact C-N 3.35Å; C647-V650 PolarHBondContact O-N 2.91Å; C647-F651 WeakPolarHBondContact O-CB 3.49Å; C647-F651 PolarHBondContact O-N 3.31Å
648	V	95.8	Very high	93.9	Very high	55 Å²	55	58.2 Å²	58.2	33%	0.333	33%	0.33	S	S	.	.	H	α-helix	trans	-62.8	-43.3	174.9	172.7	0	0	0	0	110.7	L319 I644 L645 L646 V650 F651 L652	L319-V648 HydrophobicContact CD1-CG1 3.74Å; I644-V648 WeakPolarHBondContact O-CG2 3.29Å; I644-V648 PolarHBondContact O-N 3.24Å; L645-V648 PolarHBondContact O-N 3.18Å; L646-V648 PolarHBondContact O-N 3.3Å; V648-V650 PolarHBondContact O-N 3.22Å; V648-F651 PolarHBondContact O-N 3.03Å; V648-L652 HydrophobicContact CG1-CD1 3.96Å; V648-L652 HydrophobicContact CG1-CG 4.4Å; V648-L652 WeakPolarHBondContact O-CG 3.45Å; V648-L652 PolarHBondContact O-N 3.13Å
649	C	94.3	Very high	93.9	Very high	2 Å²	2	60.8 Å²	60.8	1%	0.014	35%	0.345	C	S	.	.	H	α-helix	trans	-60.7	-44.5	177.3	-173.2	0	0	0	0	112.1	L105 L645 L646 C647 L652 H653	L105-C649 HydrophobicContact CD1-CB 4.29Å; L105-C649 HydrophobicContact CD2-CB 3.97Å; L645-C649 WeakPolarHBondContact O-CB 2.94Å; L645-C649 PolarHBondContact O-N 2.9Å; L646-C649 WeakPolarHBondContact O-CB 3.19Å; L646-C649 PolarHBondContact O-N 2.82Å; C647-C649 VanDerWaalsContact C-N 3.35Å; C649-L652 PolarHBondContact O-N 3.41Å; C649-H653 PolarHBondContact O-N 3.23Å; C649-H653 PolarHBondContact O-ND1 3.32Å; C649-H653 VanDerWaalsContact SG-CE1 3.5Å
650	V	94.3	Very high	93.8	Very high	105 Å²	105	61.3 Å²	61.3	64%	0.636	35%	0.348	S	S	*	.	H	α-helix	trans	-64.7	-42.6	176.4	171.9	0	0	0	0	111.2	L646 C647 V648 L652 H653 G654	L646-V650 WeakPolarHBondContact O-CG2 3.46Å; L646-V650 PolarHBondContact O-N 2Å; C647-V650 PolarHBondContact O-N 2.91Å; V648-V650 PolarHBondContact O-N 3.22Å; V650-L652 VanDerWaalsContact C-N 3.33Å; V650-L652 PolarHBondContact O-N 3.13Å; V650-H653 PolarHBondContact O-N 3.44Å; V650-G654 PolarHBondContact O-N 3.04Å
651	F	95.1	Very high	93.7	Very high	133 Å²	133	60.3 Å²	60.3	58%	0.583	34%	0.341	S	S	*	.	H	α-helix	trans	-58.7	-45	175.3	171.9	-97.1	0	0	0	111.7	C647 V648 G654 Y655	C647-F651 WeakPolarHBondContact O-CB 3.49Å; C647-F651 PolarHBondContact O-N 3.31Å; V648-F651 PolarHBondContact O-N 3.03Å; F651-G654 CarbonylContact O-C 3.4Å; F651-G654 PolarHBondContact O-N 3.16Å; F651-Y655 HydrophobicContact CZ-CD2 4.4Å; F651-Y655 WeakPolarHBondContact O-CB 3.45Å; F651-Y655 PolarHBondContact O-N 3.31Å
652	L	93.1	Very high	93.6	Very high	20 Å²	20	60.8 Å²	60.8	11%	0.105	34%	0.344	C	S	.	.	H	α-helix	trans	-65.7	-41	179.2	-71.9	171.3	0	0	0	112.4	W102 L319 V648 C649 V650 G654 Y655 F656	W102-L652 HydrophobicContact CD2-CB 4.49Å; W102-L652 HydrophobicContact CE3-CB 4.26Å; W102-L652 HydrophobicContact CH2-CB 3.7Å; W102-L652 HydrophobicContact CZ2-CB 3.88Å; W102-L652 HydrophobicContact CZ2-CD1 4.07Å; W102-L652 HydrophobicContact CZ2-CD2 4.45Å; W102-L652 HydrophobicContact CZ2-CG 4.37Å; W102-L652 HydrophobicContact CZ3-CB 3.87Å; W102-L652 WeakPolarHBondContact CZ3-O 3.42Å; L319-L652 HydrophobicContact CD2-CD1 3.57Å; V648-L652 HydrophobicContact CG1-CD1 3.96Å; V648-L652 HydrophobicContact CG1-CG 4.4Å; V648-L652 WeakPolarHBondContact O-CG 3.45Å; V648-L652 PolarHBondContact O-N 3.13Å; C649-L652 PolarHBondContact O-N 3.41Å; V650-L652 VanDerWaalsContact C-N 3.33Å; V650-L652 PolarHBondContact O-N 3.13Å; L652-G654 VanDerWaalsContact C-N 3.29Å; L652-G654 PolarHBondContact O-N 3.28Å; L652-Y655 PolarHBondContact O-N 3.11Å; L652-F656 HydrophobicContact CD2-CD2 4.33Å; L652-F656 HydrophobicContact CD2-CE2 4.01Å; L652-F656 WeakPolarHBondContact O-CD2 3.45Å; L652-F656 PolarHBondContact O-N 2.68Å
653	H	91.3	Very high	93.4	Very high	28 Å²	28	64.4 Å²	64.4	13%	0.13	36%	0.364	C	S	.	.	H	α-helix	trans	-62	-36.8	171.9	-77.6	89.3	0	0	0	112.4	W102 L262 F263 C649 V650 G657	W102-H653 WeakPolarHBondContact CB-CE1 3.48Å; W102-H653 AromaticContact CE3-CE1 3.94Å; W102-H653 AromaticContact CE3-ND1 3.87Å; L262-H653 HydrophobicContact CD2-CB 4.48Å; L262-H653 VanDerWaalsContact CD2-CD2 3.44Å; L262-H653 WeakPolarHBondContact CD2-CD2 3.26Å; F263-H653 HydrophobicContact CZ-CB 4.35Å; C649-H653 PolarHBondContact O-N 3.23Å; C649-H653 PolarHBondContact O-ND1 3.32Å; C649-H653 VanDerWaalsContact SG-CE1 3.5Å; V650-H653 PolarHBondContact O-N 3.44Å; H653-G657 VanDerWaalsContact O-CA 3.25Å; H653-G657 WeakPolarHBondContact O-CA 2.91Å; H653-G657 PolarHBondContact O-N 3.03Å
654	G	91.9	Very high	93.3	Very high	57 Å²	57	61.4 Å²	61.4	59%	0.588	35%	0.351	S	S	*	.	H	α-helix	trans	-77.9	-24.3	177.6	0	0	0	0	0	114.5	V650 F651 L652	V650-G654 PolarHBondContact O-N 3.04Å; F651-G654 CarbonylContact O-C 3.4Å; F651-G654 PolarHBondContact O-N 3.16Å; L652-G654 VanDerWaalsContact C-N 3.29Å; L652-G654 PolarHBondContact O-N 3.28Å
655	Y	92.5	Very high	93	Very high	159 Å²	159	60.1 Å²	60.1	62%	0.624	35%	0.347	S	S	*	.	H	α-helix	trans	-82.9	-37.8	178	179.4	-91.2	0	0	0	112.2	F651 L652	F651-Y655 HydrophobicContact CZ-CD2 4.4Å; F651-Y655 WeakPolarHBondContact O-CB 3.45Å; F651-Y655 PolarHBondContact O-N 3.31Å; L652-Y655 PolarHBondContact O-N 3.11Å
656	F	89.7	Confident	92.7	Very high	35 Å²	35	65.1 Å²	65.1	15%	0.154	38%	0.376	C	S	.	.	H	α-helix	trans	-101.2	-11.2	-178.2	-72.2	-74.7	0	0	0	114.3	I95 W102 L262 M322 F327 L652	I95-F656 HydrophobicContact CD1-CB 4.05Å; I95-F656 HydrophobicContact CD1-CD1 3.62Å; I95-F656 HydrophobicContact CD1-CE1 4.48Å; I95-F656 HydrophobicContact CD1-CG 4.22Å; W102-F656 HydrophobicContact CH2-CB 4.23Å; W102-F656 AromaticContact CH2-CD2 3.48Å; W102-F656 HydrophobicContact CH2-CD2 3.48Å; W102-F656 VanDerWaalsContact CH2-CD2 3.48Å; W102-F656 HydrophobicContact CH2-CE2 4.11Å; W102-F656 HydrophobicContact CH2-CG 4.12Å; W102-F656 HydrophobicContact CZ2-CD2 4.42Å; W102-F656 HydrophobicContact CZ3-CB 4.28Å; W102-F656 HydrophobicContact CZ3-CD2 4.24Å; L262-F656 HydrophobicContact CB-CB 4.47Å; L262-F656 VanDerWaalsContact CB-O 3.29Å; L262-F656 WeakPolarHBondContact CB-O 3.43Å; L262-F656 PolarHBondContact N-O 3.32Å; M322-F656 HydrophobicContact CE-CB 4.46Å; M322-F656 HydrophobicContact CE-CD1 3.5Å; M322-F656 HydrophobicContact CE-CD2 3.76Å; M322-F656 HydrophobicContact CE-CE1 3.41Å; M322-F656 VanDerWaalsContact CE-CE1 3.41Å; M322-F656 HydrophobicContact CE-CE2 3.66Å; M322-F656 HydrophobicContact CE-CG 3.65Å; M322-F656 HydrophobicContact CE-CZ 3.48Å; M322-F656 VanDerWaalsContact CE-CZ 3.48Å; M322-F656 HydrophobicContact SD-CD2 4.12Å; M322-F656 HydrophobicContact SD-CE1 4.45Å; M322-F656 HydrophobicContact SD-CE2 3.74Å; M322-F656 HydrophobicContact SD-CZ 3.92Å; F327-F656 HydrophobicContact CZ-CE1 4.28Å; F327-F656 HydrophobicContact CZ-CZ 4.47Å; L652-F656 HydrophobicContact CD2-CD2 4.33Å; L652-F656 HydrophobicContact CD2-CE2 4.01Å; L652-F656 WeakPolarHBondContact O-CD2 3.45Å; L652-F656 PolarHBondContact O-N 2.68Å
657	G	82.7	Confident	92.5	Very high	48 Å²	48	65.5 Å²	65.5	50%	0.495	38%	0.381	S	S	.	.			trans	-88.6	0	174.8	0	0	0	0	0	111.3	F263 H653	F263-G657 VanDerWaalsContact CD2-CA 3.41Å; H653-G657 VanDerWaalsContact O-CA 3.25Å; H653-G657 WeakPolarHBondContact O-CA 2.91Å; H653-G657 PolarHBondContact O-N 3.03Å

Retrieved 657 of 657 residues in 137.6 ms (Link to these results)

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