A0A096LPA6_HUMAN Loading...

RAN binding protein 6

AlphaFold DB , UniProt , Accession A0A096LPA6, Species HUMAN (Homo sapiens, Human), Gene RANBP6, Length 228 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36.4	Very low	38.3	Very low	248 Å²	248	111.4 Å²	111.4	100%	1.222	77%	0.773	S	S	*	*				0	114.5	0	-72.4	-139.8	-85.8	0	0	107.7
2	A	32	Very low	39.8	Very low	97 Å²	97	108.4 Å²	108.4	80%	0.802	75%	0.747	S	S	*	*			trans	-78.8	133.5	-166.9	0	0	0	0	0	111.8	T4	A2-T4 PolarHBondContact O-N 3.13Å
3	A	33.8	Very low	40.8	Very low	105 Å²	105	108.8 Å²	108.8	87%	0.868	74%	0.742	S	S	*	*			trans	-72	110.7	167.4	0	0	0	0	0	108.8	A5	A3-A5 PolarHBondContact O-N 3.33Å
4	T	32.2	Very low	41.6	Very low	135 Å²	135	105.7 Å²	105.7	83%	0.828	72%	0.722	S	S	*	*			trans	-73.9	109	173.5	45.2	0	0	0	0	109.4	A2 S6	A2-T4 PolarHBondContact O-N 3.13Å; T4-S6 PolarHBondContact O-N 3.42Å
5	A	36.5	Very low	42.5	Very low	100 Å²	100	103.9 Å²	103.9	83%	0.826	70%	0.698	S	S	*	*			trans	-60.4	117.2	164.5	0	0	0	0	0	109.3	A3 A7	A3-A5 PolarHBondContact O-N 3.33Å; A5-A7 PolarHBondContact O-N 3.42Å
6	S	33	Very low	43.2	Very low	120 Å²	120	101.6 Å²	101.6	84%	0.839	67%	0.673	S	S	*	*			trans	-72.6	95.9	171.3	64.7	0	0	0	0	108.9	T4 G8	T4-S6 PolarHBondContact O-N 3.42Å; S6-G8 PolarHBondContact O-N 3.19Å
7	A	38.5	Very low	44.1	Very low	91 Å²	91	103.8 Å²	103.8	75%	0.752	67%	0.672	S	S	*	*	P	Polyproline II helix	trans	-56.7	128.7	166.6	0	0	0	0	0	109.2	A5 V9	A5-A7 PolarHBondContact O-N 3.42Å; A7-V9 PolarHBondContact O-N 3.34Å
8	G	38.7	Very low	45.2	Very low	65 Å²	65	104.9 Å²	104.9	67%	0.67	67%	0.666	S	S	*	*	P	Polyproline II helix	trans	-57	126.6	-177	0	0	0	0	0	112	S6	S6-G8 PolarHBondContact O-N 3.19Å
9	V	41.9	Very low	46.1	Very low	133 Å²	133	99.7 Å²	99.7	81%	0.806	63%	0.633	S	S	*	*	P	Polyproline II helix	trans	-65.7	126.9	173.9	-179.2	0	0	0	0	108.5	A7 A11	A7-V9 PolarHBondContact O-N 3.34Å; V9-A11 PolarHBondContact O-N 2.9Å
10	P	45.6	Very low	46.8	Very low	111 Å²	111	97.2 Å²	97.2	72%	0.721	61%	0.611	S	S	*	*	P	Polyproline II helix	trans	-64	129	174.9	-16.2	28.5	0	0	0	110.3	T12	P10-T12 PolarHBondContact O-N 3.48Å
11	A	52.4	Low	47.7	Very low	20 Å²	20	97 Å²	97	17%	0.165	60%	0.603	C	S	.	*	P	Polyproline II helix	trans	-59.4	137.1	175.1	0	0	0	0	0	111.7	V9 K16 T51 F52	V9-A11 PolarHBondContact O-N 2.9Å; A11-K16 WeakPolarHBondContact O-CE 3.36Å; A11-T51 HydrophobicContact CB-CG2 4.29Å; A11-F52 HydrophobicContact CB-CD1 4.36Å; A11-F52 HydrophobicContact CB-CE1 3.43Å; A11-F52 VanDerWaalsContact CB-CE1 3.43Å; A11-F52 HydrophobicContact CB-CZ 3.5Å; A11-F52 VanDerWaalsContact CB-CZ 3.5Å
12	T	56	Low	49.2	Very low	76 Å²	76	85.7 Å²	85.7	47%	0.466	55%	0.547	S	S	.	.	P	Polyproline II helix	trans	-70.6	158.4	179.9	66.5	0	0	0	0	111.4	P10 S14 E15 K16	P10-T12 PolarHBondContact O-N 3.48Å; T12-S14 PolarHBondContact O-N 2.79Å; T12-E15 WeakPolarHBondContact CB-OE2 3.45Å; T12-E15 PolarHBondContact N-OE2 3.33Å; T12-E15 PolarHBondContact O-N 2.97Å; T12-E15 VanDerWaalsContact OG1-CD 3.23Å; T12-E15 VanDerWaalsContact OG1-CG 3.26Å; T12-E15 WeakPolarHBondContact OG1-CG 3.34Å; T12-E15 PolarHBondContact OG1-OE2 3.05Å; T12-K16 WeakPolarHBondContact O-CG 3.36Å; T12-K16 PolarHBondContact O-N 3.36Å
13	V	53.1	Low	50.6	Low	113 Å²	113	82.8 Å²	82.8	69%	0.685	52%	0.518	S	S	*	.	H	α-helix	trans	-59.2	-32.9	179.4	177	0	0	0	0	112.1	Q17	V13-Q17 PolarHBondContact O-N 3.09Å
14	S	52.1	Low	51.8	Low	66 Å²	66	83.6 Å²	83.6	46%	0.462	50%	0.502	S	S	.	.	H	α-helix	trans	-66.9	-48.5	178.9	-162.5	0	0	0	0	112	T12 K16 Q17 E18	T12-S14 PolarHBondContact O-N 2.79Å; S14-K16 PolarHBondContact O-N 3.38Å; S14-Q17 PolarHBondContact O-N 3.03Å; S14-Q17 VanDerWaalsContact O-N 3.08Å; S14-E18 PolarHBondContact O-N 2.97Å
15	E	56	Low	53.4	Low	78 Å²	78	79.4 Å²	79.4	36%	0.364	47%	0.474	S	S	.	.	H	α-helix	trans	-64.8	-31	-178.9	-61.1	161.4	133.6	0	0	111.5	T12 F19 F52	T12-E15 WeakPolarHBondContact CB-OE2 3.45Å; T12-E15 PolarHBondContact N-OE2 3.33Å; T12-E15 PolarHBondContact O-N 2.97Å; T12-E15 VanDerWaalsContact OG1-CD 3.23Å; T12-E15 VanDerWaalsContact OG1-CG 3.26Å; T12-E15 WeakPolarHBondContact OG1-CG 3.34Å; T12-E15 PolarHBondContact OG1-OE2 3.05Å; E15-F19 WeakPolarHBondContact O-CB 3.32Å; E15-F19 PolarHBondContact O-N 3.02Å; E15-F52 VanDerWaalsContact C-CE1 3.47Å; E15-F52 HydrophobicContact CB-CE1 3.67Å; E15-F52 HydrophobicContact CB-CE2 4.3Å; E15-F52 HydrophobicContact CB-CZ 3.3Å; E15-F52 HydrophobicContact CG-CZ 4.33Å
16	K	53.3	Low	54.5	Low	67 Å²	67	76.2 Å²	76.2	29%	0.291	44%	0.443	S	S	.	.	H	α-helix	trans	-64.9	-45.9	172.7	-66.6	-177.3	-169.9	-161	0	111.6	A11 T12 S14 E18 F19 Y20 F52 D55	A11-K16 WeakPolarHBondContact O-CE 3.36Å; T12-K16 WeakPolarHBondContact O-CG 3.36Å; T12-K16 PolarHBondContact O-N 3.36Å; S14-K16 PolarHBondContact O-N 3.38Å; K16-E18 VanDerWaalsContact C-N 3.34Å; K16-F19 PolarHBondContact O-N 3.35Å; K16-Y20 HydrophobicContact CB-CE2 4.42Å; K16-Y20 WeakPolarHBondContact O-CD2 3.35Å; K16-Y20 PolarHBondContact O-N 2.87Å; K16-F52 HydrophobicContact CB-CE1 4.44Å; K16-F52 HydrophobicContact CG-CD1 4.07Å; K16-F52 HydrophobicContact CG-CE1 3.81Å; K16-D55 WeakPolarHBondContact CD-OD2 3.29Å; K16-D55 WeakPolarHBondContact CE-OD2 3.49Å; K16-D55 IonicContact NZ-OD2 2.67Å; K16-D55 PolarHBondContact NZ-OD2 3.44Å
17	Q	58.2	Low	55.4	Low	139 Å²	139	72 Å²	72	65%	0.65	41%	0.411	S	S	*	.	H	α-helix	trans	-63	-40.8	178.8	-106.1	170.3	-28.1	0	0	112	V13 S14 Y20 Q21	V13-Q17 PolarHBondContact O-N 3.09Å; S14-Q17 PolarHBondContact O-N 3.03Å; S14-Q17 VanDerWaalsContact O-N 3.08Å; Q17-Y20 PolarHBondContact O-N 2.89Å; Q17-Q21 WeakPolarHBondContact O-CB 3.47Å; Q17-Q21 PolarHBondContact O-N 3.36Å
18	E	64	Low	56.3	Low	124 Å²	124	70 Å²	70	58%	0.579	39%	0.388	S	S	*	.	H	α-helix	trans	-63.6	-41.7	175.6	-72.7	170.6	-166.4	0	0	111.9	S14 K16 Q21 L22	S14-E18 PolarHBondContact O-N 2.97Å; K16-E18 VanDerWaalsContact C-N 3.34Å; E18-Q21 PolarHBondContact O-N 3.35Å; E18-L22 WeakPolarHBondContact O-CB 3.44Å; E18-L22 PolarHBondContact O-N 3.18Å
19	F	62.3	Low	56.7	Low	7 Å²	7	72.2 Å²	72.2	3%	0.031	39%	0.39	C	S	.	.	H	α-helix	trans	-65.8	-42	176	-173.3	-100	0	0	0	112.9	E15 K16 Q21 L22 L23 Y41 I44 F52 L53 A56	E15-F19 WeakPolarHBondContact O-CB 3.32Å; E15-F19 PolarHBondContact O-N 3.02Å; K16-F19 PolarHBondContact O-N 3.35Å; F19-Q21 VanDerWaalsContact C-N 3.27Å; F19-Q21 PolarHBondContact O-N 2.94Å; F19-L22 HydrophobicContact CD2-CD2 4.3Å; F19-L22 HydrophobicContact CE2-CD2 4.47Å; F19-L22 VanDerWaalsContact O-CB 3.29Å; F19-L22 WeakPolarHBondContact O-CB 3.44Å; F19-L22 PolarHBondContact O-N 3.48Å; F19-L22 VanDerWaalsContact O-N 3.16Å; F19-L23 HydrophobicContact CD1-CD1 4.06Å; F19-L23 HydrophobicContact CD1-CG 4.17Å; F19-L23 HydrophobicContact CE1-CD1 3.62Å; F19-L23 HydrophobicContact CE1-CD2 4.05Å; F19-L23 HydrophobicContact CE1-CG 3.79Å; F19-L23 HydrophobicContact CZ-CD1 4.37Å; F19-L23 HydrophobicContact CZ-CD2 3.96Å; F19-L23 HydrophobicContact CZ-CG 4.16Å; F19-L23 WeakPolarHBondContact O-CG 3.47Å; F19-L23 PolarHBondContact O-N 3.41Å; F19-Y41 HydrophobicContact CE2-CD2 4.38Å; F19-Y41 HydrophobicContact CE2-CE2 4.27Å; F19-Y41 HydrophobicContact CZ-CE2 4.39Å; F19-I44 HydrophobicContact CD2-CD1 4.01Å; F19-I44 HydrophobicContact CE2-CD1 4.14Å; F19-F52 HydrophobicContact CB-CB 4.05Å; F19-F52 HydrophobicContact CB-CD1 4.03Å; F19-F52 HydrophobicContact CB-CG 3.98Å; F19-F52 HydrophobicContact CD1-CB 3.5Å; F19-F52 VanDerWaalsContact CD1-CB 3.5Å; F19-F52 HydrophobicContact CD1-CG 4.34Å; F19-F52 HydrophobicContact CD2-CB 3.71Å; F19-F52 HydrophobicContact CD2-CD2 4.4Å; F19-F52 HydrophobicContact CD2-CG 4.16Å; F19-F52 HydrophobicContact CE1-CB 3.76Å; F19-F52 HydrophobicContact CE2-CB 4Å; F19-F52 HydrophobicContact CG-CB 3.45Å; F19-F52 VanDerWaalsContact CG-CB 3.45Å; F19-F52 HydrophobicContact CG-CD1 4.36Å; F19-F52 AromaticContact CG-CG 3.9Å; F19-F52 HydrophobicContact CG-CG 3.9Å; F19-F52 HydrophobicContact CZ-CB 4.04Å; F19-L53 HydrophobicContact CE1-CD2 4Å; F19-L53 HydrophobicContact CE1-CG 4.17Å; F19-L53 HydrophobicContact CE2-CG 4.47Å; F19-L53 HydrophobicContact CZ-CD1 4.47Å; F19-L53 HydrophobicContact CZ-CD2 3.51Å; F19-L53 HydrophobicContact CZ-CG 3.58Å; F19-A56 HydrophobicContact CE1-CB 4.42Å
20	Y	60.9	Low	57.9	Low	49 Å²	49	68 Å²	68	19%	0.192	37%	0.366	C	S	.	.	H	α-helix	trans	-64.9	-35	174.3	-74.2	-62.5	0	0	0	112.1	K16 Q17 L22 L23 K24 D55 A56 N59 A62	K16-Y20 HydrophobicContact CB-CE2 4.42Å; K16-Y20 WeakPolarHBondContact O-CD2 3.35Å; K16-Y20 PolarHBondContact O-N 2.87Å; Q17-Y20 PolarHBondContact O-N 2.89Å; Y20-L22 VanDerWaalsContact C-N 3.32Å; Y20-L23 HydrophobicContact CD1-CD1 4.33Å; Y20-L23 PolarHBondContact O-N 3.27Å; Y20-K24 WeakPolarHBondContact O-CG 3.35Å; Y20-K24 PolarHBondContact O-N 3.17Å; Y20-D55 PolarHBondContact OH-O 3.48Å; Y20-A56 HydrophobicContact CE1-CB 4.05Å; Y20-N59 WeakPolarHBondContact OH-CB 3.34Å; Y20-N59 PolarHBondContact OH-ND2 2.98Å; Y20-A62 HydrophobicContact CD1-CB 4.17Å; Y20-A62 HydrophobicContact CE1-CB 3.74Å
21	Q	65.6	Low	58.3	Low	93 Å²	93	66.5 Å²	66.5	44%	0.435	36%	0.358	S	S	.	.	H	α-helix	trans	-67.2	-37	173.6	-169.2	56.5	45.7	0	0	111.3	Q17 E18 F19 K24 N25	Q17-Q21 WeakPolarHBondContact O-CB 3.47Å; Q17-Q21 PolarHBondContact O-N 3.36Å; E18-Q21 PolarHBondContact O-N 3.35Å; F19-Q21 VanDerWaalsContact C-N 3.27Å; F19-Q21 PolarHBondContact O-N 2.94Å; Q21-K24 PolarHBondContact O-N 3.39Å; Q21-N25 PolarHBondContact NE2-OD1 3.29Å; Q21-N25 VanDerWaalsContact NE2-OD1 3.08Å; Q21-N25 WeakPolarHBondContact O-CB 3.15Å; Q21-N25 PolarHBondContact O-N 2.68Å; Q21-N25 PolarHBondContact O-ND2 3.34Å; Q21-N25 PolarHBondContact O-OD1 3.22Å
22	L	66.3	Low	58.9	Low	10 Å²	10	72.3 Å²	72.3	5%	0.052	38%	0.383	C	S	.	.	H	α-helix	trans	-61	-47.4	172.9	-176.7	65.8	0	0	0	111.8	E18 F19 Y20 K24 N25 L26 A37 I40 Y41 I44	E18-L22 WeakPolarHBondContact O-CB 3.44Å; E18-L22 PolarHBondContact O-N 3.18Å; F19-L22 HydrophobicContact CD2-CD2 4.3Å; F19-L22 HydrophobicContact CE2-CD2 4.47Å; F19-L22 VanDerWaalsContact O-CB 3.29Å; F19-L22 WeakPolarHBondContact O-CB 3.44Å; F19-L22 PolarHBondContact O-N 3.48Å; F19-L22 VanDerWaalsContact O-N 3.16Å; Y20-L22 VanDerWaalsContact C-N 3.32Å; L22-K24 VanDerWaalsContact C-N 3.3Å; L22-K24 PolarHBondContact O-N 2.98Å; L22-N25 PolarHBondContact O-N 2.77Å; L22-L26 WeakPolarHBondContact O-CG 3.38Å; L22-L26 PolarHBondContact O-N 3.06Å; L22-A37 HydrophobicContact CD1-CB 3.87Å; L22-A37 WeakPolarHBondContact CD1-O 3.27Å; L22-I40 HydrophobicContact CD1-CB 3.68Å; L22-I40 HydrophobicContact CD1-CD1 4.46Å; L22-I40 HydrophobicContact CD1-CG2 3.55Å; L22-I40 HydrophobicContact CD2-CG2 3.97Å; L22-I40 HydrophobicContact CG-CG2 4.4Å; L22-Y41 HydrophobicContact CD2-CD2 4.26Å; L22-I44 HydrophobicContact CD2-CD1 3.47Å; L22-I44 VanDerWaalsContact CD2-CD1 3.47Å
23	L	61.5	Low	59.4	Low	37 Å²	37	71 Å²	71	19%	0.194	38%	0.375	C	S	.	.	H	α-helix	trans	-58.6	-40.9	175	-68	-177.8	0	0	0	112.3	F19 Y20 N25 L26 A56	F19-L23 HydrophobicContact CD1-CD1 4.06Å; F19-L23 HydrophobicContact CD1-CG 4.17Å; F19-L23 HydrophobicContact CE1-CD1 3.62Å; F19-L23 HydrophobicContact CE1-CD2 4.05Å; F19-L23 HydrophobicContact CE1-CG 3.79Å; F19-L23 HydrophobicContact CZ-CD1 4.37Å; F19-L23 HydrophobicContact CZ-CD2 3.96Å; F19-L23 HydrophobicContact CZ-CG 4.16Å; F19-L23 WeakPolarHBondContact O-CG 3.47Å; F19-L23 PolarHBondContact O-N 3.41Å; Y20-L23 HydrophobicContact CD1-CD1 4.33Å; Y20-L23 PolarHBondContact O-N 3.27Å; L23-N25 VanDerWaalsContact C-N 3.31Å; L23-N25 PolarHBondContact O-N 3.42Å; L23-L26 HydrophobicContact CD2-CD1 4.15Å; L23-L26 PolarHBondContact O-N 3.42Å; L23-A56 HydrophobicContact CD1-CB 4.03Å
24	K	60.3	Low	59.7	Low	122 Å²	122	69.2 Å²	69.2	53%	0.53	36%	0.356	S	S	.	.	H	α-helix	trans	-65.2	-33.9	174.1	-73.4	175.4	-178.7	177.4	0	112.7	Y20 Q21 L22 I27 N28	Y20-K24 WeakPolarHBondContact O-CG 3.35Å; Y20-K24 PolarHBondContact O-N 3.17Å; Q21-K24 PolarHBondContact O-N 3.39Å; L22-K24 VanDerWaalsContact C-N 3.3Å; L22-K24 PolarHBondContact O-N 2.98Å; K24-I27 WeakPolarHBondContact O-CG1 3.48Å; K24-N28 PolarHBondContact O-N 3.2Å
25	N	65.8	Low	59.8	Low	47 Å²	47	74 Å²	74	25%	0.251	36%	0.364	S	S	.	.	H	α-helix	trans	-75	-33.7	178.9	-67.5	-13.1	0	0	0	111.9	Q21 L22 L23 I27 N28 V33 A37	Q21-N25 PolarHBondContact NE2-OD1 3.29Å; Q21-N25 VanDerWaalsContact NE2-OD1 3.08Å; Q21-N25 WeakPolarHBondContact O-CB 3.15Å; Q21-N25 PolarHBondContact O-N 2.68Å; Q21-N25 PolarHBondContact O-ND2 3.34Å; Q21-N25 PolarHBondContact O-OD1 3.22Å; L22-N25 PolarHBondContact O-N 2.77Å; L23-N25 VanDerWaalsContact C-N 3.31Å; L23-N25 PolarHBondContact O-N 3.42Å; N25-I27 PolarHBondContact O-N 3.16Å; N25-I27 VanDerWaalsContact O-N 3.15Å; N25-N28 VanDerWaalsContact O-CB 3.23Å; N25-N28 WeakPolarHBondContact O-CB 3.35Å; N25-N28 PolarHBondContact O-N 3Å; N25-N28 VanDerWaalsContact O-N 3.12Å; N25-V33 HydrophobicContact CB-CG1 3.86Å; N25-A37 HydrophobicContact CB-CB 3.62Å
26	L	58.3	Low	60.3	Low	32 Å²	32	75.4 Å²	75.4	17%	0.168	37%	0.37	C	S	.	.	H	α-helix	trans	-58.7	-25.5	174.3	-76.1	172	0	0	0	113.3	L22 L23 R34 A37 E38 Y41	L22-L26 WeakPolarHBondContact O-CG 3.38Å; L22-L26 PolarHBondContact O-N 3.06Å; L23-L26 HydrophobicContact CD2-CD1 4.15Å; L23-L26 PolarHBondContact O-N 3.42Å; L26-R34 VanDerWaalsContact O-CD 3.25Å; L26-R34 WeakPolarHBondContact O-CD 3.47Å; L26-R34 VanDerWaalsContact O-CG 3.3Å; L26-R34 WeakPolarHBondContact O-CG 3.34Å; L26-A37 HydrophobicContact CB-CB 4.41Å; L26-A37 VanDerWaalsContact CD2-C 3.46Å; L26-A37 HydrophobicContact CD2-CB 3.74Å; L26-A37 HydrophobicContact CG-CB 3.83Å; L26-E38 HydrophobicContact CD2-CB 4.29Å; L26-E38 HydrophobicContact CD2-CG 3.64Å; L26-Y41 HydrophobicContact CD1-CD2 4.26Å; L26-Y41 HydrophobicContact CD1-CG 4.46Å
27	I	53.2	Low	60.8	Low	32 Å²	32	72.3 Å²	72.3	16%	0.164	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.3	9.1	-178.7	60.2	175.3	0	0	0	113.5	K24 N25 V71 A74	K24-I27 WeakPolarHBondContact O-CG1 3.48Å; N25-I27 PolarHBondContact O-N 3.16Å; N25-I27 VanDerWaalsContact O-N 3.15Å; I27-V71 HydrophobicContact CD1-CB 3.72Å; I27-V71 HydrophobicContact CD1-CG1 3.93Å; I27-V71 HydrophobicContact CD1-CG2 3.08Å; I27-A74 HydrophobicContact CG2-CB 3.31Å
28	N	56.9	Low	60.8	Low	50 Å²	50	70.4 Å²	70.4	27%	0.267	35%	0.349	S	S	.	.			trans	-61.7	144.5	-177.1	-164.8	-71	0	0	0	111.3	K24 N25 S30 V33 R34	K24-N28 PolarHBondContact O-N 3.2Å; N25-N28 VanDerWaalsContact O-CB 3.23Å; N25-N28 WeakPolarHBondContact O-CB 3.35Å; N25-N28 PolarHBondContact O-N 3Å; N25-N28 VanDerWaalsContact O-N 3.12Å; N28-S30 PolarHBondContact O-N 2.92Å; N28-S30 WeakPolarHBondContact OD1-CB 3.34Å; N28-S30 PolarHBondContact OD1-N 3.5Å; N28-V33 HydrophobicContact CB-CB 3.86Å; N28-V33 HydrophobicContact CB-CG1 3.57Å; N28-R34 HydrophobicContact CB-CG 4.4Å; N28-R34 VanDerWaalsContact O-CD 3.31Å; N28-R34 WeakPolarHBondContact O-CD 3.44Å; N28-R34 VanDerWaalsContact O-CG 3.23Å; N28-R34 WeakPolarHBondContact O-CG 3.37Å; N28-R34 PolarHBondContact O-NH1 3.33Å
29	P	47.3	Very low	60.8	Low	110 Å²	110	69 Å²	69	71%	0.714	34%	0.342	S	S	*	.	S	Bend	trans	-57.9	-30.9	174.2	-25.9	34.7	0	0	0	113.5
30	S	66.8	Low	61	Low	44 Å²	44	72.4 Å²	72.4	31%	0.308	36%	0.36	S	S	.	.	S	Bend	trans	-74.7	123.1	177.8	177.6	0	0	0	0	111.8	N28 M32 V33 R34	N28-S30 PolarHBondContact O-N 2.92Å; N28-S30 WeakPolarHBondContact OD1-CB 3.34Å; N28-S30 PolarHBondContact OD1-N 3.5Å; S30-M32 PolarHBondContact O-N 2.9Å; S30-M32 PolarHBondContact OG-N 3Å; S30-V33 PolarHBondContact O-N 3.21Å; S30-R34 PolarHBondContact O-N 3.09Å; S30-R34 VanDerWaalsContact O-N 3.14Å
31	C	54.6	Low	61	Low	81 Å²	81	70.9 Å²	70.9	55%	0.547	35%	0.354	S	S	.	.	H	α-helix	trans	-60.4	-34.7	175.5	55.2	0	0	0	0	112.6	R34 R35	C31-R34 PolarHBondContact O-N 3.02Å; C31-R35 WeakPolarHBondContact O-CB 3.32Å; C31-R35 PolarHBondContact O-N 2.92Å
32	M	65.6	Low	60.7	Low	142 Å²	142	72.4 Å²	72.4	70%	0.7	36%	0.361	S	S	*	.	H	α-helix	trans	-64.9	-44.3	177.6	-66.1	-63.7	-65.2	0	0	111.5	S30 R34 R35 Q36	S30-M32 PolarHBondContact O-N 2.9Å; S30-M32 PolarHBondContact OG-N 3Å; M32-R34 VanDerWaalsContact C-N 3.35Å; M32-R35 PolarHBondContact O-N 3.48Å; M32-Q36 WeakPolarHBondContact O-CB 3.46Å; M32-Q36 PolarHBondContact O-N 3.43Å; M32-Q36 VanDerWaalsContact O-N 3.1Å
33	V	64.9	Low	60.6	Low	48 Å²	48	78.2 Å²	78.2	29%	0.291	39%	0.392	S	S	.	.	H	α-helix	trans	-68	-37	-179.8	178	0	0	0	0	111.2	N25 N28 S30 A37	N25-V33 HydrophobicContact CB-CG1 3.86Å; N28-V33 HydrophobicContact CB-CB 3.86Å; N28-V33 HydrophobicContact CB-CG1 3.57Å; S30-V33 PolarHBondContact O-N 3.21Å; V33-A37 WeakPolarHBondContact O-CB 3.33Å; V33-A37 PolarHBondContact O-N 2.91Å; V33-A37 VanDerWaalsContact O-N 3.08Å
34	R	59	Low	60.7	Low	75 Å²	75	78 Å²	78	28%	0.283	39%	0.391	S	S	.	.	H	α-helix	trans	-65	-48.7	175.1	-67.5	-164.9	-54.3	-119.6	3.6	112.4	L26 N28 S30 C31 M32 Q36 A37 E38	L26-R34 VanDerWaalsContact O-CD 3.25Å; L26-R34 WeakPolarHBondContact O-CD 3.47Å; L26-R34 VanDerWaalsContact O-CG 3.3Å; L26-R34 WeakPolarHBondContact O-CG 3.34Å; N28-R34 HydrophobicContact CB-CG 4.4Å; N28-R34 VanDerWaalsContact O-CD 3.31Å; N28-R34 WeakPolarHBondContact O-CD 3.44Å; N28-R34 VanDerWaalsContact O-CG 3.23Å; N28-R34 WeakPolarHBondContact O-CG 3.37Å; N28-R34 PolarHBondContact O-NH1 3.33Å; S30-R34 PolarHBondContact O-N 3.09Å; S30-R34 VanDerWaalsContact O-N 3.14Å; C31-R34 PolarHBondContact O-N 3.02Å; M32-R34 VanDerWaalsContact C-N 3.35Å; R34-Q36 VanDerWaalsContact C-N 3.29Å; R34-Q36 PolarHBondContact O-N 3.47Å; R34-A37 CarbonylContact O-C 3.54Å; R34-A37 WeakPolarHBondContact O-CA 3.3Å; R34-A37 WeakPolarHBondContact O-CB 3.33Å; R34-A37 PolarHBondContact O-N 2.98Å; R34-E38 WeakPolarHBondContact O-CG 3.4Å; R34-E38 PolarHBondContact O-N 3.31Å
35	R	54.8	Low	60.7	Low	166 Å²	166	76.4 Å²	76.4	63%	0.626	39%	0.393	S	S	*	.	H	α-helix	trans	-60.3	-41.4	-179.1	-169.3	176.8	-174.4	159.2	5.6	111.7	C31 M32 A37 E38 E39	C31-R35 WeakPolarHBondContact O-CB 3.32Å; C31-R35 PolarHBondContact O-N 2.92Å; M32-R35 PolarHBondContact O-N 3.48Å; R35-A37 VanDerWaalsContact C-N 3.31Å; R35-A37 PolarHBondContact O-N 2.96Å; R35-E38 PolarHBondContact O-N 3.32Å; R35-E39 PolarHBondContact O-N 3.38Å
36	Q	66.6	Low	60.1	Low	108 Å²	108	75.9 Å²	75.9	51%	0.505	40%	0.398	S	S	.	.	H	α-helix	trans	-61.9	-40.4	174.2	-167.8	65.8	48.7	0	0	111.9	M32 R34 I40	M32-Q36 WeakPolarHBondContact O-CB 3.46Å; M32-Q36 PolarHBondContact O-N 3.43Å; M32-Q36 VanDerWaalsContact O-N 3.1Å; R34-Q36 VanDerWaalsContact C-N 3.29Å; R34-Q36 PolarHBondContact O-N 3.47Å; Q36-I40 HydrophobicContact CG-CD1 4.04Å; Q36-I40 WeakPolarHBondContact O-CB 3.27Å; Q36-I40 WeakPolarHBondContact O-CD1 3.31Å; Q36-I40 WeakPolarHBondContact O-CG1 3.47Å; Q36-I40 PolarHBondContact O-N 3.11Å
37	A	64.4	Low	59.8	Low	2 Å²	2	81.1 Å²	81.1	2%	0.017	43%	0.426	C	S	.	.	H	α-helix	trans	-70.3	-34.6	177.7	0	0	0	0	0	112.5	L22 N25 L26 V33 R34 R35 I40 Y41	L22-A37 HydrophobicContact CD1-CB 3.87Å; L22-A37 WeakPolarHBondContact CD1-O 3.27Å; N25-A37 HydrophobicContact CB-CB 3.62Å; L26-A37 HydrophobicContact CB-CB 4.41Å; L26-A37 VanDerWaalsContact CD2-C 3.46Å; L26-A37 HydrophobicContact CD2-CB 3.74Å; L26-A37 HydrophobicContact CG-CB 3.83Å; V33-A37 WeakPolarHBondContact O-CB 3.33Å; V33-A37 PolarHBondContact O-N 2.91Å; V33-A37 VanDerWaalsContact O-N 3.08Å; R34-A37 CarbonylContact O-C 3.54Å; R34-A37 WeakPolarHBondContact O-CA 3.3Å; R34-A37 WeakPolarHBondContact O-CB 3.33Å; R34-A37 PolarHBondContact O-N 2.98Å; R35-A37 VanDerWaalsContact C-N 3.31Å; R35-A37 PolarHBondContact O-N 2.96Å; A37-I40 PolarHBondContact O-N 2.92Å; A37-Y41 WeakPolarHBondContact O-CB 3.07Å; A37-Y41 PolarHBondContact O-N 3.42Å
38	E	56.9	Low	59.9	Low	100 Å²	100	82 Å²	82	47%	0.467	43%	0.434	S	S	.	.	H	α-helix	trans	-63.3	-48.6	173	-72.2	165	-173.5	0	0	110.3	L26 R34 R35 I40 Y41 E42	L26-E38 HydrophobicContact CD2-CB 4.29Å; L26-E38 HydrophobicContact CD2-CG 3.64Å; R34-E38 WeakPolarHBondContact O-CG 3.4Å; R34-E38 PolarHBondContact O-N 3.31Å; R35-E38 PolarHBondContact O-N 3.32Å; E38-I40 PolarHBondContact O-N 3.2Å; E38-Y41 PolarHBondContact O-N 2.97Å; E38-E42 WeakPolarHBondContact O-CG 3.49Å; E38-E42 PolarHBondContact O-N 3.44Å
39	E	65.3	Low	59.8	Low	94 Å²	94	80.8 Å²	80.8	44%	0.439	43%	0.426	S	S	.	.	H	α-helix	trans	-61.2	-41.7	176.6	-74.2	174.1	-170.2	0	0	112.5	R35 N43	R35-E39 PolarHBondContact O-N 3.38Å; E39-N43 PolarHBondContact O-N 2.91Å; E39-N43 PolarHBondContact O-ND2 3.34Å
40	I	65.9	Low	59.9	Low	78 Å²	78	77 Å²	77	40%	0.4	40%	0.401	S	S	.	.	H	α-helix	trans	-65.5	-43.5	176	-67.8	163.5	0	0	0	110.1	L22 Q36 A37 E38 N43 I44	L22-I40 HydrophobicContact CD1-CB 3.68Å; L22-I40 HydrophobicContact CD1-CD1 4.46Å; L22-I40 HydrophobicContact CD1-CG2 3.55Å; L22-I40 HydrophobicContact CD2-CG2 3.97Å; L22-I40 HydrophobicContact CG-CG2 4.4Å; Q36-I40 HydrophobicContact CG-CD1 4.04Å; Q36-I40 WeakPolarHBondContact O-CB 3.27Å; Q36-I40 WeakPolarHBondContact O-CD1 3.31Å; Q36-I40 WeakPolarHBondContact O-CG1 3.47Å; Q36-I40 PolarHBondContact O-N 3.11Å; A37-I40 PolarHBondContact O-N 2.92Å; E38-I40 PolarHBondContact O-N 3.2Å; I40-N43 PolarHBondContact O-N 2.91Å; I40-I44 WeakPolarHBondContact O-CG1 3.43Å; I40-I44 PolarHBondContact O-N 2.99Å
41	Y	61.4	Low	59.3	Low	17 Å²	17	77.6 Å²	77.6	7%	0.067	40%	0.403	C	S	.	.	H	α-helix	trans	-60.3	-46.8	178.2	-178.3	-93.9	0	0	0	111.5	F19 L22 L26 A37 E38 N43 I44 K49 L53	F19-Y41 HydrophobicContact CE2-CD2 4.38Å; F19-Y41 HydrophobicContact CE2-CE2 4.27Å; F19-Y41 HydrophobicContact CZ-CE2 4.39Å; L22-Y41 HydrophobicContact CD2-CD2 4.26Å; L26-Y41 HydrophobicContact CD1-CD2 4.26Å; L26-Y41 HydrophobicContact CD1-CG 4.46Å; A37-Y41 WeakPolarHBondContact O-CB 3.07Å; A37-Y41 PolarHBondContact O-N 3.42Å; E38-Y41 PolarHBondContact O-N 2.97Å; Y41-N43 PolarHBondContact O-N 3.3Å; Y41-I44 PolarHBondContact O-N 3.43Å; Y41-K49 WeakPolarHBondContact O-CE 3.4Å; Y41-K49 PolarHBondContact O-NZ 3.07Å; Y41-K49 VanDerWaalsContact O-NZ 3.16Å; Y41-L53 HydrophobicContact CE2-CD1 4.32Å; Y41-L53 WeakPolarHBondContact OH-CD1 3.44Å
42	E	58.6	Low	59.4	Low	125 Å²	125	74.5 Å²	74.5	58%	0.584	38%	0.38	S	S	*	.	H	α-helix	trans	-57.5	-37.7	179.2	-74.8	-51.9	138.1	0	0	112.5	E38 I44 K49	E38-E42 WeakPolarHBondContact O-CG 3.49Å; E38-E42 PolarHBondContact O-N 3.44Å; E42-I44 PolarHBondContact O-N 2.88Å; E42-K49 PolarHBondContact O-NZ 3.25Å
43	N	64.1	Low	58.9	Low	133 Å²	133	68 Å²	68	71%	0.711	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.1	-2.7	-177.2	-70.2	-53.6	0	0	0	115.1	E39 I40 Y41	E39-N43 PolarHBondContact O-N 2.91Å; E39-N43 PolarHBondContact O-ND2 3.34Å; I40-N43 PolarHBondContact O-N 2.91Å; Y41-N43 PolarHBondContact O-N 3.3Å
44	I	64.1	Low	58.4	Low	33 Å²	33	66.8 Å²	66.8	17%	0.169	34%	0.34	C	S	.	.	S	Bend	trans	-71	130.9	175.7	-59.3	176.5	0	0	0	110	F19 L22 I40 Y41 E42 G46 C48 K49	F19-I44 HydrophobicContact CD2-CD1 4.01Å; F19-I44 HydrophobicContact CE2-CD1 4.14Å; L22-I44 HydrophobicContact CD2-CD1 3.47Å; L22-I44 VanDerWaalsContact CD2-CD1 3.47Å; I40-I44 WeakPolarHBondContact O-CG1 3.43Å; I40-I44 PolarHBondContact O-N 2.99Å; Y41-I44 PolarHBondContact O-N 3.43Å; E42-I44 PolarHBondContact O-N 2.88Å; I44-G46 PolarHBondContact O-N 3.29Å; I44-C48 HydrophobicContact CG2-CB 3.85Å; I44-K49 HydrophobicContact CB-CD 4.32Å; I44-K49 HydrophobicContact CB-CG 3.66Å; I44-K49 HydrophobicContact CG2-CB 4.48Å; I44-K49 HydrophobicContact CG2-CG 3.59Å; I44-K49 WeakPolarHBondContact O-CD 3.19Å; I44-K49 WeakPolarHBondContact O-CE 3.23Å; I44-K49 PolarHBondContact O-NZ 3.39Å
45	P	60	Low	58.2	Low	88 Å²	88	65 Å²	65	57%	0.571	34%	0.336	S	S	*	.			trans	-55.8	137.2	174	-25.5	34.2	0	0	0	112.5	L47 C48 K49	P45-L47 VanDerWaalsContact C-N 3.29Å; P45-L47 PolarHBondContact O-N 3.27Å; P45-L47 VanDerWaalsContact O-N 3.15Å; P45-C48 WeakPolarHBondContact O-CB 3.31Å; P45-C48 PolarHBondContact O-N 2.85Å; P45-K49 PolarHBondContact O-N 3.2Å
46	G	53	Low	58.1	Low	35 Å²	35	57.6 Å²	57.6	36%	0.361	31%	0.311	S	S	.	.	H	α-helix	trans	-54.5	-37.7	-173	0	0	0	0	0	114.8	I44 C48 K49 T50	I44-G46 PolarHBondContact O-N 3.29Å; G46-C48 VanDerWaalsContact C-N 3.33Å; G46-C48 PolarHBondContact O-N 2.7Å; G46-K49 PolarHBondContact O-N 3.34Å; G46-T50 PolarHBondContact O-N 3.06Å; G46-T50 PolarHBondContact O-OG1 3.31Å
47	L	52	Low	57.3	Low	143 Å²	143	53.2 Å²	53.2	75%	0.749	29%	0.291	S	S	*	.	H	α-helix	trans	-64.5	-36.4	177.9	-142.7	88.3	0	0	0	112.5	P45 T51	P45-L47 VanDerWaalsContact C-N 3.29Å; P45-L47 PolarHBondContact O-N 3.27Å; P45-L47 VanDerWaalsContact O-N 3.15Å; L47-T51 PolarHBondContact O-N 3.49Å; L47-T51 PolarHBondContact O-OG1 2.96Å; L47-T51 VanDerWaalsContact O-OG1 3.09Å
48	C	54.8	Low	56.7	Low	50 Å²	50	62.1 Å²	62.1	34%	0.338	33%	0.325	S	S	.	.	H	α-helix	trans	-74.1	-45.8	176.2	-69	0	0	0	0	111.2	I44 P45 G46 T50 T51 F52	I44-C48 HydrophobicContact CG2-CB 3.85Å; P45-C48 WeakPolarHBondContact O-CB 3.31Å; P45-C48 PolarHBondContact O-N 2.85Å; G46-C48 VanDerWaalsContact C-N 3.33Å; G46-C48 PolarHBondContact O-N 2.7Å; C48-T50 PolarHBondContact O-N 2.89Å; C48-T51 PolarHBondContact O-N 2.71Å; C48-T51 VanDerWaalsContact O-N 3.07Å; C48-F52 HydrophobicContact CB-CD2 4.14Å; C48-F52 HydrophobicContact CB-CE2 3.89Å; C48-F52 WeakPolarHBondContact O-CD2 3.43Å; C48-F52 PolarHBondContact O-N 3.28Å
49	K	54.9	Low	56.6	Low	25 Å²	25	61 Å²	61	11%	0.109	32%	0.322	C	S	.	.	H	α-helix	trans	-49.5	-49.6	173.5	-75.2	179.4	173	166	0	110.8	Y41 E42 I44 P45 G46 T51 F52 L53 F86	Y41-K49 WeakPolarHBondContact O-CE 3.4Å; Y41-K49 PolarHBondContact O-NZ 3.07Å; Y41-K49 VanDerWaalsContact O-NZ 3.16Å; E42-K49 PolarHBondContact O-NZ 3.25Å; I44-K49 HydrophobicContact CB-CD 4.32Å; I44-K49 HydrophobicContact CB-CG 3.66Å; I44-K49 HydrophobicContact CG2-CB 4.48Å; I44-K49 HydrophobicContact CG2-CG 3.59Å; I44-K49 WeakPolarHBondContact O-CD 3.19Å; I44-K49 WeakPolarHBondContact O-CE 3.23Å; I44-K49 PolarHBondContact O-NZ 3.39Å; P45-K49 PolarHBondContact O-N 3.2Å; G46-K49 PolarHBondContact O-N 3.34Å; K49-T51 PolarHBondContact O-N 2.72Å; K49-F52 PolarHBondContact O-N 2.87Å; K49-L53 HydrophobicContact CB-CD1 4.14Å; K49-L53 WeakPolarHBondContact O-CB 3.49Å; K49-L53 VanDerWaalsContact O-CD1 3.25Å; K49-L53 WeakPolarHBondContact O-CD1 3Å; K49-L53 WeakPolarHBondContact O-CG 3.34Å; K49-L53 PolarHBondContact O-N 2.96Å; K49-F86 HydrophobicContact CB-CZ 4.16Å; K49-F86 HydrophobicContact CD-CZ 4.48Å
50	T	51.2	Low	55.8	Low	31 Å²	31	63.4 Å²	63.4	19%	0.19	33%	0.327	C	S	.	.	H	α-helix	trans	-58	-48.6	179.7	-36.8	0	0	0	0	111	G46 C48 L54 F94	G46-T50 PolarHBondContact O-N 3.06Å; G46-T50 PolarHBondContact O-OG1 3.31Å; C48-T50 PolarHBondContact O-N 2.89Å; T50-L54 HydrophobicContact CG2-CD1 4.1Å; T50-L54 VanDerWaalsContact O-CB 3.3Å; T50-L54 WeakPolarHBondContact O-CB 3.43Å; T50-L54 WeakPolarHBondContact O-CD1 3.27Å; T50-L54 WeakPolarHBondContact O-CG 3.49Å; T50-L54 PolarHBondContact O-N 3.24Å; T50-F94 HydrophobicContact CG2-CE2 4.37Å
51	T	53.8	Low	54.9	Low	56 Å²	56	69.6 Å²	69.6	34%	0.344	35%	0.345	S	S	.	.	H	α-helix	trans	-67.4	-41.1	-177	-54.3	0	0	0	0	113	A11 L47 C48 K49 L54 D55	A11-T51 HydrophobicContact CB-CG2 4.29Å; L47-T51 PolarHBondContact O-N 3.49Å; L47-T51 PolarHBondContact O-OG1 2.96Å; L47-T51 VanDerWaalsContact O-OG1 3.09Å; C48-T51 PolarHBondContact O-N 2.71Å; C48-T51 VanDerWaalsContact O-N 3.07Å; K49-T51 PolarHBondContact O-N 2.72Å; T51-L54 PolarHBondContact O-N 3.41Å; T51-D55 PolarHBondContact O-N 3.26Å; T51-D55 VanDerWaalsContact O-N 3.14Å
52	F	56.2	Low	54.3	Low	15 Å²	15	70.3 Å²	70.3	7%	0.066	36%	0.355	C	S	.	.	H	α-helix	trans	-74.2	-38.7	-179.5	-69.4	-61	0	0	0	113.3	A11 E15 K16 F19 C48 K49 L54 D55 A56	A11-F52 HydrophobicContact CB-CD1 4.36Å; A11-F52 HydrophobicContact CB-CE1 3.43Å; A11-F52 VanDerWaalsContact CB-CE1 3.43Å; A11-F52 HydrophobicContact CB-CZ 3.5Å; A11-F52 VanDerWaalsContact CB-CZ 3.5Å; E15-F52 VanDerWaalsContact C-CE1 3.47Å; E15-F52 HydrophobicContact CB-CE1 3.67Å; E15-F52 HydrophobicContact CB-CE2 4.3Å; E15-F52 HydrophobicContact CB-CZ 3.3Å; E15-F52 HydrophobicContact CG-CZ 4.33Å; K16-F52 HydrophobicContact CB-CE1 4.44Å; K16-F52 HydrophobicContact CG-CD1 4.07Å; K16-F52 HydrophobicContact CG-CE1 3.81Å; F19-F52 HydrophobicContact CB-CB 4.05Å; F19-F52 HydrophobicContact CB-CD1 4.03Å; F19-F52 HydrophobicContact CB-CG 3.98Å; F19-F52 HydrophobicContact CD1-CB 3.5Å; F19-F52 VanDerWaalsContact CD1-CB 3.5Å; F19-F52 HydrophobicContact CD1-CG 4.34Å; F19-F52 HydrophobicContact CD2-CB 3.71Å; F19-F52 HydrophobicContact CD2-CD2 4.4Å; F19-F52 HydrophobicContact CD2-CG 4.16Å; F19-F52 HydrophobicContact CE1-CB 3.76Å; F19-F52 HydrophobicContact CE2-CB 4Å; F19-F52 HydrophobicContact CG-CB 3.45Å; F19-F52 VanDerWaalsContact CG-CB 3.45Å; F19-F52 HydrophobicContact CG-CD1 4.36Å; F19-F52 AromaticContact CG-CG 3.9Å; F19-F52 HydrophobicContact CG-CG 3.9Å; F19-F52 HydrophobicContact CZ-CB 4.04Å; C48-F52 HydrophobicContact CB-CD2 4.14Å; C48-F52 HydrophobicContact CB-CE2 3.89Å; C48-F52 WeakPolarHBondContact O-CD2 3.43Å; C48-F52 PolarHBondContact O-N 3.28Å; K49-F52 PolarHBondContact O-N 2.87Å; F52-L54 VanDerWaalsContact C-N 3.28Å; F52-L54 PolarHBondContact O-N 3.01Å; F52-D55 PolarHBondContact O-N 2.97Å; F52-A56 PolarHBondContact O-N 2.94Å
53	L	55.6	Low	54.4	Low	6 Å²	6	64.7 Å²	64.7	3%	0.031	33%	0.33	C	S	.	.	H	α-helix	trans	-68.1	-32.5	174.9	-71.7	159.7	0	0	0	111.5	F19 Y41 K49 A56 V57 T78 M82	F19-L53 HydrophobicContact CE1-CD2 4Å; F19-L53 HydrophobicContact CE1-CG 4.17Å; F19-L53 HydrophobicContact CE2-CG 4.47Å; F19-L53 HydrophobicContact CZ-CD1 4.47Å; F19-L53 HydrophobicContact CZ-CD2 3.51Å; F19-L53 HydrophobicContact CZ-CG 3.58Å; Y41-L53 HydrophobicContact CE2-CD1 4.32Å; Y41-L53 WeakPolarHBondContact OH-CD1 3.44Å; K49-L53 HydrophobicContact CB-CD1 4.14Å; K49-L53 WeakPolarHBondContact O-CB 3.49Å; K49-L53 VanDerWaalsContact O-CD1 3.25Å; K49-L53 WeakPolarHBondContact O-CD1 3Å; K49-L53 WeakPolarHBondContact O-CG 3.34Å; K49-L53 PolarHBondContact O-N 2.96Å; L53-A56 PolarHBondContact O-N 3.08Å; L53-V57 WeakPolarHBondContact O-CB 3.46Å; L53-V57 VanDerWaalsContact O-CG2 3.26Å; L53-V57 WeakPolarHBondContact O-CG2 3.42Å; L53-V57 PolarHBondContact O-N 3.41Å; L53-T78 HydrophobicContact CD2-CG2 3.49Å; L53-T78 VanDerWaalsContact CD2-CG2 3.49Å; L53-M82 HydrophobicContact CB-CE 3.2Å; L53-M82 HydrophobicContact CB-SD 3.4Å; L53-M82 WeakPolarHBondContact CB-SD 3.45Å; L53-M82 HydrophobicContact CD1-CE 3.53Å; L53-M82 HydrophobicContact CD1-CG 3.66Å; L53-M82 HydrophobicContact CD1-SD 3.42Å; L53-M82 WeakPolarHBondContact CD1-SD 3.36Å; L53-M82 HydrophobicContact CD2-SD 3.79Å; L53-M82 HydrophobicContact CG-CE 3.88Å; L53-M82 HydrophobicContact CG-SD 3.69Å
54	L	54.4	Low	54.1	Low	22 Å²	22	59.2 Å²	59.2	12%	0.115	30%	0.3	C	S	.	.	H	α-helix	trans	-66	-38.2	171.7	-73.4	167.6	0	0	0	113.6	T50 T51 F52 V57 R58 F94	T50-L54 HydrophobicContact CG2-CD1 4.1Å; T50-L54 VanDerWaalsContact O-CB 3.3Å; T50-L54 WeakPolarHBondContact O-CB 3.43Å; T50-L54 WeakPolarHBondContact O-CD1 3.27Å; T50-L54 WeakPolarHBondContact O-CG 3.49Å; T50-L54 PolarHBondContact O-N 3.24Å; T51-L54 PolarHBondContact O-N 3.41Å; F52-L54 VanDerWaalsContact C-N 3.28Å; F52-L54 PolarHBondContact O-N 3.01Å; L54-V57 PolarHBondContact O-N 3.17Å; L54-R58 WeakPolarHBondContact O-CB 3.24Å; L54-R58 VanDerWaalsContact O-CG 3.22Å; L54-R58 WeakPolarHBondContact O-CG 3.42Å; L54-R58 PolarHBondContact O-N 3.27Å; L54-F94 HydrophobicContact CD1-CE1 3.53Å; L54-F94 HydrophobicContact CD1-CE2 3.81Å; L54-F94 HydrophobicContact CD1-CZ 3.07Å; L54-F94 HydrophobicContact CD2-CD1 3.19Å; L54-F94 HydrophobicContact CD2-CD2 3.75Å; L54-F94 HydrophobicContact CD2-CE1 3.01Å; L54-F94 HydrophobicContact CD2-CE2 3.58Å; L54-F94 HydrophobicContact CD2-CG 3.57Å; L54-F94 HydrophobicContact CD2-CZ 3.23Å; L54-F94 HydrophobicContact CG-CD1 4.42Å; L54-F94 HydrophobicContact CG-CE1 3.83Å; L54-F94 HydrophobicContact CG-CE2 4.11Å; L54-F94 HydrophobicContact CG-CZ 3.66Å
55	D	54.2	Low	54.3	Low	37 Å²	37	62.1 Å²	62.1	20%	0.198	31%	0.313	C	S	.	.	H	α-helix	trans	-68.7	-35.9	172	-93.4	4.4	0	0	0	111.4	K16 Y20 T51 F52 R58 N59	K16-D55 WeakPolarHBondContact CD-OD2 3.29Å; K16-D55 WeakPolarHBondContact CE-OD2 3.49Å; K16-D55 IonicContact NZ-OD2 2.67Å; K16-D55 PolarHBondContact NZ-OD2 3.44Å; Y20-D55 PolarHBondContact OH-O 3.48Å; T51-D55 PolarHBondContact O-N 3.26Å; T51-D55 VanDerWaalsContact O-N 3.14Å; F52-D55 PolarHBondContact O-N 2.97Å; D55-R58 PolarHBondContact O-N 3.23Å; D55-N59 WeakPolarHBondContact O-CB 3.44Å; D55-N59 PolarHBondContact O-N 3.48Å
56	A	51.8	Low	54.9	Low	11 Å²	11	59.6 Å²	59.6	9%	0.091	29%	0.294	C	S	.	.	H	α-helix	trans	-66.7	-37.3	173.5	0	0	0	0	0	112.9	F19 Y20 L23 F52 L53	F19-A56 HydrophobicContact CE1-CB 4.42Å; Y20-A56 HydrophobicContact CE1-CB 4.05Å; L23-A56 HydrophobicContact CD1-CB 4.03Å; F52-A56 PolarHBondContact O-N 2.94Å; L53-A56 PolarHBondContact O-N 3.08Å
57	V	50	Low	55.8	Low	17 Å²	17	63.7 Å²	63.7	10%	0.103	32%	0.315	C	S	.	.	H	α-helix	trans	-71.4	-37.5	173.8	172.1	0	0	0	0	111.5	L53 L54 Y64 L79 T97	L53-V57 WeakPolarHBondContact O-CB 3.46Å; L53-V57 VanDerWaalsContact O-CG2 3.26Å; L53-V57 WeakPolarHBondContact O-CG2 3.42Å; L53-V57 PolarHBondContact O-N 3.41Å; L54-V57 PolarHBondContact O-N 3.17Å; V57-Y64 HydrophobicContact CG2-CE2 4.32Å; V57-L79 HydrophobicContact CG2-CD1 3.97Å; V57-T97 HydrophobicContact CG1-CG2 3.7Å
58	R	51.7	Low	56.9	Low	189 Å²	189	61.6 Å²	61.6	71%	0.713	30%	0.301	S	S	*	.	H	α-helix	trans	-72.5	-32.6	175.4	-79.3	174.7	154	-173.9	-6.9	112.8	L54 D55 R60	L54-R58 WeakPolarHBondContact O-CB 3.24Å; L54-R58 VanDerWaalsContact O-CG 3.22Å; L54-R58 WeakPolarHBondContact O-CG 3.42Å; L54-R58 PolarHBondContact O-N 3.27Å; D55-R58 PolarHBondContact O-N 3.23Å; R58-R60 VanDerWaalsContact C-N 3.34Å; R58-R60 PolarHBondContact O-N 2.94Å
59	N	54.4	Low	57.9	Low	76 Å²	76	61 Å²	61	41%	0.406	30%	0.297	S	S	.	.			trans	-85.7	76.9	-180	-158	-6.7	0	0	0	110	Y20 D55 R61 A62	Y20-N59 WeakPolarHBondContact OH-CB 3.34Å; Y20-N59 PolarHBondContact OH-ND2 2.98Å; D55-N59 WeakPolarHBondContact O-CB 3.44Å; D55-N59 PolarHBondContact O-N 3.48Å; N59-R61 PolarHBondContact O-N 3.35Å; N59-A62 HydrophobicContact CB-CB 4.46Å; N59-A62 PolarHBondContact O-N 2.71Å
60	R	50.3	Low	58.9	Low	145 Å²	145	66 Å²	66	55%	0.547	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-38.5	-39.7	-178.5	-99.9	-174	-100	-157.1	-5.3	114.7	R58 A62 E65	R58-R60 VanDerWaalsContact C-N 3.34Å; R58-R60 PolarHBondContact O-N 2.94Å; R60-A62 PolarHBondContact O-N 3.37Å; R60-E65 WeakPolarHBondContact CD-OE1 3.44Å; R60-E65 VanDerWaalsContact O-CB 3.29Å; R60-E65 WeakPolarHBondContact O-CB 3.42Å; R60-E65 WeakPolarHBondContact O-CG 3.41Å; R60-E65 PolarHBondContact O-N 3.06Å
61	R	45.8	Very low	59.9	Low	207 Å²	207	65.6 Å²	65.6	78%	0.781	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.5	-20.3	-176.4	-72.4	-174.8	173.9	-175.6	-1.4	115.4	N59	N59-R61 PolarHBondContact O-N 3.35Å
62	A	49.2	Very low	61.1	Low	33 Å²	33	64.2 Å²	64.2	27%	0.273	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.5	-15.9	-170.3	0	0	0	0	0	114.5	Y20 N59 R60	Y20-A62 HydrophobicContact CD1-CB 4.17Å; Y20-A62 HydrophobicContact CE1-CB 3.74Å; N59-A62 HydrophobicContact CB-CB 4.46Å; N59-A62 PolarHBondContact O-N 2.71Å; R60-A62 PolarHBondContact O-N 3.37Å
63	G	59.8	Low	62.1	Low	7 Å²	7	64.1 Å²	64.1	7%	0.072	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-123.4	-74.2	-176.2	0	0	0	0	0	113.3	R72	G63-R72 WeakPolarHBondContact O-CA 3.4Å; G63-R72 WeakPolarHBondContact O-CG 3.13Å
64	Y	58.8	Low	62.9	Low	17 Å²	17	65.2 Å²	65.2	7%	0.067	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-18.6	-172.8	-58.7	-78.9	0	0	0	114.5	V57 R72 A75 L79 A101	V57-Y64 HydrophobicContact CG2-CE2 4.32Å; Y64-R72 WeakPolarHBondContact O-CD 3.48Å; Y64-A75 HydrophobicContact CE1-CB 4.4Å; Y64-L79 WeakPolarHBondContact OH-CB 3.42Å; Y64-L79 WeakPolarHBondContact OH-CD1 3.28Å; Y64-A101 HydrophobicContact CE2-CB 4.46Å
65	E	68.1	Low	64	Low	95 Å²	95	65.2 Å²	65.2	44%	0.444	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.1	12.1	178.3	-57.3	174	-179.9	0	0	111.8	R60	R60-E65 WeakPolarHBondContact CD-OE1 3.44Å; R60-E65 VanDerWaalsContact O-CB 3.29Å; R60-E65 WeakPolarHBondContact O-CB 3.42Å; R60-E65 WeakPolarHBondContact O-CG 3.41Å; R60-E65 PolarHBondContact O-N 3.06Å
66	D	72.9	Confident	65.4	Low	34 Å²	34	63.4 Å²	63.4	18%	0.182	31%	0.306	C	S	.	.			trans	-58.7	138.8	175.5	-173.5	-75	0	0	0	110	H68 V71 R72	D66-H68 PolarHBondContact O-N 3.49Å; D66-H68 VanDerWaalsContact O-N 3.11Å; D66-H68 WeakPolarHBondContact OD1-CB 3.09Å; D66-H68 PolarHBondContact OD1-N 3.3Å; D66-V71 HydrophobicContact CB-CB 3.84Å; D66-V71 HydrophobicContact CB-CG1 3.68Å; D66-V71 HydrophobicContact CB-CG2 4.36Å; D66-V71 WeakPolarHBondContact OD1-CG2 3.45Å; D66-R72 HydrophobicContact CB-CG 4.26Å; D66-R72 VanDerWaalsContact O-CD 3.29Å; D66-R72 WeakPolarHBondContact O-CD 3.25Å; D66-R72 WeakPolarHBondContact O-CG 3.17Å; D66-R72 PolarHBondContact O-NH1 2.97Å
67	P	72.1	Confident	66.7	Low	122 Å²	122	66.3 Å²	66.3	79%	0.792	32%	0.323	S	S	*	.	S	Bend	trans	-53.4	-33.8	179.6	-27.3	34.8	0	0	0	113.9	R72	P67-R72 VanDerWaalsContact C-NH1 3.26Å; P67-R72 PolarHBondContact O-NH1 3.35Å
68	H	74.9	Confident	68	Low	98 Å²	98	66.7 Å²	66.7	45%	0.454	33%	0.325	S	S	.	.	S	Bend	trans	-92.3	121.1	-172.1	-165.8	-70.4	0	0	0	112.3	D66 R70 V71 R72	D66-H68 PolarHBondContact O-N 3.49Å; D66-H68 VanDerWaalsContact O-N 3.11Å; D66-H68 WeakPolarHBondContact OD1-CB 3.09Å; D66-H68 PolarHBondContact OD1-N 3.3Å; H68-R70 VanDerWaalsContact C-N 3.27Å; H68-R70 WeakPolarHBondContact ND1-CB 3.46Å; H68-R70 PolarHBondContact ND1-N 3.49Å; H68-R70 VanDerWaalsContact ND1-N 3.18Å; H68-R70 PolarHBondContact O-N 3.31Å; H68-R70 VanDerWaalsContact O-N 3.13Å; H68-V71 HydrophobicContact CB-CG2 3.8Å; H68-V71 WeakPolarHBondContact O-CB 3.29Å; H68-V71 PolarHBondContact O-N 3.06Å; H68-R72 PolarHBondContact O-N 3.12Å
69	P	76.7	Confident	69.3	Low	39 Å²	39	57.8 Å²	57.8	25%	0.253	29%	0.292	S	S	.	.	H	α-helix	trans	-62.6	-28.4	-173.2	23.4	-33.9	0	0	0	114.4	V71 R72 A73 N111 V114	P69-V71 VanDerWaalsContact C-N 3.34Å; P69-R72 PolarHBondContact O-N 2.92Å; P69-A73 WeakPolarHBondContact O-CB 3.44Å; P69-A73 PolarHBondContact O-N 3.09Å; P69-N111 HydrophobicContact CB-CB 4.22Å; P69-N111 WeakPolarHBondContact CB-ND2 3.35Å; P69-V114 HydrophobicContact CB-CG2 3.87Å; P69-V114 VanDerWaalsContact O-CG2 3.28Å; P69-V114 WeakPolarHBondContact O-CG2 3.39Å
70	R	75.1	Confident	70.7	Confident	128 Å²	128	54.1 Å²	54.1	48%	0.483	27%	0.272	S	S	.	.	H	α-helix	trans	-66.9	-32.8	174.7	-64.1	175.7	72.8	-177.4	1.3	113	H68 A74	H68-R70 VanDerWaalsContact C-N 3.27Å; H68-R70 WeakPolarHBondContact ND1-CB 3.46Å; H68-R70 PolarHBondContact ND1-N 3.49Å; H68-R70 VanDerWaalsContact ND1-N 3.18Å; H68-R70 PolarHBondContact O-N 3.31Å; H68-R70 VanDerWaalsContact O-N 3.13Å; R70-A74 WeakPolarHBondContact O-CB 3.45Å; R70-A74 PolarHBondContact O-N 3.42Å
71	V	72.3	Confident	72.1	Confident	24 Å²	24	51.8 Å²	51.8	15%	0.145	27%	0.267	C	S	.	.	H	α-helix	trans	-65.1	-48.8	175.1	-176.7	0	0	0	0	108.8	I27 D66 H68 P69 A73 A74 A75	I27-V71 HydrophobicContact CD1-CB 3.72Å; I27-V71 HydrophobicContact CD1-CG1 3.93Å; I27-V71 HydrophobicContact CD1-CG2 3.08Å; D66-V71 HydrophobicContact CB-CB 3.84Å; D66-V71 HydrophobicContact CB-CG1 3.68Å; D66-V71 HydrophobicContact CB-CG2 4.36Å; D66-V71 WeakPolarHBondContact OD1-CG2 3.45Å; H68-V71 HydrophobicContact CB-CG2 3.8Å; H68-V71 WeakPolarHBondContact O-CB 3.29Å; H68-V71 PolarHBondContact O-N 3.06Å; P69-V71 VanDerWaalsContact C-N 3.34Å; V71-A73 VanDerWaalsContact C-N 3.34Å; V71-A73 PolarHBondContact O-N 3.01Å; V71-A74 PolarHBondContact O-N 3.18Å; V71-A75 PolarHBondContact O-N 3.02Å
72	R	79.7	Confident	73.5	Confident	27 Å²	27	42 Å²	42	10%	0.102	23%	0.23	C	C	.	.	H	α-helix	trans	-60.7	-42.9	180	-55	-163.7	-67.3	-86.9	13.1	112.5	G63 Y64 D66 P67 H68 P69 A75 C76 V114	G63-R72 WeakPolarHBondContact O-CA 3.4Å; G63-R72 WeakPolarHBondContact O-CG 3.13Å; Y64-R72 WeakPolarHBondContact O-CD 3.48Å; D66-R72 HydrophobicContact CB-CG 4.26Å; D66-R72 VanDerWaalsContact O-CD 3.29Å; D66-R72 WeakPolarHBondContact O-CD 3.25Å; D66-R72 WeakPolarHBondContact O-CG 3.17Å; D66-R72 PolarHBondContact O-NH1 2.97Å; P67-R72 VanDerWaalsContact C-NH1 3.26Å; P67-R72 PolarHBondContact O-NH1 3.35Å; H68-R72 PolarHBondContact O-N 3.12Å; P69-R72 PolarHBondContact O-N 2.92Å; R72-A75 PolarHBondContact O-N 3.36Å; R72-C76 PolarHBondContact O-N 2.92Å; R72-C76 VanDerWaalsContact O-N 3.09Å; R72-C76 PolarHBondContact O-SG 2.91Å; R72-V114 HydrophobicContact CB-CG1 3.69Å; R72-V114 HydrophobicContact CB-CG2 4.08Å
73	A	76.6	Confident	75.1	Confident	12 Å²	12	40.4 Å²	40.4	10%	0.099	22%	0.217	C	C	.	.	H	α-helix	trans	-62.7	-45.2	175.4	0	0	0	0	0	112	P69 V71 A75 C76 T77 V114 H117	P69-A73 WeakPolarHBondContact O-CB 3.44Å; P69-A73 PolarHBondContact O-N 3.09Å; V71-A73 VanDerWaalsContact C-N 3.34Å; V71-A73 PolarHBondContact O-N 3.01Å; A73-A75 VanDerWaalsContact C-N 3.34Å; A73-A75 PolarHBondContact O-N 3.25Å; A73-C76 WeakPolarHBondContact O-CB 3.42Å; A73-C76 PolarHBondContact O-N 3.5Å; A73-T77 PolarHBondContact O-N 3.44Å; A73-T77 PolarHBondContact O-OG1 3.06Å; A73-V114 HydrophobicContact CB-CG2 4.43Å; A73-H117 HydrophobicContact CB-CB 4.38Å
74	A	73.1	Confident	76.2	Confident	29 Å²	29	43.3 Å²	43.3	24%	0.24	23%	0.234	C	C	.	.	H	α-helix	trans	-62	-42.3	176.3	0	0	0	0	0	111.7	I27 R70 V71 C76 T77 T78	I27-A74 HydrophobicContact CG2-CB 3.31Å; R70-A74 WeakPolarHBondContact O-CB 3.45Å; R70-A74 PolarHBondContact O-N 3.42Å; V71-A74 PolarHBondContact O-N 3.18Å; A74-C76 VanDerWaalsContact C-N 3.31Å; A74-C76 PolarHBondContact O-N 3.36Å; A74-T77 PolarHBondContact O-N 3.36Å; A74-T78 WeakPolarHBondContact O-CB 3.42Å; A74-T78 PolarHBondContact O-N 3.47Å; A74-T78 PolarHBondContact O-OG1 3.2Å
75	A	76.4	Confident	77.1	Confident	22 Å²	22	46.6 Å²	46.6	18%	0.182	25%	0.252	C	S	.	.	H	α-helix	trans	-58.1	-42.6	175.6	0	0	0	0	0	112.3	Y64 V71 R72 A73 L79	Y64-A75 HydrophobicContact CE1-CB 4.4Å; V71-A75 PolarHBondContact O-N 3.02Å; R72-A75 PolarHBondContact O-N 3.36Å; A73-A75 VanDerWaalsContact C-N 3.34Å; A73-A75 PolarHBondContact O-N 3.25Å; A75-L79 WeakPolarHBondContact O-CB 3.38Å; A75-L79 PolarHBondContact O-N 2.86Å
76	C	83.3	Confident	77.5	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-62.5	-47.6	174.7	-63.4	0	0	0	0	111.6	R72 A73 A74 T78 L79 G80 H117 A121	R72-C76 PolarHBondContact O-N 2.92Å; R72-C76 VanDerWaalsContact O-N 3.09Å; R72-C76 PolarHBondContact O-SG 2.91Å; A73-C76 WeakPolarHBondContact O-CB 3.42Å; A73-C76 PolarHBondContact O-N 3.5Å; A74-C76 VanDerWaalsContact C-N 3.31Å; A74-C76 PolarHBondContact O-N 3.36Å; C76-T78 PolarHBondContact O-N 2.96Å; C76-L79 PolarHBondContact O-N 3.14Å; C76-G80 PolarHBondContact O-N 3.16Å; C76-H117 HydrophobicContact CB-CB 3.8Å; C76-A121 HydrophobicContact CB-CB 4.45Å; C76-A121 WeakPolarHBondContact O-CB 3.22Å
77	T	80.3	Confident	78	Confident	71 Å²	71	44.2 Å²	44.2	44%	0.436	25%	0.245	S	C	.	.	H	α-helix	trans	-60.9	-45.7	178.1	-60	0	0	0	0	111.8	A73 A74 L79 G80 Q81 H117	A73-T77 PolarHBondContact O-N 3.44Å; A73-T77 PolarHBondContact O-OG1 3.06Å; A74-T77 PolarHBondContact O-N 3.36Å; T77-L79 VanDerWaalsContact C-N 3.28Å; T77-L79 PolarHBondContact O-N 2.86Å; T77-G80 PolarHBondContact O-N 2.99Å; T77-G80 VanDerWaalsContact O-N 3.13Å; T77-Q81 PolarHBondContact O-N 3.32Å; T77-H117 PolarHBondContact OG1-ND1 3.34Å
78	T	75.9	Confident	78.8	Confident	25 Å²	25	41 Å²	41	15%	0.153	22%	0.224	C	C	.	.	H	α-helix	trans	-59.1	-41.9	177	-59.8	0	0	0	0	110.9	L53 A74 C76 G80 Q81 M82	L53-T78 HydrophobicContact CD2-CG2 3.49Å; L53-T78 VanDerWaalsContact CD2-CG2 3.49Å; A74-T78 WeakPolarHBondContact O-CB 3.42Å; A74-T78 PolarHBondContact O-N 3.47Å; A74-T78 PolarHBondContact O-OG1 3.2Å; C76-T78 PolarHBondContact O-N 2.96Å; T78-G80 VanDerWaalsContact C-N 3.34Å; T78-G80 PolarHBondContact O-N 3.12Å; T78-Q81 PolarHBondContact O-N 3.37Å; T78-M82 VanDerWaalsContact O-CG 3.26Å; T78-M82 WeakPolarHBondContact O-CG 3.25Å; T78-M82 PolarHBondContact O-N 3.09Å
79	L	80.2	Confident	79.1	Confident	2 Å²	2	41.6 Å²	41.6	1%	0.01	23%	0.231	C	C	.	.	H	α-helix	trans	-64.4	-39.1	176.5	-177.8	143.4	0	0	0	112.5	V57 Y64 A75 C76 T77 M82 A83 F90 V98 L102 A121	V57-L79 HydrophobicContact CG2-CD1 3.97Å; Y64-L79 WeakPolarHBondContact OH-CB 3.42Å; Y64-L79 WeakPolarHBondContact OH-CD1 3.28Å; A75-L79 WeakPolarHBondContact O-CB 3.38Å; A75-L79 PolarHBondContact O-N 2.86Å; C76-L79 PolarHBondContact O-N 3.14Å; T77-L79 VanDerWaalsContact C-N 3.28Å; T77-L79 PolarHBondContact O-N 2.86Å; L79-M82 PolarHBondContact O-N 3.29Å; L79-A83 PolarHBondContact O-N 3.37Å; L79-F90 HydrophobicContact CG-CE1 4.49Å; L79-F90 HydrophobicContact CG-CZ 4.44Å; L79-V98 HydrophobicContact CD1-CB 4.27Å; L79-V98 HydrophobicContact CD1-CG1 3.71Å; L79-V98 HydrophobicContact CD1-CG2 3.9Å; L79-V98 HydrophobicContact CD2-CG1 3.44Å; L79-V98 VanDerWaalsContact CD2-CG1 3.44Å; L79-V98 HydrophobicContact CG-CG1 4.05Å; L79-L102 HydrophobicContact CD2-CD1 3.72Å; L79-L102 HydrophobicContact CD2-CD2 4.06Å; L79-L102 HydrophobicContact CD2-CG 4.09Å; L79-A121 HydrophobicContact CD2-CB 4.29Å
80	G	83.3	Confident	79.1	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-58.8	-49.8	171.6	0	0	0	0	0	111.3	C76 T77 T78 M82 A83 T84 I124	C76-G80 PolarHBondContact O-N 3.16Å; T77-G80 PolarHBondContact O-N 2.99Å; T77-G80 VanDerWaalsContact O-N 3.13Å; T78-G80 VanDerWaalsContact C-N 3.34Å; T78-G80 PolarHBondContact O-N 3.12Å; G80-M82 VanDerWaalsContact C-N 3.31Å; G80-M82 PolarHBondContact O-N 2.93Å; G80-A83 WeakPolarHBondContact O-CB 3.19Å; G80-A83 PolarHBondContact O-N 3.48Å; G80-T84 PolarHBondContact O-N 3.43Å; G80-I124 WeakPolarHBondContact O-CG2 3.42Å
81	Q	79.2	Confident	79.8	Confident	95 Å²	95	33.8 Å²	33.8	44%	0.444	20%	0.197	S	C	.	.	H	α-helix	trans	-58.6	-42.5	178.9	-169.7	60.8	50	0	0	112.2	T77 T78 A83 T84 D85	T77-Q81 PolarHBondContact O-N 3.32Å; T78-Q81 PolarHBondContact O-N 3.37Å; Q81-A83 VanDerWaalsContact C-N 3.28Å; Q81-A83 PolarHBondContact O-N 2.88Å; Q81-T84 PolarHBondContact O-N 3.31Å; Q81-D85 PolarHBondContact NE2-OD1 3.3Å; Q81-D85 WeakPolarHBondContact O-CB 3.4Å; Q81-D85 PolarHBondContact O-N 3.41Å
82	M	75	Confident	80.4	Confident	1 Å²	1	38 Å²	38	1%	0.005	21%	0.213	C	C	.	.	H	α-helix	trans	-60.8	-37.7	174.2	-70.6	176	78.4	0	0	113.1	L53 T78 L79 G80 T84 D85 F86 F90	L53-M82 HydrophobicContact CB-CE 3.2Å; L53-M82 HydrophobicContact CB-SD 3.4Å; L53-M82 WeakPolarHBondContact CB-SD 3.45Å; L53-M82 HydrophobicContact CD1-CE 3.53Å; L53-M82 HydrophobicContact CD1-CG 3.66Å; L53-M82 HydrophobicContact CD1-SD 3.42Å; L53-M82 WeakPolarHBondContact CD1-SD 3.36Å; L53-M82 HydrophobicContact CD2-SD 3.79Å; L53-M82 HydrophobicContact CG-CE 3.88Å; L53-M82 HydrophobicContact CG-SD 3.69Å; T78-M82 VanDerWaalsContact O-CG 3.26Å; T78-M82 WeakPolarHBondContact O-CG 3.25Å; T78-M82 PolarHBondContact O-N 3.09Å; L79-M82 PolarHBondContact O-N 3.29Å; G80-M82 VanDerWaalsContact C-N 3.31Å; G80-M82 PolarHBondContact O-N 2.93Å; M82-T84 VanDerWaalsContact C-N 3.25Å; M82-T84 PolarHBondContact O-N 3.2Å; M82-D85 PolarHBondContact O-N 2.87Å; M82-F86 HydrophobicContact CB-CD2 4.03Å; M82-F86 HydrophobicContact CB-CE2 4.39Å; M82-F86 HydrophobicContact CG-CD2 4.35Å; M82-F86 HydrophobicContact CG-CE2 4.23Å; M82-F86 WeakPolarHBondContact O-CB 3.45Å; M82-F86 WeakPolarHBondContact O-CD2 3.49Å; M82-F86 PolarHBondContact O-N 3.15Å; M82-F90 HydrophobicContact CB-CE1 4.29Å; M82-F90 HydrophobicContact CB-CE2 4.22Å; M82-F90 HydrophobicContact CB-CZ 4.07Å; M82-F90 HydrophobicContact CE-CD2 4.02Å; M82-F90 HydrophobicContact CE-CE2 3.33Å; M82-F90 HydrophobicContact CE-CZ 3.94Å; M82-F90 HydrophobicContact SD-CE2 4.21Å; M82-F90 HydrophobicContact SD-CZ 4.22Å
83	A	84.1	Confident	80.4	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-63	-37.5	-179.8	0	0	0	0	0	111.1	L79 G80 Q81 A87 F90 Q91 I124 F125	L79-A83 PolarHBondContact O-N 3.37Å; G80-A83 WeakPolarHBondContact O-CB 3.19Å; G80-A83 PolarHBondContact O-N 3.48Å; Q81-A83 VanDerWaalsContact C-N 3.28Å; Q81-A83 PolarHBondContact O-N 2.88Å; A83-A87 WeakPolarHBondContact O-CB 3.5Å; A83-A87 PolarHBondContact O-N 3.4Å; A83-F90 HydrophobicContact CB-CD1 3.98Å; A83-F90 HydrophobicContact CB-CE1 4.19Å; A83-Q91 PolarHBondContact O-NE2 3.25Å; A83-I124 HydrophobicContact CB-CG2 4.31Å; A83-F125 HydrophobicContact CB-CB 4.2Å; A83-F125 HydrophobicContact CB-CD2 3.81Å; A83-F125 HydrophobicContact CB-CG 4.43Å
84	T	82.6	Confident	80.6	Confident	68 Å²	68	44.3 Å²	44.3	42%	0.417	24%	0.239	S	C	.	.	H	α-helix	trans	-71.1	-54.1	171.8	-55	0	0	0	0	112.1	G80 Q81 M82 F86 A87 I124	G80-T84 PolarHBondContact O-N 3.43Å; Q81-T84 PolarHBondContact O-N 3.31Å; M82-T84 VanDerWaalsContact C-N 3.25Å; M82-T84 PolarHBondContact O-N 3.2Å; T84-F86 PolarHBondContact O-N 3.02Å; T84-A87 WeakPolarHBondContact O-CB 3.45Å; T84-A87 PolarHBondContact O-N 2.89Å; T84-I124 WeakPolarHBondContact OG1-CG2 3.37Å
85	D	76.8	Confident	81.4	Confident	86 Å²	86	44.5 Å²	44.5	46%	0.46	24%	0.235	S	C	.	.	H	α-helix	trans	-63	-31.1	-171.3	-66.2	-12.6	0	0	0	113.3	Q81 M82	Q81-D85 PolarHBondContact NE2-OD1 3.3Å; Q81-D85 WeakPolarHBondContact O-CB 3.4Å; Q81-D85 PolarHBondContact O-N 3.41Å; M82-D85 PolarHBondContact O-N 2.87Å
86	F	77.3	Confident	81.9	Confident	45 Å²	45	49.6 Å²	49.6	20%	0.197	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.5	15.8	-174.8	-57.8	-66.1	0	0	0	112.8	K49 M82 T84 N89 F90	K49-F86 HydrophobicContact CB-CZ 4.16Å; K49-F86 HydrophobicContact CD-CZ 4.48Å; M82-F86 HydrophobicContact CB-CD2 4.03Å; M82-F86 HydrophobicContact CB-CE2 4.39Å; M82-F86 HydrophobicContact CG-CD2 4.35Å; M82-F86 HydrophobicContact CG-CE2 4.23Å; M82-F86 WeakPolarHBondContact O-CB 3.45Å; M82-F86 WeakPolarHBondContact O-CD2 3.49Å; M82-F86 PolarHBondContact O-N 3.15Å; T84-F86 PolarHBondContact O-N 3.02Å; F86-N89 PolarHBondContact O-N 3.45Å; F86-F90 HydrophobicContact CB-CB 3.72Å; F86-F90 HydrophobicContact CB-CG 4.45Å; F86-F90 PolarHBondContact O-N 3.12Å
87	A	83.1	Confident	81.9	Confident	34 Å²	34	52.7 Å²	52.7	28%	0.281	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	145	174	0	0	0	0	0	112.1	A83 T84 N89 D128	A83-A87 WeakPolarHBondContact O-CB 3.5Å; A83-A87 PolarHBondContact O-N 3.4Å; T84-A87 WeakPolarHBondContact O-CB 3.45Å; T84-A87 PolarHBondContact O-N 2.89Å; A87-N89 VanDerWaalsContact C-N 3.33Å; A87-D128 HydrophobicContact CB-CB 3.61Å
88	P	88.6	Confident	82.2	Confident	54 Å²	54	49.3 Å²	49.3	35%	0.351	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	cis	-88.9	4.8	-12.3	36.7	-35.8	0	0	0	112.5	F90 Q91 K92	P88-F90 VanDerWaalsContact C-N 3.33Å; P88-F90 PolarHBondContact O-N 3.47Å; P88-Q91 PolarHBondContact O-N 3.5Å; P88-Q91 PolarHBondContact O-OE1 3.25Å; P88-K92 WeakPolarHBondContact O-CG 3.31Å; P88-K92 PolarHBondContact O-N 3.28Å
89	N	80.9	Confident	82.9	Confident	112 Å²	112	48.3 Å²	48.3	60%	0.599	25%	0.247	S	C	*	.	H	α-helix	trans	-70	-32.3	-171.2	-71.8	-34.6	0	0	0	112.2	F86 A87 K92 K93	F86-N89 PolarHBondContact O-N 3.45Å; A87-N89 VanDerWaalsContact C-N 3.33Å; N89-K92 PolarHBondContact O-N 3.21Å; N89-K93 VanDerWaalsContact O-CB 3.31Å; N89-K93 WeakPolarHBondContact O-CB 3.34Å; N89-K93 PolarHBondContact O-N 3.43Å
90	F	78.7	Confident	83.4	Confident	3 Å²	3	50.5 Å²	50.5	1%	0.013	27%	0.265	C	S	.	.	H	α-helix	trans	-62.4	-46.2	174.3	-174	-104.7	0	0	0	111.6	L79 M82 A83 F86 P88 K93 F94 V98 F125	L79-F90 HydrophobicContact CG-CE1 4.49Å; L79-F90 HydrophobicContact CG-CZ 4.44Å; M82-F90 HydrophobicContact CB-CE1 4.29Å; M82-F90 HydrophobicContact CB-CE2 4.22Å; M82-F90 HydrophobicContact CB-CZ 4.07Å; M82-F90 HydrophobicContact CE-CD2 4.02Å; M82-F90 HydrophobicContact CE-CE2 3.33Å; M82-F90 HydrophobicContact CE-CZ 3.94Å; M82-F90 HydrophobicContact SD-CE2 4.21Å; M82-F90 HydrophobicContact SD-CZ 4.22Å; A83-F90 HydrophobicContact CB-CD1 3.98Å; A83-F90 HydrophobicContact CB-CE1 4.19Å; F86-F90 HydrophobicContact CB-CB 3.72Å; F86-F90 HydrophobicContact CB-CG 4.45Å; F86-F90 PolarHBondContact O-N 3.12Å; P88-F90 VanDerWaalsContact C-N 3.33Å; P88-F90 PolarHBondContact O-N 3.47Å; F90-K93 PolarHBondContact O-N 2.94Å; F90-F94 AromaticContact CD2-CD2 3.45Å; F90-F94 HydrophobicContact CD2-CD2 3.45Å; F90-F94 VanDerWaalsContact CD2-CD2 3.45Å; F90-F94 AromaticContact CD2-CE2 4Å; F90-F94 HydrophobicContact CD2-CE2 4Å; F90-F94 HydrophobicContact CD2-CG 4.46Å; F90-F94 HydrophobicContact CE2-CB 4.49Å; F90-F94 AromaticContact CE2-CD2 3.65Å; F90-F94 HydrophobicContact CE2-CD2 3.65Å; F90-F94 HydrophobicContact CE2-CE2 4.32Å; F90-F94 HydrophobicContact CE2-CG 4.32Å; F90-F94 HydrophobicContact CG-CD2 4.14Å; F90-F94 WeakPolarHBondContact O-CB 3.35Å; F90-F94 WeakPolarHBondContact O-CD2 3.3Å; F90-F94 PolarHBondContact O-N 3.49Å; F90-V98 HydrophobicContact CE1-CG2 3.98Å; F90-V98 HydrophobicContact CZ-CG2 3.9Å; F90-F125 HydrophobicContact CD1-CD2 4.06Å; F90-F125 AromaticContact CD1-CE2 3.68Å; F90-F125 HydrophobicContact CD1-CE2 3.68Å; F90-F125 AromaticContact CE1-CD2 3.94Å; F90-F125 HydrophobicContact CE1-CD2 3.94Å; F90-F125 AromaticContact CE1-CE2 3.71Å; F90-F125 HydrophobicContact CE1-CE2 3.71Å
91	Q	88.5	Confident	83.6	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-61.6	-50.2	177	-66.4	79.5	-8.7	0	0	110.1	A83 P88 K93 F94 H95 F125 D128 C129	A83-Q91 PolarHBondContact O-NE2 3.25Å; P88-Q91 PolarHBondContact O-N 3.5Å; P88-Q91 PolarHBondContact O-OE1 3.25Å; Q91-K93 PolarHBondContact O-N 3.08Å; Q91-F94 PolarHBondContact O-N 3.14Å; Q91-H95 WeakPolarHBondContact O-CB 3.42Å; Q91-H95 PolarHBondContact O-CD2 3.5Å; Q91-H95 PolarHBondContact O-N 3.22Å; Q91-F125 HydrophobicContact CB-CE1 4.35Å; Q91-F125 HydrophobicContact CB-CE2 4.4Å; Q91-F125 HydrophobicContact CB-CZ 3.96Å; Q91-F125 HydrophobicContact CG-CD1 4.4Å; Q91-F125 HydrophobicContact CG-CD2 4.25Å; Q91-F125 HydrophobicContact CG-CE1 4.07Å; Q91-F125 HydrophobicContact CG-CE2 3.93Å; Q91-F125 HydrophobicContact CG-CG 4.48Å; Q91-F125 HydrophobicContact CG-CZ 3.83Å; Q91-F125 WeakPolarHBondContact CG-O 3.47Å; Q91-D128 VanDerWaalsContact NE2-CB 3.32Å; Q91-C129 HydrophobicContact CB-CB 4.25Å; Q91-C129 HydrophobicContact CG-CB 3.99Å
92	K	85.1	Confident	84.2	Confident	111 Å²	111	46.8 Å²	46.8	48%	0.483	25%	0.251	S	S	.	.	H	α-helix	trans	-57.8	-32.5	179	-72.3	175.1	-177.2	178.3	0	114.1	P88 N89 H95 P130 L133	P88-K92 WeakPolarHBondContact O-CG 3.31Å; P88-K92 PolarHBondContact O-N 3.28Å; N89-K92 PolarHBondContact O-N 3.21Å; K92-H95 PolarHBondContact O-CD2 3.02Å; K92-H95 VanDerWaalsContact O-CD2 3.27Å; K92-H95 PolarHBondContact O-NE2 3.48Å; K92-P130 HydrophobicContact CG-CG 4.06Å; K92-L133 HydrophobicContact CB-CD1 4.24Å; K92-L133 HydrophobicContact CG-CD1 3.88Å
93	K	79.6	Confident	85	Confident	148 Å²	148	47.1 Å²	47.1	64%	0.643	25%	0.253	S	S	*	.	H	α-helix	trans	-97	-26.7	-174.1	-166	173.1	170.3	-177.3	0	113.5	N89 F90 Q91	N89-K93 VanDerWaalsContact O-CB 3.31Å; N89-K93 WeakPolarHBondContact O-CB 3.34Å; N89-K93 PolarHBondContact O-N 3.43Å; F90-K93 PolarHBondContact O-N 2.94Å; Q91-K93 PolarHBondContact O-N 3.08Å
94	F	81.8	Confident	85.4	Confident	25 Å²	25	52 Å²	52	11%	0.11	27%	0.271	C	S	.	.	H	α-helix	trans	-126.6	5.2	-169.1	-52.8	-63.1	0	0	0	115.2	T50 L54 F90 Q91 E96 T97 V98	T50-F94 HydrophobicContact CG2-CE2 4.37Å; L54-F94 HydrophobicContact CD1-CE1 3.53Å; L54-F94 HydrophobicContact CD1-CE2 3.81Å; L54-F94 HydrophobicContact CD1-CZ 3.07Å; L54-F94 HydrophobicContact CD2-CD1 3.19Å; L54-F94 HydrophobicContact CD2-CD2 3.75Å; L54-F94 HydrophobicContact CD2-CE1 3.01Å; L54-F94 HydrophobicContact CD2-CE2 3.58Å; L54-F94 HydrophobicContact CD2-CG 3.57Å; L54-F94 HydrophobicContact CD2-CZ 3.23Å; L54-F94 HydrophobicContact CG-CD1 4.42Å; L54-F94 HydrophobicContact CG-CE1 3.83Å; L54-F94 HydrophobicContact CG-CE2 4.11Å; L54-F94 HydrophobicContact CG-CZ 3.66Å; F90-F94 AromaticContact CD2-CD2 3.45Å; F90-F94 HydrophobicContact CD2-CD2 3.45Å; F90-F94 VanDerWaalsContact CD2-CD2 3.45Å; F90-F94 AromaticContact CD2-CE2 4Å; F90-F94 HydrophobicContact CD2-CE2 4Å; F90-F94 HydrophobicContact CD2-CG 4.46Å; F90-F94 HydrophobicContact CE2-CB 4.49Å; F90-F94 AromaticContact CE2-CD2 3.65Å; F90-F94 HydrophobicContact CE2-CD2 3.65Å; F90-F94 HydrophobicContact CE2-CE2 4.32Å; F90-F94 HydrophobicContact CE2-CG 4.32Å; F90-F94 HydrophobicContact CG-CD2 4.14Å; F90-F94 WeakPolarHBondContact O-CB 3.35Å; F90-F94 WeakPolarHBondContact O-CD2 3.3Å; F90-F94 PolarHBondContact O-N 3.49Å; Q91-F94 PolarHBondContact O-N 3.14Å; F94-E96 VanDerWaalsContact C-N 3.29Å; F94-E96 PolarHBondContact O-N 3.42Å; F94-E96 VanDerWaalsContact O-N 3.14Å; F94-T97 PolarHBondContact O-N 3.37Å; F94-T97 VanDerWaalsContact O-N 3.09Å; F94-V98 HydrophobicContact CB-CG2 3.74Å; F94-V98 WeakPolarHBondContact O-CB 3.41Å; F94-V98 VanDerWaalsContact O-CG2 3.32Å; F94-V98 WeakPolarHBondContact O-CG2 3.44Å; F94-V98 PolarHBondContact O-N 3Å
95	H	89.5	Confident	85.7	Confident	33 Å²	33	49.1 Å²	49.1	15%	0.153	25%	0.253	C	S	.	.	H	α-helix	trans	-41.3	-51.8	178.8	53.5	81.3	0	0	0	114	Q91 K92 T97 I99 F125 Y137	Q91-H95 WeakPolarHBondContact O-CB 3.42Å; Q91-H95 PolarHBondContact O-CD2 3.5Å; Q91-H95 PolarHBondContact O-N 3.22Å; K92-H95 PolarHBondContact O-CD2 3.02Å; K92-H95 VanDerWaalsContact O-CD2 3.27Å; K92-H95 PolarHBondContact O-NE2 3.48Å; H95-T97 PolarHBondContact O-N 3.19Å; H95-I99 HydrophobicContact CB-CD1 4.36Å; H95-I99 VanDerWaalsContact O-CB 3.25Å; H95-I99 WeakPolarHBondContact O-CB 3.46Å; H95-I99 VanDerWaalsContact O-CG1 3.24Å; H95-I99 WeakPolarHBondContact O-CG1 3.29Å; H95-I99 PolarHBondContact O-N 3.3Å; H95-F125 HydrophobicContact CB-CE1 4.35Å; H95-F125 HydrophobicContact CB-CZ 4.21Å; H95-Y137 HydrophobicContact CB-CE2 4.13Å; H95-Y137 PolarHBondContact CE1-OH 3.27Å; H95-Y137 AromaticContact CG-CE2 3.96Å; H95-Y137 AromaticContact ND1-CE2 3.28Å; H95-Y137 VanDerWaalsContact ND1-CE2 3.28Å; H95-Y137 WeakPolarHBondContact ND1-CE2 3.34Å; H95-Y137 AromaticContact ND1-CZ 3.3Å; H95-Y137 VanDerWaalsContact ND1-CZ 3.3Å; H95-Y137 PolarHBondContact ND1-OH 3.5Å
96	E	86.6	Confident	86.4	Confident	129 Å²	129	45.1 Å²	45.1	60%	0.603	23%	0.232	S	C	*	.	H	α-helix	trans	-61.9	-48.2	-176.2	-170.8	-175.1	169.5	0	0	112.1	F94 A100 Y137	F94-E96 VanDerWaalsContact C-N 3.29Å; F94-E96 PolarHBondContact O-N 3.42Å; F94-E96 VanDerWaalsContact O-N 3.14Å; E96-A100 WeakPolarHBondContact O-CB 3.41Å; E96-A100 PolarHBondContact O-N 3.35Å; E96-Y137 HydrophobicContact CB-CE1 4.43Å; E96-Y137 WeakPolarHBondContact CB-OH 3.28Å; E96-Y137 HydrophobicContact CG-CE1 4.36Å
97	T	82.1	Confident	86.9	Confident	64 Å²	64	46.7 Å²	46.7	39%	0.393	24%	0.24	S	C	.	.	H	α-helix	trans	-71	-43	-176.3	-58	0	0	0	0	111.1	V57 F94 H95 A101	V57-T97 HydrophobicContact CG1-CG2 3.7Å; F94-T97 PolarHBondContact O-N 3.37Å; F94-T97 VanDerWaalsContact O-N 3.09Å; H95-T97 PolarHBondContact O-N 3.19Å; T97-A101 VanDerWaalsContact O-CB 3.25Å; T97-A101 WeakPolarHBondContact O-CB 3.23Å; T97-A101 PolarHBondContact O-N 2.89Å
98	V	86.6	Confident	86.6	Confident	1 Å²	1	50.4 Å²	50.4	1%	0.006	26%	0.255	C	S	.	.	H	α-helix	trans	-70.3	-50.5	-175	171.7	0	0	0	0	111.3	L79 F90 F94 A100 A101 L102 F125	L79-V98 HydrophobicContact CD1-CB 4.27Å; L79-V98 HydrophobicContact CD1-CG1 3.71Å; L79-V98 HydrophobicContact CD1-CG2 3.9Å; L79-V98 HydrophobicContact CD2-CG1 3.44Å; L79-V98 VanDerWaalsContact CD2-CG1 3.44Å; L79-V98 HydrophobicContact CG-CG1 4.05Å; F90-V98 HydrophobicContact CE1-CG2 3.98Å; F90-V98 HydrophobicContact CZ-CG2 3.9Å; F94-V98 HydrophobicContact CB-CG2 3.74Å; F94-V98 WeakPolarHBondContact O-CB 3.41Å; F94-V98 VanDerWaalsContact O-CG2 3.32Å; F94-V98 WeakPolarHBondContact O-CG2 3.44Å; F94-V98 PolarHBondContact O-N 3Å; V98-A100 VanDerWaalsContact C-N 3.33Å; V98-A100 PolarHBondContact O-N 2.66Å; V98-A101 PolarHBondContact O-N 3.48Å; V98-L102 HydrophobicContact CG1-CD1 3.97Å; V98-L102 HydrophobicContact CG1-CG 4.4Å; V98-L102 WeakPolarHBondContact O-CG 3.46Å; V98-L102 PolarHBondContact O-N 3.17Å; V98-F125 HydrophobicContact CB-CD2 4.21Å; V98-F125 HydrophobicContact CB-CE2 3.77Å; V98-F125 HydrophobicContact CB-CZ 4.1Å; V98-F125 HydrophobicContact CG1-CD1 4.49Å; V98-F125 HydrophobicContact CG1-CD2 3.41Å; V98-F125 VanDerWaalsContact CG1-CD2 3.41Å; V98-F125 HydrophobicContact CG1-CE2 3.51Å; V98-F125 HydrophobicContact CG1-CG 3.93Å; V98-F125 HydrophobicContact CG1-CZ 4.13Å; V98-F125 HydrophobicContact CG2-CE2 4.07Å
99	I	91.8	Very high	85.7	Confident	4 Å²	4	49.4 Å²	49.4	2%	0.021	25%	0.246	C	C	.	.	H	α-helix	trans	-59.5	-47.9	179.1	-66.8	171.3	0	0	0	109.4	H95 A101 L102 L103 L122 F125 L134 Y137	H95-I99 HydrophobicContact CB-CD1 4.36Å; H95-I99 VanDerWaalsContact O-CB 3.25Å; H95-I99 WeakPolarHBondContact O-CB 3.46Å; H95-I99 VanDerWaalsContact O-CG1 3.24Å; H95-I99 WeakPolarHBondContact O-CG1 3.29Å; H95-I99 PolarHBondContact O-N 3.3Å; I99-A101 VanDerWaalsContact C-N 3.34Å; I99-A101 PolarHBondContact O-N 2.91Å; I99-L102 PolarHBondContact O-N 3.1Å; I99-L103 HydrophobicContact CG2-CD1 3.63Å; I99-L103 HydrophobicContact CG2-CG 4.13Å; I99-L103 WeakPolarHBondContact O-CB 3.22Å; I99-L103 VanDerWaalsContact O-CG 3.22Å; I99-L103 WeakPolarHBondContact O-CG 3.47Å; I99-L103 PolarHBondContact O-N 3.1Å; I99-L122 HydrophobicContact CG1-CD1 4.48Å; I99-F125 HydrophobicContact CD1-CD1 4.47Å; I99-F125 HydrophobicContact CD1-CE1 4Å; I99-F125 HydrophobicContact CG1-CD1 4.06Å; I99-F125 HydrophobicContact CG1-CE1 3.84Å; I99-L134 HydrophobicContact CD1-CD1 4.4Å; I99-Y137 HydrophobicContact CD1-CD2 3.83Å; I99-Y137 HydrophobicContact CD1-CE2 4.46Å; I99-Y137 HydrophobicContact CD1-CG 3.96Å
100	A	90.2	Very high	85.5	Confident	48 Å²	48	48.3 Å²	48.3	40%	0.397	26%	0.261	S	S	.	.	H	α-helix	trans	-61.4	-39.1	179	0	0	0	0	0	113.1	E96 V98 R104	E96-A100 WeakPolarHBondContact O-CB 3.41Å; E96-A100 PolarHBondContact O-N 3.35Å; V98-A100 VanDerWaalsContact C-N 3.33Å; V98-A100 PolarHBondContact O-N 2.66Å; A100-R104 VanDerWaalsContact O-CB 3.28Å; A100-R104 WeakPolarHBondContact O-CB 3.42Å; A100-R104 PolarHBondContact O-N 3.16Å; A100-R104 VanDerWaalsContact O-N 3.09Å
101	A	87.1	Confident	85.8	Confident	17 Å²	17	50.5 Å²	50.5	14%	0.14	27%	0.273	C	S	.	.	H	α-helix	trans	-68	-43.6	179	0	0	0	0	0	112.4	Y64 T97 V98 I99 T105	Y64-A101 HydrophobicContact CE2-CB 4.46Å; T97-A101 VanDerWaalsContact O-CB 3.25Å; T97-A101 WeakPolarHBondContact O-CB 3.23Å; T97-A101 PolarHBondContact O-N 2.89Å; V98-A101 PolarHBondContact O-N 3.48Å; I99-A101 VanDerWaalsContact C-N 3.34Å; I99-A101 PolarHBondContact O-N 2.91Å; A101-T105 WeakPolarHBondContact O-CB 3.31Å; A101-T105 PolarHBondContact O-N 3.08Å; A101-T105 PolarHBondContact O-OG1 3.24Å
102	L	92.1	Very high	85.9	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-67.2	-47.8	179.1	-69.4	178.3	0	0	0	111.6	L79 V98 I99 R104 T105 M106 A118 A121 L122	L79-L102 HydrophobicContact CD2-CD1 3.72Å; L79-L102 HydrophobicContact CD2-CD2 4.06Å; L79-L102 HydrophobicContact CD2-CG 4.09Å; V98-L102 HydrophobicContact CG1-CD1 3.97Å; V98-L102 HydrophobicContact CG1-CG 4.4Å; V98-L102 WeakPolarHBondContact O-CG 3.46Å; V98-L102 PolarHBondContact O-N 3.17Å; I99-L102 PolarHBondContact O-N 3.1Å; L102-R104 VanDerWaalsContact C-N 3.32Å; L102-R104 PolarHBondContact O-N 3.28Å; L102-T105 WeakPolarHBondContact O-CA 3.19Å; L102-T105 WeakPolarHBondContact O-CB 3.33Å; L102-T105 PolarHBondContact O-N 3.27Å; L102-M106 WeakPolarHBondContact O-CG 3.35Å; L102-M106 PolarHBondContact O-N 2.82Å; L102-A118 HydrophobicContact CD2-CB 4.26Å; L102-A121 HydrophobicContact CD1-CB 4.16Å; L102-A121 HydrophobicContact CD2-CB 3.79Å; L102-L122 HydrophobicContact CD1-CB 3.92Å; L102-L122 HydrophobicContact CD1-CD1 4.11Å
103	L	93	Very high	86	Confident	8 Å²	8	55.5 Å²	55.5	4%	0.042	29%	0.29	C	S	.	.	H	α-helix	trans	-58.8	-42.7	177.2	-70.6	-179.2	0	0	0	112	I99 T105 M106 E107 L122 M141 N144	I99-L103 HydrophobicContact CG2-CD1 3.63Å; I99-L103 HydrophobicContact CG2-CG 4.13Å; I99-L103 WeakPolarHBondContact O-CB 3.22Å; I99-L103 VanDerWaalsContact O-CG 3.22Å; I99-L103 WeakPolarHBondContact O-CG 3.47Å; I99-L103 PolarHBondContact O-N 3.1Å; L103-T105 VanDerWaalsContact C-N 3.31Å; L103-T105 PolarHBondContact O-N 3.08Å; L103-M106 PolarHBondContact O-N 3.18Å; L103-E107 PolarHBondContact O-N 3.3Å; L103-E107 VanDerWaalsContact O-N 3.11Å; L103-L122 HydrophobicContact CD2-CD2 3.73Å; L103-M141 HydrophobicContact CD1-CB 4.2Å; L103-M141 HydrophobicContact CD1-CG 4.41Å; L103-M141 HydrophobicContact CD2-CG 4.18Å; L103-N144 HydrophobicContact CD1-CB 4.38Å; L103-N144 HydrophobicContact CD2-CB 4.22Å; L103-N144 WeakPolarHBondContact CD2-OD1 3.49Å; L103-N144 PolarHBondContact O-ND2 3.37Å
104	R	90.6	Very high	86.5	Confident	103 Å²	103	48.5 Å²	48.5	39%	0.389	26%	0.26	S	S	.	.	H	α-helix	trans	-63.1	-38.5	174.2	-174.3	-177.6	-61.5	166.8	5.6	112.2	A100 L102 M106 E107 N108	A100-R104 VanDerWaalsContact O-CB 3.28Å; A100-R104 WeakPolarHBondContact O-CB 3.42Å; A100-R104 PolarHBondContact O-N 3.16Å; A100-R104 VanDerWaalsContact O-N 3.09Å; L102-R104 VanDerWaalsContact C-N 3.32Å; L102-R104 PolarHBondContact O-N 3.28Å; R104-M106 VanDerWaalsContact C-N 3.3Å; R104-E107 PolarHBondContact O-N 2.86Å; R104-N108 WeakPolarHBondContact O-CB 3.39Å; R104-N108 PolarHBondContact O-N 3.05Å
105	T	89.7	Confident	87	Confident	6 Å²	6	47.8 Å²	47.8	4%	0.037	26%	0.257	C	S	.	.	H	α-helix	trans	-69.7	-30.8	180	-58.7	0	0	0	0	111.3	A101 L102 L103 Q109 V114 A118	A101-T105 WeakPolarHBondContact O-CB 3.31Å; A101-T105 PolarHBondContact O-N 3.08Å; A101-T105 PolarHBondContact O-OG1 3.24Å; L102-T105 WeakPolarHBondContact O-CA 3.19Å; L102-T105 WeakPolarHBondContact O-CB 3.33Å; L102-T105 PolarHBondContact O-N 3.27Å; L103-T105 VanDerWaalsContact C-N 3.31Å; L103-T105 PolarHBondContact O-N 3.08Å; T105-Q109 HydrophobicContact CG2-CG 3.99Å; T105-Q109 WeakPolarHBondContact O-CB 3.29Å; T105-Q109 WeakPolarHBondContact O-CG 3.25Å; T105-V114 HydrophobicContact CG2-CG1 3.71Å; T105-A118 HydrophobicContact CG2-CB 3.69Å
106	M	91.3	Very high	87.2	Confident	3 Å²	3	47.1 Å²	47.1	2%	0.015	26%	0.256	C	S	.	.	H	α-helix	trans	-68.6	-42.8	172.1	-68.1	172	61.2	0	0	111.9	L102 L103 R104 Q115 A118 A119 L122 L145 V148 L168	L102-M106 WeakPolarHBondContact O-CG 3.35Å; L102-M106 PolarHBondContact O-N 2.82Å; L103-M106 PolarHBondContact O-N 3.18Å; R104-M106 VanDerWaalsContact C-N 3.3Å; M106-Q115 WeakPolarHBondContact O-CG 3.49Å; M106-Q115 PolarHBondContact O-NE2 3.34Å; M106-A118 HydrophobicContact CG-CB 3.83Å; M106-A119 HydrophobicContact CE-CB 3.78Å; M106-A119 HydrophobicContact CG-CB 4.3Å; M106-A119 HydrophobicContact SD-CB 3.93Å; M106-L122 HydrophobicContact SD-CD2 4.16Å; M106-L145 HydrophobicContact CE-CD2 3.49Å; M106-L145 VanDerWaalsContact CE-CD2 3.49Å; M106-V148 HydrophobicContact CB-CG2 4.48Å; M106-L168 HydrophobicContact CE-CD1 3.38Å
107	E	87.6	Confident	87.3	Confident	78 Å²	78	44.5 Å²	44.5	36%	0.364	24%	0.243	S	C	.	.	H	α-helix	trans	-72.5	-55.1	178.5	-74.8	179.2	162.4	0	0	113.3	L103 R104 Q109 N144 V148	L103-E107 PolarHBondContact O-N 3.3Å; L103-E107 VanDerWaalsContact O-N 3.11Å; R104-E107 PolarHBondContact O-N 2.86Å; E107-Q109 PolarHBondContact O-N 3.21Å; E107-N144 WeakPolarHBondContact CG-ND2 3.39Å; E107-N144 VanDerWaalsContact OE1-CG 3.32Å; E107-N144 PolarHBondContact OE1-ND2 3.3Å; E107-N144 PolarHBondContact OE2-ND2 2.71Å; E107-V148 HydrophobicContact CB-CG2 4.43Å; E107-V148 HydrophobicContact CG-CG2 3.53Å
108	N	76.3	Confident	87.8	Confident	112 Å²	112	41.4 Å²	41.4	60%	0.599	23%	0.225	S	C	*	.	S	Bend	trans	-98.3	42	-161.9	-67	-45.5	0	0	0	113.6	R104	R104-N108 WeakPolarHBondContact O-CB 3.39Å; R104-N108 PolarHBondContact O-N 3.05Å
109	Q	71.3	Confident	88.3	Confident	33 Å²	33	41.5 Å²	41.5	15%	0.154	23%	0.226	C	C	.	.			trans	-132.4	123.8	179.8	-72.1	-65.7	-43.6	0	0	112.1	T105 E107 N111 V114 Q115	T105-Q109 HydrophobicContact CG2-CG 3.99Å; T105-Q109 WeakPolarHBondContact O-CB 3.29Å; T105-Q109 WeakPolarHBondContact O-CG 3.25Å; E107-Q109 PolarHBondContact O-N 3.21Å; Q109-N111 PolarHBondContact O-N 2.9Å; Q109-V114 HydrophobicContact CG-CG1 4.06Å; Q109-Q115 HydrophobicContact CB-CG 3.81Å; Q109-Q115 VanDerWaalsContact O-CD 3.23Å; Q109-Q115 PolarHBondContact O-NE2 3.42Å
110	G	75.6	Confident	88.4	Confident	89 Å²	89	43.5 Å²	43.5	92%	0.918	24%	0.24	S	C	*	.	S	Bend	trans	-74.5	-8.8	171.2	0	0	0	0	0	113.8
111	N	86.3	Confident	88.5	Confident	49 Å²	49	41.2 Å²	41.2	26%	0.262	22%	0.221	S	C	.	.			trans	-102.8	111.9	-179.8	-168.8	-57.3	0	0	0	111.2	P69 Q109 R113 V114 Q115	P69-N111 HydrophobicContact CB-CB 4.22Å; P69-N111 WeakPolarHBondContact CB-ND2 3.35Å; Q109-N111 PolarHBondContact O-N 2.9Å; N111-R113 VanDerWaalsContact C-N 3.27Å; N111-R113 PolarHBondContact O-N 2.81Å; N111-R113 WeakPolarHBondContact OD1-CB 3.47Å; N111-R113 PolarHBondContact OD1-N 3.31Å; N111-V114 HydrophobicContact CB-CB 4.38Å; N111-V114 HydrophobicContact CB-CG2 3.97Å; N111-V114 PolarHBondContact O-N 2.9Å; N111-V114 VanDerWaalsContact O-N 3.13Å; N111-V114 PolarHBondContact OD1-N 3.02Å; N111-Q115 PolarHBondContact O-N 3.41Å
112	Q	89.3	Confident	89	Confident	37 Å²	37	40.4 Å²	40.4	17%	0.173	21%	0.214	C	C	.	.	H	α-helix	trans	-65.2	-26.3	-176.4	-63.8	-170.5	-32.2	0	0	114.7	Q115 S116 E155 T161 A164	Q112-Q115 PolarHBondContact O-N 3.5Å; Q112-S116 WeakPolarHBondContact O-CB 3.44Å; Q112-S116 PolarHBondContact O-N 2.83Å; Q112-E155 PolarHBondContact NE2-OE2 3.31Å; Q112-E155 VanDerWaalsContact NE2-OE2 3.17Å; Q112-T161 VanDerWaalsContact NE2-CB 3.32Å; Q112-A164 HydrophobicContact CB-CB 4.07Å; Q112-A164 HydrophobicContact CG-CB 4.31Å
113	R	88.7	Confident	89.2	Confident	178 Å²	178	41.7 Å²	41.7	67%	0.672	22%	0.221	S	C	*	.	H	α-helix	trans	-66.6	-44.6	174.9	-61.2	-175.2	179.8	-149.1	0.8	109.8	N111 Q115 S116 H117 L163	N111-R113 VanDerWaalsContact C-N 3.27Å; N111-R113 PolarHBondContact O-N 2.81Å; N111-R113 WeakPolarHBondContact OD1-CB 3.47Å; N111-R113 PolarHBondContact OD1-N 3.31Å; R113-Q115 VanDerWaalsContact C-N 3.33Å; R113-Q115 PolarHBondContact O-N 2.92Å; R113-S116 PolarHBondContact O-N 2.97Å; R113-H117 PolarHBondContact O-CD2 2.96Å; R113-H117 PolarHBondContact O-N 3.21Å; R113-L163 HydrophobicContact CG-CD2 3.85Å
114	V	88.3	Confident	89.2	Confident	1 Å²	1	43.4 Å²	43.4	1%	0.006	23%	0.23	C	C	.	.	H	α-helix	trans	-61.4	-43.4	177.6	-178	0	0	0	0	110.8	P69 R72 A73 T105 Q109 N111 S116 H117 A118	P69-V114 HydrophobicContact CB-CG2 3.87Å; P69-V114 VanDerWaalsContact O-CG2 3.28Å; P69-V114 WeakPolarHBondContact O-CG2 3.39Å; R72-V114 HydrophobicContact CB-CG1 3.69Å; R72-V114 HydrophobicContact CB-CG2 4.08Å; A73-V114 HydrophobicContact CB-CG2 4.43Å; T105-V114 HydrophobicContact CG2-CG1 3.71Å; Q109-V114 HydrophobicContact CG-CG1 4.06Å; N111-V114 HydrophobicContact CB-CB 4.38Å; N111-V114 HydrophobicContact CB-CG2 3.97Å; N111-V114 PolarHBondContact O-N 2.9Å; N111-V114 VanDerWaalsContact O-N 3.13Å; N111-V114 PolarHBondContact OD1-N 3.02Å; V114-S116 VanDerWaalsContact C-N 3.34Å; V114-S116 PolarHBondContact O-N 2.96Å; V114-H117 PolarHBondContact O-N 3.35Å; V114-A118 PolarHBondContact O-N 2.87Å
115	Q	93.1	Very high	89.4	Confident	10 Å²	10	38.5 Å²	38.5	5%	0.047	21%	0.211	C	C	.	.	H	α-helix	trans	-59.5	-44.3	175.4	-68.5	175.1	-43.1	0	0	112.2	M106 Q109 N111 Q112 R113 A118 A119 K152 A164	M106-Q115 WeakPolarHBondContact O-CG 3.49Å; M106-Q115 PolarHBondContact O-NE2 3.34Å; Q109-Q115 HydrophobicContact CB-CG 3.81Å; Q109-Q115 VanDerWaalsContact O-CD 3.23Å; Q109-Q115 PolarHBondContact O-NE2 3.42Å; N111-Q115 PolarHBondContact O-N 3.41Å; Q112-Q115 PolarHBondContact O-N 3.5Å; R113-Q115 VanDerWaalsContact C-N 3.33Å; R113-Q115 PolarHBondContact O-N 2.92Å; Q115-A118 PolarHBondContact O-N 2.95Å; Q115-A119 WeakPolarHBondContact O-CB 3.44Å; Q115-A119 PolarHBondContact O-N 2.8Å; Q115-K152 VanDerWaalsContact OE1-CE 3.27Å; Q115-A164 HydrophobicContact CB-CB 4.1Å
116	S	93.6	Very high	89.6	Confident	20 Å²	20	38.2 Å²	38.2	14%	0.14	21%	0.209	C	C	.	.	H	α-helix	trans	-62.6	-45	176.4	174.6	0	0	0	0	111.8	Q112 R113 V114 A118 A119 S120 Q167	Q112-S116 WeakPolarHBondContact O-CB 3.44Å; Q112-S116 PolarHBondContact O-N 2.83Å; R113-S116 PolarHBondContact O-N 2.97Å; V114-S116 VanDerWaalsContact C-N 3.34Å; V114-S116 PolarHBondContact O-N 2.96Å; S116-A118 VanDerWaalsContact C-N 3.35Å; S116-A118 PolarHBondContact O-N 2.8Å; S116-A119 PolarHBondContact O-N 3.28Å; S116-S120 WeakPolarHBondContact O-CB 3.42Å; S116-S120 PolarHBondContact O-N 3.46Å; S116-Q167 WeakPolarHBondContact O-CG 3.43Å
117	H	88.6	Confident	89.7	Confident	73 Å²	73	44.8 Å²	44.8	34%	0.338	24%	0.24	S	C	.	.	H	α-helix	trans	-62.6	-39.8	175.7	-79	-82.2	0	0	0	112.6	A73 C76 T77 R113 V114 S120 A121	A73-H117 HydrophobicContact CB-CB 4.38Å; C76-H117 HydrophobicContact CB-CB 3.8Å; T77-H117 PolarHBondContact OG1-ND1 3.34Å; R113-H117 PolarHBondContact O-CD2 2.96Å; R113-H117 PolarHBondContact O-N 3.21Å; V114-H117 PolarHBondContact O-N 3.35Å; H117-S120 PolarHBondContact O-N 2.89Å; H117-A121 WeakPolarHBondContact O-CB 3.37Å; H117-A121 PolarHBondContact O-N 3.25Å
118	A	93.8	Very high	89.9	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-64.7	-43.6	175.8	0	0	0	0	0	112.2	L102 T105 M106 V114 Q115 S116 S120 A121 L122	L102-A118 HydrophobicContact CD2-CB 4.26Å; T105-A118 HydrophobicContact CG2-CB 3.69Å; M106-A118 HydrophobicContact CG-CB 3.83Å; V114-A118 PolarHBondContact O-N 2.87Å; Q115-A118 PolarHBondContact O-N 2.95Å; S116-A118 VanDerWaalsContact C-N 3.35Å; S116-A118 PolarHBondContact O-N 2.8Å; A118-S120 VanDerWaalsContact C-N 3.33Å; A118-S120 PolarHBondContact O-N 3.18Å; A118-A121 PolarHBondContact O-N 3.25Å; A118-L122 PolarHBondContact O-N 3.43Å
119	A	96.1	Very high	90.6	Very high	3 Å²	3	39.4 Å²	39.4	3%	0.025	21%	0.214	C	C	.	.	H	α-helix	trans	-64.3	-37.6	176.7	0	0	0	0	0	112.2	M106 Q115 S116 L122 I123 Q167 T171	M106-A119 HydrophobicContact CE-CB 3.78Å; M106-A119 HydrophobicContact CG-CB 4.3Å; M106-A119 HydrophobicContact SD-CB 3.93Å; Q115-A119 WeakPolarHBondContact O-CB 3.44Å; Q115-A119 PolarHBondContact O-N 2.8Å; S116-A119 PolarHBondContact O-N 3.28Å; A119-L122 PolarHBondContact O-N 3.34Å; A119-I123 WeakPolarHBondContact O-CG1 3.44Å; A119-I123 PolarHBondContact O-N 3.32Å; A119-Q167 HydrophobicContact CB-CB 4.38Å; A119-Q167 HydrophobicContact CB-CG 3.67Å; A119-T171 WeakPolarHBondContact CB-OG1 3.46Å; A119-T171 PolarHBondContact O-OG1 3.42Å
120	S	94.9	Very high	91.6	Very high	45 Å²	45	39.3 Å²	39.3	32%	0.315	22%	0.217	S	C	.	.	H	α-helix	trans	-65.9	-45.1	173	-167.9	0	0	0	0	112	S116 H117 A118 L122 I123 I124	S116-S120 WeakPolarHBondContact O-CB 3.42Å; S116-S120 PolarHBondContact O-N 3.46Å; H117-S120 PolarHBondContact O-N 2.89Å; A118-S120 VanDerWaalsContact C-N 3.33Å; A118-S120 PolarHBondContact O-N 3.18Å; S120-L122 PolarHBondContact O-N 2.98Å; S120-I123 PolarHBondContact O-N 3.31Å; S120-I124 WeakPolarHBondContact O-CG1 3.36Å; S120-I124 PolarHBondContact O-N 2.94Å
121	A	92.1	Very high	92.3	Very high	1 Å²	1	39.9 Å²	39.9	1%	0.008	19%	0.194	C	C	.	.	H	α-helix	trans	-63.1	-31.7	176.8	0	0	0	0	0	112.2	C76 L79 L102 H117 A118 I124 F125	C76-A121 HydrophobicContact CB-CB 4.45Å; C76-A121 WeakPolarHBondContact O-CB 3.22Å; L79-A121 HydrophobicContact CD2-CB 4.29Å; L102-A121 HydrophobicContact CD1-CB 4.16Å; L102-A121 HydrophobicContact CD2-CB 3.79Å; H117-A121 WeakPolarHBondContact O-CB 3.37Å; H117-A121 PolarHBondContact O-N 3.25Å; A118-A121 PolarHBondContact O-N 3.25Å; A121-I124 PolarHBondContact O-N 3.43Å; A121-F125 WeakPolarHBondContact O-CB 3.5Å; A121-F125 PolarHBondContact O-N 3.36Å
122	L	96.6	Very high	92.6	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-66.7	-42.6	175.7	-176.1	59.8	0	0	0	111.7	I99 L102 L103 M106 A118 A119 S120 F125 I126 M141 T171	I99-L122 HydrophobicContact CG1-CD1 4.48Å; L102-L122 HydrophobicContact CD1-CB 3.92Å; L102-L122 HydrophobicContact CD1-CD1 4.11Å; L103-L122 HydrophobicContact CD2-CD2 3.73Å; M106-L122 HydrophobicContact SD-CD2 4.16Å; A118-L122 PolarHBondContact O-N 3.43Å; A119-L122 PolarHBondContact O-N 3.34Å; S120-L122 PolarHBondContact O-N 2.98Å; L122-F125 WeakPolarHBondContact O-CB 3.38Å; L122-F125 PolarHBondContact O-N 2.94Å; L122-I126 HydrophobicContact CD1-CG2 4.13Å; L122-I126 WeakPolarHBondContact O-CG1 3.18Å; L122-I126 WeakPolarHBondContact O-CG2 3.33Å; L122-I126 PolarHBondContact O-N 2.91Å; L122-M141 HydrophobicContact CD1-SD 4.48Å; L122-M141 HydrophobicContact CD2-SD 4.38Å; L122-T171 HydrophobicContact CB-CG2 4.43Å; L122-T171 HydrophobicContact CD2-CG2 3.9Å; L122-T171 HydrophobicContact CG-CG2 4.31Å
123	I	96.4	Very high	92.7	Very high	27 Å²	27	41.7 Å²	41.7	14%	0.138	21%	0.212	C	C	.	.	H	α-helix	trans	-56.5	-52.3	174.6	-66.6	168.9	0	0	0	110.1	A119 S120 F125 I126 E127 T170 T171	A119-I123 WeakPolarHBondContact O-CG1 3.44Å; A119-I123 PolarHBondContact O-N 3.32Å; S120-I123 PolarHBondContact O-N 3.31Å; I123-F125 PolarHBondContact O-N 2.91Å; I123-I126 WeakPolarHBondContact O-CG1 3.38Å; I123-I126 PolarHBondContact O-N 3.31Å; I123-I126 VanDerWaalsContact O-N 3.14Å; I123-E127 PolarHBondContact O-N 2.98Å; I123-E127 VanDerWaalsContact O-N 3.08Å; I123-T170 HydrophobicContact CD1-CG2 3.95Å; I123-T171 HydrophobicContact CG1-CG2 4.13Å
124	I	94.1	Very high	92.8	Very high	44 Å²	44	33.3 Å²	33.3	23%	0.226	18%	0.18	C	C	.	.	H	α-helix	trans	-59.5	-38	-179.5	-60.2	165.7	0	0	0	110.5	G80 A83 T84 S120 A121	G80-I124 WeakPolarHBondContact O-CG2 3.42Å; A83-I124 HydrophobicContact CB-CG2 4.31Å; T84-I124 WeakPolarHBondContact OG1-CG2 3.37Å; S120-I124 WeakPolarHBondContact O-CG1 3.36Å; S120-I124 PolarHBondContact O-N 2.94Å; A121-I124 PolarHBondContact O-N 3.43Å
125	F	94	Very high	92.9	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-66.2	-42.9	177.8	-171.8	-87.9	0	0	0	113.3	A83 F90 Q91 H95 V98 I99 A121 L122 I123 C129	A83-F125 HydrophobicContact CB-CB 4.2Å; A83-F125 HydrophobicContact CB-CD2 3.81Å; A83-F125 HydrophobicContact CB-CG 4.43Å; F90-F125 HydrophobicContact CD1-CD2 4.06Å; F90-F125 AromaticContact CD1-CE2 3.68Å; F90-F125 HydrophobicContact CD1-CE2 3.68Å; F90-F125 AromaticContact CE1-CD2 3.94Å; F90-F125 HydrophobicContact CE1-CD2 3.94Å; F90-F125 AromaticContact CE1-CE2 3.71Å; F90-F125 HydrophobicContact CE1-CE2 3.71Å; Q91-F125 HydrophobicContact CB-CE1 4.35Å; Q91-F125 HydrophobicContact CB-CE2 4.4Å; Q91-F125 HydrophobicContact CB-CZ 3.96Å; Q91-F125 HydrophobicContact CG-CD1 4.4Å; Q91-F125 HydrophobicContact CG-CD2 4.25Å; Q91-F125 HydrophobicContact CG-CE1 4.07Å; Q91-F125 HydrophobicContact CG-CE2 3.93Å; Q91-F125 HydrophobicContact CG-CG 4.48Å; Q91-F125 HydrophobicContact CG-CZ 3.83Å; Q91-F125 WeakPolarHBondContact CG-O 3.47Å; H95-F125 HydrophobicContact CB-CE1 4.35Å; H95-F125 HydrophobicContact CB-CZ 4.21Å; V98-F125 HydrophobicContact CB-CD2 4.21Å; V98-F125 HydrophobicContact CB-CE2 3.77Å; V98-F125 HydrophobicContact CB-CZ 4.1Å; V98-F125 HydrophobicContact CG1-CD1 4.49Å; V98-F125 HydrophobicContact CG1-CD2 3.41Å; V98-F125 VanDerWaalsContact CG1-CD2 3.41Å; V98-F125 HydrophobicContact CG1-CE2 3.51Å; V98-F125 HydrophobicContact CG1-CG 3.93Å; V98-F125 HydrophobicContact CG1-CZ 4.13Å; V98-F125 HydrophobicContact CG2-CE2 4.07Å; I99-F125 HydrophobicContact CD1-CD1 4.47Å; I99-F125 HydrophobicContact CD1-CE1 4Å; I99-F125 HydrophobicContact CG1-CD1 4.06Å; I99-F125 HydrophobicContact CG1-CE1 3.84Å; A121-F125 WeakPolarHBondContact O-CB 3.5Å; A121-F125 PolarHBondContact O-N 3.36Å; L122-F125 WeakPolarHBondContact O-CB 3.38Å; L122-F125 PolarHBondContact O-N 2.94Å; I123-F125 PolarHBondContact O-N 2.91Å; F125-C129 WeakPolarHBondContact O-CB 3.38Å; F125-C129 PolarHBondContact O-N 3.21Å
126	I	94.7	Very high	93	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-76.2	-27	-175.6	64.1	176.8	0	0	0	113.3	L122 I123 D128 C129 L134 M141 S174 V175	L122-I126 HydrophobicContact CD1-CG2 4.13Å; L122-I126 WeakPolarHBondContact O-CG1 3.18Å; L122-I126 WeakPolarHBondContact O-CG2 3.33Å; L122-I126 PolarHBondContact O-N 2.91Å; I123-I126 WeakPolarHBondContact O-CG1 3.38Å; I123-I126 PolarHBondContact O-N 3.31Å; I123-I126 VanDerWaalsContact O-N 3.14Å; I126-D128 VanDerWaalsContact C-N 3.32Å; I126-D128 PolarHBondContact O-N 3.29Å; I126-C129 WeakPolarHBondContact O-CB 3.11Å; I126-C129 PolarHBondContact O-N 3.45Å; I126-C129 VanDerWaalsContact O-N 3.09Å; I126-L134 HydrophobicContact CB-CD1 4.45Å; I126-L134 HydrophobicContact CB-CD2 4.28Å; I126-L134 HydrophobicContact CG2-CD1 3.77Å; I126-L134 HydrophobicContact CG2-CD2 4.4Å; I126-M141 HydrophobicContact CG2-SD 4.47Å; I126-S174 WeakPolarHBondContact CD1-OG 3.19Å; I126-V175 HydrophobicContact CD1-CB 4.35Å; I126-V175 HydrophobicContact CD1-CG2 3.52Å
127	E	91.7	Very high	93	Very high	141 Å²	141	42 Å²	42	66%	0.659	22%	0.223	S	C	*	.	H	α-helix	trans	-55.5	-45.3	179.8	-172.4	172.7	176.9	0	0	112.1	I123	I123-E127 PolarHBondContact O-N 2.98Å; I123-E127 VanDerWaalsContact O-N 3.08Å
128	D	91.5	Very high	93.2	Very high	68 Å²	68	38.9 Å²	38.9	36%	0.364	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.3	10.2	178.3	-75.4	-56.2	0	0	0	113.4	A87 Q91 I126	A87-D128 HydrophobicContact CB-CB 3.61Å; Q91-D128 VanDerWaalsContact NE2-CB 3.32Å; I126-D128 VanDerWaalsContact C-N 3.32Å; I126-D128 PolarHBondContact O-N 3.29Å
129	C	92.9	Very high	93.3	Very high	8 Å²	8	42.2 Å²	42.2	5%	0.054	23%	0.227	C	C	.	.	S	Bend	trans	-82.4	125.7	179.4	-170.3	0	0	0	0	110.7	Q91 F125 I126 K131	Q91-C129 HydrophobicContact CB-CB 4.25Å; Q91-C129 HydrophobicContact CG-CB 3.99Å; F125-C129 WeakPolarHBondContact O-CB 3.38Å; F125-C129 PolarHBondContact O-N 3.21Å; I126-C129 WeakPolarHBondContact O-CB 3.11Å; I126-C129 PolarHBondContact O-N 3.45Å; I126-C129 VanDerWaalsContact O-N 3.09Å; C129-K131 PolarHBondContact O-N 3.44Å; C129-K131 VanDerWaalsContact O-N 3.16Å
130	P	92.3	Very high	93.2	Very high	32 Å²	32	45.8 Å²	45.8	21%	0.208	25%	0.252	C	S	.	.			trans	-54.3	126	174.3	-25.8	34.2	0	0	0	111.2	K92 S132 L133 L134	K92-P130 HydrophobicContact CG-CG 4.06Å; P130-S132 PolarHBondContact O-N 3.26Å; P130-L133 HydrophobicContact CB-CD1 4.32Å; P130-L133 HydrophobicContact CB-CG 4.41Å; P130-L133 HydrophobicContact CG-CD1 4.09Å; P130-L133 WeakPolarHBondContact O-CA 3.5Å; P130-L133 WeakPolarHBondContact O-CB 3.3Å; P130-L133 PolarHBondContact O-N 2.8Å; P130-L134 PolarHBondContact O-N 3.49Å; P130-L134 VanDerWaalsContact O-N 3.08Å
131	K	89.9	Confident	93.2	Very high	100 Å²	100	43.7 Å²	43.7	44%	0.435	24%	0.237	S	C	.	.	H	α-helix	trans	-50.3	-36.9	178.6	-72	-173.4	176.1	-177.1	0	112.2	C129 L133 L134 V135 T178 E180	C129-K131 PolarHBondContact O-N 3.44Å; C129-K131 VanDerWaalsContact O-N 3.16Å; K131-L133 PolarHBondContact O-N 3.26Å; K131-L134 PolarHBondContact O-N 2.91Å; K131-V135 WeakPolarHBondContact O-CG1 3.28Å; K131-V135 WeakPolarHBondContact O-CG2 3.34Å; K131-V135 PolarHBondContact O-N 3.26Å; K131-T178 VanDerWaalsContact CE-O 3.23Å; K131-T178 WeakPolarHBondContact CE-O 3.34Å; K131-E180 IonicContact NZ-OE1 3.68Å; K131-E180 PolarHBondContact NZ-OE1 3.2Å; K131-E180 IonicContact NZ-OE2 2.77Å; K131-E180 PolarHBondContact NZ-OE2 3.13Å
132	S	91.4	Very high	93.3	Very high	91 Å²	91	43.7 Å²	43.7	64%	0.636	24%	0.237	S	C	*	.	H	α-helix	trans	-62.5	-25.3	177.1	61.9	0	0	0	0	114.6	P130 V135	P130-S132 PolarHBondContact O-N 3.26Å; S132-V135 VanDerWaalsContact O-CG2 3.29Å; S132-V135 WeakPolarHBondContact O-CG2 3.43Å
133	L	92.2	Very high	93.2	Very high	34 Å²	34	49.1 Å²	49.1	18%	0.178	26%	0.261	C	S	.	.	H	α-helix	trans	-89.7	-43.4	173.9	-70.9	175	0	0	0	111.3	K92 P130 K131 V135 L136 Y137	K92-L133 HydrophobicContact CB-CD1 4.24Å; K92-L133 HydrophobicContact CG-CD1 3.88Å; P130-L133 HydrophobicContact CB-CD1 4.32Å; P130-L133 HydrophobicContact CB-CG 4.41Å; P130-L133 HydrophobicContact CG-CD1 4.09Å; P130-L133 WeakPolarHBondContact O-CA 3.5Å; P130-L133 WeakPolarHBondContact O-CB 3.3Å; P130-L133 PolarHBondContact O-N 2.8Å; K131-L133 PolarHBondContact O-N 3.26Å; L133-V135 PolarHBondContact O-N 3.04Å; L133-L136 HydrophobicContact CD2-CD1 4.31Å; L133-L136 VanDerWaalsContact O-CB 3.3Å; L133-L136 WeakPolarHBondContact O-CB 3.21Å; L133-L136 WeakPolarHBondContact O-CG 3.24Å; L133-L136 PolarHBondContact O-N 3.13Å; L133-L136 VanDerWaalsContact O-N 3.1Å; L133-Y137 WeakPolarHBondContact O-CD2 3.47Å
134	L	90.6	Very high	93.2	Very high	1 Å²	1	48.6 Å²	48.6	1%	0.005	26%	0.258	C	S	.	.	H	α-helix	trans	-59	-37.6	-176.6	-171.1	62.3	0	0	0	112.1	I99 I126 P130 K131 L136 Y137 V138 M141 T178 I179	I99-L134 HydrophobicContact CD1-CD1 4.4Å; I126-L134 HydrophobicContact CB-CD1 4.45Å; I126-L134 HydrophobicContact CB-CD2 4.28Å; I126-L134 HydrophobicContact CG2-CD1 3.77Å; I126-L134 HydrophobicContact CG2-CD2 4.4Å; P130-L134 PolarHBondContact O-N 3.49Å; P130-L134 VanDerWaalsContact O-N 3.08Å; K131-L134 PolarHBondContact O-N 2.91Å; L134-L136 PolarHBondContact O-N 3.43Å; L134-L136 VanDerWaalsContact O-N 3.1Å; L134-Y137 PolarHBondContact O-N 2.97Å; L134-V138 PolarHBondContact O-N 3.48Å; L134-M141 HydrophobicContact CD1-CE 3.81Å; L134-M141 HydrophobicContact CD1-SD 4.4Å; L134-M141 HydrophobicContact CG-CE 4.26Å; L134-T178 HydrophobicContact CD2-CG2 3.4Å; L134-I179 HydrophobicContact CD2-CG2 3.86Å; L134-I179 HydrophobicContact CG-CG2 4.38Å
135	V	91	Very high	93.3	Very high	47 Å²	47	46.5 Å²	46.5	29%	0.285	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-24.2	179.6	-63.4	0	0	0	0	113.7	K131 S132 L133 Y137 K182	K131-V135 WeakPolarHBondContact O-CG1 3.28Å; K131-V135 WeakPolarHBondContact O-CG2 3.34Å; K131-V135 PolarHBondContact O-N 3.26Å; S132-V135 VanDerWaalsContact O-CG2 3.29Å; S132-V135 WeakPolarHBondContact O-CG2 3.43Å; L133-V135 PolarHBondContact O-N 3.04Å; V135-Y137 PolarHBondContact O-N 3.38Å; V135-K182 HydrophobicContact CG1-CD 3.64Å
136	L	94	Very high	93.4	Very high	122 Å²	122	49 Å²	49	64%	0.639	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-20.7	175.6	-56.1	175	0	0	0	112.4	L133 L134	L133-L136 HydrophobicContact CD2-CD1 4.31Å; L133-L136 VanDerWaalsContact O-CB 3.3Å; L133-L136 WeakPolarHBondContact O-CB 3.21Å; L133-L136 WeakPolarHBondContact O-CG 3.24Å; L133-L136 PolarHBondContact O-N 3.13Å; L133-L136 VanDerWaalsContact O-N 3.1Å; L134-L136 PolarHBondContact O-N 3.43Å; L134-L136 VanDerWaalsContact O-N 3.1Å
137	Y	94.6	Very high	93.5	Very high	44 Å²	44	51.5 Å²	51.5	17%	0.173	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.7	-9.3	-173.4	-60.8	-74.4	0	0	0	113.8	H95 E96 I99 L133 L134 V135 D139 S140 M141	H95-Y137 HydrophobicContact CB-CE2 4.13Å; H95-Y137 PolarHBondContact CE1-OH 3.27Å; H95-Y137 AromaticContact CG-CE2 3.96Å; H95-Y137 AromaticContact ND1-CE2 3.28Å; H95-Y137 VanDerWaalsContact ND1-CE2 3.28Å; H95-Y137 WeakPolarHBondContact ND1-CE2 3.34Å; H95-Y137 AromaticContact ND1-CZ 3.3Å; H95-Y137 VanDerWaalsContact ND1-CZ 3.3Å; H95-Y137 PolarHBondContact ND1-OH 3.5Å; E96-Y137 HydrophobicContact CB-CE1 4.43Å; E96-Y137 WeakPolarHBondContact CB-OH 3.28Å; E96-Y137 HydrophobicContact CG-CE1 4.36Å; I99-Y137 HydrophobicContact CD1-CD2 3.83Å; I99-Y137 HydrophobicContact CD1-CE2 4.46Å; I99-Y137 HydrophobicContact CD1-CG 3.96Å; L133-Y137 WeakPolarHBondContact O-CD2 3.47Å; L134-Y137 PolarHBondContact O-N 2.97Å; V135-Y137 PolarHBondContact O-N 3.38Å; Y137-D139 VanDerWaalsContact C-N 3.35Å; Y137-D139 PolarHBondContact O-N 3.04Å; Y137-S140 PolarHBondContact O-N 3.11Å; Y137-M141 VanDerWaalsContact O-CB 3.29Å; Y137-M141 WeakPolarHBondContact O-CB 3.25Å; Y137-M141 PolarHBondContact O-N 2.72Å
138	V	92.9	Very high	93.7	Very high	8 Å²	8	45.1 Å²	45.1	5%	0.048	25%	0.247	C	C	.	.	H	α-helix	trans	-51.6	-50.6	-171.9	165.9	0	0	0	0	112.2	L134 S140 M141 V142 I179 Y186	L134-V138 PolarHBondContact O-N 3.48Å; V138-S140 PolarHBondContact O-N 3.2Å; V138-M141 PolarHBondContact O-N 3.42Å; V138-V142 HydrophobicContact CG1-CG2 4.02Å; V138-V142 VanDerWaalsContact O-CB 3.25Å; V138-V142 WeakPolarHBondContact O-CB 3.36Å; V138-V142 WeakPolarHBondContact O-CG2 3.45Å; V138-V142 PolarHBondContact O-N 3.09Å; V138-I179 HydrophobicContact CB-CD1 4.48Å; V138-I179 HydrophobicContact CG1-CD1 3.52Å; V138-I179 HydrophobicContact CG2-CB 4.41Å; V138-I179 HydrophobicContact CG2-CD1 4.05Å; V138-I179 HydrophobicContact CG2-CG2 3.75Å; V138-Y186 HydrophobicContact CG1-CD2 4.47Å; V138-Y186 HydrophobicContact CG1-CE2 3.54Å
139	D	94.3	Very high	93.9	Very high	71 Å²	71	41.9 Å²	41.9	38%	0.38	23%	0.23	S	C	.	.	H	α-helix	trans	-61.5	-45.9	-176.1	-174.4	69.1	0	0	0	112.5	Y137 K143 Y186	Y137-D139 VanDerWaalsContact C-N 3.35Å; Y137-D139 PolarHBondContact O-N 3.04Å; D139-K143 VanDerWaalsContact CG-NZ 3.29Å; D139-K143 WeakPolarHBondContact O-CB 3.36Å; D139-K143 WeakPolarHBondContact O-CD 3.45Å; D139-K143 WeakPolarHBondContact O-CG 3.33Å; D139-K143 PolarHBondContact O-N 3.2Å; D139-K143 VanDerWaalsContact O-N 3.08Å; D139-K143 WeakPolarHBondContact OD1-CE 3.39Å; D139-K143 IonicContact OD1-NZ 2.8Å; D139-K143 PolarHBondContact OD1-NZ 3.01Å; D139-K143 VanDerWaalsContact OD1-NZ 3.16Å; D139-K143 VanDerWaalsContact OD2-CE 3.31Å; D139-K143 WeakPolarHBondContact OD2-CE 3.45Å; D139-K143 IonicContact OD2-NZ 2.95Å; D139-K143 PolarHBondContact OD2-NZ 3.46Å; D139-Y186 WeakPolarHBondContact CA-OH 3.49Å; D139-Y186 PolarHBondContact OD1-OH 3.42Å
140	S	94.3	Very high	94.1	Very high	78 Å²	78	44.2 Å²	44.2	55%	0.545	24%	0.244	S	C	.	.	H	α-helix	trans	-65.1	-45.7	177.3	-178.1	0	0	0	0	111.7	Y137 V138 N144	Y137-S140 PolarHBondContact O-N 3.11Å; V138-S140 PolarHBondContact O-N 3.2Å; S140-N144 WeakPolarHBondContact O-CB 3.49Å; S140-N144 PolarHBondContact O-N 3.25Å
141	M	94.6	Very high	94.2	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-62.6	-49	-179.7	-179.4	169.3	60.9	0	0	111.2	L103 L122 I126 L134 Y137 V138 N144 L145 V175	L103-M141 HydrophobicContact CD1-CB 4.2Å; L103-M141 HydrophobicContact CD1-CG 4.41Å; L103-M141 HydrophobicContact CD2-CG 4.18Å; L122-M141 HydrophobicContact CD1-SD 4.48Å; L122-M141 HydrophobicContact CD2-SD 4.38Å; I126-M141 HydrophobicContact CG2-SD 4.47Å; L134-M141 HydrophobicContact CD1-CE 3.81Å; L134-M141 HydrophobicContact CD1-SD 4.4Å; L134-M141 HydrophobicContact CG-CE 4.26Å; Y137-M141 VanDerWaalsContact O-CB 3.29Å; Y137-M141 WeakPolarHBondContact O-CB 3.25Å; Y137-M141 PolarHBondContact O-N 2.72Å; V138-M141 PolarHBondContact O-N 3.42Å; M141-N144 WeakPolarHBondContact O-CB 3.39Å; M141-N144 PolarHBondContact O-N 2.98Å; M141-L145 HydrophobicContact CG-CD1 4.07Å; M141-L145 HydrophobicContact CG-CG 4.47Å; M141-L145 VanDerWaalsContact O-CG 3.25Å; M141-L145 WeakPolarHBondContact O-CG 3.03Å; M141-L145 PolarHBondContact O-N 3.45Å; M141-V175 HydrophobicContact CE-CB 4.41Å; M141-V175 HydrophobicContact CE-CG1 3.63Å; M141-V175 HydrophobicContact CE-CG2 3.83Å; M141-V175 HydrophobicContact SD-CG2 3.89Å
142	V	95.1	Very high	94.4	Very high	1 Å²	1	42.3 Å²	42.3	1%	0.006	24%	0.235	C	C	.	.	H	α-helix	trans	-67.5	-39.9	-177	177.6	0	0	0	0	111.5	V138 L145 H146 V175 F183 Y186 I189 F190	V138-V142 HydrophobicContact CG1-CG2 4.02Å; V138-V142 VanDerWaalsContact O-CB 3.25Å; V138-V142 WeakPolarHBondContact O-CB 3.36Å; V138-V142 WeakPolarHBondContact O-CG2 3.45Å; V138-V142 PolarHBondContact O-N 3.09Å; V142-L145 PolarHBondContact O-N 3.36Å; V142-H146 WeakPolarHBondContact O-CB 3.01Å; V142-H146 PolarHBondContact O-N 2.99Å; V142-V175 HydrophobicContact CG2-CG1 4.17Å; V142-F183 HydrophobicContact CG2-CE2 4.45Å; V142-Y186 HydrophobicContact CB-CD1 4.14Å; V142-Y186 HydrophobicContact CB-CE1 4.28Å; V142-Y186 HydrophobicContact CB-CG 4.26Å; V142-Y186 HydrophobicContact CG1-CD1 3.53Å; V142-Y186 HydrophobicContact CG1-CD2 4.1Å; V142-Y186 HydrophobicContact CG1-CE1 4.16Å; V142-Y186 HydrophobicContact CG1-CG 3.49Å; V142-Y186 VanDerWaalsContact CG1-CG 3.49Å; V142-Y186 HydrophobicContact CG2-CD2 4.34Å; V142-Y186 HydrophobicContact CG2-CE2 4.46Å; V142-I189 HydrophobicContact CG1-CD1 4.4Å; V142-F190 HydrophobicContact CG1-CD2 4.48Å; V142-F190 HydrophobicContact CG1-CE2 3.33Å; V142-F190 HydrophobicContact CG1-CZ 3.78Å
143	K	94.7	Very high	94.7	Very high	115 Å²	115	38.4 Å²	38.4	50%	0.5	21%	0.207	S	C	.	.	H	α-helix	trans	-62.4	-42.3	173.7	-74.9	171.7	179.6	168.9	0	112.5	D139 H146 S147	D139-K143 VanDerWaalsContact CG-NZ 3.29Å; D139-K143 WeakPolarHBondContact O-CB 3.36Å; D139-K143 WeakPolarHBondContact O-CD 3.45Å; D139-K143 WeakPolarHBondContact O-CG 3.33Å; D139-K143 PolarHBondContact O-N 3.2Å; D139-K143 VanDerWaalsContact O-N 3.08Å; D139-K143 WeakPolarHBondContact OD1-CE 3.39Å; D139-K143 IonicContact OD1-NZ 2.8Å; D139-K143 PolarHBondContact OD1-NZ 3.01Å; D139-K143 VanDerWaalsContact OD1-NZ 3.16Å; D139-K143 VanDerWaalsContact OD2-CE 3.31Å; D139-K143 WeakPolarHBondContact OD2-CE 3.45Å; D139-K143 IonicContact OD2-NZ 2.95Å; D139-K143 PolarHBondContact OD2-NZ 3.46Å; K143-H146 PolarHBondContact O-N 3.38Å; K143-S147 WeakPolarHBondContact O-CB 3.32Å; K143-S147 PolarHBondContact O-N 3.21Å
144	N	95.5	Very high	94.8	Very high	15 Å²	15	42 Å²	42	8%	0.08	22%	0.223	C	C	.	.	H	α-helix	trans	-61.4	-50.3	174.3	177.6	-72.3	0	0	0	111	L103 E107 S140 M141 H146 S147 V148	L103-N144 HydrophobicContact CD1-CB 4.38Å; L103-N144 HydrophobicContact CD2-CB 4.22Å; L103-N144 WeakPolarHBondContact CD2-OD1 3.49Å; L103-N144 PolarHBondContact O-ND2 3.37Å; E107-N144 WeakPolarHBondContact CG-ND2 3.39Å; E107-N144 VanDerWaalsContact OE1-CG 3.32Å; E107-N144 PolarHBondContact OE1-ND2 3.3Å; E107-N144 PolarHBondContact OE2-ND2 2.71Å; S140-N144 WeakPolarHBondContact O-CB 3.49Å; S140-N144 PolarHBondContact O-N 3.25Å; M141-N144 WeakPolarHBondContact O-CB 3.39Å; M141-N144 PolarHBondContact O-N 2.98Å; N144-H146 VanDerWaalsContact C-N 3.31Å; N144-H146 PolarHBondContact O-N 3.47Å; N144-S147 WeakPolarHBondContact O-CB 3.42Å; N144-S147 PolarHBondContact O-N 2.97Å; N144-S147 VanDerWaalsContact O-N 3.12Å; N144-V148 WeakPolarHBondContact O-CG2 3.26Å; N144-V148 PolarHBondContact O-N 2.98Å
145	L	96.8	Very high	95	Very high	1 Å²	1	43.8 Å²	43.8	1%	0.005	23%	0.231	C	C	.	.	H	α-helix	trans	-58.7	-41.3	178.8	-68.9	174.7	0	0	0	112.3	M106 M141 V142 L149 L168 T171 I172 V175 F190	M106-L145 HydrophobicContact CE-CD2 3.49Å; M106-L145 VanDerWaalsContact CE-CD2 3.49Å; M141-L145 HydrophobicContact CG-CD1 4.07Å; M141-L145 HydrophobicContact CG-CG 4.47Å; M141-L145 VanDerWaalsContact O-CG 3.25Å; M141-L145 WeakPolarHBondContact O-CG 3.03Å; M141-L145 PolarHBondContact O-N 3.45Å; V142-L145 PolarHBondContact O-N 3.36Å; L145-L149 VanDerWaalsContact O-CB 3.28Å; L145-L149 WeakPolarHBondContact O-CB 3.4Å; L145-L149 PolarHBondContact O-N 3.44Å; L145-L168 HydrophobicContact CD2-CD1 3.64Å; L145-T171 HydrophobicContact CD2-CG2 4.03Å; L145-I172 HydrophobicContact CB-CG1 4.13Å; L145-I172 HydrophobicContact CD1-CG1 4.26Å; L145-V175 HydrophobicContact CD1-CB 4.44Å; L145-V175 HydrophobicContact CD1-CG2 3.96Å; L145-F190 HydrophobicContact CB-CE1 4.44Å; L145-F190 HydrophobicContact CB-CZ 4.26Å
146	H	97.1	Very high	95.2	Very high	53 Å²	53	42.1 Å²	42.1	25%	0.245	22%	0.221	C	C	.	.	H	α-helix	trans	-64.1	-45.2	175	177.1	-101.3	0	0	0	112	V142 K143 N144 V148 L149 V150 I189 F190	V142-H146 WeakPolarHBondContact O-CB 3.01Å; V142-H146 PolarHBondContact O-N 2.99Å; K143-H146 PolarHBondContact O-N 3.38Å; N144-H146 VanDerWaalsContact C-N 3.31Å; N144-H146 PolarHBondContact O-N 3.47Å; H146-V148 PolarHBondContact O-N 2.95Å; H146-L149 WeakPolarHBondContact O-CB 3.47Å; H146-L149 PolarHBondContact O-N 3.38Å; H146-L149 VanDerWaalsContact O-N 3.15Å; H146-V150 WeakPolarHBondContact O-CG2 3.43Å; H146-V150 PolarHBondContact O-N 3.38Å; H146-I189 HydrophobicContact CB-CD1 4.12Å; H146-I189 PolarHBondContact CD2-O 3.17Å; H146-I189 VanDerWaalsContact CD2-O 3.27Å; H146-I189 PolarHBondContact NE2-O 3.44Å; H146-I189 VanDerWaalsContact NE2-O 3.17Å; H146-F190 HydrophobicContact CB-CE1 3.98Å; H146-F190 HydrophobicContact CB-CE2 4.23Å; H146-F190 HydrophobicContact CB-CZ 3.65Å
147	S	95.9	Very high	95.2	Very high	51 Å²	51	40.3 Å²	40.3	36%	0.357	21%	0.211	S	C	.	.	H	α-helix	trans	-56.7	-49.4	175.7	-178.4	0	0	0	0	111.6	K143 N144 L149 V150 I151	K143-S147 WeakPolarHBondContact O-CB 3.32Å; K143-S147 PolarHBondContact O-N 3.21Å; N144-S147 WeakPolarHBondContact O-CB 3.42Å; N144-S147 PolarHBondContact O-N 2.97Å; N144-S147 VanDerWaalsContact O-N 3.12Å; S147-L149 VanDerWaalsContact C-N 3.3Å; S147-L149 PolarHBondContact O-N 2.92Å; S147-V150 PolarHBondContact O-N 3.11Å; S147-I151 WeakPolarHBondContact O-CG1 3.28Å; S147-I151 PolarHBondContact O-N 3.26Å
148	V	95.8	Very high	95.2	Very high	7 Å²	7	46.6 Å²	46.6	4%	0.042	23%	0.234	C	C	.	.	H	α-helix	trans	-63.4	-37.9	177.2	-176.8	0	0	0	0	110.8	M106 E107 N144 H146 I151 K152 L168	M106-V148 HydrophobicContact CB-CG2 4.48Å; E107-V148 HydrophobicContact CB-CG2 4.43Å; E107-V148 HydrophobicContact CG-CG2 3.53Å; N144-V148 WeakPolarHBondContact O-CG2 3.26Å; N144-V148 PolarHBondContact O-N 2.98Å; H146-V148 PolarHBondContact O-N 2.95Å; V148-I151 PolarHBondContact O-N 3.03Å; V148-K152 HydrophobicContact CG1-CG 3.94Å; V148-K152 WeakPolarHBondContact O-CB 3.45Å; V148-K152 VanDerWaalsContact O-CG 3.25Å; V148-K152 WeakPolarHBondContact O-CG 3.49Å; V148-K152 PolarHBondContact O-N 2.74Å; V148-L168 HydrophobicContact CB-CD1 4.37Å; V148-L168 HydrophobicContact CB-CD2 4.16Å; V148-L168 HydrophobicContact CG1-CD1 4.2Å; V148-L168 HydrophobicContact CG1-CD2 3.85Å
149	L	97.1	Very high	95.2	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-60.6	-49	179	176.5	64.6	0	0	0	111.6	L145 H146 S147 I151 K152 L153 L165 L168 V169 I172 F190 L194 I197	L145-L149 VanDerWaalsContact O-CB 3.28Å; L145-L149 WeakPolarHBondContact O-CB 3.4Å; L145-L149 PolarHBondContact O-N 3.44Å; H146-L149 WeakPolarHBondContact O-CB 3.47Å; H146-L149 PolarHBondContact O-N 3.38Å; H146-L149 VanDerWaalsContact O-N 3.15Å; S147-L149 VanDerWaalsContact C-N 3.3Å; S147-L149 PolarHBondContact O-N 2.92Å; L149-I151 VanDerWaalsContact C-N 3.32Å; L149-I151 PolarHBondContact O-N 3.05Å; L149-K152 PolarHBondContact O-N 3.03Å; L149-L153 VanDerWaalsContact O-CB 3.27Å; L149-L153 WeakPolarHBondContact O-CB 3.39Å; L149-L153 PolarHBondContact O-N 3.02Å; L149-L165 HydrophobicContact CD1-CD1 3.54Å; L149-L168 HydrophobicContact CB-CD2 3.8Å; L149-L168 HydrophobicContact CD1-CD2 4.13Å; L149-V169 HydrophobicContact CD1-CG1 4.4Å; L149-I172 HydrophobicContact CB-CD1 4.43Å; L149-I172 HydrophobicContact CD1-CD1 4.41Å; L149-I172 HydrophobicContact CD2-CD1 4.1Å; L149-F190 HydrophobicContact CD2-CD1 3.63Å; L149-F190 HydrophobicContact CD2-CE1 4.08Å; L149-L194 HydrophobicContact CD2-CD2 4.46Å; L149-I197 HydrophobicContact CD1-CD1 3.9Å
150	V	96.2	Very high	95.1	Very high	58 Å²	58	49.9 Å²	49.9	35%	0.352	26%	0.264	S	S	.	.	H	α-helix	trans	-59.2	-46	178.5	174.2	0	0	0	0	110.3	H146 S147 K152 L153 Q154	H146-V150 WeakPolarHBondContact O-CG2 3.43Å; H146-V150 PolarHBondContact O-N 3.38Å; S147-V150 PolarHBondContact O-N 3.11Å; V150-K152 PolarHBondContact O-N 3.28Å; V150-L153 PolarHBondContact O-N 3.43Å; V150-Q154 WeakPolarHBondContact O-CG 3.43Å; V150-Q154 PolarHBondContact O-N 2.86Å; V150-Q154 VanDerWaalsContact O-N 3.12Å
151	I	94.8	Very high	94.9	Very high	82 Å²	82	48 Å²	48	42%	0.421	25%	0.249	S	C	.	.	H	α-helix	trans	-61.6	-47.4	178.6	-65.8	165.9	0	0	0	111.2	S147 V148 L149 L153 Q154 E155	S147-I151 WeakPolarHBondContact O-CG1 3.28Å; S147-I151 PolarHBondContact O-N 3.26Å; V148-I151 PolarHBondContact O-N 3.03Å; L149-I151 VanDerWaalsContact C-N 3.32Å; L149-I151 PolarHBondContact O-N 3.05Å; I151-L153 PolarHBondContact O-N 3Å; I151-Q154 PolarHBondContact O-N 3.48Å; I151-E155 PolarHBondContact O-N 3.24Å
152	K	94.7	Very high	94.9	Very high	9 Å²	9	51.1 Å²	51.1	4%	0.039	26%	0.263	C	S	.	.	H	α-helix	trans	-71.7	-30.2	-176.8	-63.1	-61.4	154.6	-167.9	0	113.1	Q115 V148 L149 V150 E155 L156 A164 L165	Q115-K152 VanDerWaalsContact OE1-CE 3.27Å; V148-K152 HydrophobicContact CG1-CG 3.94Å; V148-K152 WeakPolarHBondContact O-CB 3.45Å; V148-K152 VanDerWaalsContact O-CG 3.25Å; V148-K152 WeakPolarHBondContact O-CG 3.49Å; V148-K152 PolarHBondContact O-N 2.74Å; L149-K152 PolarHBondContact O-N 3.03Å; V150-K152 PolarHBondContact O-N 3.28Å; K152-E155 VanDerWaalsContact CD-OE2 3.31Å; K152-E155 WeakPolarHBondContact CD-OE2 3.38Å; K152-E155 IonicContact NZ-OE1 2.71Å; K152-E155 PolarHBondContact NZ-OE1 3.38Å; K152-E155 IonicContact NZ-OE2 2.98Å; K152-E155 PolarHBondContact NZ-OE2 3.44Å; K152-E155 PolarHBondContact O-N 3.49Å; K152-L156 PolarHBondContact O-N 3.38Å; K152-A164 HydrophobicContact CD-CB 4.05Å; K152-L165 HydrophobicContact CB-CB 4.09Å; K152-L165 HydrophobicContact CB-CD1 3.99Å
153	L	96.2	Very high	94.8	Very high	9 Å²	9	54.5 Å²	54.5	5%	0.047	28%	0.28	C	S	.	.	H	α-helix	trans	-63.7	-42.6	169.7	179.5	50	0	0	0	111.4	L149 V150 I151 E155 L156 I157 I197 L200	L149-L153 VanDerWaalsContact O-CB 3.27Å; L149-L153 WeakPolarHBondContact O-CB 3.39Å; L149-L153 PolarHBondContact O-N 3.02Å; V150-L153 PolarHBondContact O-N 3.43Å; I151-L153 PolarHBondContact O-N 3Å; L153-E155 PolarHBondContact O-N 3.13Å; L153-L156 HydrophobicContact CD1-CD2 4.41Å; L153-L156 WeakPolarHBondContact O-CB 3.3Å; L153-L156 PolarHBondContact O-N 2.91Å; L153-I157 HydrophobicContact CD1-CD1 4.12Å; L153-I157 HydrophobicContact CD1-CG1 4.39Å; L153-I157 HydrophobicContact CG-CD1 4.21Å; L153-I157 WeakPolarHBondContact O-CG1 3.23Å; L153-I157 PolarHBondContact O-N 3Å; L153-I197 HydrophobicContact CD1-CD1 4.4Å; L153-I197 HydrophobicContact CD1-CG1 3.61Å; L153-I197 HydrophobicContact CD2-CG1 4.26Å; L153-I197 HydrophobicContact CG-CG1 4.48Å; L153-L200 HydrophobicContact CD1-CD1 4Å
154	Q	95.1	Very high	94.8	Very high	110 Å²	110	49.2 Å²	49.2	51%	0.514	26%	0.258	S	S	.	.	H	α-helix	trans	-64.8	-38.9	174.5	-65.3	-59.1	-29.9	0	0	112.4	V150 I151 L156 I157 R158	V150-Q154 WeakPolarHBondContact O-CG 3.43Å; V150-Q154 PolarHBondContact O-N 2.86Å; V150-Q154 VanDerWaalsContact O-N 3.12Å; I151-Q154 PolarHBondContact O-N 3.48Å; Q154-L156 VanDerWaalsContact C-N 3.35Å; Q154-I157 PolarHBondContact O-N 3.01Å; Q154-R158 WeakPolarHBondContact O-CB 3.48Å; Q154-R158 PolarHBondContact O-N 2.82Å
155	E	94	Very high	94.8	Very high	39 Å²	39	48.6 Å²	48.6	18%	0.182	26%	0.255	C	S	.	.	H	α-helix	trans	-62.5	-39.4	172.8	-72.6	177.1	-164.2	0	0	112.6	Q112 I151 K152 L153 N159	Q112-E155 PolarHBondContact NE2-OE2 3.31Å; Q112-E155 VanDerWaalsContact NE2-OE2 3.17Å; I151-E155 PolarHBondContact O-N 3.24Å; K152-E155 VanDerWaalsContact CD-OE2 3.31Å; K152-E155 WeakPolarHBondContact CD-OE2 3.38Å; K152-E155 IonicContact NZ-OE1 2.71Å; K152-E155 PolarHBondContact NZ-OE1 3.38Å; K152-E155 IonicContact NZ-OE2 2.98Å; K152-E155 PolarHBondContact NZ-OE2 3.44Å; K152-E155 PolarHBondContact O-N 3.49Å; L153-E155 PolarHBondContact O-N 3.13Å; E155-N159 WeakPolarHBondContact O-CB 3.41Å; E155-N159 PolarHBondContact O-N 3.21Å
156	L	95.4	Very high	94.8	Very high	11 Å²	11	49.4 Å²	49.4	6%	0.058	26%	0.259	C	S	.	.	H	α-helix	trans	-60.1	-49.7	174.2	178.2	73.1	0	0	0	110.8	K152 L153 Q154 G160 K162 L165 L206 L209	K152-L156 PolarHBondContact O-N 3.38Å; L153-L156 HydrophobicContact CD1-CD2 4.41Å; L153-L156 WeakPolarHBondContact O-CB 3.3Å; L153-L156 PolarHBondContact O-N 2.91Å; Q154-L156 VanDerWaalsContact C-N 3.35Å; L156-G160 WeakPolarHBondContact O-CA 3.25Å; L156-G160 PolarHBondContact O-N 3.17Å; L156-K162 HydrophobicContact CD1-CB 3.8Å; L156-L165 HydrophobicContact CB-CD2 4.01Å; L156-L165 HydrophobicContact CD2-CD2 3.76Å; L156-L165 HydrophobicContact CG-CD2 4.38Å; L156-L206 HydrophobicContact CD1-CD2 4Å; L156-L209 HydrophobicContact CD1-CD2 4.19Å; L156-L209 HydrophobicContact CD2-CD2 3.68Å
157	I	95.1	Very high	94.8	Very high	85 Å²	85	48.3 Å²	48.3	44%	0.436	25%	0.254	S	S	.	.	H	α-helix	trans	-63.6	-44.8	-177.6	-67.2	164.2	0	0	0	110.9	L153 Q154 L200	L153-I157 HydrophobicContact CD1-CD1 4.12Å; L153-I157 HydrophobicContact CD1-CG1 4.39Å; L153-I157 HydrophobicContact CG-CD1 4.21Å; L153-I157 WeakPolarHBondContact O-CG1 3.23Å; L153-I157 PolarHBondContact O-N 3Å; Q154-I157 PolarHBondContact O-N 3.01Å; I157-L200 HydrophobicContact CD1-CD1 4Å; I157-L200 HydrophobicContact CG1-CD1 3.82Å
158	R	94.7	Very high	94.9	Very high	175 Å²	175	46 Å²	46	66%	0.66	24%	0.237	S	C	*	.	H	α-helix	trans	-77.4	-41.9	-174.2	-166.5	-174.1	57.9	-142.8	-8.4	113.1	Q154	Q154-R158 WeakPolarHBondContact O-CB 3.48Å; Q154-R158 PolarHBondContact O-N 2.82Å
159	N	92.8	Very high	95	Very high	97 Å²	97	45.7 Å²	45.7	52%	0.519	24%	0.235	S	C	.	.	H	α-helix	trans	-125.6	4.5	-165.5	-60.7	1	0	0	0	113.1	E155 T161	E155-N159 WeakPolarHBondContact O-CB 3.41Å; E155-N159 PolarHBondContact O-N 3.21Å; N159-T161 VanDerWaalsContact CB-OG1 3.23Å; N159-T161 WeakPolarHBondContact CB-OG1 3.31Å; N159-T161 PolarHBondContact O-N 3.02Å; N159-T161 PolarHBondContact O-OG1 3.37Å
160	G	91.3	Very high	95	Very high	51 Å²	51	47.4 Å²	47.4	53%	0.526	25%	0.246	S	C	.	.			trans	66.2	16.4	-176.9	0	0	0	0	0	114	L156 K162	L156-G160 WeakPolarHBondContact O-CA 3.25Å; L156-G160 PolarHBondContact O-N 3.17Å; G160-K162 PolarHBondContact O-N 3.26Å
161	T	91	Very high	95.1	Very high	40 Å²	40	44.6 Å²	44.6	25%	0.245	23%	0.229	C	C	.	.			trans	-89.9	113.6	-167.9	-26.8	0	0	0	0	112.5	Q112 N159	Q112-T161 VanDerWaalsContact NE2-CB 3.32Å; N159-T161 VanDerWaalsContact CB-OG1 3.23Å; N159-T161 WeakPolarHBondContact CB-OG1 3.31Å; N159-T161 PolarHBondContact O-N 3.02Å; N159-T161 PolarHBondContact O-OG1 3.37Å
162	K	93.9	Very high	95.2	Very high	65 Å²	65	40.8 Å²	40.8	28%	0.283	21%	0.209	S	C	.	.			trans	-114.9	-21.4	-165.9	68.3	-166.1	178.6	-163.8	0	116.5	L156 G160 A164 L165 E166 E205 L206 L209	L156-K162 HydrophobicContact CD1-CB 3.8Å; G160-K162 PolarHBondContact O-N 3.26Å; K162-A164 PolarHBondContact O-N 3.09Å; K162-L165 WeakPolarHBondContact O-CB 3.49Å; K162-L165 PolarHBondContact O-N 3.48Å; K162-E166 WeakPolarHBondContact CD-OE1 3.32Å; K162-E166 WeakPolarHBondContact O-CG 3.31Å; K162-E166 PolarHBondContact O-N 3.01Å; K162-E205 PolarHBondContact NZ-O 3.07Å; K162-L206 HydrophobicContact CB-CD2 4.24Å; K162-L206 HydrophobicContact CD-CD2 3.56Å; K162-L209 HydrophobicContact CB-CD2 4.41Å
163	L	93.3	Very high	95.4	Very high	71 Å²	71	40.7 Å²	40.7	37%	0.372	21%	0.21	S	C	.	.	H	α-helix	trans	-56.3	-51.5	-167.5	179.5	69.4	0	0	0	113.4	R113 L165 Q167	R113-L163 HydrophobicContact CG-CD2 3.85Å; L163-L165 VanDerWaalsContact C-N 3.31Å; L163-L165 PolarHBondContact O-N 3.4Å; L163-Q167 PolarHBondContact O-N 3.41Å
164	A	93.3	Very high	95.3	Very high	5 Å²	5	41.6 Å²	41.6	4%	0.041	22%	0.217	C	C	.	.	H	α-helix	trans	-68.3	-33.4	179.6	0	0	0	0	0	111.8	Q112 Q115 K152 K162 Q167 L168	Q112-A164 HydrophobicContact CB-CB 4.07Å; Q112-A164 HydrophobicContact CG-CB 4.31Å; Q115-A164 HydrophobicContact CB-CB 4.1Å; K152-A164 HydrophobicContact CD-CB 4.05Å; K162-A164 PolarHBondContact O-N 3.09Å; A164-Q167 PolarHBondContact O-N 2.97Å; A164-L168 VanDerWaalsContact O-CB 3.3Å; A164-L168 WeakPolarHBondContact O-CB 3.18Å; A164-L168 PolarHBondContact O-N 3.41Å
165	L	96.3	Very high	95.3	Very high	1 Å²	1	36.4 Å²	36.4	1%	0.005	19%	0.193	C	C	.	.	H	α-helix	trans	-67.6	-42.8	177.7	-177.1	59.3	0	0	0	111.9	L149 K152 L156 K162 L163 Q167 L168 V169 I197 L209	L149-L165 HydrophobicContact CD1-CD1 3.54Å; K152-L165 HydrophobicContact CB-CB 4.09Å; K152-L165 HydrophobicContact CB-CD1 3.99Å; L156-L165 HydrophobicContact CB-CD2 4.01Å; L156-L165 HydrophobicContact CD2-CD2 3.76Å; L156-L165 HydrophobicContact CG-CD2 4.38Å; K162-L165 WeakPolarHBondContact O-CB 3.49Å; K162-L165 PolarHBondContact O-N 3.48Å; L163-L165 VanDerWaalsContact C-N 3.31Å; L163-L165 PolarHBondContact O-N 3.4Å; L165-Q167 VanDerWaalsContact C-N 3.27Å; L165-Q167 PolarHBondContact O-N 2.87Å; L165-L168 HydrophobicContact CD1-CD2 4.47Å; L165-L168 PolarHBondContact O-N 3.19Å; L165-V169 HydrophobicContact CD1-CG1 4.33Å; L165-V169 PolarHBondContact O-N 2.87Å; L165-I197 HydrophobicContact CD1-CD1 4.11Å; L165-I197 HydrophobicContact CD2-CD1 4.33Å; L165-L209 HydrophobicContact CD2-CD1 4.19Å; L165-L209 HydrophobicContact CD2-CD2 3.93Å; L165-L209 HydrophobicContact CG-CD1 3.91Å
166	E	97.5	Very high	95.4	Very high	19 Å²	19	34.5 Å²	34.5	9%	0.089	18%	0.184	C	C	.	.	H	α-helix	trans	-57.2	-41.3	175.3	-75.5	175.5	176.6	0	0	111.7	K162 V169 T170 L209 K212	K162-E166 WeakPolarHBondContact CD-OE1 3.32Å; K162-E166 WeakPolarHBondContact O-CG 3.31Å; K162-E166 PolarHBondContact O-N 3.01Å; E166-V169 VanDerWaalsContact O-CG2 3.24Å; E166-V169 WeakPolarHBondContact O-CG2 3.25Å; E166-T170 PolarHBondContact O-OG1 3.18Å; E166-L209 HydrophobicContact CB-CD1 4.47Å; E166-L209 HydrophobicContact CG-CB 3.7Å; E166-L209 HydrophobicContact CG-CD1 3.82Å; E166-L209 HydrophobicContact CG-CG 4.3Å; E166-K212 HydrophobicContact CB-CD 4.29Å; E166-K212 WeakPolarHBondContact O-CD 3.02Å
167	Q	97.3	Very high	95.3	Very high	30 Å²	30	37.9 Å²	37.9	14%	0.14	20%	0.202	C	C	.	.	H	α-helix	trans	-73.2	-40.9	176.6	-168.1	61.8	24.9	0	0	111.8	S116 A119 L163 A164 L165 V169 T170 T171	S116-Q167 WeakPolarHBondContact O-CG 3.43Å; A119-Q167 HydrophobicContact CB-CB 4.38Å; A119-Q167 HydrophobicContact CB-CG 3.67Å; L163-Q167 PolarHBondContact O-N 3.41Å; A164-Q167 PolarHBondContact O-N 2.97Å; L165-Q167 VanDerWaalsContact C-N 3.27Å; L165-Q167 PolarHBondContact O-N 2.87Å; Q167-V169 PolarHBondContact O-N 3.4Å; Q167-T170 WeakPolarHBondContact O-CA 3.42Å; Q167-T170 VanDerWaalsContact O-CB 3.29Å; Q167-T170 WeakPolarHBondContact O-CB 3.4Å; Q167-T170 PolarHBondContact O-N 3.16Å; Q167-T170 VanDerWaalsContact O-N 3.09Å; Q167-T171 PolarHBondContact O-N 3Å; Q167-T171 PolarHBondContact O-OG1 2.88Å
168	L	97.3	Very high	95.2	Very high	2 Å²	2	35 Å²	35	1%	0.01	19%	0.188	C	C	.	.	H	α-helix	trans	-60.2	-43.6	-179.1	-178.7	69.7	0	0	0	112.8	M106 L145 V148 L149 A164 L165 T170 T171 I172	M106-L168 HydrophobicContact CE-CD1 3.38Å; L145-L168 HydrophobicContact CD2-CD1 3.64Å; V148-L168 HydrophobicContact CB-CD1 4.37Å; V148-L168 HydrophobicContact CB-CD2 4.16Å; V148-L168 HydrophobicContact CG1-CD1 4.2Å; V148-L168 HydrophobicContact CG1-CD2 3.85Å; L149-L168 HydrophobicContact CB-CD2 3.8Å; L149-L168 HydrophobicContact CD1-CD2 4.13Å; A164-L168 VanDerWaalsContact O-CB 3.3Å; A164-L168 WeakPolarHBondContact O-CB 3.18Å; A164-L168 PolarHBondContact O-N 3.41Å; L165-L168 HydrophobicContact CD1-CD2 4.47Å; L165-L168 PolarHBondContact O-N 3.19Å; L168-T170 PolarHBondContact O-N 3.41Å; L168-T171 WeakPolarHBondContact O-CB 3.26Å; L168-T171 PolarHBondContact O-N 3.19Å; L168-T171 VanDerWaalsContact O-N 3.12Å; L168-I172 HydrophobicContact CG-CD1 4.05Å; L168-I172 WeakPolarHBondContact O-CG1 3.06Å; L168-I172 PolarHBondContact O-N 3.44Å
169	V	98.1	Very high	95.1	Very high	0 Å²	0	27 Å²	27	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-63.2	-32.7	176.7	-63.3	0	0	0	0	111.8	L149 L165 E166 Q167 I172 A173 L194 I197 L209 K212 C216	L149-V169 HydrophobicContact CD1-CG1 4.4Å; L165-V169 HydrophobicContact CD1-CG1 4.33Å; L165-V169 PolarHBondContact O-N 2.87Å; E166-V169 VanDerWaalsContact O-CG2 3.24Å; E166-V169 WeakPolarHBondContact O-CG2 3.25Å; Q167-V169 PolarHBondContact O-N 3.4Å; V169-I172 PolarHBondContact O-N 3.05Å; V169-A173 PolarHBondContact O-N 3.46Å; V169-L194 HydrophobicContact CG1-CD2 4.06Å; V169-I197 HydrophobicContact CG1-CD1 4.41Å; V169-L209 HydrophobicContact CG2-CD1 4.35Å; V169-K212 HydrophobicContact CG2-CB 3.77Å; V169-C216 HydrophobicContact CB-CB 4.4Å; V169-C216 PolarHBondContact O-SG 3.41Å
170	T	97.9	Very high	95.1	Very high	36 Å²	36	26.2 Å²	26.2	22%	0.221	15%	0.152	C	C	.	.	H	α-helix	trans	-67.1	-42	174.1	-45.2	0	0	0	0	110.4	I123 E166 Q167 L168 A173 S174 K212	I123-T170 HydrophobicContact CD1-CG2 3.95Å; E166-T170 PolarHBondContact O-OG1 3.18Å; Q167-T170 WeakPolarHBondContact O-CA 3.42Å; Q167-T170 VanDerWaalsContact O-CB 3.29Å; Q167-T170 WeakPolarHBondContact O-CB 3.4Å; Q167-T170 PolarHBondContact O-N 3.16Å; Q167-T170 VanDerWaalsContact O-N 3.09Å; L168-T170 PolarHBondContact O-N 3.41Å; T170-A173 WeakPolarHBondContact O-CB 3.42Å; T170-A173 PolarHBondContact O-N 3.02Å; T170-S174 PolarHBondContact O-N 3.36Å; T170-K212 PolarHBondContact OG1-NZ 2.92Å; T170-K212 VanDerWaalsContact OG1-NZ 3.14Å
171	T	97.4	Very high	95.3	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-64.1	-41.5	176.8	-56	0	0	0	0	112.2	A119 L122 I123 L145 Q167 L168 A173 S174 V175	A119-T171 WeakPolarHBondContact CB-OG1 3.46Å; A119-T171 PolarHBondContact O-OG1 3.42Å; L122-T171 HydrophobicContact CB-CG2 4.43Å; L122-T171 HydrophobicContact CD2-CG2 3.9Å; L122-T171 HydrophobicContact CG-CG2 4.31Å; I123-T171 HydrophobicContact CG1-CG2 4.13Å; L145-T171 HydrophobicContact CD2-CG2 4.03Å; Q167-T171 PolarHBondContact O-N 3Å; Q167-T171 PolarHBondContact O-OG1 2.88Å; L168-T171 WeakPolarHBondContact O-CB 3.26Å; L168-T171 PolarHBondContact O-N 3.19Å; L168-T171 VanDerWaalsContact O-N 3.12Å; T171-A173 VanDerWaalsContact C-N 3.34Å; T171-S174 PolarHBondContact O-N 3.47Å; T171-V175 WeakPolarHBondContact O-CG2 3.25Å; T171-V175 PolarHBondContact O-N 3.27Å
172	I	97.8	Very high	95.4	Very high	1 Å²	1	32.2 Å²	32.2	1%	0.005	16%	0.162	C	C	.	.	H	α-helix	trans	-62.1	-43.4	175.6	-66.4	159.9	0	0	0	110.6	L145 L149 L168 V169 S174 V175 A176 F183 F190 I220	L145-I172 HydrophobicContact CB-CG1 4.13Å; L145-I172 HydrophobicContact CD1-CG1 4.26Å; L149-I172 HydrophobicContact CB-CD1 4.43Å; L149-I172 HydrophobicContact CD1-CD1 4.41Å; L149-I172 HydrophobicContact CD2-CD1 4.1Å; L168-I172 HydrophobicContact CG-CD1 4.05Å; L168-I172 WeakPolarHBondContact O-CG1 3.06Å; L168-I172 PolarHBondContact O-N 3.44Å; V169-I172 PolarHBondContact O-N 3.05Å; I172-S174 PolarHBondContact O-N 3.44Å; I172-V175 PolarHBondContact O-N 3.35Å; I172-A176 WeakPolarHBondContact O-CB 3.2Å; I172-A176 PolarHBondContact O-N 3.48Å; I172-F183 HydrophobicContact CG2-CZ 4.35Å; I172-F190 HydrophobicContact CD1-CD1 3.85Å; I172-F190 HydrophobicContact CD1-CE1 3.55Å; I172-F190 HydrophobicContact CG1-CD1 4.38Å; I172-F190 HydrophobicContact CG1-CE1 3.86Å; I172-F190 HydrophobicContact CG2-CD1 3.93Å; I172-F190 HydrophobicContact CG2-CE1 4.01Å; I172-F190 HydrophobicContact CG2-CG 4.42Å; I172-I220 HydrophobicContact CG2-CD1 4.08Å
173	A	97.5	Very high	95.4	Very high	7 Å²	7	29.2 Å²	29.2	6%	0.058	15%	0.149	C	C	.	.	H	α-helix	trans	-57.6	-49.1	176.7	0	0	0	0	0	111.5	V169 T170 T171 V175 A176 D177 C216 H219	V169-A173 PolarHBondContact O-N 3.46Å; T170-A173 WeakPolarHBondContact O-CB 3.42Å; T170-A173 PolarHBondContact O-N 3.02Å; T171-A173 VanDerWaalsContact C-N 3.34Å; A173-V175 PolarHBondContact O-N 3.26Å; A173-A176 PolarHBondContact O-N 3.31Å; A173-D177 WeakPolarHBondContact O-CB 3.2Å; A173-D177 PolarHBondContact O-N 3.14Å; A173-C216 HydrophobicContact CB-CB 3.94Å; A173-H219 HydrophobicContact CB-CB 4.23Å
174	S	95.4	Very high	95.6	Very high	29 Å²	29	28.3 Å²	28.3	20%	0.203	15%	0.147	C	C	.	.	H	α-helix	trans	-63.9	-39.6	179.3	178.2	0	0	0	0	112.8	I126 T170 T171 I172 D177 T178	I126-S174 WeakPolarHBondContact CD1-OG 3.19Å; T170-S174 PolarHBondContact O-N 3.36Å; T171-S174 PolarHBondContact O-N 3.47Å; I172-S174 PolarHBondContact O-N 3.44Å; S174-D177 PolarHBondContact O-N 2.92Å; S174-T178 WeakPolarHBondContact O-CB 3.4Å; S174-T178 PolarHBondContact O-N 3Å; S174-T178 PolarHBondContact O-OG1 3.14Å
175	V	94.7	Very high	95.7	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-62.5	-45.7	173.3	168.8	0	0	0	0	111.3	I126 M141 V142 L145 T171 I172 A173 D177 T178 I179	I126-V175 HydrophobicContact CD1-CB 4.35Å; I126-V175 HydrophobicContact CD1-CG2 3.52Å; M141-V175 HydrophobicContact CE-CB 4.41Å; M141-V175 HydrophobicContact CE-CG1 3.63Å; M141-V175 HydrophobicContact CE-CG2 3.83Å; M141-V175 HydrophobicContact SD-CG2 3.89Å; V142-V175 HydrophobicContact CG2-CG1 4.17Å; L145-V175 HydrophobicContact CD1-CB 4.44Å; L145-V175 HydrophobicContact CD1-CG2 3.96Å; T171-V175 WeakPolarHBondContact O-CG2 3.25Å; T171-V175 PolarHBondContact O-N 3.27Å; I172-V175 PolarHBondContact O-N 3.35Å; A173-V175 PolarHBondContact O-N 3.26Å; V175-D177 VanDerWaalsContact C-N 3.34Å; V175-D177 PolarHBondContact O-N 3.09Å; V175-T178 PolarHBondContact O-N 2.68Å; V175-I179 HydrophobicContact CG1-CD1 4.38Å; V175-I179 WeakPolarHBondContact O-CG1 3.43Å; V175-I179 WeakPolarHBondContact O-CG2 3.45Å; V175-I179 PolarHBondContact O-N 2.84Å; V175-I179 VanDerWaalsContact O-N 3.08Å
176	A	95.2	Very high	95.7	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-60.2	-45.3	178.2	0	0	0	0	0	111.6	I172 A173 T178 I179 E180 F183 I220 A223	I172-A176 WeakPolarHBondContact O-CB 3.2Å; I172-A176 PolarHBondContact O-N 3.48Å; A173-A176 PolarHBondContact O-N 3.31Å; A176-T178 VanDerWaalsContact C-N 3.31Å; A176-T178 PolarHBondContact O-N 3.05Å; A176-I179 PolarHBondContact O-N 3.27Å; A176-E180 PolarHBondContact O-N 3.24Å; A176-F183 HydrophobicContact CB-CD1 4.31Å; A176-F183 HydrophobicContact CB-CD2 3.67Å; A176-F183 HydrophobicContact CB-CE1 4.47Å; A176-F183 HydrophobicContact CB-CE2 3.84Å; A176-F183 HydrophobicContact CB-CG 3.93Å; A176-F183 HydrophobicContact CB-CZ 4.24Å; A176-I220 HydrophobicContact CB-CG1 3.74Å; A176-A223 HydrophobicContact CB-CB 4.36Å; A176-A223 WeakPolarHBondContact O-CB 3.47Å
177	D	93.9	Very high	95.7	Very high	82 Å²	82	34.9 Å²	34.9	44%	0.439	18%	0.182	S	C	.	.	H	α-helix	trans	-61.5	-38	177.3	-157.6	68.8	0	0	0	112.3	A173 S174 V175 E180 H219	A173-D177 WeakPolarHBondContact O-CB 3.2Å; A173-D177 PolarHBondContact O-N 3.14Å; S174-D177 PolarHBondContact O-N 2.92Å; V175-D177 VanDerWaalsContact C-N 3.34Å; V175-D177 PolarHBondContact O-N 3.09Å; D177-E180 WeakPolarHBondContact O-CG 3.42Å; D177-H219 IonicContact OD1-CE1 2.66Å; D177-H219 IonicContact OD1-ND1 3.16Å; D177-H219 PolarHBondContact OD1-ND1 2.91Å
178	T	92.4	Very high	95.6	Very high	23 Å²	23	38.1 Å²	38.1	14%	0.141	20%	0.2	C	C	.	.	H	α-helix	trans	-74.7	-33.8	-177.9	-51.6	0	0	0	0	112.8	K131 L134 S174 V175 A176	K131-T178 VanDerWaalsContact CE-O 3.23Å; K131-T178 WeakPolarHBondContact CE-O 3.34Å; L134-T178 HydrophobicContact CD2-CG2 3.4Å; S174-T178 WeakPolarHBondContact O-CB 3.4Å; S174-T178 PolarHBondContact O-N 3Å; S174-T178 PolarHBondContact O-OG1 3.14Å; V175-T178 PolarHBondContact O-N 2.68Å; A176-T178 VanDerWaalsContact C-N 3.31Å; A176-T178 PolarHBondContact O-N 3.05Å
179	I	92.6	Very high	95.5	Very high	7 Å²	7	41.1 Å²	41.1	4%	0.036	22%	0.216	C	C	.	.	H	α-helix	trans	-101.1	-9.4	-174	78.9	173	0	0	0	114.1	L134 V138 V175 A176 E181 K182 F183	L134-I179 HydrophobicContact CD2-CG2 3.86Å; L134-I179 HydrophobicContact CG-CG2 4.38Å; V138-I179 HydrophobicContact CB-CD1 4.48Å; V138-I179 HydrophobicContact CG1-CD1 3.52Å; V138-I179 HydrophobicContact CG2-CB 4.41Å; V138-I179 HydrophobicContact CG2-CD1 4.05Å; V138-I179 HydrophobicContact CG2-CG2 3.75Å; V175-I179 HydrophobicContact CG1-CD1 4.38Å; V175-I179 WeakPolarHBondContact O-CG1 3.43Å; V175-I179 WeakPolarHBondContact O-CG2 3.45Å; V175-I179 PolarHBondContact O-N 2.84Å; V175-I179 VanDerWaalsContact O-N 3.08Å; A176-I179 PolarHBondContact O-N 3.27Å; I179-E181 PolarHBondContact O-N 3.15Å; I179-K182 HydrophobicContact CB-CB 4.29Å; I179-K182 HydrophobicContact CD1-CB 4.42Å; I179-K182 HydrophobicContact CG1-CB 4.38Å; I179-K182 VanDerWaalsContact O-CB 3.29Å; I179-K182 WeakPolarHBondContact O-CB 3.38Å; I179-K182 PolarHBondContact O-N 3.46Å; I179-F183 HydrophobicContact CD1-CB 4.01Å; I179-F183 HydrophobicContact CD1-CD2 3.69Å; I179-F183 HydrophobicContact CD1-CG 4.32Å; I179-F183 HydrophobicContact CG1-CB 3.88Å; I179-F183 HydrophobicContact CG1-CD2 4.03Å; I179-F183 HydrophobicContact CG1-CG 4.47Å
180	E	94	Very high	95.5	Very high	82 Å²	82	41.1 Å²	41.1	38%	0.383	22%	0.216	S	C	.	.	G	3₁₀ helix	trans	51.5	-124.7	170.5	-62.3	165.8	167.9	0	0	111.8	K131 A176 D177 K182 F183 A223	K131-E180 IonicContact NZ-OE1 3.68Å; K131-E180 PolarHBondContact NZ-OE1 3.2Å; K131-E180 IonicContact NZ-OE2 2.77Å; K131-E180 PolarHBondContact NZ-OE2 3.13Å; A176-E180 PolarHBondContact O-N 3.24Å; D177-E180 WeakPolarHBondContact O-CG 3.42Å; E180-K182 PolarHBondContact O-N 2.96Å; E180-F183 VanDerWaalsContact O-CB 3.31Å; E180-F183 WeakPolarHBondContact O-CB 3.29Å; E180-F183 PolarHBondContact O-N 3Å; E180-A223 CarbonylContact C-O 3.24Å; E180-A223 VanDerWaalsContact C-O 3.24Å
181	E	94.1	Very high	95.5	Very high	117 Å²	117	39.9 Å²	39.9	55%	0.547	21%	0.208	S	C	.	.	G	3₁₀ helix	trans	-59.2	-19.4	-175.7	68.8	-76.9	173.5	0	0	113.4	I179 F183 V184 A223	I179-E181 PolarHBondContact O-N 3.15Å; E181-F183 PolarHBondContact O-N 3.05Å; E181-V184 WeakPolarHBondContact O-CB 2.77Å; E181-V184 WeakPolarHBondContact O-CG2 3.4Å; E181-V184 PolarHBondContact O-N 3.27Å; E181-A223 WeakPolarHBondContact CA-O 2.99Å; E181-A223 PolarHBondContact N-O 3.26Å
182	K	93.1	Very high	95.5	Very high	100 Å²	100	43.8 Å²	43.8	44%	0.435	23%	0.233	S	C	.	.	G	3₁₀ helix	trans	-73.5	-8.9	175.9	-57.9	-179.5	179.5	179.1	0	112.7	V135 I179 E180 V184 P185 Y186	V135-K182 HydrophobicContact CG1-CD 3.64Å; I179-K182 HydrophobicContact CB-CB 4.29Å; I179-K182 HydrophobicContact CD1-CB 4.42Å; I179-K182 HydrophobicContact CG1-CB 4.38Å; I179-K182 VanDerWaalsContact O-CB 3.29Å; I179-K182 WeakPolarHBondContact O-CB 3.38Å; I179-K182 PolarHBondContact O-N 3.46Å; E180-K182 PolarHBondContact O-N 2.96Å; K182-V184 VanDerWaalsContact C-N 3.35Å; K182-P185 WeakPolarHBondContact O-CD 3.22Å; K182-Y186 WeakPolarHBondContact O-CE2 3Å
183	F	95.2	Very high	95.5	Very high	1 Å²	1	44.8 Å²	44.8	0%	0.004	24%	0.24	C	C	.	.	G	3₁₀ helix	trans	-78.4	-18.2	173.1	-157.3	-88.5	0	0	0	112.9	V142 I172 A176 I179 E180 E181 Y186 Y187 F190 I220 A223 V224	V142-F183 HydrophobicContact CG2-CE2 4.45Å; I172-F183 HydrophobicContact CG2-CZ 4.35Å; A176-F183 HydrophobicContact CB-CD1 4.31Å; A176-F183 HydrophobicContact CB-CD2 3.67Å; A176-F183 HydrophobicContact CB-CE1 4.47Å; A176-F183 HydrophobicContact CB-CE2 3.84Å; A176-F183 HydrophobicContact CB-CG 3.93Å; A176-F183 HydrophobicContact CB-CZ 4.24Å; I179-F183 HydrophobicContact CD1-CB 4.01Å; I179-F183 HydrophobicContact CD1-CD2 3.69Å; I179-F183 HydrophobicContact CD1-CG 4.32Å; I179-F183 HydrophobicContact CG1-CB 3.88Å; I179-F183 HydrophobicContact CG1-CD2 4.03Å; I179-F183 HydrophobicContact CG1-CG 4.47Å; E180-F183 VanDerWaalsContact O-CB 3.31Å; E180-F183 WeakPolarHBondContact O-CB 3.29Å; E180-F183 PolarHBondContact O-N 3Å; E181-F183 PolarHBondContact O-N 3.05Å; F183-Y186 WeakPolarHBondContact O-CB 3.48Å; F183-Y186 PolarHBondContact O-N 2.94Å; F183-Y187 PolarHBondContact O-N 3.41Å; F183-F190 HydrophobicContact CE1-CD2 4.18Å; F183-F190 AromaticContact CZ-CD2 3.71Å; F183-F190 HydrophobicContact CZ-CD2 3.71Å; F183-F190 AromaticContact CZ-CE2 3.97Å; F183-F190 HydrophobicContact CZ-CE2 3.97Å; F183-F190 HydrophobicContact CZ-CG 4.36Å; F183-I220 HydrophobicContact CD1-CG1 4.37Å; F183-I220 HydrophobicContact CD1-CG2 4.06Å; F183-I220 HydrophobicContact CE1-CB 4.46Å; F183-I220 HydrophobicContact CE1-CD1 3.99Å; F183-I220 HydrophobicContact CE1-CG1 3.82Å; F183-I220 HydrophobicContact CE1-CG2 3.89Å; F183-I220 HydrophobicContact CZ-CD1 4.17Å; F183-I220 HydrophobicContact CZ-CG1 4.16Å; F183-A223 HydrophobicContact CB-CB 4.4Å; F183-V224 HydrophobicContact CB-CG1 4.38Å; F183-V224 HydrophobicContact CD1-CG1 4.19Å
184	V	96.2	Very high	95.5	Very high	53 Å²	53	44.4 Å²	44.4	32%	0.321	24%	0.237	S	C	.	.	G	3₁₀ helix	trans	-48.1	-45.9	-176.5	173.1	0	0	0	0	113.9	E181 K182 Y186 Y187 V224	E181-V184 WeakPolarHBondContact O-CB 2.77Å; E181-V184 WeakPolarHBondContact O-CG2 3.4Å; E181-V184 PolarHBondContact O-N 3.27Å; K182-V184 VanDerWaalsContact C-N 3.35Å; V184-Y186 PolarHBondContact O-N 3.44Å; V184-Y187 PolarHBondContact O-N 2.67Å; V184-V224 HydrophobicContact CG2-CB 3.83Å; V184-V224 HydrophobicContact CG2-CG1 4.02Å
185	P	95.9	Very high	95.7	Very high	97 Å²	97	48.3 Å²	48.3	63%	0.63	25%	0.251	S	S	*	.	G	3₁₀ helix	trans	-63.1	-16.8	-179.6	-21.4	34.7	0	0	0	114.3	K182	K182-P185 WeakPolarHBondContact O-CD 3.22Å
186	Y	96.1	Very high	95.8	Very high	33 Å²	33	51.9 Å²	51.9	13%	0.129	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-105.8	-5.6	-174.7	-49.3	-72.9	0	0	0	113.1	V138 D139 V142 K182 F183 V184 D188 I189 F190	V138-Y186 HydrophobicContact CG1-CD2 4.47Å; V138-Y186 HydrophobicContact CG1-CE2 3.54Å; D139-Y186 WeakPolarHBondContact CA-OH 3.49Å; D139-Y186 PolarHBondContact OD1-OH 3.42Å; V142-Y186 HydrophobicContact CB-CD1 4.14Å; V142-Y186 HydrophobicContact CB-CE1 4.28Å; V142-Y186 HydrophobicContact CB-CG 4.26Å; V142-Y186 HydrophobicContact CG1-CD1 3.53Å; V142-Y186 HydrophobicContact CG1-CD2 4.1Å; V142-Y186 HydrophobicContact CG1-CE1 4.16Å; V142-Y186 HydrophobicContact CG1-CG 3.49Å; V142-Y186 VanDerWaalsContact CG1-CG 3.49Å; V142-Y186 HydrophobicContact CG2-CD2 4.34Å; V142-Y186 HydrophobicContact CG2-CE2 4.46Å; K182-Y186 WeakPolarHBondContact O-CE2 3Å; F183-Y186 WeakPolarHBondContact O-CB 3.48Å; F183-Y186 PolarHBondContact O-N 2.94Å; V184-Y186 PolarHBondContact O-N 3.44Å; Y186-D188 VanDerWaalsContact C-N 3.34Å; Y186-D188 PolarHBondContact O-N 3.11Å; Y186-I189 HydrophobicContact CD1-CD1 4.26Å; Y186-I189 WeakPolarHBondContact O-CG1 3.38Å; Y186-I189 PolarHBondContact O-N 2.77Å; Y186-F190 WeakPolarHBondContact O-CD2 3.12Å; Y186-F190 PolarHBondContact O-N 3.41Å
187	Y	96.9	Very high	95.9	Very high	33 Å²	33	51.9 Å²	51.9	13%	0.129	27%	0.267	C	S	.	.	H	α-helix	trans	-53.5	-49.6	-178.2	180	-91.1	0	0	0	112.7	F183 V184 I189 F190 M191 I220 V224 K228	F183-Y187 PolarHBondContact O-N 3.41Å; V184-Y187 PolarHBondContact O-N 2.67Å; Y187-I189 PolarHBondContact O-N 2.9Å; Y187-F190 PolarHBondContact O-N 2.99Å; Y187-M191 HydrophobicContact CD1-CB 4.43Å; Y187-M191 HydrophobicContact CD2-CE 3.92Å; Y187-M191 HydrophobicContact CE1-CB 4.21Å; Y187-M191 HydrophobicContact CE1-CE 4.46Å; Y187-M191 HydrophobicContact CE1-CG 4.2Å; Y187-M191 HydrophobicContact CE2-CE 3.23Å; Y187-M191 WeakPolarHBondContact O-CB 3.37Å; Y187-M191 PolarHBondContact O-N 3.13Å; Y187-I220 HydrophobicContact CD2-CG2 3.54Å; Y187-I220 HydrophobicContact CE2-CG2 3.98Å; Y187-V224 HydrophobicContact CD2-CB 4.35Å; Y187-V224 HydrophobicContact CD2-CG1 3.97Å; Y187-V224 HydrophobicContact CD2-CG2 3.69Å; Y187-V224 HydrophobicContact CE2-CG2 3.86Å; Y187-K228 HydrophobicContact CD1-CD 3.81Å; Y187-K228 HydrophobicContact CD1-CG 4.48Å; Y187-K228 HydrophobicContact CE1-CD 4.1Å; Y187-K228 HydrophobicContact CE2-CB 4.47Å; Y187-K228 HydrophobicContact CG-CD 4.25Å; Y187-K228 HydrophobicContact CG-CG 4.47Å; Y187-K228 PolarHBondContact OH-O 3.5Å
188	D	96.1	Very high	96.1	Very high	97 Å²	97	49.2 Å²	49.2	52%	0.519	25%	0.254	S	S	.	.	H	α-helix	trans	-69.1	-20	-172.9	-64.3	-38.2	0	0	0	113.1	Y186 P192 K228	Y186-D188 VanDerWaalsContact C-N 3.34Å; Y186-D188 PolarHBondContact O-N 3.11Å; D188-P192 WeakPolarHBondContact O-CD 3.46Å; D188-P192 WeakPolarHBondContact O-CG 3.23Å; D188-K228 IonicContact OD1-NZ 2.68Å; D188-K228 PolarHBondContact OD1-NZ 3.34Å; D188-K228 IonicContact OD2-NZ 3.97Å; D188-K228 PolarHBondContact OD2-NZ 3.25Å
189	I	95.8	Very high	96.4	Very high	65 Å²	65	54.6 Å²	54.6	33%	0.333	28%	0.277	S	S	.	.	H	α-helix	trans	-84	-31.3	178	63	163.2	0	0	0	112.4	V142 H146 Y186 Y187	V142-I189 HydrophobicContact CG1-CD1 4.4Å; H146-I189 HydrophobicContact CB-CD1 4.12Å; H146-I189 PolarHBondContact CD2-O 3.17Å; H146-I189 VanDerWaalsContact CD2-O 3.27Å; H146-I189 PolarHBondContact NE2-O 3.44Å; H146-I189 VanDerWaalsContact NE2-O 3.17Å; Y186-I189 HydrophobicContact CD1-CD1 4.26Å; Y186-I189 WeakPolarHBondContact O-CG1 3.38Å; Y186-I189 PolarHBondContact O-N 2.77Å; Y187-I189 PolarHBondContact O-N 2.9Å
190	F	97.6	Very high	96.5	Very high	1 Å²	1	57.3 Å²	57.3	0%	0.004	29%	0.292	C	S	.	.	H	α-helix	trans	-88.5	-40.9	179	-74.7	-84.8	0	0	0	113.3	V142 L145 H146 L149 I172 F183 Y186 Y187 P192 S193 L194 I220	V142-F190 HydrophobicContact CG1-CD2 4.48Å; V142-F190 HydrophobicContact CG1-CE2 3.33Å; V142-F190 HydrophobicContact CG1-CZ 3.78Å; L145-F190 HydrophobicContact CB-CE1 4.44Å; L145-F190 HydrophobicContact CB-CZ 4.26Å; H146-F190 HydrophobicContact CB-CE1 3.98Å; H146-F190 HydrophobicContact CB-CE2 4.23Å; H146-F190 HydrophobicContact CB-CZ 3.65Å; L149-F190 HydrophobicContact CD2-CD1 3.63Å; L149-F190 HydrophobicContact CD2-CE1 4.08Å; I172-F190 HydrophobicContact CD1-CD1 3.85Å; I172-F190 HydrophobicContact CD1-CE1 3.55Å; I172-F190 HydrophobicContact CG1-CD1 4.38Å; I172-F190 HydrophobicContact CG1-CE1 3.86Å; I172-F190 HydrophobicContact CG2-CD1 3.93Å; I172-F190 HydrophobicContact CG2-CE1 4.01Å; I172-F190 HydrophobicContact CG2-CG 4.42Å; F183-F190 HydrophobicContact CE1-CD2 4.18Å; F183-F190 AromaticContact CZ-CD2 3.71Å; F183-F190 HydrophobicContact CZ-CD2 3.71Å; F183-F190 AromaticContact CZ-CE2 3.97Å; F183-F190 HydrophobicContact CZ-CE2 3.97Å; F183-F190 HydrophobicContact CZ-CG 4.36Å; Y186-F190 WeakPolarHBondContact O-CD2 3.12Å; Y186-F190 PolarHBondContact O-N 3.41Å; Y187-F190 PolarHBondContact O-N 2.99Å; F190-P192 VanDerWaalsContact C-CD 3.48Å; F190-S193 PolarHBondContact O-N 3.31Å; F190-S193 VanDerWaalsContact O-N 3.09Å; F190-L194 HydrophobicContact CB-CD1 4.01Å; F190-L194 HydrophobicContact CB-CG 4.47Å; F190-L194 WeakPolarHBondContact O-CG 3.41Å; F190-L194 PolarHBondContact O-N 3.24Å; F190-I220 HydrophobicContact CB-CD1 4.35Å
191	M	97.3	Very high	96.5	Very high	10 Å²	10	53.5 Å²	53.5	5%	0.049	27%	0.274	C	S	.	.	H	α-helix	trans	-58.5	-39.4	-165.8	-164	56.7	72.8	0	0	114	Y187 L194 K195 I217 I220	Y187-M191 HydrophobicContact CD1-CB 4.43Å; Y187-M191 HydrophobicContact CD2-CE 3.92Å; Y187-M191 HydrophobicContact CE1-CB 4.21Å; Y187-M191 HydrophobicContact CE1-CE 4.46Å; Y187-M191 HydrophobicContact CE1-CG 4.2Å; Y187-M191 HydrophobicContact CE2-CE 3.23Å; Y187-M191 WeakPolarHBondContact O-CB 3.37Å; Y187-M191 PolarHBondContact O-N 3.13Å; M191-L194 PolarHBondContact O-N 3.44Å; M191-K195 HydrophobicContact CG-CD 4.17Å; M191-K195 HydrophobicContact CG-CG 4.47Å; M191-K195 WeakPolarHBondContact O-CB 3.38Å; M191-K195 WeakPolarHBondContact O-CG 3.32Å; M191-K195 PolarHBondContact O-N 3.48Å; M191-K195 HydrophobicContact SD-CG 4.39Å; M191-I217 HydrophobicContact CE-CG2 4.14Å; M191-I217 HydrophobicContact SD-CG1 4.05Å; M191-I217 HydrophobicContact SD-CG2 3.97Å; M191-I220 HydrophobicContact CE-CB 4.44Å; M191-I220 HydrophobicContact CE-CG2 3.85Å
192	P	97.6	Very high	96.6	Very high	82 Å²	82	52.5 Å²	52.5	53%	0.532	28%	0.276	S	S	.	.	H	α-helix	trans	-60.5	-46.2	174.9	-24.4	35.5	0	0	0	113.1	D188 F190 H196	D188-P192 WeakPolarHBondContact O-CD 3.46Å; D188-P192 WeakPolarHBondContact O-CG 3.23Å; F190-P192 VanDerWaalsContact C-CD 3.48Å; P192-H196 WeakPolarHBondContact O-CB 3.49Å; P192-H196 PolarHBondContact O-N 2.77Å
193	S	97.8	Very high	96.7	Very high	21 Å²	21	53.4 Å²	53.4	15%	0.147	28%	0.281	C	S	.	.	H	α-helix	trans	-66.9	-39.5	179.7	-61	0	0	0	0	112.3	F190 H196 I197	F190-S193 PolarHBondContact O-N 3.31Å; F190-S193 VanDerWaalsContact O-N 3.09Å; S193-H196 PolarHBondContact O-N 3.29Å; S193-I197 WeakPolarHBondContact O-CG1 3.45Å; S193-I197 PolarHBondContact O-N 3.04Å
194	L	98.3	Very high	96.6	Very high	0 Å²	0	61 Å²	61	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-66.6	-44.1	178.1	-64.5	173.5	0	0	0	111.7	L149 V169 F190 M191 H196 I197 V198 T213 I217 I220	L149-L194 HydrophobicContact CD2-CD2 4.46Å; V169-L194 HydrophobicContact CG1-CD2 4.06Å; F190-L194 HydrophobicContact CB-CD1 4.01Å; F190-L194 HydrophobicContact CB-CG 4.47Å; F190-L194 WeakPolarHBondContact O-CG 3.41Å; F190-L194 PolarHBondContact O-N 3.24Å; M191-L194 PolarHBondContact O-N 3.44Å; L194-H196 VanDerWaalsContact C-N 3.31Å; L194-H196 PolarHBondContact O-N 2.82Å; L194-I197 PolarHBondContact O-N 2.92Å; L194-V198 PolarHBondContact O-N 3.31Å; L194-V198 VanDerWaalsContact O-N 3.11Å; L194-T213 HydrophobicContact CB-CG2 4.03Å; L194-T213 HydrophobicContact CD2-CG2 3.95Å; L194-T213 VanDerWaalsContact O-CG2 3.3Å; L194-T213 WeakPolarHBondContact O-CG2 3.18Å; L194-I217 HydrophobicContact CB-CD1 3.95Å; L194-I217 HydrophobicContact CB-CG1 3.74Å; L194-I217 HydrophobicContact CD1-CG1 4.07Å; L194-I220 HydrophobicContact CD1-CD1 3.48Å; L194-I220 VanDerWaalsContact CD1-CD1 3.48Å
195	K	97.9	Very high	96.6	Very high	111 Å²	111	64 Å²	64	48%	0.483	33%	0.325	S	S	.	.	H	α-helix	trans	-59	-44.6	173.6	-74.3	176	178.1	175.6	0	111.2	M191 I197 V198 E199	M191-K195 HydrophobicContact CG-CD 4.17Å; M191-K195 HydrophobicContact CG-CG 4.47Å; M191-K195 WeakPolarHBondContact O-CB 3.38Å; M191-K195 WeakPolarHBondContact O-CG 3.32Å; M191-K195 PolarHBondContact O-N 3.48Å; M191-K195 HydrophobicContact SD-CG 4.39Å; K195-I197 VanDerWaalsContact C-N 3.32Å; K195-I197 PolarHBondContact O-N 2.86Å; K195-V198 PolarHBondContact O-N 3.5Å; K195-V198 VanDerWaalsContact O-N 3.09Å; K195-E199 WeakPolarHBondContact O-CG 3.49Å; K195-E199 PolarHBondContact O-N 3.01Å
196	H	97.8	Very high	96.6	Very high	74 Å²	74	60.2 Å²	60.2	34%	0.343	30%	0.299	S	S	.	.	H	α-helix	trans	-59.9	-41	176.5	-169.6	49.3	0	0	0	112.5	P192 S193 L194 V198 E199 L200	P192-H196 WeakPolarHBondContact O-CB 3.49Å; P192-H196 PolarHBondContact O-N 2.77Å; S193-H196 PolarHBondContact O-N 3.29Å; L194-H196 VanDerWaalsContact C-N 3.31Å; L194-H196 PolarHBondContact O-N 2.82Å; H196-V198 VanDerWaalsContact C-N 3.32Å; H196-V198 PolarHBondContact O-N 2.93Å; H196-E199 IonicContact ND1-OE2 2.72Å; H196-E199 PolarHBondContact O-N 3.12Å; H196-L200 VanDerWaalsContact NE2-CD1 3.33Å; H196-L200 WeakPolarHBondContact NE2-CD1 3.21Å; H196-L200 WeakPolarHBondContact O-CB 3.17Å; H196-L200 VanDerWaalsContact O-CG 3.27Å; H196-L200 WeakPolarHBondContact O-CG 3.22Å; H196-L200 PolarHBondContact O-N 3.15Å
197	I	98	Very high	96.7	Very high	0 Å²	0	65.3 Å²	65.3	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-60.1	-42.7	174.7	-70.1	161.2	0	0	0	111.1	L149 L153 L165 V169 S193 L194 K195 E199 L200 A201 L209 T213	L149-I197 HydrophobicContact CD1-CD1 3.9Å; L153-I197 HydrophobicContact CD1-CD1 4.4Å; L153-I197 HydrophobicContact CD1-CG1 3.61Å; L153-I197 HydrophobicContact CD2-CG1 4.26Å; L153-I197 HydrophobicContact CG-CG1 4.48Å; L165-I197 HydrophobicContact CD1-CD1 4.11Å; L165-I197 HydrophobicContact CD2-CD1 4.33Å; V169-I197 HydrophobicContact CG1-CD1 4.41Å; S193-I197 WeakPolarHBondContact O-CG1 3.45Å; S193-I197 PolarHBondContact O-N 3.04Å; L194-I197 PolarHBondContact O-N 2.92Å; K195-I197 VanDerWaalsContact C-N 3.32Å; K195-I197 PolarHBondContact O-N 2.86Å; I197-E199 VanDerWaalsContact C-N 3.34Å; I197-E199 PolarHBondContact O-N 3.46Å; I197-L200 PolarHBondContact O-N 3.08Å; I197-A201 WeakPolarHBondContact O-CB 3.43Å; I197-A201 PolarHBondContact O-N 2.93Å; I197-L209 HydrophobicContact CG2-CD1 4.2Å; I197-L209 HydrophobicContact CG2-CD2 4.07Å; I197-L209 HydrophobicContact CG2-CG 3.92Å; I197-T213 HydrophobicContact CB-CG2 3.99Å; I197-T213 HydrophobicContact CG2-CG2 3.91Å; I197-T213 VanDerWaalsContact CG2-OG1 3.27Å; I197-T213 WeakPolarHBondContact CG2-OG1 3.48Å
198	V	97.9	Very high	96.7	Very high	27 Å²	27	68.5 Å²	68.5	16%	0.164	34%	0.341	C	S	.	.	H	α-helix	trans	-64.5	-39	179.3	176.3	0	0	0	0	111.9	L194 K195 H196 R210 T213 I214 I217	L194-V198 PolarHBondContact O-N 3.31Å; L194-V198 VanDerWaalsContact O-N 3.11Å; K195-V198 PolarHBondContact O-N 3.5Å; K195-V198 VanDerWaalsContact O-N 3.09Å; H196-V198 VanDerWaalsContact C-N 3.32Å; H196-V198 PolarHBondContact O-N 2.93Å; V198-R210 HydrophobicContact CG1-CG 4.29Å; V198-T213 HydrophobicContact CG2-CG2 3.63Å; V198-I214 HydrophobicContact CG1-CD1 4.39Å; V198-I214 HydrophobicContact CG1-CG1 4.27Å; V198-I214 HydrophobicContact CG2-CG1 3.92Å; V198-I217 HydrophobicContact CG2-CD1 3.94Å
199	E	97.3	Very high	96.8	Very high	135 Å²	135	63.9 Å²	63.9	63%	0.631	32%	0.316	S	S	*	.	H	α-helix	trans	-68	-39.5	176.3	-69.2	168.7	175.9	0	0	112.2	K195 H196 I197 V202	K195-E199 WeakPolarHBondContact O-CG 3.49Å; K195-E199 PolarHBondContact O-N 3.01Å; H196-E199 IonicContact ND1-OE2 2.72Å; H196-E199 PolarHBondContact O-N 3.12Å; I197-E199 VanDerWaalsContact C-N 3.34Å; I197-E199 PolarHBondContact O-N 3.46Å; E199-V202 WeakPolarHBondContact O-CG1 2.97Å
200	L	95.4	Very high	96.9	Very high	65 Å²	65	65.4 Å²	65.4	34%	0.34	32%	0.318	S	S	.	.	H	α-helix	trans	-73.3	-38.7	178.1	-72.7	175.2	0	0	0	112.9	L153 I157 H196 I197 V202	L153-L200 HydrophobicContact CD1-CD1 4Å; I157-L200 HydrophobicContact CD1-CD1 4Å; I157-L200 HydrophobicContact CG1-CD1 3.82Å; H196-L200 VanDerWaalsContact NE2-CD1 3.33Å; H196-L200 WeakPolarHBondContact NE2-CD1 3.21Å; H196-L200 WeakPolarHBondContact O-CB 3.17Å; H196-L200 VanDerWaalsContact O-CG 3.27Å; H196-L200 WeakPolarHBondContact O-CG 3.22Å; H196-L200 PolarHBondContact O-N 3.15Å; I197-L200 PolarHBondContact O-N 3.08Å; L200-V202 PolarHBondContact O-N 3.1Å
201	A	95.1	Very high	96.9	Very high	1 Å²	1	67.2 Å²	67.2	1%	0.008	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80	42.4	-168.9	0	0	0	0	0	114.3	I197 L206 R210	I197-A201 WeakPolarHBondContact O-CB 3.43Å; I197-A201 PolarHBondContact O-N 2.93Å; A201-L206 HydrophobicContact CB-CB 3.77Å; A201-L206 HydrophobicContact CB-CD1 4.3Å; A201-R210 HydrophobicContact CB-CB 3.79Å; A201-R210 HydrophobicContact CB-CG 4.29Å; A201-R210 WeakPolarHBondContact O-CD 3.49Å
202	V	94.8	Very high	97	Very high	97 Å²	97	68.8 Å²	68.8	59%	0.588	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.6	-22.3	-178.4	-66.3	0	0	0	0	114	E199 L200	E199-V202 WeakPolarHBondContact O-CG1 2.97Å; L200-V202 PolarHBondContact O-N 3.1Å
203	Q	94.8	Very high	97	Very high	118 Å²	118	64.9 Å²	64.9	55%	0.551	32%	0.318	S	S	*	.	S	Bend	trans	-70	151.5	-177.1	-61.7	170.6	0.9	0	0	111.6	E205 L206	Q203-E205 PolarHBondContact O-N 3.36Å; Q203-E205 VanDerWaalsContact O-N 3.17Å; Q203-L206 PolarHBondContact O-N 3.06Å
204	K	95	Very high	97.1	Very high	160 Å²	160	67.7 Å²	67.7	70%	0.696	33%	0.331	S	S	*	.	G	3₁₀ helix	trans	-59.1	-34.3	-175.1	-174.2	-179.6	176.7	-176.2	0	111.9	L206 K207	K204-L206 PolarHBondContact O-N 3.09Å; K204-K207 HydrophobicContact CG-CD 4.34Å; K204-K207 WeakPolarHBondContact O-CG 3.3Å; K204-K207 PolarHBondContact O-N 3.03Å
205	E	94.9	Very high	97.1	Very high	117 Å²	117	72.5 Å²	72.5	55%	0.547	35%	0.353	S	S	.	.	G	3₁₀ helix	trans	-69.6	-23.4	-179.1	-59.7	67.3	-143.1	0	0	111.8	K162 Q203	K162-E205 PolarHBondContact NZ-O 3.07Å; Q203-E205 PolarHBondContact O-N 3.36Å; Q203-E205 VanDerWaalsContact O-N 3.17Å
206	L	96.8	Very high	97.1	Very high	17 Å²	17	67.2 Å²	67.2	9%	0.089	33%	0.33	C	S	.	.	G	3₁₀ helix	trans	-101.4	7.1	-177.5	-58	179.6	0	0	0	112.9	L156 K162 A201 Q203 K204 L208 L209 R210	L156-L206 HydrophobicContact CD1-CD2 4Å; K162-L206 HydrophobicContact CB-CD2 4.24Å; K162-L206 HydrophobicContact CD-CD2 3.56Å; A201-L206 HydrophobicContact CB-CB 3.77Å; A201-L206 HydrophobicContact CB-CD1 4.3Å; Q203-L206 PolarHBondContact O-N 3.06Å; K204-L206 PolarHBondContact O-N 3.09Å; L206-L208 VanDerWaalsContact C-N 3.3Å; L206-L208 PolarHBondContact O-N 3.42Å; L206-L209 HydrophobicContact CD2-CD2 4.47Å; L206-L209 WeakPolarHBondContact O-CB 3.05Å; L206-L209 PolarHBondContact O-N 3.27Å; L206-R210 PolarHBondContact O-N 2.83Å
207	K	96.9	Very high	97.1	Very high	140 Å²	140	65.7 Å²	65.7	61%	0.609	32%	0.324	S	S	*	.	H	α-helix	trans	-55.7	-41.9	-179.9	-78.4	-177.3	176.7	-167.3	0	113.3	K204 R210 G211	K204-K207 HydrophobicContact CG-CD 4.34Å; K204-K207 WeakPolarHBondContact O-CG 3.3Å; K204-K207 PolarHBondContact O-N 3.03Å; K207-R210 PolarHBondContact O-N 3.14Å; K207-G211 PolarHBondContact O-N 3.48Å
208	L	97.4	Very high	97.1	Very high	100 Å²	100	68.6 Å²	68.6	52%	0.524	34%	0.344	S	S	.	.	H	α-helix	trans	-64	-49.4	178.3	-179.7	61.1	0	0	0	110.9	L206 R210 G211 K212	L206-L208 VanDerWaalsContact C-N 3.3Å; L206-L208 PolarHBondContact O-N 3.42Å; L208-R210 VanDerWaalsContact C-N 3.33Å; L208-R210 PolarHBondContact O-N 3.48Å; L208-G211 PolarHBondContact O-N 2.77Å; L208-K212 HydrophobicContact CD1-CD 4.37Å; L208-K212 HydrophobicContact CD1-CG 4.34Å; L208-K212 HydrophobicContact CG-CD 4.36Å; L208-K212 WeakPolarHBondContact O-CG 3.29Å; L208-K212 PolarHBondContact O-N 3.49Å
209	L	98.2	Very high	97.1	Very high	0 Å²	0	69.8 Å²	69.8	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-55	-49.2	174.2	176.9	60.3	0	0	0	111.4	L156 K162 L165 E166 V169 I197 L206 G211 K212 T213	L156-L209 HydrophobicContact CD1-CD2 4.19Å; L156-L209 HydrophobicContact CD2-CD2 3.68Å; K162-L209 HydrophobicContact CB-CD2 4.41Å; L165-L209 HydrophobicContact CD2-CD1 4.19Å; L165-L209 HydrophobicContact CD2-CD2 3.93Å; L165-L209 HydrophobicContact CG-CD1 3.91Å; E166-L209 HydrophobicContact CB-CD1 4.47Å; E166-L209 HydrophobicContact CG-CB 3.7Å; E166-L209 HydrophobicContact CG-CD1 3.82Å; E166-L209 HydrophobicContact CG-CG 4.3Å; V169-L209 HydrophobicContact CG2-CD1 4.35Å; I197-L209 HydrophobicContact CG2-CD1 4.2Å; I197-L209 HydrophobicContact CG2-CD2 4.07Å; I197-L209 HydrophobicContact CG2-CG 3.92Å; L206-L209 HydrophobicContact CD2-CD2 4.47Å; L206-L209 WeakPolarHBondContact O-CB 3.05Å; L206-L209 PolarHBondContact O-N 3.27Å; L209-G211 VanDerWaalsContact C-N 3.35Å; L209-G211 PolarHBondContact O-N 3.39Å; L209-K212 PolarHBondContact O-N 2.92Å; L209-T213 WeakPolarHBondContact O-CB 3.34Å; L209-T213 PolarHBondContact O-N 2.97Å; L209-T213 PolarHBondContact O-OG1 3.27Å
210	R	98.3	Very high	97.1	Very high	97 Å²	97	63.4 Å²	63.4	37%	0.366	32%	0.318	S	S	.	.	H	α-helix	trans	-58.3	-46.1	179.1	-168.9	179	-177.4	177.9	1.8	112	V198 A201 L206 K207 L208 T213 I214	V198-R210 HydrophobicContact CG1-CG 4.29Å; A201-R210 HydrophobicContact CB-CB 3.79Å; A201-R210 HydrophobicContact CB-CG 4.29Å; A201-R210 WeakPolarHBondContact O-CD 3.49Å; L206-R210 PolarHBondContact O-N 2.83Å; K207-R210 PolarHBondContact O-N 3.14Å; L208-R210 VanDerWaalsContact C-N 3.33Å; L208-R210 PolarHBondContact O-N 3.48Å; R210-T213 PolarHBondContact O-N 3.5Å; R210-I214 HydrophobicContact CG-CD1 4.08Å; R210-I214 WeakPolarHBondContact O-CG1 3.44Å; R210-I214 PolarHBondContact O-N 3.05Å
211	G	98.3	Very high	97.2	Very high	39 Å²	39	61.8 Å²	61.8	40%	0.402	32%	0.317	S	S	.	.	H	α-helix	trans	-59.5	-50.9	178.3	0	0	0	0	0	111.9	K207 L208 L209 T213 I214 E215	K207-G211 PolarHBondContact O-N 3.48Å; L208-G211 PolarHBondContact O-N 2.77Å; L209-G211 VanDerWaalsContact C-N 3.35Å; L209-G211 PolarHBondContact O-N 3.39Å; G211-T213 VanDerWaalsContact C-N 3.29Å; G211-T213 PolarHBondContact O-N 2.93Å; G211-I214 PolarHBondContact O-N 3.25Å; G211-E215 PolarHBondContact O-N 3.37Å
212	K	98.4	Very high	97.3	Very high	43 Å²	43	68.1 Å²	68.1	19%	0.187	35%	0.35	C	S	.	.	H	α-helix	trans	-61.6	-35.7	177.6	-71.2	-176.2	162	-150.2	0	113.1	E166 V169 T170 L208 L209 C216	E166-K212 HydrophobicContact CB-CD 4.29Å; E166-K212 WeakPolarHBondContact O-CD 3.02Å; V169-K212 HydrophobicContact CG2-CB 3.77Å; T170-K212 PolarHBondContact OG1-NZ 2.92Å; T170-K212 VanDerWaalsContact OG1-NZ 3.14Å; L208-K212 HydrophobicContact CD1-CD 4.37Å; L208-K212 HydrophobicContact CD1-CG 4.34Å; L208-K212 HydrophobicContact CG-CD 4.36Å; L208-K212 WeakPolarHBondContact O-CG 3.29Å; L208-K212 PolarHBondContact O-N 3.49Å; L209-K212 PolarHBondContact O-N 2.92Å; K212-C216 WeakPolarHBondContact O-CB 3.44Å; K212-C216 PolarHBondContact O-N 2.92Å
213	T	98.6	Very high	97.3	Very high	0 Å²	0	64.1 Å²	64.1	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-69.3	-39	176.3	-56.8	0	0	0	0	111.8	L194 I197 V198 L209 R210 G211 C216 I217	L194-T213 HydrophobicContact CB-CG2 4.03Å; L194-T213 HydrophobicContact CD2-CG2 3.95Å; L194-T213 VanDerWaalsContact O-CG2 3.3Å; L194-T213 WeakPolarHBondContact O-CG2 3.18Å; I197-T213 HydrophobicContact CB-CG2 3.99Å; I197-T213 HydrophobicContact CG2-CG2 3.91Å; I197-T213 VanDerWaalsContact CG2-OG1 3.27Å; I197-T213 WeakPolarHBondContact CG2-OG1 3.48Å; V198-T213 HydrophobicContact CG2-CG2 3.63Å; L209-T213 WeakPolarHBondContact O-CB 3.34Å; L209-T213 PolarHBondContact O-N 2.97Å; L209-T213 PolarHBondContact O-OG1 3.27Å; R210-T213 PolarHBondContact O-N 3.5Å; G211-T213 VanDerWaalsContact C-N 3.29Å; G211-T213 PolarHBondContact O-N 2.93Å; T213-C216 WeakPolarHBondContact O-CB 3.39Å; T213-C216 PolarHBondContact O-N 2.83Å; T213-I217 HydrophobicContact CG2-CD1 4.29Å; T213-I217 VanDerWaalsContact O-CG1 3.31Å; T213-I217 WeakPolarHBondContact O-CG1 3.29Å; T213-I217 PolarHBondContact O-N 2.95Å
214	I	98.5	Very high	97.3	Very high	81 Å²	81	59.2 Å²	59.2	42%	0.415	31%	0.306	S	S	.	.	H	α-helix	trans	-64.7	-42.5	174.9	-69	166.3	0	0	0	110.6	V198 R210 G211 I217 S218	V198-I214 HydrophobicContact CG1-CD1 4.39Å; V198-I214 HydrophobicContact CG1-CG1 4.27Å; V198-I214 HydrophobicContact CG2-CG1 3.92Å; R210-I214 HydrophobicContact CG-CD1 4.08Å; R210-I214 WeakPolarHBondContact O-CG1 3.44Å; R210-I214 PolarHBondContact O-N 3.05Å; G211-I214 PolarHBondContact O-N 3.25Å; I214-I217 PolarHBondContact O-N 3.3Å; I214-S218 PolarHBondContact O-N 3Å; I214-S218 PolarHBondContact O-OG 3.4Å
215	E	98.2	Very high	97.3	Very high	100 Å²	100	53.1 Å²	53.1	47%	0.467	29%	0.288	S	S	.	.	H	α-helix	trans	-58.6	-47.4	172.8	179.1	176.3	-150.1	0	0	110.9	G211 I217 S218 H219	G211-E215 PolarHBondContact O-N 3.37Å; E215-I217 PolarHBondContact O-N 3.41Å; E215-S218 WeakPolarHBondContact O-CA 3.06Å; E215-S218 WeakPolarHBondContact O-CB 3.44Å; E215-S218 PolarHBondContact O-N 3.16Å; E215-H219 PolarHBondContact O-CD2 3.44Å; E215-H219 VanDerWaalsContact O-CD2 3.31Å; E215-H219 PolarHBondContact O-N 3.28Å
216	C	98.5	Very high	97	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-57.6	-47.4	175.7	-178.3	0	0	0	0	112.8	V169 A173 K212 T213 S218 H219 I220	V169-C216 HydrophobicContact CB-CB 4.4Å; V169-C216 PolarHBondContact O-SG 3.41Å; A173-C216 HydrophobicContact CB-CB 3.94Å; K212-C216 WeakPolarHBondContact O-CB 3.44Å; K212-C216 PolarHBondContact O-N 2.92Å; T213-C216 WeakPolarHBondContact O-CB 3.39Å; T213-C216 PolarHBondContact O-N 2.83Å; C216-S218 PolarHBondContact O-N 3.08Å; C216-H219 PolarHBondContact O-N 3.34Å; C216-I220 WeakPolarHBondContact O-CG1 3.42Å; C216-I220 PolarHBondContact O-N 3.03Å
217	I	98.4	Very high	96.4	Very high	42 Å²	42	66.2 Å²	66.2	22%	0.215	35%	0.345	C	S	.	.	H	α-helix	trans	-58	-39.5	175	-70.3	167.1	0	0	0	110.8	M191 L194 V198 T213 I214 E215 I220 G221	M191-I217 HydrophobicContact CE-CG2 4.14Å; M191-I217 HydrophobicContact SD-CG1 4.05Å; M191-I217 HydrophobicContact SD-CG2 3.97Å; L194-I217 HydrophobicContact CB-CD1 3.95Å; L194-I217 HydrophobicContact CB-CG1 3.74Å; L194-I217 HydrophobicContact CD1-CG1 4.07Å; V198-I217 HydrophobicContact CG2-CD1 3.94Å; T213-I217 HydrophobicContact CG2-CD1 4.29Å; T213-I217 VanDerWaalsContact O-CG1 3.31Å; T213-I217 WeakPolarHBondContact O-CG1 3.29Å; T213-I217 PolarHBondContact O-N 2.95Å; I214-I217 PolarHBondContact O-N 3.3Å; E215-I217 PolarHBondContact O-N 3.41Å; I217-I220 PolarHBondContact O-N 3.38Å; I217-G221 PolarHBondContact O-N 3.33Å
218	S	97.8	Very high	95.6	Very high	62 Å²	62	64.7 Å²	64.7	43%	0.434	34%	0.339	S	S	.	.	H	α-helix	trans	-67.4	-46.1	-180	-54.1	0	0	0	0	111.9	I214 E215 C216 I220 G221 L222	I214-S218 PolarHBondContact O-N 3Å; I214-S218 PolarHBondContact O-OG 3.4Å; E215-S218 WeakPolarHBondContact O-CA 3.06Å; E215-S218 WeakPolarHBondContact O-CB 3.44Å; E215-S218 PolarHBondContact O-N 3.16Å; C216-S218 PolarHBondContact O-N 3.08Å; S218-I220 VanDerWaalsContact C-N 3.35Å; S218-I220 PolarHBondContact O-N 3.34Å; S218-G221 PolarHBondContact O-N 3.4Å; S218-L222 WeakPolarHBondContact O-CG 3.47Å; S218-L222 PolarHBondContact O-N 2.67Å
219	H	97.6	Very high	95.5	Very high	51 Å²	51	62.9 Å²	62.9	24%	0.236	33%	0.329	C	S	.	.	H	α-helix	trans	-61.9	-41.3	174.6	-80	-79.1	0	0	0	112.3	A173 D177 E215 C216 G221 L222 A223	A173-H219 HydrophobicContact CB-CB 4.23Å; D177-H219 IonicContact OD1-CE1 2.66Å; D177-H219 IonicContact OD1-ND1 3.16Å; D177-H219 PolarHBondContact OD1-ND1 2.91Å; E215-H219 PolarHBondContact O-CD2 3.44Å; E215-H219 VanDerWaalsContact O-CD2 3.31Å; E215-H219 PolarHBondContact O-N 3.28Å; C216-H219 PolarHBondContact O-N 3.34Å; H219-G221 PolarHBondContact O-N 3.29Å; H219-L222 PolarHBondContact O-N 3.33Å; H219-A223 WeakPolarHBondContact O-CB 3.49Å; H219-A223 PolarHBondContact O-N 2.77Å
220	I	97.6	Very high	95.4	Very high	1 Å²	1	66.2 Å²	66.2	1%	0.005	35%	0.347	C	S	.	.	H	α-helix	trans	-60.7	-47	174	-70.3	170.7	0	0	0	110.2	I172 A176 F183 Y187 F190 M191 L194 C216 I217 S218 L222 A223 V224	I172-I220 HydrophobicContact CG2-CD1 4.08Å; A176-I220 HydrophobicContact CB-CG1 3.74Å; F183-I220 HydrophobicContact CD1-CG1 4.37Å; F183-I220 HydrophobicContact CD1-CG2 4.06Å; F183-I220 HydrophobicContact CE1-CB 4.46Å; F183-I220 HydrophobicContact CE1-CD1 3.99Å; F183-I220 HydrophobicContact CE1-CG1 3.82Å; F183-I220 HydrophobicContact CE1-CG2 3.89Å; F183-I220 HydrophobicContact CZ-CD1 4.17Å; F183-I220 HydrophobicContact CZ-CG1 4.16Å; Y187-I220 HydrophobicContact CD2-CG2 3.54Å; Y187-I220 HydrophobicContact CE2-CG2 3.98Å; F190-I220 HydrophobicContact CB-CD1 4.35Å; M191-I220 HydrophobicContact CE-CB 4.44Å; M191-I220 HydrophobicContact CE-CG2 3.85Å; L194-I220 HydrophobicContact CD1-CD1 3.48Å; L194-I220 VanDerWaalsContact CD1-CD1 3.48Å; C216-I220 WeakPolarHBondContact O-CG1 3.42Å; C216-I220 PolarHBondContact O-N 3.03Å; I217-I220 PolarHBondContact O-N 3.38Å; S218-I220 VanDerWaalsContact C-N 3.35Å; S218-I220 PolarHBondContact O-N 3.34Å; I220-L222 VanDerWaalsContact C-N 3.32Å; I220-L222 PolarHBondContact O-N 2.78Å; I220-A223 PolarHBondContact O-N 3.29Å; I220-V224 HydrophobicContact CG2-CG1 4.41Å; I220-V224 WeakPolarHBondContact O-CG1 3.26Å; I220-V224 WeakPolarHBondContact O-CG2 3.41Å; I220-V224 PolarHBondContact O-N 3.33Å
221	G	97.1	Very high	95.2	Very high	31 Å²	31	64.5 Å²	64.5	32%	0.32	35%	0.346	S	S	.	.	H	α-helix	trans	-60.1	-39.3	177.9	0	0	0	0	0	113.3	I217 S218 H219 G225	I217-G221 PolarHBondContact O-N 3.33Å; S218-G221 PolarHBondContact O-N 3.4Å; H219-G221 PolarHBondContact O-N 3.29Å; G221-G225 PolarHBondContact O-N 3.01Å; G221-G225 VanDerWaalsContact O-N 3.16Å
222	L	96.8	Very high	95	Very high	134 Å²	134	66 Å²	66	70%	0.702	34%	0.342	S	S	*	.	H	α-helix	trans	-65.1	-44.4	173.8	-71.4	170.8	0	0	0	111.7	S218 H219 I220	S218-L222 WeakPolarHBondContact O-CG 3.47Å; S218-L222 PolarHBondContact O-N 2.67Å; H219-L222 PolarHBondContact O-N 3.33Å; I220-L222 VanDerWaalsContact C-N 3.32Å; I220-L222 PolarHBondContact O-N 2.78Å
223	A	94.9	Very high	94.8	Very high	13 Å²	13	67.4 Å²	67.4	11%	0.107	35%	0.352	C	S	.	.	H	α-helix	trans	-65.3	-40.5	-178.4	0	0	0	0	0	113	A176 E180 E181 F183 H219 I220	A176-A223 HydrophobicContact CB-CB 4.36Å; A176-A223 WeakPolarHBondContact O-CB 3.47Å; E180-A223 CarbonylContact C-O 3.24Å; E180-A223 VanDerWaalsContact C-O 3.24Å; E181-A223 WeakPolarHBondContact CA-O 2.99Å; E181-A223 PolarHBondContact N-O 3.26Å; F183-A223 HydrophobicContact CB-CB 4.4Å; H219-A223 WeakPolarHBondContact O-CB 3.49Å; H219-A223 PolarHBondContact O-N 2.77Å; I220-A223 PolarHBondContact O-N 3.29Å
224	V	95.9	Very high	94.6	Very high	16 Å²	16	71.9 Å²	71.9	10%	0.097	38%	0.375	C	S	.	.	H	α-helix	trans	-86.4	-17.1	-177.2	-55.6	0	0	0	0	113.9	F183 V184 Y187 I220 K228	F183-V224 HydrophobicContact CB-CG1 4.38Å; F183-V224 HydrophobicContact CD1-CG1 4.19Å; V184-V224 HydrophobicContact CG2-CB 3.83Å; V184-V224 HydrophobicContact CG2-CG1 4.02Å; Y187-V224 HydrophobicContact CD2-CB 4.35Å; Y187-V224 HydrophobicContact CD2-CG1 3.97Å; Y187-V224 HydrophobicContact CD2-CG2 3.69Å; Y187-V224 HydrophobicContact CE2-CG2 3.86Å; I220-V224 HydrophobicContact CG2-CG1 4.41Å; I220-V224 WeakPolarHBondContact O-CG1 3.26Å; I220-V224 WeakPolarHBondContact O-CG2 3.41Å; I220-V224 PolarHBondContact O-N 3.33Å; V224-K228 HydrophobicContact CB-CB 4.16Å; V224-K228 HydrophobicContact CG2-CB 3.63Å
225	G	93.5	Very high	94.3	Very high	31 Å²	31	71.3 Å²	71.3	32%	0.32	37%	0.373	S	S	.	.			trans	76.1	175.8	-179.1	0	0	0	0	0	114.3	G221 E227 K228	G221-G225 PolarHBondContact O-N 3.01Å; G221-G225 VanDerWaalsContact O-N 3.16Å; G225-E227 PolarHBondContact O-N 3.01Å; G225-E227 VanDerWaalsContact O-N 3.13Å; G225-K228 PolarHBondContact O-N 3.08Å
226	K	88.9	Confident	94	Very high	208 Å²	208	69.1 Å²	69.1	90%	0.904	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-20.5	-170.4	-174	-179.4	175.1	-171.6	0	114.8	K228	K226-K228 PolarHBondContact O-N 3.22Å
227	E	83.7	Confident	93.6	Very high	202 Å²	202	74.8 Å²	74.8	94%	0.944	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.8	-0.9	-174.2	-57.1	-138.3	148.3	0	0	113.7	G225	G225-E227 PolarHBondContact O-N 3.01Å; G225-E227 VanDerWaalsContact O-N 3.13Å
228	K	80.8	Confident	93.1	Very high	107 Å²	107	77.8 Å²	77.8	47%	0.465	41%	0.412	S	S	.	.			trans	-119.5	0	176.4	-103.2	-60.6	-167.5	178.8	0	113	Y187 D188 V224 G225 K226	Y187-K228 HydrophobicContact CD1-CD 3.81Å; Y187-K228 HydrophobicContact CD1-CG 4.48Å; Y187-K228 HydrophobicContact CE1-CD 4.1Å; Y187-K228 HydrophobicContact CE2-CB 4.47Å; Y187-K228 HydrophobicContact CG-CD 4.25Å; Y187-K228 HydrophobicContact CG-CG 4.47Å; Y187-K228 PolarHBondContact OH-O 3.5Å; D188-K228 IonicContact OD1-NZ 2.68Å; D188-K228 PolarHBondContact OD1-NZ 3.34Å; D188-K228 IonicContact OD2-NZ 3.97Å; D188-K228 PolarHBondContact OD2-NZ 3.25Å; V224-K228 HydrophobicContact CB-CB 4.16Å; V224-K228 HydrophobicContact CG2-CB 3.63Å; G225-K228 PolarHBondContact O-N 3.08Å; K226-K228 PolarHBondContact O-N 3.22Å

Retrieved 228 of 228 residues in 136.9 ms (Link to these results)

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