A0A060X2C8_ONCMY Loading...

HEAT repeat-containing protein 4

AlphaFold DB , UniProt , Accession A0A060X2C8, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene n/a, Length 654 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	35.9	Very low	38.9	Very low	238 Å²	238	146.4 Å²	146.4	100%	1.172	83%	0.826	S	S	*	*				0	125.9	0	-80	179.4	172.7	0	0	107.8
2	N	31.1	Very low	39	Very low	160 Å²	160	148.1 Å²	148.1	86%	0.856	82%	0.822	S	S	*	*			trans	-106.8	130.7	170.9	-82.7	-20.9	0	0	0	108.3	T4	N2-T4 PolarHBondContact O-N 3.17Å
3	Q	42.2	Very low	38.8	Very low	183 Å²	183	148.7 Å²	148.7	86%	0.855	82%	0.82	S	S	*	*	S	Bend	trans	-89.7	13.5	-163.5	-76.3	179.9	-15.1	0	0	115.9
4	T	43.7	Very low	39	Very low	131 Å²	131	149.8 Å²	149.8	80%	0.804	82%	0.816	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.2	4.2	-170.8	-14.9	0	0	0	0	115.3	N2	N2-T4 PolarHBondContact O-N 3.17Å
5	A	39.6	Very low	39.2	Very low	79 Å²	79	148.5 Å²	148.5	65%	0.653	82%	0.815	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.5	-3.9	-175.9	0	0	0	0	0	115.2	T7	A5-T7 PolarHBondContact O-N 2.85Å
6	N	42.3	Very low	40	Very low	151 Å²	151	146.8 Å²	146.8	81%	0.807	81%	0.813	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.4	7.6	-167.5	-74.4	-1.4	0	0	0	115.7
7	T	42.9	Very low	40.9	Very low	133 Å²	133	148.3 Å²	148.3	82%	0.816	81%	0.813	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124.7	22.3	-174.1	39.2	0	0	0	0	115.4	A5	A5-T7 PolarHBondContact O-N 2.85Å
8	V	37.2	Very low	41.7	Very low	120 Å²	120	141.9 Å²	141.9	73%	0.727	78%	0.78	S	S	*	*			trans	-99.9	101.5	169.7	-175.6	0	0	0	0	109.8	V10	V8-V10 HydrophobicContact CG1-CG2 4.27Å; V8-V10 PolarHBondContact O-N 3.4Å
9	A	35.8	Very low	42.7	Very low	96 Å²	96	137.9 Å²	137.9	79%	0.793	76%	0.761	S	S	*	*			trans	-80.2	101.7	171.2	0	0	0	0	0	109.9	K11	A9-K11 PolarHBondContact O-N 3.48Å
10	V	40.8	Very low	43.9	Very low	125 Å²	125	139 Å²	139	76%	0.758	75%	0.753	S	S	*	*			trans	-78.7	109.9	171.2	-178.4	0	0	0	0	108.2	V8 H12	V8-V10 HydrophobicContact CG1-CG2 4.27Å; V8-V10 PolarHBondContact O-N 3.4Å; V10-H12 PolarHBondContact O-N 2.93Å
11	K	36.1	Very low	44.8	Very low	194 Å²	194	132.9 Å²	132.9	84%	0.843	72%	0.72	S	S	*	*			trans	-73.5	113.6	169.7	-75.4	-176.4	177	-179.6	0	108.7	A9 I13	A9-K11 PolarHBondContact O-N 3.48Å; K11-I13 PolarHBondContact O-N 2.56Å
12	H	40.3	Very low	46.2	Very low	167 Å²	167	126.6 Å²	126.6	77%	0.773	69%	0.688	S	S	*	*			trans	-71.4	117.8	174	-143.3	-78.5	0	0	0	108.8	V10	V10-H12 PolarHBondContact O-N 2.93Å
13	I	36.7	Very low	47.9	Very low	156 Å²	156	124.5 Å²	124.5	80%	0.8	68%	0.676	S	S	*	*			trans	-89.4	101.5	168.3	-62	172.1	0	0	0	105.6	K11	K11-I13 PolarHBondContact O-N 2.56Å
14	E	41.1	Very low	48.8	Very low	164 Å²	164	118.8 Å²	118.8	77%	0.766	66%	0.657	S	S	*	*	P	Polyproline II helix	trans	-71.8	131.9	165.9	-73	-178.7	170.6	0	0	108.6
15	T	42.9	Very low	49.7	Very low	130 Å²	130	116.6 Å²	116.6	80%	0.798	64%	0.64	S	S	*	*	P	Polyproline II helix	trans	-62.1	126.6	171.9	23	0	0	0	0	108.9	Q17	T15-Q17 PolarHBondContact O-N 3.38Å
16	P	51.2	Low	51	Low	121 Å²	121	117.8 Å²	117.8	79%	0.786	64%	0.635	S	S	*	*	P	Polyproline II helix	trans	-60.5	135.8	-178.7	22.2	-30.5	0	0	0	110.3
17	Q	54.9	Low	52.1	Low	173 Å²	173	116.5 Å²	116.5	81%	0.808	64%	0.635	S	S	*	*	P	Polyproline II helix	trans	-59.9	142.8	175.3	-70.5	-165.6	-17.7	0	0	110.3	T15	T15-Q17 PolarHBondContact O-N 3.38Å
18	P	56.8	Low	53.1	Low	34 Å²	34	121.5 Å²	121.5	22%	0.221	64%	0.639	C	S	.	*	P	Polyproline II helix	trans	-59.5	141.5	177.6	23.5	-31.3	0	0	0	110.4	E43	P18-E43 HydrophobicContact CB-CG 4.49Å
19	P	60.7	Low	54.4	Low	65 Å²	65	117.5 Å²	117.5	42%	0.422	62%	0.618	S	S	.	*	P	Polyproline II helix	trans	-64	148.6	178.9	26.5	-33	0	0	0	110.6	D23 I48	P19-D23 HydrophobicContact CB-CB 4.36Å; P19-I48 HydrophobicContact CG-CD1 3.52Å
20	R	64.9	Low	55.9	Low	159 Å²	159	115.2 Å²	115.2	60%	0.6	61%	0.605	S	S	*	*	P	Polyproline II helix	trans	-73.1	154.9	-176.3	-65.2	179.9	176.9	-171.8	-2.3	109.6	Q22 D23	R20-Q22 PolarHBondContact O-N 3.43Å; R20-D23 PolarHBondContact N-OD2 3.49Å; R20-D23 WeakPolarHBondContact O-CB 3.4Å; R20-D23 PolarHBondContact O-N 3.38Å
21	L	63.7	Low	57.1	Low	11 Å²	11	114.6 Å²	114.6	6%	0.058	61%	0.606	C	S	.	*	H	α-helix	trans	-54.7	-27.6	175.7	-73.9	161.9	0	0	0	113.3	D23 S24 L25 T36 F45	L21-D23 VanDerWaalsContact C-N 3.27Å; L21-D23 PolarHBondContact O-N 3.33Å; L21-S24 PolarHBondContact O-N 3.32Å; L21-S24 PolarHBondContact O-OG 3.14Å; L21-L25 HydrophobicContact CB-CD1 4.36Å; L21-L25 WeakPolarHBondContact O-CB 3.49Å; L21-L25 WeakPolarHBondContact O-CD1 3.44Å; L21-L25 VanDerWaalsContact O-CG 3.3Å; L21-L25 WeakPolarHBondContact O-CG 3.26Å; L21-L25 PolarHBondContact O-N 3.46Å; L21-T36 HydrophobicContact CD1-CG2 3.86Å; L21-F45 HydrophobicContact CD1-CB 4.02Å; L21-F45 HydrophobicContact CD1-CD2 4.37Å; L21-F45 HydrophobicContact CD2-CB 3.53Å; L21-F45 HydrophobicContact CG-CB 4.42Å
22	Q	65.6	Low	58.5	Low	106 Å²	106	113.4 Å²	113.4	50%	0.495	60%	0.603	S	S	.	*	H	α-helix	trans	-67.8	-27.1	176.7	-60.4	174.5	6.7	0	0	112.8	R20 S24 V33 H35	R20-Q22 PolarHBondContact O-N 3.43Å; Q22-S24 VanDerWaalsContact C-N 3.32Å; Q22-V33 HydrophobicContact CG-CG1 4.41Å; Q22-H35 PolarHBondContact NE2-CE1 3.01Å; Q22-H35 PolarHBondContact NE2-ND1 3.03Å
23	D	65.5	Low	59.9	Low	116 Å²	116	106.5 Å²	106.5	62%	0.62	57%	0.572	S	S	*	*	H	α-helix	trans	-80.8	-17.8	-177.8	-54.1	-36.6	0	0	0	111.9	P19 R20 L21	P19-D23 HydrophobicContact CB-CB 4.36Å; R20-D23 PolarHBondContact N-OD2 3.49Å; R20-D23 WeakPolarHBondContact O-CB 3.4Å; R20-D23 PolarHBondContact O-N 3.38Å; L21-D23 VanDerWaalsContact C-N 3.27Å; L21-D23 PolarHBondContact O-N 3.33Å
24	S	61.1	Low	61.4	Low	64 Å²	64	104.4 Å²	104.4	45%	0.448	56%	0.562	S	S	.	*	H	α-helix	trans	-111.1	-13.4	-174.7	38.1	0	0	0	0	114.1	L21 Q22	L21-S24 PolarHBondContact O-N 3.32Å; L21-S24 PolarHBondContact O-OG 3.14Å; Q22-S24 VanDerWaalsContact C-N 3.32Å
25	L	64.4	Low	62.8	Low	84 Å²	84	102.8 Å²	102.8	44%	0.44	55%	0.554	S	S	.	*	S	Bend	trans	-105.8	155.5	-178.2	-67	171.4	0	0	0	112.7	L21 V33	L21-L25 HydrophobicContact CB-CD1 4.36Å; L21-L25 WeakPolarHBondContact O-CB 3.49Å; L21-L25 WeakPolarHBondContact O-CD1 3.44Å; L21-L25 VanDerWaalsContact O-CG 3.3Å; L21-L25 WeakPolarHBondContact O-CG 3.26Å; L21-L25 PolarHBondContact O-N 3.46Å; L25-V33 HydrophobicContact CD1-CG1 4.04Å
26	N	66.4	Low	64.3	Low	105 Å²	105	97.7 Å²	97.7	56%	0.561	52%	0.523	S	S	*	.			trans	-61.8	126.3	-178.2	-174.6	-27.7	0	0	0	110.9	R28 A29	N26-R28 PolarHBondContact O-N 3.34Å; N26-R28 WeakPolarHBondContact OD1-CB 3.4Å; N26-R28 PolarHBondContact OD1-N 3.11Å; N26-A29 VanDerWaalsContact O-CB 3.27Å; N26-A29 WeakPolarHBondContact O-CB 3.4Å; N26-A29 PolarHBondContact O-N 3.18Å
27	P	64.9	Low	65.6	Low	124 Å²	124	101 Å²	101	81%	0.805	53%	0.528	S	S	*	.	G	3₁₀ helix	trans	-60.4	-16.4	-177.7	19.7	-30.9	0	0	0	114.4	A29	P27-A29 PolarHBondContact O-N 2.76Å
28	R	64.8	Low	66.8	Low	237 Å²	237	94.3 Å²	94.3	89%	0.894	50%	0.498	S	S	*	.	G	3₁₀ helix	trans	-69.2	-14.1	171.5	-71.7	-174.4	169.8	176.4	-2.3	114.4	N26 G30	N26-R28 PolarHBondContact O-N 3.34Å; N26-R28 WeakPolarHBondContact OD1-CB 3.4Å; N26-R28 PolarHBondContact OD1-N 3.11Å; R28-G30 VanDerWaalsContact C-N 3.26Å; R28-G30 PolarHBondContact O-N 3.39Å
29	A	64.3	Low	67.8	Low	36 Å²	36	95.7 Å²	95.7	30%	0.298	50%	0.503	S	S	.	.	G	3₁₀ helix	trans	-70.6	-21.2	179.1	0	0	0	0	0	113.1	N26 P27 S31 H32 V33	N26-A29 VanDerWaalsContact O-CB 3.27Å; N26-A29 WeakPolarHBondContact O-CB 3.4Å; N26-A29 PolarHBondContact O-N 3.18Å; P27-A29 PolarHBondContact O-N 2.76Å; A29-S31 PolarHBondContact O-N 3.02Å; A29-H32 WeakPolarHBondContact O-CB 3.5Å; A29-H32 PolarHBondContact O-N 3.48Å; A29-V33 HydrophobicContact CB-CG2 3.57Å
30	G	66.6	Low	68.8	Low	49 Å²	49	93.6 Å²	93.6	51%	0.505	49%	0.488	S	S	.	.	G	3₁₀ helix	trans	45.6	-122.2	169.6	0	0	0	0	0	114.1	R28 H32 V33	R28-G30 VanDerWaalsContact C-N 3.26Å; R28-G30 PolarHBondContact O-N 3.39Å; G30-H32 PolarHBondContact O-N 3.46Å; G30-V33 PolarHBondContact O-N 2.94Å
31	S	65.6	Low	69.5	Low	111 Å²	111	87.9 Å²	87.9	78%	0.776	47%	0.468	S	S	*	.	G	3₁₀ helix	trans	-70.4	-4.5	-177.9	55	0	0	0	0	115.5	A29	A29-S31 PolarHBondContact O-N 3.02Å
32	H	66.6	Low	70.2	Confident	170 Å²	170	88.4 Å²	88.4	79%	0.787	47%	0.47	S	S	*	.	G	3₁₀ helix	trans	-93.8	0.6	178.2	-58.8	-68.6	0	0	0	113.1	A29 G30	A29-H32 WeakPolarHBondContact O-CB 3.5Å; A29-H32 PolarHBondContact O-N 3.48Å; G30-H32 PolarHBondContact O-N 3.46Å
33	V	69.4	Low	70.7	Confident	21 Å²	21	83.9 Å²	83.9	13%	0.127	45%	0.449	C	S	.	.	S	Bend	trans	-78.6	126.1	175.2	-179.5	0	0	0	0	109.8	Q22 L25 A29 G30 H35	Q22-V33 HydrophobicContact CG-CG1 4.41Å; L25-V33 HydrophobicContact CD1-CG1 4.04Å; A29-V33 HydrophobicContact CB-CG2 3.57Å; G30-V33 PolarHBondContact O-N 2.94Å; V33-H35 PolarHBondContact O-N 2.97Å
34	L	68.5	Low	71.4	Confident	112 Å²	112	81.4 Å²	81.4	59%	0.586	44%	0.435	S	S	*	.	P	Polyproline II helix	trans	-71.1	125.7	178.3	-148.4	144.1	0	0	0	109.6	F45	L34-F45 HydrophobicContact CD2-CE2 4.45Å
35	H	70.8	Confident	72.1	Confident	130 Å²	130	83.4 Å²	83.4	60%	0.602	44%	0.436	S	S	*	.	P	Polyproline II helix	trans	-100.9	117.9	178.2	-65.3	-34.2	0	0	0	109.9	Q22 V33	Q22-H35 PolarHBondContact NE2-CE1 3.01Å; Q22-H35 PolarHBondContact NE2-ND1 3.03Å; V33-H35 PolarHBondContact O-N 2.97Å
36	T	74.3	Confident	72.4	Confident	23 Å²	23	80.6 Å²	80.6	14%	0.141	42%	0.423	C	S	.	.			trans	-132.8	137	174	-179.6	0	0	0	0	110.2	L21 N38 E41 Q42	L21-T36 HydrophobicContact CD1-CG2 3.86Å; T36-N38 PolarHBondContact OG1-N 3.44Å; T36-N38 VanDerWaalsContact OG1-N 3.1Å; T36-E41 WeakPolarHBondContact CB-OE2 3.36Å; T36-E41 HydrophobicContact CG2-CB 3.57Å; T36-E41 PolarHBondContact OG1-OE2 3.5Å; T36-Q42 HydrophobicContact CG2-CG 3.9Å; T36-Q42 PolarHBondContact O-NE2 3.27Å
37	E	77.3	Confident	72.5	Confident	190 Å²	190	78 Å²	78	89%	0.888	42%	0.42	S	S	*	.			trans	-92.5	-2.5	172.8	-61.4	-174.9	167.5	0	0	111.5
38	N	81.3	Confident	72.9	Confident	33 Å²	33	76 Å²	76	18%	0.176	40%	0.402	C	S	.	.			trans	-84	120.5	179.8	-170.2	-56.2	0	0	0	110.8	T36 F40 E41 Q42 L136 P137	T36-N38 PolarHBondContact OG1-N 3.44Å; T36-N38 VanDerWaalsContact OG1-N 3.1Å; N38-F40 PolarHBondContact O-N 2.97Å; N38-F40 VanDerWaalsContact OD1-CB 3.28Å; N38-F40 WeakPolarHBondContact OD1-CB 3.37Å; N38-F40 PolarHBondContact OD1-N 3.37Å; N38-E41 HydrophobicContact CB-CB 4.37Å; N38-E41 HydrophobicContact CB-CG 4.32Å; N38-E41 PolarHBondContact O-N 3.4Å; N38-E41 VanDerWaalsContact O-N 3.15Å; N38-Q42 WeakPolarHBondContact O-CG 3.27Å; N38-Q42 PolarHBondContact O-N 2.96Å; N38-L136 HydrophobicContact CB-CD1 4.13Å; N38-L136 WeakPolarHBondContact ND2-CB 3.4Å; N38-P137 PolarHBondContact ND2-O 2.84Å
39	N	76.9	Confident	73.4	Confident	64 Å²	64	64.9 Å²	64.9	34%	0.342	36%	0.361	S	S	.	.	H	α-helix	trans	-55.3	-36.1	-179.1	-66.3	-12.4	0	0	0	113.2	Q42 E43 Y71 T139	N39-Q42 PolarHBondContact O-N 3.2Å; N39-E43 WeakPolarHBondContact O-CG 3.27Å; N39-E43 PolarHBondContact O-N 2.93Å; N39-Y71 HydrophobicContact CB-CE1 4.12Å; N39-Y71 PolarHBondContact O-OH 2.93Å; N39-T139 HydrophobicContact CB-CG2 4.44Å
40	F	81.4	Confident	74	Confident	21 Å²	21	70.4 Å²	70.4	9%	0.092	38%	0.378	C	S	.	.	H	α-helix	trans	-66.8	-44.7	178.8	173.2	-104.6	0	0	0	112.2	N38 Q42 E43 I44 I63 M65 Y71 P137	N38-F40 PolarHBondContact O-N 2.97Å; N38-F40 VanDerWaalsContact OD1-CB 3.28Å; N38-F40 WeakPolarHBondContact OD1-CB 3.37Å; N38-F40 PolarHBondContact OD1-N 3.37Å; F40-Q42 VanDerWaalsContact C-N 3.33Å; F40-E43 PolarHBondContact O-N 3.23Å; F40-I44 HydrophobicContact CD1-CD1 4.48Å; F40-I44 HydrophobicContact CD2-CD1 4.46Å; F40-I44 HydrophobicContact CE1-CD1 3.63Å; F40-I44 HydrophobicContact CE1-CG1 4.45Å; F40-I44 HydrophobicContact CE2-CD1 3.57Å; F40-I44 HydrophobicContact CE2-CG1 4.04Å; F40-I44 HydrophobicContact CZ-CD1 3.11Å; F40-I44 HydrophobicContact CZ-CG1 4.02Å; F40-I44 PolarHBondContact O-N 3.04Å; F40-I63 HydrophobicContact CD2-CD1 4.48Å; F40-I63 HydrophobicContact CD2-CG2 4.48Å; F40-I63 HydrophobicContact CE1-CD1 4.25Å; F40-I63 HydrophobicContact CE2-CB 4.3Å; F40-I63 HydrophobicContact CE2-CD1 3.77Å; F40-I63 HydrophobicContact CE2-CG2 3.59Å; F40-I63 HydrophobicContact CZ-CD1 3.58Å; F40-I63 HydrophobicContact CZ-CG2 4.2Å; F40-M65 HydrophobicContact CD2-SD 4.32Å; F40-M65 HydrophobicContact CE2-SD 3.88Å; F40-Y71 HydrophobicContact CB-CD1 3.73Å; F40-Y71 HydrophobicContact CB-CD2 4.32Å; F40-Y71 HydrophobicContact CB-CE1 3.68Å; F40-Y71 HydrophobicContact CB-CE2 4.28Å; F40-Y71 HydrophobicContact CB-CG 4.04Å; F40-Y71 HydrophobicContact CD2-CD1 4.4Å; F40-Y71 AromaticContact CD2-CD2 3.56Å; F40-Y71 HydrophobicContact CD2-CD2 3.56Å; F40-Y71 AromaticContact CD2-CE2 3.84Å; F40-Y71 HydrophobicContact CD2-CE2 3.84Å; F40-Y71 AromaticContact CD2-CG 3.85Å; F40-Y71 HydrophobicContact CD2-CG 3.85Å; F40-Y71 HydrophobicContact CE2-CD2 4.37Å; F40-Y71 HydrophobicContact CG-CD1 4.47Å; F40-Y71 HydrophobicContact CG-CD2 4.38Å; F40-Y71 HydrophobicContact CG-CG 4.31Å; F40-P137 HydrophobicContact CB-CB 4.22Å; F40-P137 HydrophobicContact CB-CG 4.46Å; F40-P137 HydrophobicContact CD1-CB 4.11Å; F40-P137 HydrophobicContact CD1-CG 3.45Å; F40-P137 VanDerWaalsContact CD1-CG 3.45Å; F40-P137 HydrophobicContact CD2-CG 4.45Å; F40-P137 HydrophobicContact CE1-CG 3.63Å; F40-P137 HydrophobicContact CG-CB 4.02Å; F40-P137 HydrophobicContact CG-CG 3.86Å; F40-P137 HydrophobicContact CZ-CG 4.19Å
41	E	80.7	Confident	74.8	Confident	39 Å²	39	71.3 Å²	71.3	18%	0.182	37%	0.37	C	S	.	.	H	α-helix	trans	-67.8	-36.8	178.3	-70.2	-168.9	142.6	0	0	111.4	T36 N38 I44 F45 L136	T36-E41 WeakPolarHBondContact CB-OE2 3.36Å; T36-E41 HydrophobicContact CG2-CB 3.57Å; T36-E41 PolarHBondContact OG1-OE2 3.5Å; N38-E41 HydrophobicContact CB-CB 4.37Å; N38-E41 HydrophobicContact CB-CG 4.32Å; N38-E41 PolarHBondContact O-N 3.4Å; N38-E41 VanDerWaalsContact O-N 3.15Å; E41-I44 PolarHBondContact O-N 2.89Å; E41-F45 HydrophobicContact CB-CD2 3.86Å; E41-F45 HydrophobicContact CB-CE2 3.69Å; E41-F45 HydrophobicContact CG-CE2 3.98Å; E41-F45 VanDerWaalsContact O-CB 3.27Å; E41-F45 WeakPolarHBondContact O-CB 3.49Å; E41-F45 WeakPolarHBondContact O-CD2 3.23Å; E41-F45 VanDerWaalsContact O-CG 3.3Å; E41-F45 WeakPolarHBondContact O-CG 3.35Å; E41-F45 PolarHBondContact O-N 3.48Å; E41-L136 HydrophobicContact CG-CD1 4.4Å; E41-L136 HydrophobicContact CG-CD2 4.22Å; E41-L136 WeakPolarHBondContact OE1-CD2 3.26Å
42	Q	77.6	Confident	75.5	Confident	21 Å²	21	69 Å²	69	10%	0.098	35%	0.351	C	S	.	.	H	α-helix	trans	-60	-47.6	173	-69.7	-179	-0.2	0	0	111.2	T36 N38 N39 F40 S46	T36-Q42 HydrophobicContact CG2-CG 3.9Å; T36-Q42 PolarHBondContact O-NE2 3.27Å; N38-Q42 WeakPolarHBondContact O-CG 3.27Å; N38-Q42 PolarHBondContact O-N 2.96Å; N39-Q42 PolarHBondContact O-N 3.2Å; F40-Q42 VanDerWaalsContact C-N 3.33Å; Q42-S46 WeakPolarHBondContact O-CB 3.45Å; Q42-S46 PolarHBondContact O-N 3.26Å; Q42-S46 PolarHBondContact O-OG 2.98Å
43	E	77.1	Confident	76	Confident	12 Å²	12	68.1 Å²	68.1	6%	0.056	35%	0.347	C	S	.	.	H	α-helix	trans	-64.2	-41.3	178.8	-75.7	-169.1	-169.3	0	0	112.8	P18 N39 F40 S46 G47 I48 A49 M65 N67 S69 Y71	P18-E43 HydrophobicContact CB-CG 4.49Å; N39-E43 WeakPolarHBondContact O-CG 3.27Å; N39-E43 PolarHBondContact O-N 2.93Å; F40-E43 PolarHBondContact O-N 3.23Å; E43-S46 PolarHBondContact O-OG 3.47Å; E43-G47 PolarHBondContact O-N 3.37Å; E43-I48 PolarHBondContact O-N 3.29Å; E43-A49 HydrophobicContact CB-CB 4.38Å; E43-M65 HydrophobicContact CB-CE 4.26Å; E43-N67 VanDerWaalsContact CD-ND2 3.27Å; E43-N67 PolarHBondContact OE1-ND2 3.32Å; E43-N67 PolarHBondContact OE2-ND2 3.26Å; E43-S69 PolarHBondContact OE1-OG 3.46Å; E43-S69 WeakPolarHBondContact OE2-CB 3.47Å; E43-S69 PolarHBondContact OE2-OG 2.88Å; E43-Y71 PolarHBondContact OE1-OH 2.96Å; E43-Y71 PolarHBondContact OE2-OH 3.41Å
44	I	79.4	Confident	76.1	Confident	63 Å²	63	71 Å²	71	32%	0.323	36%	0.359	S	S	.	.	H	α-helix	trans	-69.7	-49.1	178.2	-83.1	-165.8	0	0	0	112.3	F40 E41 G47 M65	F40-I44 HydrophobicContact CD1-CD1 4.48Å; F40-I44 HydrophobicContact CD2-CD1 4.46Å; F40-I44 HydrophobicContact CE1-CD1 3.63Å; F40-I44 HydrophobicContact CE1-CG1 4.45Å; F40-I44 HydrophobicContact CE2-CD1 3.57Å; F40-I44 HydrophobicContact CE2-CG1 4.04Å; F40-I44 HydrophobicContact CZ-CD1 3.11Å; F40-I44 HydrophobicContact CZ-CG1 4.02Å; F40-I44 PolarHBondContact O-N 3.04Å; E41-I44 PolarHBondContact O-N 2.89Å; I44-G47 PolarHBondContact O-N 2.9Å; I44-M65 HydrophobicContact CG1-CE 3.81Å
45	F	76.5	Confident	75.7	Confident	107 Å²	107	77.3 Å²	77.3	47%	0.469	38%	0.375	S	S	.	.	H	α-helix	trans	-77	-24.8	-172.2	-64.2	-41.4	0	0	0	112.7	L21 L34 E41 G47	L21-F45 HydrophobicContact CD1-CB 4.02Å; L21-F45 HydrophobicContact CD1-CD2 4.37Å; L21-F45 HydrophobicContact CD2-CB 3.53Å; L21-F45 HydrophobicContact CG-CB 4.42Å; L34-F45 HydrophobicContact CD2-CE2 4.45Å; E41-F45 HydrophobicContact CB-CD2 3.86Å; E41-F45 HydrophobicContact CB-CE2 3.69Å; E41-F45 HydrophobicContact CG-CE2 3.98Å; E41-F45 VanDerWaalsContact O-CB 3.27Å; E41-F45 WeakPolarHBondContact O-CB 3.49Å; E41-F45 WeakPolarHBondContact O-CD2 3.23Å; E41-F45 VanDerWaalsContact O-CG 3.3Å; E41-F45 WeakPolarHBondContact O-CG 3.35Å; E41-F45 PolarHBondContact O-N 3.48Å; F45-G47 VanDerWaalsContact C-N 3.26Å
46	S	70.7	Confident	75.6	Confident	25 Å²	25	74.4 Å²	74.4	18%	0.175	36%	0.364	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-14.9	173.8	61.2	0	0	0	0	112.1	Q42 E43 I48	Q42-S46 WeakPolarHBondContact O-CB 3.45Å; Q42-S46 PolarHBondContact O-N 3.26Å; Q42-S46 PolarHBondContact O-OG 2.98Å; E43-S46 PolarHBondContact O-OG 3.47Å; S46-I48 PolarHBondContact O-N 2.89Å; S46-I48 WeakPolarHBondContact OG-CB 3.48Å; S46-I48 WeakPolarHBondContact OG-CD1 3.33Å; S46-I48 WeakPolarHBondContact OG-CG1 3.25Å; S46-I48 PolarHBondContact OG-N 3.28Å
47	G	68.9	Low	74.9	Confident	49 Å²	49	77.8 Å²	77.8	51%	0.505	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.2	12	-175.2	0	0	0	0	0	114	E43 I44 F45 A49	E43-G47 PolarHBondContact O-N 3.37Å; I44-G47 PolarHBondContact O-N 2.9Å; F45-G47 VanDerWaalsContact C-N 3.26Å; G47-A49 VanDerWaalsContact C-N 3.27Å; G47-A49 PolarHBondContact O-N 2.92Å
48	I	73.1	Confident	74.2	Confident	83 Å²	83	79.3 Å²	79.3	43%	0.426	38%	0.384	S	S	.	.	S	Bend	trans	-65.4	-34.4	180	-68.6	168.8	0	0	0	111	P19 E43 S46	P19-I48 HydrophobicContact CG-CD1 3.52Å; E43-I48 PolarHBondContact O-N 3.29Å; S46-I48 PolarHBondContact O-N 2.89Å; S46-I48 WeakPolarHBondContact OG-CB 3.48Å; S46-I48 WeakPolarHBondContact OG-CD1 3.33Å; S46-I48 WeakPolarHBondContact OG-CG1 3.25Å; S46-I48 PolarHBondContact OG-N 3.28Å
49	A	75.1	Confident	73.3	Confident	4 Å²	4	80.2 Å²	80.2	3%	0.033	39%	0.389	C	S	.	.	S	Bend	trans	-137.9	145.5	178.5	0	0	0	0	0	110.9	E43 G47 M65 D66 N67	E43-A49 HydrophobicContact CB-CB 4.38Å; G47-A49 VanDerWaalsContact C-N 3.27Å; G47-A49 PolarHBondContact O-N 2.92Å; A49-M65 HydrophobicContact CB-CB 4.15Å; A49-M65 HydrophobicContact CB-CE 3.73Å; A49-M65 WeakPolarHBondContact O-CE 3.38Å; A49-D66 WeakPolarHBondContact CA-OD1 3.39Å; A49-D66 VanDerWaalsContact CB-OD1 3.3Å; A49-D66 WeakPolarHBondContact CB-OD1 3.07Å; A49-N67 HydrophobicContact CB-CB 4.16Å; A49-N67 WeakPolarHBondContact CB-ND2 3.41Å
50	K	77.1	Confident	72.9	Confident	151 Å²	151	81.3 Å²	81.3	66%	0.657	39%	0.391	S	S	*	.			trans	-111.2	141.3	177.2	-66.8	-179.5	-176.7	174.4	0	110.4	V52 D66	K50-V52 PolarHBondContact O-N 3.17Å; K50-D66 VanDerWaalsContact N-CG 3.31Å; K50-D66 PolarHBondContact N-OD1 3.38Å; K50-D66 PolarHBondContact N-OD2 2.87Å; K50-D66 PolarHBondContact O-N 3.31Å
51	Q	82.1	Confident	72.5	Confident	69 Å²	69	83.2 Å²	83.2	32%	0.322	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64	125.4	175.4	177.3	172.4	14.1	0	0	110.7	I63 M65	Q51-I63 HydrophobicContact CG-CG2 3.88Å; Q51-M65 HydrophobicContact CB-SD 4.2Å
52	V	80.7	Confident	72.5	Confident	62 Å²	62	83.2 Å²	83.2	38%	0.376	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	112.4	171.4	-177.9	0	0	0	0	108.6	K50 Q54 I64 D66	K50-V52 PolarHBondContact O-N 3.17Å; V52-Q54 PolarHBondContact O-N 3.1Å; V52-I64 PolarHBondContact N-O 3.22Å; V52-D66 HydrophobicContact CG2-CB 3.81Å
53	H	77.1	Confident	72.7	Confident	151 Å²	151	82.4 Å²	82.4	70%	0.699	40%	0.397	S	S	*	.			trans	-74.8	109.7	179.7	-68.8	-66.4	0	0	0	111.6
54	Q	72.6	Confident	72.9	Confident	83 Å²	83	83.1 Å²	83.1	39%	0.388	40%	0.401	S	S	.	.			trans	-77.6	138.6	177	-65.6	-71.2	-17.1	0	0	111.7	V52 N59 I64	V52-Q54 PolarHBondContact O-N 3.1Å; Q54-N59 HydrophobicContact CB-CB 4.34Å; Q54-I64 HydrophobicContact CG-CD1 3.89Å; Q54-I64 HydrophobicContact CG-CG1 4.38Å
55	R	59.3	Low	72.9	Confident	243 Å²	243	80.2 Å²	80.2	92%	0.917	39%	0.386	S	S	*	.			trans	-91.2	-13.5	175.2	-66.9	-175.5	-178.2	179.5	1.3	113.7
56	D	68.4	Low	72.9	Confident	69 Å²	69	79.1 Å²	79.1	37%	0.369	39%	0.385	S	S	.	.			trans	-76.9	125.5	-178.4	-169.6	-26.7	0	0	0	111.5	R58 N59	D56-R58 PolarHBondContact O-N 3.38Å; D56-R58 VanDerWaalsContact O-N 3.13Å; D56-R58 WeakPolarHBondContact OD1-CG 3.46Å; D56-R58 PolarHBondContact OD1-N 2.91Å; D56-N59 PolarHBondContact O-N 3.44Å
57	P	60.4	Low	73	Confident	95 Å²	95	81 Å²	81	62%	0.617	39%	0.393	S	S	*	.	G	3₁₀ helix	trans	-54.9	-28	177.1	-25.9	33.3	0	0	0	115.7	N59 H60	P57-N59 VanDerWaalsContact C-N 3.25Å; P57-N59 PolarHBondContact O-N 3.34Å; P57-H60 WeakPolarHBondContact CA-CD2 3.42Å; P57-H60 PolarHBondContact O-CD2 3.05Å; P57-H60 VanDerWaalsContact O-CD2 3.3Å; P57-H60 PolarHBondContact O-N 3.21Å
58	R	61.4	Low	73.3	Confident	221 Å²	221	85.2 Å²	85.2	83%	0.834	41%	0.405	S	S	*	.	G	3₁₀ helix	trans	-70.7	-22.3	-177	-61.3	-179.6	-154.1	-169.5	6.6	113.2	D56	D56-R58 PolarHBondContact O-N 3.38Å; D56-R58 VanDerWaalsContact O-N 3.13Å; D56-R58 WeakPolarHBondContact OD1-CG 3.46Å; D56-R58 PolarHBondContact OD1-N 2.91Å
59	N	62.9	Low	73.4	Confident	53 Å²	53	82.9 Å²	82.9	28%	0.283	40%	0.395	S	S	.	.	G	3₁₀ helix	trans	-102.6	11.8	-176.7	-65.5	-21.2	0	0	0	112.5	Q54 D56 P57 D61 R62	Q54-N59 HydrophobicContact CB-CB 4.34Å; D56-N59 PolarHBondContact O-N 3.44Å; P57-N59 VanDerWaalsContact C-N 3.25Å; P57-N59 PolarHBondContact O-N 3.34Å; N59-D61 PolarHBondContact O-N 3Å; N59-R62 PolarHBondContact O-N 3.15Å
60	H	69.4	Low	73.7	Confident	86 Å²	86	85.4 Å²	85.4	40%	0.398	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-26.7	-179.5	-83.5	-46	0	0	0	114	P57 R62 K73	P57-H60 WeakPolarHBondContact CA-CD2 3.42Å; P57-H60 PolarHBondContact O-CD2 3.05Å; P57-H60 VanDerWaalsContact O-CD2 3.3Å; P57-H60 PolarHBondContact O-N 3.21Å; H60-R62 VanDerWaalsContact C-N 3.26Å; H60-K73 WeakPolarHBondContact O-CD 3.5Å; H60-K73 WeakPolarHBondContact O-CE 3.44Å; H60-K73 PolarHBondContact O-NZ 2.87Å
61	D	72.8	Confident	74	Confident	61 Å²	61	78.4 Å²	78.4	33%	0.326	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	3	177.4	-63.3	-20.7	0	0	0	112.3	N59 Q72 K73 L75 R131	N59-D61 PolarHBondContact O-N 3Å; D61-Q72 PolarHBondContact O-NE2 3.3Å; D61-Q72 VanDerWaalsContact O-NE2 3.13Å; D61-K73 VanDerWaalsContact O-CB 3.32Å; D61-K73 WeakPolarHBondContact O-CB 3.38Å; D61-K73 WeakPolarHBondContact O-CG 3.34Å; D61-K73 PolarHBondContact O-N 2.89Å; D61-L75 WeakPolarHBondContact OD1-CD1 3.25Å; D61-R131 IonicContact OD1-NH1 3.69Å
62	R	79.6	Confident	74	Confident	40 Å²	40	77.1 Å²	77.1	15%	0.151	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	155.1	178.3	-67.8	-171.6	175.1	-145.9	-1.1	112.4	N59 H60 E70 Y71 K73 Y142 E145	N59-R62 PolarHBondContact O-N 3.15Å; H60-R62 VanDerWaalsContact C-N 3.26Å; R62-E70 IonicContact NH1-OE2 2.86Å; R62-E70 PolarHBondContact NH1-OE2 3.5Å; R62-Y71 CarbonylContact C-O 3.43Å; R62-Y71 WeakPolarHBondContact CA-O 3.28Å; R62-K73 VanDerWaalsContact O-CE 3.29Å; R62-K73 WeakPolarHBondContact O-CE 3.34Å; R62-Y142 PolarHBondContact NH1-OH 2.82Å; R62-E145 IonicContact NH2-OE1 3.69Å; R62-E145 PolarHBondContact NH2-OE1 2.92Å; R62-E145 IonicContact NH2-OE2 3.35Å; R62-E145 PolarHBondContact NH2-OE2 2.87Å
63	I	81.3	Confident	74.1	Confident	4 Å²	4	76.2 Å²	76.2	2%	0.021	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	124.2	169.3	-59	164.9	0	0	0	107.1	F40 Q51 M65 E70 Y71 K73 W133 P137	F40-I63 HydrophobicContact CD2-CD1 4.48Å; F40-I63 HydrophobicContact CD2-CG2 4.48Å; F40-I63 HydrophobicContact CE1-CD1 4.25Å; F40-I63 HydrophobicContact CE2-CB 4.3Å; F40-I63 HydrophobicContact CE2-CD1 3.77Å; F40-I63 HydrophobicContact CE2-CG2 3.59Å; F40-I63 HydrophobicContact CZ-CD1 3.58Å; F40-I63 HydrophobicContact CZ-CG2 4.2Å; Q51-I63 HydrophobicContact CG-CG2 3.88Å; I63-M65 HydrophobicContact CG2-SD 4Å; I63-E70 WeakPolarHBondContact O-CA 3.34Å; I63-Y71 PolarHBondContact N-O 2.88Å; I63-Y71 PolarHBondContact O-N 3.24Å; I63-K73 HydrophobicContact CD1-CG 4.04Å; I63-K73 HydrophobicContact CG1-CD 4.22Å; I63-K73 HydrophobicContact CG1-CG 3.81Å; I63-W133 HydrophobicContact CD1-CH2 3.59Å; I63-W133 HydrophobicContact CD1-CZ2 4.32Å; I63-P137 HydrophobicContact CD1-CB 4.08Å; I63-P137 HydrophobicContact CD1-CG 3.58Å
64	I	81.3	Confident	74.4	Confident	27 Å²	27	71.2 Å²	71.2	14%	0.138	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	127.2	178.6	-55.7	-175.5	0	0	0	106.8	V52 Q54 E70	V52-I64 PolarHBondContact N-O 3.22Å; Q54-I64 HydrophobicContact CG-CD1 3.89Å; Q54-I64 HydrophobicContact CG-CG1 4.38Å; I64-E70 HydrophobicContact CG1-CG 4.32Å
65	M	80.4	Confident	74.6	Confident	1 Å²	1	69.1 Å²	69.1	1%	0.005	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	157.9	176.8	-57.1	-58.7	-78.6	0	0	109.7	F40 E43 I44 A49 Q51 I63 N67 N68 S69 Y71	F40-M65 HydrophobicContact CD2-SD 4.32Å; F40-M65 HydrophobicContact CE2-SD 3.88Å; E43-M65 HydrophobicContact CB-CE 4.26Å; I44-M65 HydrophobicContact CG1-CE 3.81Å; A49-M65 HydrophobicContact CB-CB 4.15Å; A49-M65 HydrophobicContact CB-CE 3.73Å; A49-M65 WeakPolarHBondContact O-CE 3.38Å; Q51-M65 HydrophobicContact CB-SD 4.2Å; I63-M65 HydrophobicContact CG2-SD 4Å; M65-N67 WeakPolarHBondContact CB-OD1 3.5Å; M65-N67 PolarHBondContact O-N 3.41Å; M65-N68 PolarHBondContact O-N 3.48Å; M65-N68 VanDerWaalsContact O-N 3.11Å; M65-S69 WeakPolarHBondContact CB-O 3.38Å; M65-S69 PolarHBondContact N-O 2.95Å; M65-Y71 HydrophobicContact CG-CD2 3.98Å; M65-Y71 HydrophobicContact CG-CE2 3.71Å
66	D	76.6	Confident	75.2	Confident	85 Å²	85	61.9 Å²	61.9	46%	0.455	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-18.1	179.5	56.9	-3.6	0	0	0	114.2	A49 K50 V52 N68	A49-D66 WeakPolarHBondContact CA-OD1 3.39Å; A49-D66 VanDerWaalsContact CB-OD1 3.3Å; A49-D66 WeakPolarHBondContact CB-OD1 3.07Å; K50-D66 VanDerWaalsContact N-CG 3.31Å; K50-D66 PolarHBondContact N-OD1 3.38Å; K50-D66 PolarHBondContact N-OD2 2.87Å; K50-D66 PolarHBondContact O-N 3.31Å; V52-D66 HydrophobicContact CG2-CB 3.81Å; D66-N68 PolarHBondContact O-N 2.86Å
67	N	73.5	Confident	75.1	Confident	63 Å²	63	64.7 Å²	64.7	34%	0.337	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.1	9.4	169.4	66.7	-5.1	0	0	0	113.6	E43 A49 M65 S69	E43-N67 VanDerWaalsContact CD-ND2 3.27Å; E43-N67 PolarHBondContact OE1-ND2 3.32Å; E43-N67 PolarHBondContact OE2-ND2 3.26Å; A49-N67 HydrophobicContact CB-CB 4.16Å; A49-N67 WeakPolarHBondContact CB-ND2 3.41Å; M65-N67 WeakPolarHBondContact CB-OD1 3.5Å; M65-N67 PolarHBondContact O-N 3.41Å; N67-S69 PolarHBondContact ND2-OG 3.28Å; N67-S69 PolarHBondContact O-N 2.88Å; N67-S69 WeakPolarHBondContact OD1-CB 3.49Å; N67-S69 PolarHBondContact OD1-N 3.34Å; N67-S69 PolarHBondContact OD1-OG 2.8Å
68	N	73.3	Confident	75.1	Confident	139 Å²	139	64.8 Å²	64.8	74%	0.743	31%	0.313	S	S	*	.	S	Bend	trans	65.4	11.1	-173.3	-54.8	-36.1	0	0	0	115.4	M65 D66 E70	M65-N68 PolarHBondContact O-N 3.48Å; M65-N68 VanDerWaalsContact O-N 3.11Å; D66-N68 PolarHBondContact O-N 2.86Å; N68-E70 PolarHBondContact O-N 3.04Å
69	S	76.6	Confident	74.7	Confident	33 Å²	33	62.8 Å²	62.8	23%	0.231	31%	0.311	C	S	.	.			trans	-66.7	131.4	167.4	-68	0	0	0	0	109.6	E43 M65 N67	E43-S69 PolarHBondContact OE1-OG 3.46Å; E43-S69 WeakPolarHBondContact OE2-CB 3.47Å; E43-S69 PolarHBondContact OE2-OG 2.88Å; M65-S69 WeakPolarHBondContact CB-O 3.38Å; M65-S69 PolarHBondContact N-O 2.95Å; N67-S69 PolarHBondContact ND2-OG 3.28Å; N67-S69 PolarHBondContact O-N 2.88Å; N67-S69 WeakPolarHBondContact OD1-CB 3.49Å; N67-S69 PolarHBondContact OD1-N 3.34Å; N67-S69 PolarHBondContact OD1-OG 2.8Å
70	E	81	Confident	74.3	Confident	57 Å²	57	65 Å²	65	27%	0.266	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	132.4	178.8	-67.9	-169.5	-162.8	0	0	111.3	R62 I63 I64 N68 A140 Y142	R62-E70 IonicContact NH1-OE2 2.86Å; R62-E70 PolarHBondContact NH1-OE2 3.5Å; I63-E70 WeakPolarHBondContact O-CA 3.34Å; I64-E70 HydrophobicContact CG1-CG 4.32Å; N68-E70 PolarHBondContact O-N 3.04Å; E70-A140 HydrophobicContact CB-CB 3.88Å; E70-A140 WeakPolarHBondContact O-CB 3.34Å; E70-A140 PolarHBondContact O-N 3.33Å; E70-Y142 VanDerWaalsContact CD-OH 3.31Å; E70-Y142 PolarHBondContact OE1-OH 2.98Å; E70-Y142 WeakPolarHBondContact OE2-CE2 3.2Å; E70-Y142 VanDerWaalsContact OE2-CZ 3.3Å; E70-Y142 PolarHBondContact OE2-OH 3Å
71	Y	82.4	Confident	73.7	Confident	4 Å²	4	62.7 Å²	62.7	2%	0.016	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	136.6	179.4	-57.6	-88.7	0	0	0	111.5	N39 F40 E43 R62 I63 M65 P137 T138 T139	N39-Y71 HydrophobicContact CB-CE1 4.12Å; N39-Y71 PolarHBondContact O-OH 2.93Å; F40-Y71 HydrophobicContact CB-CD1 3.73Å; F40-Y71 HydrophobicContact CB-CD2 4.32Å; F40-Y71 HydrophobicContact CB-CE1 3.68Å; F40-Y71 HydrophobicContact CB-CE2 4.28Å; F40-Y71 HydrophobicContact CB-CG 4.04Å; F40-Y71 HydrophobicContact CD2-CD1 4.4Å; F40-Y71 AromaticContact CD2-CD2 3.56Å; F40-Y71 HydrophobicContact CD2-CD2 3.56Å; F40-Y71 AromaticContact CD2-CE2 3.84Å; F40-Y71 HydrophobicContact CD2-CE2 3.84Å; F40-Y71 AromaticContact CD2-CG 3.85Å; F40-Y71 HydrophobicContact CD2-CG 3.85Å; F40-Y71 HydrophobicContact CE2-CD2 4.37Å; F40-Y71 HydrophobicContact CG-CD1 4.47Å; F40-Y71 HydrophobicContact CG-CD2 4.38Å; F40-Y71 HydrophobicContact CG-CG 4.31Å; E43-Y71 PolarHBondContact OE1-OH 2.96Å; E43-Y71 PolarHBondContact OE2-OH 3.41Å; R62-Y71 CarbonylContact C-O 3.43Å; R62-Y71 WeakPolarHBondContact CA-O 3.28Å; I63-Y71 PolarHBondContact N-O 2.88Å; I63-Y71 PolarHBondContact O-N 3.24Å; M65-Y71 HydrophobicContact CG-CD2 3.98Å; M65-Y71 HydrophobicContact CG-CE2 3.71Å; Y71-P137 HydrophobicContact CG-CB 4.5Å; Y71-T138 CarbonylContact C-O 3.51Å; Y71-T138 WeakPolarHBondContact CA-O 3.32Å; Y71-T139 HydrophobicContact CD1-CG2 4.02Å; Y71-T139 HydrophobicContact CE1-CG2 3.63Å
72	Q	82.9	Confident	72.8	Confident	43 Å²	43	61.7 Å²	61.7	20%	0.201	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	129.7	175.1	-175.4	60.4	37.1	0	0	110	D61 P137 T138	D61-Q72 PolarHBondContact O-NE2 3.3Å; D61-Q72 VanDerWaalsContact O-NE2 3.13Å; Q72-P137 VanDerWaalsContact O-CA 3.31Å; Q72-P137 WeakPolarHBondContact O-CA 3.23Å; Q72-T138 PolarHBondContact N-O 3.36Å; Q72-T138 PolarHBondContact O-N 3.24Å; Q72-T138 VanDerWaalsContact O-N 3.11Å
73	K	83.8	Confident	71.4	Confident	43 Å²	43	64.2 Å²	64.2	19%	0.187	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	134.1	176	-57.5	-176.3	-176.8	161.2	0	110.5	H60 D61 R62 I63 L75 W133	H60-K73 WeakPolarHBondContact O-CD 3.5Å; H60-K73 WeakPolarHBondContact O-CE 3.44Å; H60-K73 PolarHBondContact O-NZ 2.87Å; D61-K73 VanDerWaalsContact O-CB 3.32Å; D61-K73 WeakPolarHBondContact O-CB 3.38Å; D61-K73 WeakPolarHBondContact O-CG 3.34Å; D61-K73 PolarHBondContact O-N 2.89Å; R62-K73 VanDerWaalsContact O-CE 3.29Å; R62-K73 WeakPolarHBondContact O-CE 3.34Å; I63-K73 HydrophobicContact CD1-CG 4.04Å; I63-K73 HydrophobicContact CG1-CD 4.22Å; I63-K73 HydrophobicContact CG1-CG 3.81Å; K73-L75 HydrophobicContact CB-CD1 4.22Å; K73-L75 HydrophobicContact CB-CD2 4.21Å; K73-L75 HydrophobicContact CB-CG 3.85Å; K73-L75 HydrophobicContact CD-CD1 4.37Å; K73-L75 PolarHBondContact O-N 3.3Å; K73-W133 HydrophobicContact CB-CH2 3.87Å; K73-W133 HydrophobicContact CB-CZ3 3.94Å; K73-W133 HydrophobicContact CD-CH2 3.91Å; K73-W133 HydrophobicContact CD-CZ2 3.93Å; K73-W133 HydrophobicContact CG-CH2 3.54Å; K73-W133 HydrophobicContact CG-CZ2 4.1Å; K73-W133 HydrophobicContact CG-CZ3 4.11Å
74	N	81.5	Confident	70.1	Confident	45 Å²	45	70 Å²	70	24%	0.241	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	91.5	171.9	-70.4	-31.6	0	0	0	109.2	V134 D135 L136	N74-V134 HydrophobicContact CB-CG2 4.31Å; N74-V134 WeakPolarHBondContact O-CG2 3.32Å; N74-V134 PolarHBondContact O-N 3.32Å; N74-D135 HydrophobicContact CB-CB 3.86Å; N74-L136 PolarHBondContact ND2-O 3.24Å
75	L	76.9	Confident	68.8	Low	39 Å²	39	74.9 Å²	74.9	20%	0.204	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	145	-176	-60.6	177	0	0	0	111.5	D61 K73 R131 W133	D61-L75 WeakPolarHBondContact OD1-CD1 3.25Å; K73-L75 HydrophobicContact CB-CD1 4.22Å; K73-L75 HydrophobicContact CB-CD2 4.21Å; K73-L75 HydrophobicContact CB-CG 3.85Å; K73-L75 HydrophobicContact CD-CD1 4.37Å; K73-L75 PolarHBondContact O-N 3.3Å; L75-R131 HydrophobicContact CB-CB 4.46Å; L75-W133 HydrophobicContact CD2-CD2 4.23Å; L75-W133 HydrophobicContact CD2-CG 4.39Å
76	Q	73	Confident	67.2	Low	92 Å²	92	83 Å²	83	43%	0.43	43%	0.429	S	S	.	.	P	Polyproline II helix	trans	-56.2	139.9	174.3	-171.9	-178.7	16	0	0	111	R131 R132 V134	Q76-R131 WeakPolarHBondContact O-CD 3.33Å; Q76-R132 PolarHBondContact N-O 3.08Å; Q76-V134 HydrophobicContact CB-CG1 4.15Å
77	D	65.3	Low	65.6	Low	127 Å²	127	84.4 Å²	84.4	68%	0.679	44%	0.44	S	S	*	.	P	Polyproline II helix	trans	-56.6	141.8	172.1	-79.4	-24.1	0	0	0	111.7	F79	D77-F79 PolarHBondContact O-N 2.84Å
78	F	62.2	Low	64.3	Low	97 Å²	97	90 Å²	90	43%	0.425	46%	0.462	S	S	.	.	P	Polyproline II helix	trans	-61.4	123.5	175.6	-80	-68.5	0	0	0	111.6	R131	F78-R131 HydrophobicContact CD1-CG 4.28Å; F78-R131 HydrophobicContact CE1-CG 4.17Å; F78-R131 VanDerWaalsContact CE2-NE 3.31Å
79	F	51.6	Low	62.5	Low	180 Å²	180	87 Å²	87	79%	0.789	46%	0.456	S	S	*	.	S	Bend	trans	-119.8	135.9	172.3	-151.2	-91.9	0	0	0	110.5	D77	D77-F79 PolarHBondContact O-N 2.84Å
80	P	55.3	Low	60.5	Low	98 Å²	98	93.8 Å²	93.8	64%	0.636	48%	0.484	S	S	*	.	S	Bend	cis	-68.5	146.7	-3.7	28.9	-33.9	0	0	0	112.2
81	C	56.5	Low	58.3	Low	38 Å²	38	97.4 Å²	97.4	26%	0.257	51%	0.51	S	S	.	.	P	Polyproline II helix	trans	-55.9	140	174.3	-73.7	0	0	0	0	110.3	K85 W86	C81-K85 HydrophobicContact CB-CB 4.22Å; C81-K85 HydrophobicContact CB-CD 3.88Å; C81-W86 PolarHBondContact O-NE1 2.91Å
82	G	54.4	Low	55.9	Low	41 Å²	41	105.8 Å²	105.8	42%	0.423	55%	0.552	S	S	.	*	P	Polyproline II helix	trans	-58.9	157	176.2	0	0	0	0	0	113.1	D84 K85	G82-D84 PolarHBondContact O-N 3.49Å; G82-K85 PolarHBondContact O-N 3.16Å; G82-K85 VanDerWaalsContact O-N 3.09Å
83	P	48.7	Very low	53.3	Low	93 Å²	93	112.7 Å²	112.7	60%	0.604	58%	0.584	S	S	*	*	G	3₁₀ helix	trans	-57.6	-21.2	-171.8	20.1	-30.7	0	0	0	114.4	K85 W86 T87	P83-K85 PolarHBondContact O-N 3.45Å; P83-W86 WeakPolarHBondContact O-CB 3.44Å; P83-W86 PolarHBondContact O-N 3.45Å; P83-T87 PolarHBondContact O-N 2.75Å; P83-T87 VanDerWaalsContact O-N 3.11Å; P83-T87 PolarHBondContact O-OG1 2.85Å
84	D	55.8	Low	50.7	Low	126 Å²	126	118 Å²	118	67%	0.674	61%	0.614	S	S	*	*	G	3₁₀ helix	trans	-64.1	-23.2	177.6	-44.5	-46.1	0	0	0	114.1	G82 T87	G82-D84 PolarHBondContact O-N 3.49Å; D84-T87 PolarHBondContact O-OG1 3.05Å
85	K	53.8	Low	48.1	Very low	128 Å²	128	125.3 Å²	125.3	56%	0.557	65%	0.647	S	S	*	*	G	3₁₀ helix	trans	-85.1	-21	172.5	-75.7	-175.1	177.3	-179.8	0	112.2	C81 G82 P83	C81-K85 HydrophobicContact CB-CB 4.22Å; C81-K85 HydrophobicContact CB-CD 3.88Å; G82-K85 PolarHBondContact O-N 3.16Å; G82-K85 VanDerWaalsContact O-N 3.09Å; P83-K85 PolarHBondContact O-N 3.45Å
86	W	45.8	Very low	45.8	Very low	173 Å²	173	130 Å²	130	66%	0.655	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.7	-36.4	179.9	-62.9	54.1	0	0	0	110.8	C81 P83 K88 A89	C81-W86 PolarHBondContact O-NE1 2.91Å; P83-W86 WeakPolarHBondContact O-CB 3.44Å; P83-W86 PolarHBondContact O-N 3.45Å; W86-K88 PolarHBondContact O-N 3.41Å; W86-A89 WeakPolarHBondContact O-CB 3.45Å; W86-A89 PolarHBondContact O-N 2.93Å
87	T	43.3	Very low	43.8	Very low	113 Å²	113	135 Å²	135	69%	0.693	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71	-12.5	177.8	49.2	0	0	0	0	114.2	P83 D84	P83-T87 PolarHBondContact O-N 2.75Å; P83-T87 VanDerWaalsContact O-N 3.11Å; P83-T87 PolarHBondContact O-OG1 2.85Å; D84-T87 PolarHBondContact O-OG1 3.05Å
88	K	45.5	Very low	41.9	Very low	182 Å²	182	132.6 Å²	132.6	79%	0.791	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.9	-2.4	170.3	-70.1	-176.2	178.7	178.7	0	113.7	W86	W86-K88 PolarHBondContact O-N 3.41Å
89	A	35.4	Very low	40	Very low	74 Å²	74	139.9 Å²	139.9	61%	0.612	73%	0.731	S	S	*	*			trans	-101.7	11.3	-174.7	0	0	0	0	0	114.4	W86	W86-A89 WeakPolarHBondContact O-CB 3.45Å; W86-A89 PolarHBondContact O-N 2.93Å
90	E	35.8	Very low	38.8	Very low	176 Å²	176	134.7 Å²	134.7	82%	0.822	73%	0.728	S	S	*	*	S	Bend	trans	-108.5	65.4	169.5	-75.4	-172.6	166.9	0	0	110.9
91	T	35.3	Very low	37.5	Very low	134 Å²	134	138.7 Å²	138.7	82%	0.822	74%	0.736	S	S	*	*	S	Bend	trans	-173.4	65	151.5	17.2	0	0	0	0	107.7
92	M	31	Very low	36	Very low	179 Å²	179	144.3 Å²	144.3	88%	0.882	76%	0.763	S	S	*	*			trans	-177.4	69.5	150.1	-82.4	-127.2	157.5	0	0	109.4
93	H	28.1	Very low	34.9	Very low	188 Å²	188	151.3 Å²	151.3	87%	0.87	79%	0.785	S	S	*	*			trans	-118.3	86.9	151.1	-90.8	-3.1	0	0	0	107.5
94	N	29.1	Very low	33.8	Very low	155 Å²	155	154.2 Å²	154.2	83%	0.829	79%	0.794	S	S	*	*			trans	-176.3	88	139	-90.7	-14.9	0	0	0	107.6
95	E	27.5	Very low	32.5	Very low	199 Å²	199	155.8 Å²	155.8	93%	0.93	80%	0.802	S	S	*	*			trans	-166.7	110	139.7	-106.3	167.4	-154.9	0	0	109.3
96	T	28.5	Very low	31.1	Very low	137 Å²	137	154.3 Å²	154.3	84%	0.84	81%	0.814	S	S	*	*			trans	-63.4	129.3	173.7	32.9	0	0	0	0	112.1
97	Q	31.3	Very low	30.1	Very low	196 Å²	196	152.2 Å²	152.2	92%	0.916	82%	0.82	S	S	*	*			trans	42.1	105.1	138.6	-61.1	-163.4	-8.8	0	0	119
98	G	25.1	Very low	29.3	Very low	77 Å²	77	152.8 Å²	152.8	79%	0.794	83%	0.826	S	S	*	*			trans	-152.5	98.9	153.3	0	0	0	0	0	109.6	G100	G98-G100 PolarHBondContact O-N 3.2Å
99	W	23.2	Very low	28.3	Very low	250 Å²	250	150.6 Å²	150.6	95%	0.947	83%	0.827	S	S	*	*			trans	-70	118.5	168.7	-88.2	63.9	0	0	0	109.3
100	G	25.4	Very low	27.8	Very low	71 Å²	71	156.8 Å²	156.8	73%	0.732	84%	0.84	S	S	*	*			trans	-148.7	108.4	168.7	0	0	0	0	0	108.9	G98 N102	G98-G100 PolarHBondContact O-N 3.2Å; G100-N102 PolarHBondContact O-N 3.23Å
101	F	27.4	Very low	27.3	Very low	182 Å²	182	152.5 Å²	152.5	80%	0.798	84%	0.835	S	S	*	*			trans	-47.9	129.5	173.7	-88.8	-105.6	0	0	0	111.6
102	N	25.4	Very low	26.9	Very low	157 Å²	157	155 Å²	155	84%	0.84	83%	0.83	S	S	*	*			trans	-158.4	118.3	135.9	-95.9	-23.3	0	0	0	109.8	G100	G100-N102 PolarHBondContact O-N 3.23Å
103	Q	30.5	Very low	26.6	Very low	187 Å²	187	155.9 Å²	155.9	87%	0.874	83%	0.829	S	S	*	*			trans	-87.5	101.7	-179.5	-158.1	175.8	37.1	0	0	107.2
104	I	26.9	Very low	26.5	Very low	154 Å²	154	156.8 Å²	156.8	79%	0.79	83%	0.826	S	S	*	*			trans	-142.1	127.3	164.5	-53.1	-179.5	0	0	0	109.2
105	N	28.7	Very low	26.3	Very low	160 Å²	160	155 Å²	155	86%	0.856	83%	0.826	S	S	*	*			trans	-46.9	129.8	-176.6	-61.5	-36.1	0	0	0	114.5
106	A	24	Very low	26.2	Very low	96 Å²	96	153.1 Å²	153.1	79%	0.793	82%	0.821	S	S	*	*			trans	-133	107.2	162.1	0	0	0	0	0	109.7
107	T	24.5	Very low	26.1	Very low	129 Å²	129	155.3 Å²	155.3	79%	0.791	82%	0.819	S	S	*	*			trans	-61.4	130.1	166.8	44.4	0	0	0	0	110.7	V109	T107-V109 PolarHBondContact O-N 2.89Å
108	P	26.4	Very low	25.9	Very low	125 Å²	125	155.6 Å²	155.6	81%	0.812	82%	0.817	S	S	*	*			trans	-87.6	112.1	172.3	29.5	-24.2	0	0	0	110.4	K110	P108-K110 PolarHBondContact O-N 2.88Å
109	V	24.4	Very low	26	Very low	136 Å²	136	159.1 Å²	159.1	82%	0.824	81%	0.813	S	S	*	*			trans	-67.4	114.9	165.3	175.7	0	0	0	0	108.2	T107 A111	T107-V109 PolarHBondContact O-N 2.89Å; V109-A111 PolarHBondContact O-N 3.08Å
110	K	25.6	Very low	26.1	Very low	204 Å²	204	159 Å²	159	89%	0.887	81%	0.813	S	S	*	*			trans	-63.4	111.5	173.8	-79.5	177.7	176.1	173.7	0	110	P108 R112	P108-K110 PolarHBondContact O-N 2.88Å; K110-R112 PolarHBondContact O-N 3.11Å
111	A	25.9	Very low	26.5	Very low	86 Å²	86	161.6 Å²	161.6	71%	0.711	81%	0.814	S	S	*	*			trans	-76	115.2	165.8	0	0	0	0	0	109.7	V109	V109-A111 PolarHBondContact O-N 3.08Å
112	R	26	Very low	26.6	Very low	188 Å²	188	155.8 Å²	155.8	71%	0.709	81%	0.806	S	S	*	*			trans	-72	126.2	166.3	-80.2	-179.8	172.7	174.7	-0.5	108.9	K110	K110-R112 PolarHBondContact O-N 3.11Å
113	F	24.4	Very low	26.9	Very low	197 Å²	197	157.5 Å²	157.5	86%	0.864	81%	0.811	S	S	*	*			trans	-124.2	120.6	159.6	-95.9	-85.4	0	0	0	109.4
114	Y	25.8	Very low	27.2	Very low	207 Å²	207	158 Å²	158	81%	0.812	81%	0.805	S	S	*	*			trans	-71.8	128.3	163.4	-75.6	-94.5	0	0	0	108.3
115	S	25.4	Very low	27.6	Very low	117 Å²	117	160.8 Å²	160.8	82%	0.818	81%	0.805	S	S	*	*			trans	-138.6	126.3	163.6	179.6	0	0	0	0	108.9
116	L	25.5	Very low	28.1	Very low	160 Å²	160	159 Å²	159	84%	0.838	80%	0.8	S	S	*	*			trans	-67.1	145.4	179.5	-87.7	85.7	0	0	0	111.7
117	K	26.6	Very low	29	Very low	183 Å²	183	160.3 Å²	160.3	80%	0.796	79%	0.789	S	S	*	*			trans	-25.6	121.2	169	-69.8	170	174.6	175.4	0	115.7
118	F	26.9	Very low	30	Very low	201 Å²	201	164.5 Å²	164.5	88%	0.882	80%	0.797	S	S	*	*			trans	-122.9	120.9	137	-89.6	-85.5	0	0	0	108.8	W120	F118-W120 PolarHBondContact O-N 3.33Å
119	H	26.3	Very low	31.3	Very low	152 Å²	152	162.1 Å²	162.1	70%	0.704	80%	0.795	S	S	*	*			trans	-67.7	119	175.5	-100.4	63.5	0	0	0	109.7
120	W	26.6	Very low	32.9	Very low	247 Å²	247	160.6 Å²	160.6	94%	0.936	79%	0.786	S	S	*	*			trans	-117.5	102.9	151.2	-86	94.3	0	0	0	108.4	F118 G122	F118-W120 PolarHBondContact O-N 3.33Å; W120-G122 VanDerWaalsContact C-N 3.32Å; W120-G122 PolarHBondContact O-N 3.07Å; W120-G122 VanDerWaalsContact O-N 3.08Å
121	V	33.2	Very low	34.7	Very low	126 Å²	126	154.7 Å²	154.7	76%	0.764	76%	0.758	S	S	*	*			trans	-72.1	90.9	166.6	177	0	0	0	0	106.7
122	G	29.8	Very low	36.8	Very low	60 Å²	60	159.9 Å²	159.9	62%	0.619	76%	0.759	S	S	*	*			trans	-117.2	103.5	167.1	0	0	0	0	0	108.2	W120 R124	W120-G122 VanDerWaalsContact C-N 3.32Å; W120-G122 PolarHBondContact O-N 3.07Å; W120-G122 VanDerWaalsContact O-N 3.08Å; G122-R124 PolarHBondContact O-N 3.04Å
123	M	32.5	Very low	39.1	Very low	193 Å²	193	157.1 Å²	157.1	95%	0.951	75%	0.749	S	S	*	*			trans	-46.9	106.8	172.4	-80.3	171.5	142.1	0	0	110.4
124	R	35.6	Very low	41.7	Very low	197 Å²	197	152.5 Å²	152.5	74%	0.743	74%	0.737	S	S	*	*			trans	-89.4	108	159.9	-80.1	-167.9	-177.1	-153.3	1.7	107.7	G122 V126	G122-R124 PolarHBondContact O-N 3.04Å; R124-V126 PolarHBondContact O-N 3.34Å
125	R	35	Very low	44.2	Very low	212 Å²	212	147.7 Å²	147.7	80%	0.8	73%	0.725	S	S	*	*			trans	-50.6	123.9	158.9	-84.2	-178.7	175.2	-179.6	-1	107.7	E127	R125-E127 VanDerWaalsContact C-N 3.28Å; R125-E127 HydrophobicContact CB-CG 4.46Å; R125-E127 PolarHBondContact O-N 3.36Å
126	V	39.5	Very low	46.9	Very low	123 Å²	123	145.3 Å²	145.3	75%	0.745	70%	0.703	S	S	*	*			trans	-74.4	88.8	170.6	-176.3	0	0	0	0	106.8	R124 K128	R124-V126 PolarHBondContact O-N 3.34Å; V126-K128 PolarHBondContact O-N 3.44Å
127	E	43.2	Very low	49.7	Very low	123 Å²	123	137.8 Å²	137.8	58%	0.575	66%	0.664	S	S	*	*			trans	-83.3	105	168.4	-74.7	-175.7	-178.3	0	0	108.6	R125 G129 T130	R125-E127 VanDerWaalsContact C-N 3.28Å; R125-E127 HydrophobicContact CB-CG 4.46Å; R125-E127 PolarHBondContact O-N 3.36Å; E127-G129 PolarHBondContact O-N 3.5Å; E127-T130 HydrophobicContact CB-CG2 4.48Å; E127-T130 PolarHBondContact O-OG1 3.2Å
128	K	44.9	Very low	52.3	Low	218 Å²	218	132.4 Å²	132.4	95%	0.948	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.5	120.1	174.4	-153.9	178.6	-174.7	-176.4	0	108.4	V126	V126-K128 PolarHBondContact O-N 3.44Å
129	G	54.5	Low	54.8	Low	74 Å²	74	126.7 Å²	126.7	76%	0.763	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	113.5	6.3	173.5	0	0	0	0	0	117.5	E127	E127-G129 PolarHBondContact O-N 3.5Å
130	T	58.1	Low	56.8	Low	105 Å²	105	120.3 Å²	120.3	64%	0.644	60%	0.601	S	S	*	*	S	Bend	trans	-79.6	-18.2	-176.2	37.1	0	0	0	0	116	E127	E127-T130 HydrophobicContact CB-CG2 4.48Å; E127-T130 PolarHBondContact O-OG1 3.2Å
131	R	64.1	Low	58.7	Low	80 Å²	80	112.1 Å²	112.1	30%	0.302	58%	0.576	S	S	.	*	S	Bend	trans	-119.7	133.6	175.1	-61.3	-162.5	-156.3	155.4	21.5	111.2	D61 L75 Q76 F78	D61-R131 IonicContact OD1-NH1 3.69Å; L75-R131 HydrophobicContact CB-CB 4.46Å; Q76-R131 WeakPolarHBondContact O-CD 3.33Å; F78-R131 HydrophobicContact CD1-CG 4.28Å; F78-R131 HydrophobicContact CE1-CG 4.17Å; F78-R131 VanDerWaalsContact CE2-NE 3.31Å
132	R	68.8	Low	60	Low	194 Å²	194	111.6 Å²	111.6	73%	0.732	56%	0.561	S	S	*	*			trans	-89.6	151.2	175.1	-62.7	-176.5	-178.8	-152.4	0.4	110.5	Q76	Q76-R132 PolarHBondContact N-O 3.08Å
133	W	74.4	Confident	61.1	Low	130 Å²	130	110.5 Å²	110.5	49%	0.492	55%	0.546	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	131.3	166.8	-70.3	82.4	0	0	0	109.1	I63 K73 L75 P137	I63-W133 HydrophobicContact CD1-CH2 3.59Å; I63-W133 HydrophobicContact CD1-CZ2 4.32Å; K73-W133 HydrophobicContact CB-CH2 3.87Å; K73-W133 HydrophobicContact CB-CZ3 3.94Å; K73-W133 HydrophobicContact CD-CH2 3.91Å; K73-W133 HydrophobicContact CD-CZ2 3.93Å; K73-W133 HydrophobicContact CG-CH2 3.54Å; K73-W133 HydrophobicContact CG-CZ2 4.1Å; K73-W133 HydrophobicContact CG-CZ3 4.11Å; L75-W133 HydrophobicContact CD2-CD2 4.23Å; L75-W133 HydrophobicContact CD2-CG 4.39Å; W133-P137 HydrophobicContact CH2-CG 3.68Å; W133-P137 HydrophobicContact CZ3-CB 4.41Å; W133-P137 HydrophobicContact CZ3-CG 3.49Å; W133-P137 VanDerWaalsContact CZ3-CG 3.49Å
134	V	78.3	Confident	62.2	Low	100 Å²	100	106.2 Å²	106.2	61%	0.606	53%	0.531	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.2	-23.6	173.8	-87.8	0	0	0	0	112	N74 Q76	N74-V134 HydrophobicContact CB-CG2 4.31Å; N74-V134 WeakPolarHBondContact O-CG2 3.32Å; N74-V134 PolarHBondContact O-N 3.32Å; Q76-V134 HydrophobicContact CB-CG1 4.15Å
135	D	80.1	Confident	63	Low	107 Å²	107	101.8 Å²	101.8	57%	0.572	52%	0.519	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-156.8	169.7	176.2	-154.1	-13.7	0	0	0	110.4	N74	N74-D135 HydrophobicContact CB-CB 3.86Å
136	L	81.9	Confident	63.8	Low	66 Å²	66	96.6 Å²	96.6	35%	0.346	51%	0.506	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	154.1	174.9	-69.3	173.9	0	0	0	111.8	N38 E41 N74	N38-L136 HydrophobicContact CB-CD1 4.13Å; N38-L136 WeakPolarHBondContact ND2-CB 3.4Å; E41-L136 HydrophobicContact CG-CD1 4.4Å; E41-L136 HydrophobicContact CG-CD2 4.22Å; E41-L136 WeakPolarHBondContact OE1-CD2 3.26Å; N74-L136 PolarHBondContact ND2-O 3.24Å
137	P	83.8	Confident	64.1	Low	3 Å²	3	93.7 Å²	93.7	2%	0.019	50%	0.501	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.7	148.4	174.2	-20.9	30.3	0	0	0	112.9	N38 F40 I63 Y71 Q72 W133	N38-P137 PolarHBondContact ND2-O 2.84Å; F40-P137 HydrophobicContact CB-CB 4.22Å; F40-P137 HydrophobicContact CB-CG 4.46Å; F40-P137 HydrophobicContact CD1-CB 4.11Å; F40-P137 HydrophobicContact CD1-CG 3.45Å; F40-P137 VanDerWaalsContact CD1-CG 3.45Å; F40-P137 HydrophobicContact CD2-CG 4.45Å; F40-P137 HydrophobicContact CE1-CG 3.63Å; F40-P137 HydrophobicContact CG-CB 4.02Å; F40-P137 HydrophobicContact CG-CG 3.86Å; F40-P137 HydrophobicContact CZ-CG 4.19Å; I63-P137 HydrophobicContact CD1-CB 4.08Å; I63-P137 HydrophobicContact CD1-CG 3.58Å; Y71-P137 HydrophobicContact CG-CB 4.5Å; Q72-P137 VanDerWaalsContact O-CA 3.31Å; Q72-P137 WeakPolarHBondContact O-CA 3.23Å; W133-P137 HydrophobicContact CH2-CG 3.68Å; W133-P137 HydrophobicContact CZ3-CB 4.41Å; W133-P137 HydrophobicContact CZ3-CG 3.49Å; W133-P137 VanDerWaalsContact CZ3-CG 3.49Å
138	T	81.7	Confident	64.2	Low	69 Å²	69	93.3 Å²	93.3	42%	0.423	50%	0.502	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	150	175.7	48.4	0	0	0	0	110.1	Y71 Q72 A140	Y71-T138 CarbonylContact C-O 3.51Å; Y71-T138 WeakPolarHBondContact CA-O 3.32Å; Q72-T138 PolarHBondContact N-O 3.36Å; Q72-T138 PolarHBondContact O-N 3.24Å; Q72-T138 VanDerWaalsContact O-N 3.11Å; T138-A140 PolarHBondContact O-N 3.44Å
139	T	77.9	Confident	64.2	Low	81 Å²	81	94 Å²	94	50%	0.497	50%	0.499	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.8	129.6	178.9	46.6	0	0	0	0	110.5	N39 Y71 D141	N39-T139 HydrophobicContact CB-CG2 4.44Å; Y71-T139 HydrophobicContact CD1-CG2 4.02Å; Y71-T139 HydrophobicContact CE1-CG2 3.63Å; T139-D141 PolarHBondContact O-N 3.02Å
140	A	69.9	Low	63.7	Low	18 Å²	18	95.9 Å²	95.9	15%	0.149	50%	0.498	C	S	.	.			trans	-70.9	99.3	-178.4	0	0	0	0	0	110.5	E70 T138 Y142	E70-A140 HydrophobicContact CB-CB 3.88Å; E70-A140 WeakPolarHBondContact O-CB 3.34Å; E70-A140 PolarHBondContact O-N 3.33Å; T138-A140 PolarHBondContact O-N 3.44Å; A140-Y142 PolarHBondContact O-N 3.18Å
141	D	66.1	Low	63	Low	75 Å²	75	95.2 Å²	95.2	40%	0.401	50%	0.495	S	S	.	.			trans	-94.2	92.6	175.9	-176.3	1	0	0	0	111.1	T139 A143 T144 E145	T139-D141 PolarHBondContact O-N 3.02Å; D141-A143 PolarHBondContact O-N 3.46Å; D141-A143 WeakPolarHBondContact OD1-CA 3.32Å; D141-A143 VanDerWaalsContact OD1-CB 3.3Å; D141-A143 WeakPolarHBondContact OD1-CB 3.41Å; D141-A143 PolarHBondContact OD1-N 3.08Å; D141-T144 PolarHBondContact O-N 3.41Å; D141-T144 PolarHBondContact OD1-N 2.74Å; D141-T144 VanDerWaalsContact OD2-CB 3.26Å; D141-T144 WeakPolarHBondContact OD2-CB 3.17Å; D141-T144 PolarHBondContact OD2-OG1 2.89Å; D141-E145 WeakPolarHBondContact O-CG 3.49Å; D141-E145 PolarHBondContact O-N 3.09Å
142	Y	59.1	Low	62.1	Low	115 Å²	115	97.7 Å²	97.7	45%	0.451	52%	0.515	S	S	.	.	H	α-helix	trans	-57.5	-29.6	175.7	-70.4	-83	0	0	0	113.4	R62 E70 A140 L146	R62-Y142 PolarHBondContact NH1-OH 2.82Å; E70-Y142 VanDerWaalsContact CD-OH 3.31Å; E70-Y142 PolarHBondContact OE1-OH 2.98Å; E70-Y142 WeakPolarHBondContact OE2-CE2 3.2Å; E70-Y142 VanDerWaalsContact OE2-CZ 3.3Å; E70-Y142 PolarHBondContact OE2-OH 3Å; A140-Y142 PolarHBondContact O-N 3.18Å; Y142-L146 WeakPolarHBondContact O-CB 3.25Å; Y142-L146 PolarHBondContact O-N 3.42Å; Y142-L146 VanDerWaalsContact O-N 3.07Å
143	A	53.8	Low	60.9	Low	37 Å²	37	98.3 Å²	98.3	31%	0.306	52%	0.518	S	S	.	.	H	α-helix	trans	-73.3	-42.8	-179	0	0	0	0	0	111	D141 L146 G147 L148	D141-A143 PolarHBondContact O-N 3.46Å; D141-A143 WeakPolarHBondContact OD1-CA 3.32Å; D141-A143 VanDerWaalsContact OD1-CB 3.3Å; D141-A143 WeakPolarHBondContact OD1-CB 3.41Å; D141-A143 PolarHBondContact OD1-N 3.08Å; A143-L146 PolarHBondContact O-N 3.44Å; A143-G147 PolarHBondContact O-N 3.22Å; A143-L148 PolarHBondContact O-N 2.96Å
144	T	55.7	Low	59.5	Low	104 Å²	104	95.4 Å²	95.4	64%	0.638	52%	0.518	S	S	*	.	H	α-helix	trans	-66.6	-37.8	173.7	-65.7	0	0	0	0	112	D141 G147	D141-T144 PolarHBondContact O-N 3.41Å; D141-T144 PolarHBondContact OD1-N 2.74Å; D141-T144 VanDerWaalsContact OD2-CB 3.26Å; D141-T144 WeakPolarHBondContact OD2-CB 3.17Å; D141-T144 PolarHBondContact OD2-OG1 2.89Å; T144-G147 PolarHBondContact O-N 3.38Å
145	E	52.4	Low	57.9	Low	104 Å²	104	94.9 Å²	94.9	49%	0.486	53%	0.533	S	S	.	.	H	α-helix	trans	-67.1	-36.8	177.2	-73.5	-177.1	167.2	0	0	113.5	R62 D141 G147	R62-E145 IonicContact NH2-OE1 3.69Å; R62-E145 PolarHBondContact NH2-OE1 2.92Å; R62-E145 IonicContact NH2-OE2 3.35Å; R62-E145 PolarHBondContact NH2-OE2 2.87Å; D141-E145 WeakPolarHBondContact O-CG 3.49Å; D141-E145 PolarHBondContact O-N 3.09Å; E145-G147 VanDerWaalsContact C-N 3.33Å
146	L	51.5	Low	55.9	Low	103 Å²	103	97.9 Å²	97.9	54%	0.539	54%	0.541	S	S	.	.	H	α-helix	trans	-85	-5.4	175.8	-73.3	164.7	0	0	0	113.3	Y142 A143 L148	Y142-L146 WeakPolarHBondContact O-CB 3.25Å; Y142-L146 PolarHBondContact O-N 3.42Å; Y142-L146 VanDerWaalsContact O-N 3.07Å; A143-L146 PolarHBondContact O-N 3.44Å; L146-L148 HydrophobicContact CB-CD1 3.88Å; L146-L148 HydrophobicContact CB-CG 3.9Å; L146-L148 HydrophobicContact CD1-CD1 4.16Å; L146-L148 PolarHBondContact O-N 2.91Å
147	G	45.9	Very low	53.9	Low	62 Å²	62	102.9 Å²	102.9	64%	0.639	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	68.4	21.9	-176.4	0	0	0	0	0	113.5	A143 T144 E145 R149	A143-G147 PolarHBondContact O-N 3.22Å; T144-G147 PolarHBondContact O-N 3.38Å; E145-G147 VanDerWaalsContact C-N 3.33Å; G147-R149 PolarHBondContact O-N 3.46Å
148	L	44.6	Very low	51.7	Low	114 Å²	114	108.1 Å²	108.1	60%	0.597	60%	0.6	S	S	*	*			trans	-85.8	110.3	179.2	-64.4	172.7	0	0	0	108.4	A143 L146	A143-L148 PolarHBondContact O-N 2.96Å; L146-L148 HydrophobicContact CB-CD1 3.88Å; L146-L148 HydrophobicContact CB-CG 3.9Å; L146-L148 HydrophobicContact CD1-CD1 4.16Å; L146-L148 PolarHBondContact O-N 2.91Å
149	R	45	Very low	49.5	Very low	234 Å²	234	113.1 Å²	113.1	88%	0.883	62%	0.618	S	S	*	*	P	Polyproline II helix	trans	-81.4	139	170	-71.1	-178.4	178.5	171.3	-1.7	109.4	G147	G147-R149 PolarHBondContact O-N 3.46Å
150	P	45.4	Very low	47.4	Very low	113 Å²	113	112.8 Å²	112.8	73%	0.734	62%	0.624	S	S	*	*	P	Polyproline II helix	trans	-58.2	145.1	167	-18.9	30.5	0	0	0	110.1	D152	P150-D152 PolarHBondContact O-N 3.07Å
151	P	42.8	Very low	45.7	Very low	91 Å²	91	117.5 Å²	117.5	59%	0.591	65%	0.653	S	S	*	*	P	Polyproline II helix	trans	-64.5	128.9	173.7	-8.5	21.9	0	0	0	109.6	Y153	P151-Y153 HydrophobicContact CB-CD2 4.16Å; P151-Y153 HydrophobicContact CB-CE2 3.57Å; P151-Y153 HydrophobicContact CG-CE2 3.92Å; P151-Y153 VanDerWaalsContact O-CD2 3.25Å; P151-Y153 WeakPolarHBondContact O-CD2 3.32Å; P151-Y153 PolarHBondContact O-N 3.09Å
152	D	44.7	Very low	44.2	Very low	132 Å²	132	124.7 Å²	124.7	71%	0.706	68%	0.675	S	S	*	*			trans	-78.2	109.5	175.9	-166.9	-12.7	0	0	0	108.8	P150 S154	P150-D152 PolarHBondContact O-N 3.07Å; D152-S154 WeakPolarHBondContact OD1-CB 3.33Å; D152-S154 PolarHBondContact OD1-N 3.37Å; D152-S154 VanDerWaalsContact OD1-N 3.11Å; D152-S154 PolarHBondContact OD1-OG 3.11Å
153	Y	44.9	Very low	43.2	Very low	206 Å²	206	128.2 Å²	128.2	81%	0.808	70%	0.695	S	S	*	*			trans	-98.4	13.6	178.7	-72.1	-82.2	0	0	0	112.6	P151 G155	P151-Y153 HydrophobicContact CB-CD2 4.16Å; P151-Y153 HydrophobicContact CB-CE2 3.57Å; P151-Y153 HydrophobicContact CG-CE2 3.92Å; P151-Y153 VanDerWaalsContact O-CD2 3.25Å; P151-Y153 WeakPolarHBondContact O-CD2 3.32Å; P151-Y153 PolarHBondContact O-N 3.09Å; Y153-G155 PolarHBondContact O-N 2.84Å; Y153-G155 VanDerWaalsContact O-N 3.16Å
154	S	43.4	Very low	42.5	Very low	70 Å²	70	134.1 Å²	134.1	49%	0.49	72%	0.717	S	S	.	*	S	Bend	trans	-70.6	110.2	166.9	67.2	0	0	0	0	107.7	D152 K156	D152-S154 WeakPolarHBondContact OD1-CB 3.33Å; D152-S154 PolarHBondContact OD1-N 3.37Å; D152-S154 VanDerWaalsContact OD1-N 3.11Å; D152-S154 PolarHBondContact OD1-OG 3.11Å; S154-K156 PolarHBondContact O-N 3.3Å
155	G	45.5	Very low	42.2	Very low	89 Å²	89	135 Å²	135	92%	0.918	72%	0.724	S	S	*	*	S	Bend	trans	-65.5	50.4	-177.4	0	0	0	0	0	115	Y153	Y153-G155 PolarHBondContact O-N 2.84Å; Y153-G155 VanDerWaalsContact O-N 3.16Å
156	K	38.5	Very low	42.4	Very low	170 Å²	170	138 Å²	138	74%	0.739	74%	0.737	S	S	*	*			trans	-107.6	113.9	160.6	-74.5	-178.4	176.1	178	0	105.7	S154 T158	S154-K156 PolarHBondContact O-N 3.3Å; K156-T158 PolarHBondContact O-N 2.95Å
157	D	39.7	Very low	43.2	Very low	171 Å²	171	138.4 Å²	138.4	91%	0.914	73%	0.733	S	S	*	*			trans	-60.4	78.3	163.2	-73.5	-40	0	0	0	108.6	E159	D157-E159 PolarHBondContact O-N 3.17Å
158	T	37.8	Very low	44.6	Very low	112 Å²	112	139.6 Å²	139.6	69%	0.687	72%	0.724	S	S	*	*			trans	-77.6	93.3	155.2	-42.6	0	0	0	0	102.4	K156 A160	K156-T158 PolarHBondContact O-N 2.95Å; T158-A160 PolarHBondContact O-N 3.46Å
159	E	35.7	Very low	46.3	Very low	174 Å²	174	135.2 Å²	135.2	81%	0.813	70%	0.703	S	S	*	*			trans	-49.1	100.7	157.1	-77.6	-170.6	150	0	0	105.2	D157 P161	D157-E159 PolarHBondContact O-N 3.17Å; E159-P161 VanDerWaalsContact O-N 3.08Å
160	A	32	Very low	48.1	Very low	75 Å²	75	126.2 Å²	126.2	62%	0.62	67%	0.672	S	S	*	*			trans	-48.3	125.9	166.2	0	0	0	0	0	104.2	T158 R162	T158-A160 PolarHBondContact O-N 3.46Å; A160-R162 VanDerWaalsContact C-N 3.32Å; A160-R162 PolarHBondContact O-N 2.84Å
161	P	34.4	Very low	49.8	Very low	117 Å²	117	124.7 Å²	124.7	76%	0.76	67%	0.668	S	S	*	*			trans	-54	111.2	176	21.1	-30.1	0	0	0	104.2	E159 Q163	E159-P161 VanDerWaalsContact O-N 3.08Å; P161-Q163 VanDerWaalsContact C-N 3.34Å; P161-Q163 PolarHBondContact O-N 2.82Å
162	R	35	Very low	51.8	Low	225 Å²	225	127.7 Å²	127.7	85%	0.849	68%	0.675	S	S	*	*			trans	-46.5	113.8	171	-73.2	179.8	-180	172.6	1.3	102.6	A160 Q164	A160-R162 VanDerWaalsContact C-N 3.32Å; A160-R162 PolarHBondContact O-N 2.84Å; R162-Q164 PolarHBondContact O-N 2.78Å
163	Q	37.5	Very low	53.8	Low	190 Å²	190	122.3 Å²	122.3	89%	0.888	65%	0.646	S	S	*	*			trans	-52.9	106.5	174.5	-78.8	-176.4	-3.6	0	0	103.6	P161 P165	P161-Q163 VanDerWaalsContact C-N 3.34Å; P161-Q163 PolarHBondContact O-N 2.82Å; Q163-P165 VanDerWaalsContact O-N 3.14Å
164	Q	39.8	Very low	56	Low	161 Å²	161	115.5 Å²	115.5	75%	0.752	63%	0.628	S	S	*	*			trans	-54.8	130.2	-178.6	-75.3	-175.3	-7.2	0	0	104.2	R162 H166	R162-Q164 PolarHBondContact O-N 2.78Å; Q164-H166 PolarHBondContact O-N 2.91Å
165	P	49.7	Very low	58.2	Low	122 Å²	122	113.6 Å²	113.6	79%	0.792	62%	0.615	S	S	*	*			trans	-47.3	120	176.6	19.1	-30.7	0	0	0	106.5	Q163 Y167	Q163-P165 VanDerWaalsContact O-N 3.14Å; P165-Y167 WeakPolarHBondContact O-CA 3.36Å; P165-Y167 PolarHBondContact O-N 2.79Å
166	H	56.1	Low	60.5	Low	166 Å²	166	110 Å²	110	77%	0.769	57%	0.574	S	S	*	*			trans	-41	104.3	-165.6	-161.4	-58.2	0	0	0	109.6	Q164 N168	Q164-H166 PolarHBondContact O-N 2.91Å; H166-N168 PolarHBondContact O-N 2.66Å
167	Y	68.5	Low	63.1	Low	112 Å²	112	104.1 Å²	104.1	44%	0.439	55%	0.548	S	S	.	.			trans	-64.8	106	-170.5	174.4	-111.9	0	0	0	108	P165 P169 W193 N226	P165-Y167 WeakPolarHBondContact O-CA 3.36Å; P165-Y167 PolarHBondContact O-N 2.79Å; Y167-P169 HydrophobicContact CD1-CG 4.24Å; Y167-P169 HydrophobicContact CE1-CB 4.21Å; Y167-P169 HydrophobicContact CE1-CG 3.6Å; Y167-P169 HydrophobicContact CE2-CB 4Å; Y167-P169 HydrophobicContact CE2-CG 4.27Å; Y167-W193 HydrophobicContact CE2-CZ2 4.42Å; Y167-N226 PolarHBondContact OH-OD1 2.94Å
168	N	75.6	Confident	65.7	Low	87 Å²	87	99 Å²	99	47%	0.465	52%	0.516	S	S	.	.			trans	-128.2	79.7	-177.2	-170.2	22.1	0	0	0	109.5	H166 R229	H166-N168 PolarHBondContact O-N 2.66Å; N168-R229 PolarHBondContact O-N 3.44Å
169	P	80	Confident	68.4	Low	22 Å²	22	93.7 Å²	93.7	14%	0.143	48%	0.483	C	S	.	.	B	Isolated β-bridge	trans	-77.7	152.6	-176.1	38.3	-41.9	0	0	0	110.6	Y167 A171 R177	Y167-P169 HydrophobicContact CD1-CG 4.24Å; Y167-P169 HydrophobicContact CE1-CB 4.21Å; Y167-P169 HydrophobicContact CE1-CG 3.6Å; Y167-P169 HydrophobicContact CE2-CB 4Å; Y167-P169 HydrophobicContact CE2-CG 4.27Å; P169-A171 PolarHBondContact O-N 3.11Å; P169-R177 VanDerWaalsContact CB-CZ 3.43Å
170	M	82.3	Confident	71.2	Confident	46 Å²	46	85.4 Å²	85.4	23%	0.227	45%	0.445	C	S	.	.			trans	-59.5	130.5	-175.5	-63.3	-178.1	76.3	0	0	112.1	E172 L173 R177 R227 R229	M170-E172 VanDerWaalsContact C-N 3.33Å; M170-E172 PolarHBondContact O-N 3.21Å; M170-L173 HydrophobicContact CB-CD1 4.15Å; M170-L173 HydrophobicContact CB-CG 4.26Å; M170-L173 PolarHBondContact O-N 3.11Å; M170-L173 HydrophobicContact SD-CD1 4.23Å; M170-R177 PolarHBondContact O-NH2 2.88Å; M170-R227 PolarHBondContact N-O 2.76Å; M170-R227 HydrophobicContact SD-CG 4.14Å; M170-R229 HydrophobicContact CG-CB 4.28Å
171	A	82.3	Confident	74.1	Confident	81 Å²	81	84.5 Å²	84.5	67%	0.669	43%	0.428	S	S	*	.	G	3₁₀ helix	trans	-67.6	-32.9	-179	0	0	0	0	0	112.7	P169 L173 S174	P169-A171 PolarHBondContact O-N 3.11Å; A171-L173 PolarHBondContact O-N 3.03Å; A171-S174 WeakPolarHBondContact O-CB 3.39Å; A171-S174 PolarHBondContact O-N 3.46Å; A171-S174 VanDerWaalsContact O-N 3.1Å; A171-S174 PolarHBondContact O-OG 2.92Å
172	E	84.3	Confident	76.8	Confident	154 Å²	154	80.6 Å²	80.6	72%	0.72	41%	0.409	S	S	*	.	G	3₁₀ helix	trans	-61.2	-29.7	178.3	-67.2	163.7	-162.6	0	0	112.7	M170 S174	M170-E172 VanDerWaalsContact C-N 3.33Å; M170-E172 PolarHBondContact O-N 3.21Å; E172-S174 VanDerWaalsContact C-N 3.32Å
173	L	86.9	Confident	79.6	Confident	19 Å²	19	70.1 Å²	70.1	10%	0.099	37%	0.369	C	S	.	.	G	3₁₀ helix	trans	-89.9	6.3	179.9	-58.8	175.5	0	0	0	112.9	M170 A171 S175 L176 R177 R227	M170-L173 HydrophobicContact CB-CD1 4.15Å; M170-L173 HydrophobicContact CB-CG 4.26Å; M170-L173 PolarHBondContact O-N 3.11Å; M170-L173 HydrophobicContact SD-CD1 4.23Å; A171-L173 PolarHBondContact O-N 3.03Å; L173-S175 VanDerWaalsContact C-N 3.32Å; L173-S175 PolarHBondContact O-N 3.22Å; L173-L176 HydrophobicContact CD2-CD1 4.24Å; L173-L176 PolarHBondContact O-N 3.27Å; L173-R177 VanDerWaalsContact O-CB 3.3Å; L173-R177 WeakPolarHBondContact O-CB 3.19Å; L173-R177 PolarHBondContact O-N 3.43Å; L173-R227 HydrophobicContact CD1-CG 3.95Å
174	S	90.2	Very high	82.4	Confident	63 Å²	63	61.7 Å²	61.7	44%	0.441	33%	0.329	S	S	.	.	H	α-helix	trans	-55.8	-44.3	-177.3	52.4	0	0	0	0	112.7	A171 E172 R177 Y178	A171-S174 WeakPolarHBondContact O-CB 3.39Å; A171-S174 PolarHBondContact O-N 3.46Å; A171-S174 VanDerWaalsContact O-N 3.1Å; A171-S174 PolarHBondContact O-OG 2.92Å; E172-S174 VanDerWaalsContact C-N 3.32Å; S174-R177 PolarHBondContact O-N 3.26Å; S174-Y178 PolarHBondContact O-N 3.44Å
175	S	91	Very high	84.9	Confident	30 Å²	30	58.2 Å²	58.2	21%	0.21	32%	0.323	C	S	.	.	H	α-helix	trans	-64.4	-44.5	178	-58.1	0	0	0	0	112.7	L173 Y178 A179 Q341	L173-S175 VanDerWaalsContact C-N 3.32Å; L173-S175 PolarHBondContact O-N 3.22Å; S175-Y178 PolarHBondContact O-N 2.89Å; S175-A179 PolarHBondContact O-N 3.06Å; S175-A179 VanDerWaalsContact O-N 3.07Å; S175-Q341 PolarHBondContact O-NE2 3.36Å
176	L	93	Very high	86.8	Confident	13 Å²	13	55.1 Å²	55.1	7%	0.068	31%	0.308	C	S	.	.	H	α-helix	trans	-69.3	-36.3	177.4	-74	171.9	0	0	0	111.8	L173 Y178 A179 V180 V225 V314	L173-L176 HydrophobicContact CD2-CD1 4.24Å; L173-L176 PolarHBondContact O-N 3.27Å; L176-Y178 VanDerWaalsContact C-N 3.35Å; L176-A179 PolarHBondContact O-N 3.45Å; L176-V180 WeakPolarHBondContact O-CB 3.05Å; L176-V180 VanDerWaalsContact O-CG2 3.31Å; L176-V180 WeakPolarHBondContact O-CG2 3.06Å; L176-V180 PolarHBondContact O-N 3.28Å; L176-V225 HydrophobicContact CB-CG1 4.02Å; L176-V314 HydrophobicContact CD1-CG1 3.94Å; L176-V314 HydrophobicContact CD2-CB 4.1Å; L176-V314 HydrophobicContact CD2-CG1 4.19Å; L176-V314 HydrophobicContact CD2-CG2 4.19Å; L176-V314 HydrophobicContact CG-CB 4.29Å; L176-V314 HydrophobicContact CG-CG1 3.89Å; L176-V314 HydrophobicContact CG-CG2 4.26Å
177	R	93.5	Very high	88.4	Confident	47 Å²	47	51.1 Å²	51.1	18%	0.177	29%	0.286	C	S	.	.	H	α-helix	trans	-60.6	-46	174.3	-173.4	-176.4	-54.5	133	23.1	111.1	P169 M170 L173 S174 A179 E181 V225 N226	P169-R177 VanDerWaalsContact CB-CZ 3.43Å; M170-R177 PolarHBondContact O-NH2 2.88Å; L173-R177 VanDerWaalsContact O-CB 3.3Å; L173-R177 WeakPolarHBondContact O-CB 3.19Å; L173-R177 PolarHBondContact O-N 3.43Å; S174-R177 PolarHBondContact O-N 3.26Å; R177-A179 VanDerWaalsContact C-N 3.34Å; R177-A179 PolarHBondContact O-N 2.97Å; R177-E181 HydrophobicContact CG-CG 4.25Å; R177-E181 WeakPolarHBondContact O-CB 3.42Å; R177-E181 WeakPolarHBondContact O-CG 3.11Å; R177-E181 PolarHBondContact O-N 3.46Å; R177-V225 HydrophobicContact CB-CB 4.11Å; R177-V225 HydrophobicContact CB-CG2 4.17Å; R177-V225 HydrophobicContact CG-CG2 4.14Å; R177-V225 PolarHBondContact NE-O 3.48Å; R177-V225 PolarHBondContact NH2-O 3.49Å; R177-V225 VanDerWaalsContact NH2-O 3.12Å; R177-N226 WeakPolarHBondContact CD-OD1 3.29Å; R177-N226 WeakPolarHBondContact CG-OD1 3.49Å; R177-N226 PolarHBondContact NE-OD1 2.98Å; R177-N226 VanDerWaalsContact NE-OD1 3.16Å
178	Y	93.8	Very high	89.5	Confident	62 Å²	62	54.2 Å²	54.2	24%	0.243	30%	0.301	C	S	.	.	H	α-helix	trans	-58.2	-48.1	174.6	-175.7	-91.7	0	0	0	111.4	S174 S175 L176 G182 T337 D338 Q341	S174-Y178 PolarHBondContact O-N 3.44Å; S175-Y178 PolarHBondContact O-N 2.89Å; L176-Y178 VanDerWaalsContact C-N 3.35Å; Y178-G182 PolarHBondContact O-N 3.45Å; Y178-T337 VanDerWaalsContact OH-C 3.29Å; Y178-T337 WeakPolarHBondContact OH-CB 3.29Å; Y178-T337 PolarHBondContact OH-OG1 3.32Å; Y178-D338 PolarHBondContact OH-N 3.49Å; Y178-D338 VanDerWaalsContact OH-N 3.14Å; Y178-D338 PolarHBondContact OH-OD1 3.46Å; Y178-Q341 HydrophobicContact CD1-CB 3.93Å; Y178-Q341 HydrophobicContact CD1-CG 3.52Å; Y178-Q341 HydrophobicContact CE1-CB 3.83Å; Y178-Q341 HydrophobicContact CE1-CG 3.82Å; Y178-Q341 HydrophobicContact CG-CG 4.31Å
179	A	94.2	Very high	90.2	Very high	1 Å²	1	51 Å²	51	1%	0.008	28%	0.284	C	S	.	.	H	α-helix	trans	-60.1	-50.1	-179.6	0	0	0	0	0	112.2	S175 L176 R177 W183 V307 Q310	S175-A179 PolarHBondContact O-N 3.06Å; S175-A179 VanDerWaalsContact O-N 3.07Å; L176-A179 PolarHBondContact O-N 3.45Å; R177-A179 VanDerWaalsContact C-N 3.34Å; R177-A179 PolarHBondContact O-N 2.97Å; A179-W183 VanDerWaalsContact O-CB 3.24Å; A179-W183 WeakPolarHBondContact O-CB 3.2Å; A179-W183 PolarHBondContact O-N 3.03Å; A179-V307 HydrophobicContact CB-CG2 4.21Å; A179-Q310 HydrophobicContact CB-CB 3.77Å; A179-Q310 HydrophobicContact CB-CG 4.33Å
180	V	94.9	Very high	90.3	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-67.5	-48	-177.5	172.1	0	0	0	0	111.4	L176 W183 R184 A221 V225 V274 A278	L176-V180 WeakPolarHBondContact O-CB 3.05Å; L176-V180 VanDerWaalsContact O-CG2 3.31Å; L176-V180 WeakPolarHBondContact O-CG2 3.06Å; L176-V180 PolarHBondContact O-N 3.28Å; V180-W183 PolarHBondContact O-N 2.92Å; V180-R184 HydrophobicContact CG1-CG 4.39Å; V180-R184 WeakPolarHBondContact O-CB 3.29Å; V180-R184 WeakPolarHBondContact O-CG 3.37Å; V180-R184 PolarHBondContact O-N 3.36Å; V180-A221 HydrophobicContact CG1-CB 4.01Å; V180-V225 HydrophobicContact CB-CG1 4.4Å; V180-V225 HydrophobicContact CB-CG2 4.28Å; V180-V225 HydrophobicContact CG1-CG2 4.33Å; V180-V225 HydrophobicContact CG2-CG1 3.94Å; V180-V274 HydrophobicContact CG2-CG1 3.94Å; V180-A278 HydrophobicContact CG2-CB 4.19Å
181	E	93.5	Very high	90.4	Very high	57 Å²	57	60.3 Å²	60.3	27%	0.266	32%	0.324	S	S	.	.	H	α-helix	trans	-69.6	-36.6	-178.8	-62.6	-56.4	160.8	0	0	112.2	R177 R184 S185 S222 N226	R177-E181 HydrophobicContact CG-CG 4.25Å; R177-E181 WeakPolarHBondContact O-CB 3.42Å; R177-E181 WeakPolarHBondContact O-CG 3.11Å; R177-E181 PolarHBondContact O-N 3.46Å; E181-R184 PolarHBondContact O-N 3.3Å; E181-R184 IonicContact OE1-NH1 3.86Å; E181-R184 IonicContact OE2-CZ 3.8Å; E181-R184 IonicContact OE2-NH1 3.15Å; E181-R184 PolarHBondContact OE2-NH1 3.3Å; E181-S185 WeakPolarHBondContact O-CB 3.47Å; E181-S185 PolarHBondContact O-N 2.94Å; E181-S222 WeakPolarHBondContact OE1-CB 3.16Å; E181-S222 PolarHBondContact OE1-OG 3.4Å; E181-N226 PolarHBondContact OE1-ND2 2.81Å
182	G	90.8	Very high	90.4	Very high	35 Å²	35	59.8 Å²	59.8	36%	0.361	31%	0.312	S	S	.	.	H	α-helix	trans	-60.9	-45.2	172.7	0	0	0	0	0	112.1	Y178 S185 A186	Y178-G182 PolarHBondContact O-N 3.45Å; G182-S185 PolarHBondContact O-N 3.38Å; G182-A186 PolarHBondContact O-N 3.12Å
183	W	94.9	Very high	90.4	Very high	4 Å²	4	56.2 Å²	56.2	2%	0.015	29%	0.293	C	S	.	.	H	α-helix	trans	-63.5	-44.4	176.2	175.9	76.4	0	0	0	112.7	A179 V180 S185 A186 W187 L214 A218 A271 V274 D304 V307	A179-W183 VanDerWaalsContact O-CB 3.24Å; A179-W183 WeakPolarHBondContact O-CB 3.2Å; A179-W183 PolarHBondContact O-N 3.03Å; V180-W183 PolarHBondContact O-N 2.92Å; W183-S185 VanDerWaalsContact C-N 3.31Å; W183-S185 PolarHBondContact O-N 3.08Å; W183-A186 PolarHBondContact O-N 3.07Å; W183-W187 AromaticContact CD1-CD1 3.57Å; W183-W187 AromaticContact CD1-NE1 3.55Å; W183-W187 AromaticContact CE2-CD1 3.5Å; W183-W187 VanDerWaalsContact CE2-CD1 3.5Å; W183-W187 AromaticContact CE2-NE1 3.69Å; W183-W187 AromaticContact CZ2-CD1 4Å; W183-W187 AromaticContact NE1-CD1 3.25Å; W183-W187 VanDerWaalsContact NE1-CD1 3.25Å; W183-W187 AromaticContact NE1-NE1 3.04Å; W183-W187 VanDerWaalsContact O-CD1 3.27Å; W183-W187 PolarHBondContact O-N 3.28Å; W183-W187 VanDerWaalsContact O-N 3.14Å; W183-L214 HydrophobicContact CH2-CD1 4.26Å; W183-A218 HydrophobicContact CH2-CB 4.39Å; W183-A218 HydrophobicContact CZ3-CB 3.9Å; W183-A271 HydrophobicContact CH2-CB 3.57Å; W183-A271 HydrophobicContact CZ2-CB 4.21Å; W183-V274 HydrophobicContact CE3-CG1 4.3Å; W183-D304 PolarHBondContact NE1-OD1 2.95Å; W183-V307 HydrophobicContact CB-CB 3.89Å; W183-V307 HydrophobicContact CB-CG1 4.3Å; W183-V307 HydrophobicContact CB-CG2 3.88Å; W183-V307 HydrophobicContact CD2-CG1 4.42Å; W183-V307 HydrophobicContact CG-CB 3.94Å; W183-V307 HydrophobicContact CG-CG1 3.79Å; W183-V307 HydrophobicContact CG-CG2 4.09Å
184	R	94.8	Very high	90.3	Very high	13 Å²	13	61.1 Å²	61.1	5%	0.049	32%	0.315	C	S	.	.	H	α-helix	trans	-60.5	-41.5	175.9	-71.2	173.1	84.1	-134.6	5.4	111.9	V180 E181 W187 K188 I189 I191 A218 S222	V180-R184 HydrophobicContact CG1-CG 4.39Å; V180-R184 WeakPolarHBondContact O-CB 3.29Å; V180-R184 WeakPolarHBondContact O-CG 3.37Å; V180-R184 PolarHBondContact O-N 3.36Å; E181-R184 PolarHBondContact O-N 3.3Å; E181-R184 IonicContact OE1-NH1 3.86Å; E181-R184 IonicContact OE2-CZ 3.8Å; E181-R184 IonicContact OE2-NH1 3.15Å; E181-R184 PolarHBondContact OE2-NH1 3.3Å; R184-W187 CarbonylContact O-C 3.53Å; R184-W187 PolarHBondContact O-N 3.23Å; R184-K188 PolarHBondContact O-N 3.48Å; R184-K188 VanDerWaalsContact O-N 3.08Å; R184-I189 HydrophobicContact CB-CB 4.42Å; R184-I189 PolarHBondContact O-N 3.19Å; R184-I191 PolarHBondContact NH2-O 3.42Å; R184-A218 HydrophobicContact CG-CB 4.23Å; R184-A218 PolarHBondContact NE-O 2.92Å; R184-A218 VanDerWaalsContact NE-O 3.08Å; R184-S222 VanDerWaalsContact NH1-CB 3.28Å; R184-S222 PolarHBondContact NH1-OG 3.46Å
185	S	92.4	Very high	90.1	Very high	89 Å²	89	62 Å²	62	62%	0.622	32%	0.321	S	S	*	.	H	α-helix	trans	-64	-46.2	176.8	-173.8	0	0	0	0	111.8	E181 G182 W183 W187 K188	E181-S185 WeakPolarHBondContact O-CB 3.47Å; E181-S185 PolarHBondContact O-N 2.94Å; G182-S185 PolarHBondContact O-N 3.38Å; W183-S185 VanDerWaalsContact C-N 3.31Å; W183-S185 PolarHBondContact O-N 3.08Å; S185-W187 PolarHBondContact O-N 3.49Å; S185-K188 PolarHBondContact O-N 3.01Å
186	A	90.4	Very high	89.9	Confident	57 Å²	57	62.8 Å²	62.8	47%	0.471	33%	0.325	S	S	.	.	H	α-helix	trans	-57.3	-35.8	176.8	0	0	0	0	0	112.3	G182 W183 A303	G182-A186 PolarHBondContact O-N 3.12Å; W183-A186 PolarHBondContact O-N 3.07Å; A186-A303 HydrophobicContact CB-CB 3.66Å
187	W	89.5	Confident	89.8	Confident	82 Å²	82	66.8 Å²	66.8	31%	0.311	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.2	5.5	176.9	-71.3	120.5	0	0	0	115.1	W183 R184 S185 I189 D304	W183-W187 AromaticContact CD1-CD1 3.57Å; W183-W187 AromaticContact CD1-NE1 3.55Å; W183-W187 AromaticContact CE2-CD1 3.5Å; W183-W187 VanDerWaalsContact CE2-CD1 3.5Å; W183-W187 AromaticContact CE2-NE1 3.69Å; W183-W187 AromaticContact CZ2-CD1 4Å; W183-W187 AromaticContact NE1-CD1 3.25Å; W183-W187 VanDerWaalsContact NE1-CD1 3.25Å; W183-W187 AromaticContact NE1-NE1 3.04Å; W183-W187 VanDerWaalsContact O-CD1 3.27Å; W183-W187 PolarHBondContact O-N 3.28Å; W183-W187 VanDerWaalsContact O-N 3.14Å; R184-W187 CarbonylContact O-C 3.53Å; R184-W187 PolarHBondContact O-N 3.23Å; S185-W187 PolarHBondContact O-N 3.49Å; W187-I189 VanDerWaalsContact C-N 3.28Å; W187-I189 HydrophobicContact CB-CD1 4.2Å; W187-I189 HydrophobicContact CB-CG1 4.11Å; W187-I189 PolarHBondContact O-N 3Å; W187-D304 WeakPolarHBondContact CZ2-OD1 3.48Å; W187-D304 WeakPolarHBondContact CZ2-OD2 3.3Å; W187-D304 PolarHBondContact NE1-OD1 3.37Å
188	K	91.1	Very high	89.6	Confident	176 Å²	176	68.2 Å²	68.2	77%	0.765	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.2	34.4	178.2	-55.7	179.8	-179.1	177.6	0	114	R184 S185 K190	R184-K188 PolarHBondContact O-N 3.48Å; R184-K188 VanDerWaalsContact O-N 3.08Å; S185-K188 PolarHBondContact O-N 3.01Å; K188-K190 PolarHBondContact O-N 3.46Å
189	I	89.9	Confident	89.4	Confident	19 Å²	19	69.3 Å²	69.3	10%	0.097	37%	0.367	C	S	.	.			trans	-82	109.8	177.6	-55.9	176.3	0	0	0	108.9	R184 W187 L214 A218	R184-I189 HydrophobicContact CB-CB 4.42Å; R184-I189 PolarHBondContact O-N 3.19Å; W187-I189 VanDerWaalsContact C-N 3.28Å; W187-I189 HydrophobicContact CB-CD1 4.2Å; W187-I189 HydrophobicContact CB-CG1 4.11Å; W187-I189 PolarHBondContact O-N 3Å; I189-L214 HydrophobicContact CD1-CG 4.32Å; I189-A218 HydrophobicContact CD1-CB 3.55Å; I189-A218 HydrophobicContact CG2-CB 4.17Å
190	K	83.1	Confident	89.2	Confident	189 Å²	189	70.3 Å²	70.3	82%	0.822	38%	0.378	S	S	*	.			trans	-95.8	-12.4	-171.2	-64.6	-175	179.4	-178.1	0	115.6	K188 T192	K188-K190 PolarHBondContact O-N 3.46Å; K190-T192 PolarHBondContact O-N 2.93Å
191	I	83.1	Confident	89.1	Confident	75 Å²	75	71.3 Å²	71.3	39%	0.385	38%	0.383	S	S	.	.			trans	-66.5	130.7	-173.8	-54.9	-175	0	0	0	109.7	R184 V196 T219	R184-I191 PolarHBondContact NH2-O 3.42Å; I191-V196 HydrophobicContact CG2-CG2 3.5Å; I191-T219 HydrophobicContact CG2-CG2 4.27Å
192	T	84.1	Confident	89.1	Confident	70 Å²	70	71.6 Å²	71.6	43%	0.429	38%	0.384	S	S	.	.			trans	-96.7	136	178.7	56.9	0	0	0	0	110.4	K190 Q194 S195 V196	K190-T192 PolarHBondContact O-N 2.93Å; T192-Q194 PolarHBondContact O-N 3.41Å; T192-S195 PolarHBondContact O-N 3.32Å; T192-S195 VanDerWaalsContact O-N 3.1Å; T192-S195 PolarHBondContact O-OG 2.9Å; T192-S195 PolarHBondContact OG1-OG 3.38Å; T192-S195 VanDerWaalsContact OG1-OG 3.1Å; T192-V196 WeakPolarHBondContact O-CG2 3.34Å
193	W	83.9	Confident	89.2	Confident	80 Å²	80	78 Å²	78	30%	0.303	40%	0.397	S	S	.	.	G	3₁₀ helix	trans	-63.2	-24.8	-176.4	63.6	-94.4	0	0	0	113.3	Y167 S195 T219 S222 N226	Y167-W193 HydrophobicContact CE2-CZ2 4.42Å; W193-S195 VanDerWaalsContact C-N 3.27Å; W193-S195 PolarHBondContact O-N 3.39Å; W193-T219 HydrophobicContact CB-CG2 3.88Å; W193-S222 VanDerWaalsContact CD1-OG 3.24Å; W193-N226 HydrophobicContact CZ2-CB 3.91Å; W193-N226 PolarHBondContact NE1-ND2 3.19Å
194	Q	85.4	Confident	89.1	Confident	121 Å²	121	78.8 Å²	78.8	57%	0.565	40%	0.404	S	S	*	.	G	3₁₀ helix	trans	-69.8	-22	177.4	-58.2	89.6	-19.8	0	0	113.5	T192	T192-Q194 PolarHBondContact O-N 3.41Å
195	S	84.5	Confident	89.1	Confident	83 Å²	83	79 Å²	79	58%	0.58	41%	0.406	S	S	*	.	G	3₁₀ helix	trans	-94.5	-4.6	-172.2	67.1	0	0	0	0	114.2	T192 W193	T192-S195 PolarHBondContact O-N 3.32Å; T192-S195 VanDerWaalsContact O-N 3.1Å; T192-S195 PolarHBondContact O-OG 2.9Å; T192-S195 PolarHBondContact OG1-OG 3.38Å; T192-S195 VanDerWaalsContact OG1-OG 3.1Å; W193-S195 VanDerWaalsContact C-N 3.27Å; W193-S195 PolarHBondContact O-N 3.39Å
196	V	86.8	Confident	89.1	Confident	46 Å²	46	81.6 Å²	81.6	28%	0.279	41%	0.406	S	S	.	.			trans	-112.4	140	-168.3	-163.4	0	0	0	0	111.5	I191 T192 L201 T219	I191-V196 HydrophobicContact CG2-CG2 3.5Å; T192-V196 WeakPolarHBondContact O-CG2 3.34Å; V196-L201 HydrophobicContact CB-CD2 4.41Å; V196-L201 HydrophobicContact CB-CG 4.37Å; V196-L201 HydrophobicContact CG1-CD1 4.43Å; V196-L201 HydrophobicContact CG1-CD2 3.72Å; V196-L201 HydrophobicContact CG1-CG 3.63Å; V196-T219 HydrophobicContact CG2-CG2 4.14Å
197	T	90.4	Very high	89.4	Confident	96 Å²	96	81.5 Å²	81.5	59%	0.589	40%	0.398	S	S	*	.			trans	-87.5	152.6	174.1	62.4	0	0	0	0	111.6	E199 G200 L201	T197-E199 VanDerWaalsContact C-N 3.32Å; T197-E199 PolarHBondContact O-N 2.82Å; T197-G200 WeakPolarHBondContact O-CA 3.41Å; T197-G200 PolarHBondContact O-N 2.74Å; T197-G200 VanDerWaalsContact O-N 3.08Å; T197-G200 PolarHBondContact OG1-N 3.17Å; T197-G200 VanDerWaalsContact OG1-N 3.11Å; T197-L201 PolarHBondContact O-N 2.82Å
198	I	89.4	Confident	89.5	Confident	77 Å²	77	84.9 Å²	84.9	40%	0.395	42%	0.421	S	S	.	.	H	α-helix	trans	-58.4	-45	177.7	-59.2	175.7	0	0	0	110.7	G200 L201 K202 P250 L253	I198-G200 VanDerWaalsContact C-N 3.3Å; I198-G200 PolarHBondContact O-N 3.29Å; I198-L201 PolarHBondContact O-N 3.41Å; I198-K202 WeakPolarHBondContact O-CB 3.41Å; I198-K202 PolarHBondContact O-N 3.23Å; I198-P250 HydrophobicContact CD1-CB 4.09Å; I198-P250 HydrophobicContact CD1-CG 3.75Å; I198-P250 HydrophobicContact CG1-CG 4.04Å; I198-P250 HydrophobicContact CG2-CB 4.39Å; I198-L253 HydrophobicContact CG2-CD1 4.35Å; I198-L253 HydrophobicContact CG2-CD2 4.32Å; I198-L253 HydrophobicContact CG2-CG 4.25Å
199	E	89.8	Confident	89.6	Confident	85 Å²	85	81.4 Å²	81.4	40%	0.397	41%	0.408	S	S	.	.	H	α-helix	trans	-63.9	-33.8	175.7	-73.8	-58.9	135.1	0	0	113	T197 K202 R203	T197-E199 VanDerWaalsContact C-N 3.32Å; T197-E199 PolarHBondContact O-N 2.82Å; E199-K202 IonicContact OE1-NZ 3.6Å; E199-R203 WeakPolarHBondContact O-CG 3.09Å; E199-R203 PolarHBondContact O-N 3.4Å; E199-R203 VanDerWaalsContact O-N 3.15Å; E199-R203 PolarHBondContact O-NH1 3.39Å
200	G	91	Very high	89.8	Confident	23 Å²	23	85.9 Å²	85.9	24%	0.237	42%	0.424	C	S	.	.	H	α-helix	trans	-63.6	-47.4	172	0	0	0	0	0	111.9	T197 I198 K202 R203 A204	T197-G200 WeakPolarHBondContact O-CA 3.41Å; T197-G200 PolarHBondContact O-N 2.74Å; T197-G200 VanDerWaalsContact O-N 3.08Å; T197-G200 PolarHBondContact OG1-N 3.17Å; T197-G200 VanDerWaalsContact OG1-N 3.11Å; I198-G200 VanDerWaalsContact C-N 3.3Å; I198-G200 PolarHBondContact O-N 3.29Å; G200-K202 VanDerWaalsContact C-N 3.34Å; G200-K202 PolarHBondContact O-N 3.33Å; G200-R203 PolarHBondContact O-N 3.46Å; G200-A204 WeakPolarHBondContact O-CB 3.17Å; G200-A204 PolarHBondContact O-N 2.89Å
201	L	92.8	Very high	90.3	Very high	20 Å²	20	81.5 Å²	81.5	11%	0.105	41%	0.406	C	S	.	.	H	α-helix	trans	-61.5	-41.6	176	-70.1	171.3	0	0	0	111.8	V196 T197 I198 R203 A204 L205 A216 T219 L253	V196-L201 HydrophobicContact CB-CD2 4.41Å; V196-L201 HydrophobicContact CB-CG 4.37Å; V196-L201 HydrophobicContact CG1-CD1 4.43Å; V196-L201 HydrophobicContact CG1-CD2 3.72Å; V196-L201 HydrophobicContact CG1-CG 3.63Å; T197-L201 PolarHBondContact O-N 2.82Å; I198-L201 PolarHBondContact O-N 3.41Å; L201-R203 PolarHBondContact O-N 3.31Å; L201-A204 PolarHBondContact O-N 2.94Å; L201-L205 WeakPolarHBondContact O-CB 3.45Å; L201-L205 VanDerWaalsContact O-CG 3.25Å; L201-L205 WeakPolarHBondContact O-CG 3.37Å; L201-L205 PolarHBondContact O-N 3.4Å; L201-A216 HydrophobicContact CD2-CB 4.13Å; L201-T219 HydrophobicContact CD2-CG2 4.34Å; L201-L253 HydrophobicContact CB-CD1 4.04Å; L201-L253 HydrophobicContact CB-CD2 4.2Å; L201-L253 HydrophobicContact CD1-CD1 3.88Å
202	K	93.8	Very high	90.7	Very high	64 Å²	64	79.8 Å²	79.8	28%	0.278	40%	0.399	S	S	.	.	H	α-helix	trans	-61.4	-41.4	178.8	-169.2	176.3	-175.9	172.4	0	112.7	I198 E199 G200 E252 L253 L256	I198-K202 WeakPolarHBondContact O-CB 3.41Å; I198-K202 PolarHBondContact O-N 3.23Å; E199-K202 IonicContact OE1-NZ 3.6Å; G200-K202 VanDerWaalsContact C-N 3.34Å; G200-K202 PolarHBondContact O-N 3.33Å; K202-E252 IonicContact NZ-OE2 3.82Å; K202-E252 PolarHBondContact NZ-OE2 3.1Å; K202-L253 HydrophobicContact CB-CD2 4.02Å; K202-L256 HydrophobicContact CG-CD1 3.82Å
203	R	92.8	Very high	91.3	Very high	168 Å²	168	77.8 Å²	77.8	63%	0.634	38%	0.384	S	S	*	.	H	α-helix	trans	-67.3	-47.2	173	-69.3	-175.3	-169.8	94.6	-1.7	111.1	E199 G200 L201 L205 K206 D207	E199-R203 WeakPolarHBondContact O-CG 3.09Å; E199-R203 PolarHBondContact O-N 3.4Å; E199-R203 VanDerWaalsContact O-N 3.15Å; E199-R203 PolarHBondContact O-NH1 3.39Å; G200-R203 PolarHBondContact O-N 3.46Å; L201-R203 PolarHBondContact O-N 3.31Å; R203-L205 VanDerWaalsContact C-N 3.3Å; R203-L205 PolarHBondContact O-N 2.85Å; R203-K206 PolarHBondContact O-N 3.23Å; R203-D207 PolarHBondContact O-N 3.31Å
204	A	92.9	Very high	91.7	Very high	21 Å²	21	74.3 Å²	74.3	17%	0.174	37%	0.371	C	S	.	.	H	α-helix	trans	-62.5	-33.4	-178.5	0	0	0	0	0	113.3	G200 L201 K206 D207 V212 R213 A216	G200-A204 WeakPolarHBondContact O-CB 3.17Å; G200-A204 PolarHBondContact O-N 2.89Å; L201-A204 PolarHBondContact O-N 2.94Å; A204-K206 VanDerWaalsContact C-N 3.26Å; A204-K206 PolarHBondContact O-N 3.39Å; A204-D207 WeakPolarHBondContact O-CB 3.16Å; A204-D207 PolarHBondContact O-N 3.11Å; A204-V212 HydrophobicContact CB-CG1 3.76Å; A204-R213 WeakPolarHBondContact O-CA 3.46Å; A204-R213 WeakPolarHBondContact O-CG 3.29Å; A204-A216 HydrophobicContact CB-CB 3.7Å
205	L	93.6	Very high	92.1	Very high	17 Å²	17	69.7 Å²	69.7	9%	0.089	35%	0.352	C	S	.	.	H	α-helix	trans	-68	-22.9	174.7	-74.8	170.7	0	0	0	113.5	L201 R203 R213 A216 I217 L253 L256 L257	L201-L205 WeakPolarHBondContact O-CB 3.45Å; L201-L205 VanDerWaalsContact O-CG 3.25Å; L201-L205 WeakPolarHBondContact O-CG 3.37Å; L201-L205 PolarHBondContact O-N 3.4Å; R203-L205 VanDerWaalsContact C-N 3.3Å; R203-L205 PolarHBondContact O-N 2.85Å; L205-R213 VanDerWaalsContact O-CD 3.22Å; L205-R213 WeakPolarHBondContact O-CD 3.18Å; L205-A216 HydrophobicContact CD2-CB 4.01Å; L205-A216 HydrophobicContact CG-CB 4.09Å; L205-I217 HydrophobicContact CD2-CB 4.49Å; L205-I217 HydrophobicContact CD2-CD1 4.25Å; L205-I217 HydrophobicContact CD2-CG1 3.35Å; L205-L253 HydrophobicContact CD1-CD2 4.08Å; L205-L256 HydrophobicContact CB-CB 4.37Å; L205-L256 HydrophobicContact CB-CD1 4.27Å; L205-L256 HydrophobicContact CD1-CB 3.84Å; L205-L256 HydrophobicContact CD1-CD1 4.1Å; L205-L257 HydrophobicContact CD1-CD2 4.4Å; L205-L257 HydrophobicContact CD2-CD2 4.11Å
206	K	93.6	Very high	92.6	Very high	144 Å²	144	66 Å²	66	63%	0.626	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.3	6.1	178.5	-64	-177.2	179.4	-173.8	0	113.1	R203 A204 L256	R203-K206 PolarHBondContact O-N 3.23Å; A204-K206 VanDerWaalsContact C-N 3.26Å; A204-K206 PolarHBondContact O-N 3.39Å; K206-L256 VanDerWaalsContact CE-CD2 3.46Å; K206-L256 HydrophobicContact CG-CD2 4.41Å
207	D	95.6	Very high	93	Very high	56 Å²	56	63.8 Å²	63.8	30%	0.299	31%	0.313	S	S	.	.			trans	-67.8	146.6	-175.7	-163.1	-81.8	0	0	0	111.7	R203 A204 H209 V212 R213	R203-D207 PolarHBondContact O-N 3.31Å; A204-D207 WeakPolarHBondContact O-CB 3.16Å; A204-D207 PolarHBondContact O-N 3.11Å; D207-H209 PolarHBondContact O-N 2.85Å; D207-H209 VanDerWaalsContact OD1-CB 3.32Å; D207-H209 WeakPolarHBondContact OD1-CB 3.43Å; D207-H209 IonicContact OD1-CD2 3.31Å; D207-H209 PolarHBondContact OD1-CD2 3.32Å; D207-H209 IonicContact OD1-CG 2.68Å; D207-H209 PolarHBondContact OD1-N 3.25Å; D207-V212 HydrophobicContact CB-CB 3.92Å; D207-V212 HydrophobicContact CB-CG1 3.78Å; D207-R213 HydrophobicContact CB-CG 4.38Å; D207-R213 VanDerWaalsContact O-CD 3.28Å; D207-R213 WeakPolarHBondContact O-CD 3.34Å; D207-R213 WeakPolarHBondContact O-CG 3.5Å; D207-R213 PolarHBondContact O-NH1 2.89Å
208	L	91.8	Very high	93.2	Very high	152 Å²	152	59.2 Å²	59.2	80%	0.796	29%	0.285	S	S	*	.	S	Bend	trans	-61.7	-36	176.9	-176.8	66.7	0	0	0	111.3	R213	L208-R213 PolarHBondContact O-NH1 3.34Å
209	H	94.1	Very high	93.4	Very high	104 Å²	104	55.7 Å²	55.7	48%	0.481	27%	0.267	S	S	.	.	S	Bend	trans	-83.8	119.6	-176.1	-59.1	-62.9	0	0	0	112.1	D207 H211 V212 R213	D207-H209 PolarHBondContact O-N 2.85Å; D207-H209 VanDerWaalsContact OD1-CB 3.32Å; D207-H209 WeakPolarHBondContact OD1-CB 3.43Å; D207-H209 IonicContact OD1-CD2 3.31Å; D207-H209 PolarHBondContact OD1-CD2 3.32Å; D207-H209 IonicContact OD1-CG 2.68Å; D207-H209 PolarHBondContact OD1-N 3.25Å; H209-H211 VanDerWaalsContact CB-CE1 3.44Å; H209-H211 WeakPolarHBondContact CB-CE1 3.4Å; H209-H211 AromaticContact CG-CE1 3.92Å; H209-H211 PolarHBondContact O-N 3.13Å; H209-H211 VanDerWaalsContact O-N 3.13Å; H209-V212 HydrophobicContact CB-CG2 4.05Å; H209-V212 WeakPolarHBondContact O-CB 3.32Å; H209-V212 PolarHBondContact O-N 3.46Å; H209-V212 VanDerWaalsContact O-N 3.08Å; H209-R213 PolarHBondContact O-N 3.48Å
210	Y	93.3	Very high	93.6	Very high	112 Å²	112	52 Å²	52	44%	0.439	25%	0.251	S	S	.	.	H	α-helix	trans	-60.2	-29.5	-176.4	77.8	-90.8	0	0	0	113.7	V212 R213 L214 V265	Y210-V212 VanDerWaalsContact C-N 3.31Å; Y210-V212 PolarHBondContact O-N 2.89Å; Y210-R213 PolarHBondContact O-N 3Å; Y210-L214 WeakPolarHBondContact O-CB 3.49Å; Y210-L214 PolarHBondContact O-N 3.39Å; Y210-V265 HydrophobicContact CD2-CG1 4.18Å; Y210-V265 HydrophobicContact CG-CG1 4.32Å; Y210-V265 HydrophobicContact CG-CG2 4.4Å
211	H	93	Very high	93.8	Very high	97 Å²	97	50.9 Å²	50.9	45%	0.449	24%	0.239	S	C	.	.	H	α-helix	trans	-69.5	-30.5	179.8	68.8	-91.1	0	0	0	112.4	H209 S215	H209-H211 VanDerWaalsContact CB-CE1 3.44Å; H209-H211 WeakPolarHBondContact CB-CE1 3.4Å; H209-H211 AromaticContact CG-CE1 3.92Å; H209-H211 PolarHBondContact O-N 3.13Å; H209-H211 VanDerWaalsContact O-N 3.13Å; H211-S215 WeakPolarHBondContact O-CB 3.33Å; H211-S215 PolarHBondContact O-N 3.33Å; H211-S215 PolarHBondContact O-OG 2.98Å
212	V	93.1	Very high	93.8	Very high	40 Å²	40	50 Å²	50	24%	0.242	24%	0.235	C	C	.	.	H	α-helix	trans	-71.2	-48.4	174.6	-178.4	0	0	0	0	109.3	A204 D207 H209 Y210 L214 S215 A216	A204-V212 HydrophobicContact CB-CG1 3.76Å; D207-V212 HydrophobicContact CB-CB 3.92Å; D207-V212 HydrophobicContact CB-CG1 3.78Å; H209-V212 HydrophobicContact CB-CG2 4.05Å; H209-V212 WeakPolarHBondContact O-CB 3.32Å; H209-V212 PolarHBondContact O-N 3.46Å; H209-V212 VanDerWaalsContact O-N 3.08Å; Y210-V212 VanDerWaalsContact C-N 3.31Å; Y210-V212 PolarHBondContact O-N 2.89Å; V212-L214 PolarHBondContact O-N 2.99Å; V212-S215 PolarHBondContact O-N 3.35Å; V212-A216 WeakPolarHBondContact O-CB 3.27Å; V212-A216 PolarHBondContact O-N 3.34Å
213	R	95	Very high	93.7	Very high	28 Å²	28	47.8 Å²	47.8	11%	0.106	23%	0.23	C	C	.	.	H	α-helix	trans	-57.3	-49.6	174.7	-59.7	-159.4	-60.3	-79.6	4.3	111.8	A204 L205 D207 L208 H209 Y210 S215 A216 I217 D263 V268	A204-R213 WeakPolarHBondContact O-CA 3.46Å; A204-R213 WeakPolarHBondContact O-CG 3.29Å; L205-R213 VanDerWaalsContact O-CD 3.22Å; L205-R213 WeakPolarHBondContact O-CD 3.18Å; D207-R213 HydrophobicContact CB-CG 4.38Å; D207-R213 VanDerWaalsContact O-CD 3.28Å; D207-R213 WeakPolarHBondContact O-CD 3.34Å; D207-R213 WeakPolarHBondContact O-CG 3.5Å; D207-R213 PolarHBondContact O-NH1 2.89Å; L208-R213 PolarHBondContact O-NH1 3.34Å; H209-R213 PolarHBondContact O-N 3.48Å; Y210-R213 PolarHBondContact O-N 3Å; R213-S215 VanDerWaalsContact C-N 3.35Å; R213-S215 PolarHBondContact O-N 3.26Å; R213-A216 WeakPolarHBondContact O-CB 3.48Å; R213-A216 PolarHBondContact O-N 3.28Å; R213-I217 VanDerWaalsContact O-CG1 3.28Å; R213-I217 WeakPolarHBondContact O-CG1 3.4Å; R213-I217 PolarHBondContact O-N 3.33Å; R213-D263 IonicContact CZ-OD1 2.78Å; R213-D263 IonicContact CZ-OD2 2.79Å; R213-D263 IonicContact NE-OD2 3.28Å; R213-D263 PolarHBondContact NE-OD2 2.89Å; R213-D263 VanDerWaalsContact NH2-CG 3.34Å; R213-D263 IonicContact NH2-OD1 3.36Å; R213-D263 PolarHBondContact NH2-OD1 3.34Å; R213-D263 IonicContact NH2-OD2 3.55Å; R213-D263 PolarHBondContact NH2-OD2 3.41Å; R213-V268 HydrophobicContact CB-CG1 4.33Å
214	L	94.1	Very high	93.7	Very high	6 Å²	6	39.8 Å²	39.8	3%	0.031	20%	0.2	C	C	.	.	H	α-helix	trans	-54.3	-49	176.3	173	62.1	0	0	0	111.9	W183 I189 Y210 V212 A216 I217 A218 R267 V268 A271	W183-L214 HydrophobicContact CH2-CD1 4.26Å; I189-L214 HydrophobicContact CD1-CG 4.32Å; Y210-L214 WeakPolarHBondContact O-CB 3.49Å; Y210-L214 PolarHBondContact O-N 3.39Å; V212-L214 PolarHBondContact O-N 2.99Å; L214-A216 VanDerWaalsContact C-N 3.35Å; L214-I217 PolarHBondContact O-N 3.17Å; L214-A218 WeakPolarHBondContact O-CB 3.5Å; L214-A218 PolarHBondContact O-N 3.27Å; L214-R267 HydrophobicContact CD1-CG 4.28Å; L214-R267 HydrophobicContact CD2-CG 4.07Å; L214-V268 HydrophobicContact CB-CG2 4.44Å; L214-A271 HydrophobicContact CD1-CB 3.38Å
215	S	93.4	Very high	93.6	Very high	25 Å²	25	38.8 Å²	38.8	18%	0.175	19%	0.192	C	C	.	.	H	α-helix	trans	-67.5	-36.7	-178.4	-58	0	0	0	0	111.9	H211 V212 R213 T219	H211-S215 WeakPolarHBondContact O-CB 3.33Å; H211-S215 PolarHBondContact O-N 3.33Å; H211-S215 PolarHBondContact O-OG 2.98Å; V212-S215 PolarHBondContact O-N 3.35Å; R213-S215 VanDerWaalsContact C-N 3.35Å; R213-S215 PolarHBondContact O-N 3.26Å; S215-T219 WeakPolarHBondContact O-CB 3.39Å; S215-T219 PolarHBondContact O-N 3.15Å; S215-T219 PolarHBondContact O-OG1 2.92Å
216	A	94.5	Very high	93.4	Very high	4 Å²	4	38.4 Å²	38.4	3%	0.033	19%	0.19	C	C	.	.	H	α-helix	trans	-62.5	-49.2	174.3	0	0	0	0	0	111.4	L201 A204 L205 V212 R213 L214 A218 T219 C220	L201-A216 HydrophobicContact CD2-CB 4.13Å; A204-A216 HydrophobicContact CB-CB 3.7Å; L205-A216 HydrophobicContact CD2-CB 4.01Å; L205-A216 HydrophobicContact CG-CB 4.09Å; V212-A216 WeakPolarHBondContact O-CB 3.27Å; V212-A216 PolarHBondContact O-N 3.34Å; R213-A216 WeakPolarHBondContact O-CB 3.48Å; R213-A216 PolarHBondContact O-N 3.28Å; L214-A216 VanDerWaalsContact C-N 3.35Å; A216-A218 PolarHBondContact O-N 2.87Å; A216-T219 WeakPolarHBondContact O-CB 3.2Å; A216-T219 PolarHBondContact O-N 3.45Å; A216-T219 VanDerWaalsContact O-N 3.14Å; A216-C220 PolarHBondContact O-N 3.16Å; A216-C220 PolarHBondContact O-SG 2.94Å; A216-C220 VanDerWaalsContact O-SG 3.36Å
217	I	95.8	Very high	93.1	Very high	1 Å²	1	33.7 Å²	33.7	1%	0.005	17%	0.168	C	C	.	.	H	α-helix	trans	-61.6	-46.4	178.3	-62.7	165.6	0	0	0	111.2	L205 R213 L214 T219 C220 A221 L257 A260 V268 A271 A272 C275	L205-I217 HydrophobicContact CD2-CB 4.49Å; L205-I217 HydrophobicContact CD2-CD1 4.25Å; L205-I217 HydrophobicContact CD2-CG1 3.35Å; R213-I217 VanDerWaalsContact O-CG1 3.28Å; R213-I217 WeakPolarHBondContact O-CG1 3.4Å; R213-I217 PolarHBondContact O-N 3.33Å; L214-I217 PolarHBondContact O-N 3.17Å; I217-T219 PolarHBondContact O-N 2.83Å; I217-C220 WeakPolarHBondContact O-CB 3.25Å; I217-C220 PolarHBondContact O-N 3.2Å; I217-C220 VanDerWaalsContact O-N 3.13Å; I217-A221 PolarHBondContact O-N 2.81Å; I217-L257 HydrophobicContact CB-CD2 4.35Å; I217-L257 HydrophobicContact CG1-CD2 3.97Å; I217-L257 HydrophobicContact CG2-CD2 4.1Å; I217-A260 HydrophobicContact CD1-CB 3.7Å; I217-V268 HydrophobicContact CD1-CG1 3.52Å; I217-A271 HydrophobicContact CB-CB 4.17Å; I217-A271 HydrophobicContact CG2-CB 3.82Å; I217-A271 VanDerWaalsContact CG2-O 3.25Å; I217-A271 WeakPolarHBondContact CG2-O 3.44Å; I217-A272 HydrophobicContact CD1-CB 4.39Å; I217-C275 HydrophobicContact CG2-CB 3.77Å
218	A	94.3	Very high	92.4	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-62.2	-31.3	177.6	0	0	0	0	0	112.4	W183 R184 I189 L214 A216 S222	W183-A218 HydrophobicContact CH2-CB 4.39Å; W183-A218 HydrophobicContact CZ3-CB 3.9Å; R184-A218 HydrophobicContact CG-CB 4.23Å; R184-A218 PolarHBondContact NE-O 2.92Å; R184-A218 VanDerWaalsContact NE-O 3.08Å; I189-A218 HydrophobicContact CD1-CB 3.55Å; I189-A218 HydrophobicContact CG2-CB 4.17Å; L214-A218 WeakPolarHBondContact O-CB 3.5Å; L214-A218 PolarHBondContact O-N 3.27Å; A216-A218 PolarHBondContact O-N 2.87Å; A218-S222 WeakPolarHBondContact O-CB 3.38Å; A218-S222 PolarHBondContact O-N 2.94Å
219	T	93.6	Very high	91.5	Very high	3 Å²	3	35.3 Å²	35.3	2%	0.018	17%	0.168	C	C	.	.	H	α-helix	trans	-71.5	-40.6	174.6	-57.1	0	0	0	0	111.2	I191 W193 V196 L201 S215 A216 I217 S222 G223	I191-T219 HydrophobicContact CG2-CG2 4.27Å; W193-T219 HydrophobicContact CB-CG2 3.88Å; V196-T219 HydrophobicContact CG2-CG2 4.14Å; L201-T219 HydrophobicContact CD2-CG2 4.34Å; S215-T219 WeakPolarHBondContact O-CB 3.39Å; S215-T219 PolarHBondContact O-N 3.15Å; S215-T219 PolarHBondContact O-OG1 2.92Å; A216-T219 WeakPolarHBondContact O-CB 3.2Å; A216-T219 PolarHBondContact O-N 3.45Å; A216-T219 VanDerWaalsContact O-N 3.14Å; I217-T219 PolarHBondContact O-N 2.83Å; T219-S222 PolarHBondContact O-N 3.29Å; T219-G223 PolarHBondContact O-N 2.98Å
220	C	94.1	Very high	90	Very high	7 Å²	7	36.1 Å²	36.1	5%	0.047	17%	0.172	C	C	.	.	H	α-helix	trans	-59.3	-45.1	170.8	-64.2	0	0	0	0	111.7	A216 I217 S222 G223 A224 V249 L257	A216-C220 PolarHBondContact O-N 3.16Å; A216-C220 PolarHBondContact O-SG 2.94Å; A216-C220 VanDerWaalsContact O-SG 3.36Å; I217-C220 WeakPolarHBondContact O-CB 3.25Å; I217-C220 PolarHBondContact O-N 3.2Å; I217-C220 VanDerWaalsContact O-N 3.13Å; C220-S222 PolarHBondContact O-N 3.45Å; C220-G223 PolarHBondContact O-N 3.34Å; C220-A224 PolarHBondContact O-N 3.05Å; C220-V249 HydrophobicContact CB-CG2 4.34Å; C220-L257 HydrophobicContact CB-CD1 4.28Å; C220-L257 HydrophobicContact CB-CD2 4.34Å
221	A	94.4	Very high	88	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-60.7	-43.5	177.4	0	0	0	0	0	112	V180 I217 A224 V225 C275 A278	V180-A221 HydrophobicContact CG1-CB 4.01Å; I217-A221 PolarHBondContact O-N 2.81Å; A221-A224 PolarHBondContact O-N 3.3Å; A221-V225 PolarHBondContact O-N 3.16Å; A221-C275 HydrophobicContact CB-CB 3.97Å; A221-A278 HydrophobicContact CB-CB 4.16Å
222	S	93.6	Very high	85.8	Confident	1 Å²	1	42.2 Å²	42.2	1%	0.007	20%	0.203	C	C	.	.	H	α-helix	trans	-63.4	-42.8	175	179.2	0	0	0	0	112.2	E181 R184 W193 A218 T219 C220 A224 V225 N226	E181-S222 WeakPolarHBondContact OE1-CB 3.16Å; E181-S222 PolarHBondContact OE1-OG 3.4Å; R184-S222 VanDerWaalsContact NH1-CB 3.28Å; R184-S222 PolarHBondContact NH1-OG 3.46Å; W193-S222 VanDerWaalsContact CD1-OG 3.24Å; A218-S222 WeakPolarHBondContact O-CB 3.38Å; A218-S222 PolarHBondContact O-N 2.94Å; T219-S222 PolarHBondContact O-N 3.29Å; C220-S222 PolarHBondContact O-N 3.45Å; S222-A224 VanDerWaalsContact C-N 3.31Å; S222-A224 PolarHBondContact O-N 3.09Å; S222-V225 WeakPolarHBondContact O-CG2 3.5Å; S222-V225 PolarHBondContact O-N 3.32Å; S222-N226 VanDerWaalsContact O-CB 3.32Å; S222-N226 WeakPolarHBondContact O-CB 3.28Å; S222-N226 PolarHBondContact O-N 3.07Å; S222-N226 VanDerWaalsContact O-N 3.12Å; S222-N226 PolarHBondContact O-ND2 3.37Å; S222-N226 PolarHBondContact OG-ND2 3.41Å
223	G	91.4	Very high	83.2	Confident	18 Å²	18	47.5 Å²	47.5	19%	0.186	23%	0.225	C	C	.	.	H	α-helix	trans	-58.4	-43.5	173.1	0	0	0	0	0	112.2	T219 C220 V225 N226 R227	T219-G223 PolarHBondContact O-N 2.98Å; C220-G223 PolarHBondContact O-N 3.34Å; G223-V225 PolarHBondContact O-N 3.08Å; G223-N226 PolarHBondContact O-N 2.64Å; G223-R227 PolarHBondContact O-N 3.33Å
224	A	91.9	Very high	80.6	Confident	0 Å²	0	52 Å²	52	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-62.7	-39.6	-178.5	0	0	0	0	0	113.7	C220 A221 S222 R227 P248 V249 A278 M279	C220-A224 PolarHBondContact O-N 3.05Å; A221-A224 PolarHBondContact O-N 3.3Å; S222-A224 VanDerWaalsContact C-N 3.31Å; S222-A224 PolarHBondContact O-N 3.09Å; A224-R227 WeakPolarHBondContact O-CD 3.31Å; A224-R227 WeakPolarHBondContact O-CG 3.39Å; A224-R227 PolarHBondContact O-NH1 3.01Å; A224-P248 WeakPolarHBondContact CA-O 3.35Å; A224-P248 HydrophobicContact CB-CB 4.2Å; A224-V249 HydrophobicContact CB-CG2 4.06Å; A224-A278 HydrophobicContact CB-CB 4.18Å; A224-M279 HydrophobicContact CB-CG 4.13Å
225	V	91.9	Very high	77.9	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-83.9	-19.5	179.9	-61	0	0	0	0	114.2	L176 R177 V180 A221 S222 G223 A278	L176-V225 HydrophobicContact CB-CG1 4.02Å; R177-V225 HydrophobicContact CB-CB 4.11Å; R177-V225 HydrophobicContact CB-CG2 4.17Å; R177-V225 HydrophobicContact CG-CG2 4.14Å; R177-V225 PolarHBondContact NE-O 3.48Å; R177-V225 PolarHBondContact NH2-O 3.49Å; R177-V225 VanDerWaalsContact NH2-O 3.12Å; V180-V225 HydrophobicContact CB-CG1 4.4Å; V180-V225 HydrophobicContact CB-CG2 4.28Å; V180-V225 HydrophobicContact CG1-CG2 4.33Å; V180-V225 HydrophobicContact CG2-CG1 3.94Å; A221-V225 PolarHBondContact O-N 3.16Å; S222-V225 WeakPolarHBondContact O-CG2 3.5Å; S222-V225 PolarHBondContact O-N 3.32Å; G223-V225 PolarHBondContact O-N 3.08Å; V225-A278 HydrophobicContact CG1-CB 3.73Å
226	N	90	Very high	75.5	Confident	8 Å²	8	64.4 Å²	64.4	4%	0.043	33%	0.327	C	S	.	.	S	Bend	trans	-98.3	7.9	179	-67	-55.2	0	0	0	112.9	Y167 R177 E181 W193 S222 G223	Y167-N226 PolarHBondContact OH-OD1 2.94Å; R177-N226 WeakPolarHBondContact CD-OD1 3.29Å; R177-N226 WeakPolarHBondContact CG-OD1 3.49Å; R177-N226 PolarHBondContact NE-OD1 2.98Å; R177-N226 VanDerWaalsContact NE-OD1 3.16Å; E181-N226 PolarHBondContact OE1-ND2 2.81Å; W193-N226 HydrophobicContact CZ2-CB 3.91Å; W193-N226 PolarHBondContact NE1-ND2 3.19Å; S222-N226 VanDerWaalsContact O-CB 3.32Å; S222-N226 WeakPolarHBondContact O-CB 3.28Å; S222-N226 PolarHBondContact O-N 3.07Å; S222-N226 VanDerWaalsContact O-N 3.12Å; S222-N226 PolarHBondContact O-ND2 3.37Å; S222-N226 PolarHBondContact OG-ND2 3.41Å; G223-N226 PolarHBondContact O-N 2.64Å
227	R	86.8	Confident	72.8	Confident	46 Å²	46	68.2 Å²	68.2	17%	0.174	36%	0.358	C	S	.	.	P	Polyproline II helix	trans	-56.4	133.3	177.9	68.1	-173.7	-179.4	-116.9	13.1	111.7	M170 L173 G223 A224	M170-R227 PolarHBondContact N-O 2.76Å; M170-R227 HydrophobicContact SD-CG 4.14Å; L173-R227 HydrophobicContact CD1-CG 3.95Å; G223-R227 PolarHBondContact O-N 3.33Å; A224-R227 WeakPolarHBondContact O-CD 3.31Å; A224-R227 WeakPolarHBondContact O-CG 3.39Å; A224-R227 PolarHBondContact O-NH1 3.01Å
228	P	80.9	Confident	70.3	Confident	69 Å²	69	72.3 Å²	72.3	45%	0.448	40%	0.401	S	S	.	.	B	Isolated β-bridge	trans	-74.6	156.3	-177.4	30.6	-34.8	0	0	0	111.7	I246	P228-I246 WeakPolarHBondContact O-CD1 3.26Å
229	R	71.7	Confident	67.6	Low	173 Å²	173	80.9 Å²	80.9	65%	0.653	44%	0.441	S	S	*	.	P	Polyproline II helix	trans	-79.6	129.7	168.2	-167.2	174.8	-174.3	172.1	3.8	109.4	N168 M170 K231	N168-R229 PolarHBondContact O-N 3.44Å; M170-R229 HydrophobicContact CG-CB 4.28Å; R229-K231 PolarHBondContact O-N 2.99Å
230	E	62.5	Low	65.1	Low	120 Å²	120	92.4 Å²	92.4	56%	0.561	49%	0.485	S	S	*	.	P	Polyproline II helix	trans	-65.1	126.5	174	-158.5	170.7	-153.1	0	0	109.4	Q232 I246	E230-Q232 PolarHBondContact O-N 3.34Å; E230-I246 HydrophobicContact CB-CD1 4.13Å
231	K	53.2	Low	62.3	Low	143 Å²	143	95.4 Å²	95.4	62%	0.622	52%	0.517	S	S	*	.	P	Polyproline II helix	trans	-74.2	123.1	170.9	-74.1	-177.2	178.7	179.6	0	107.3	R229 H233	R229-K231 PolarHBondContact O-N 2.99Å; K231-H233 PolarHBondContact O-N 3.09Å
232	Q	45.8	Very low	59.7	Low	194 Å²	194	106.4 Å²	106.4	91%	0.907	56%	0.559	S	S	*	*			trans	-58	104.3	163.5	-73.3	176.3	-18.3	0	0	107.8	E230 P234	E230-Q232 PolarHBondContact O-N 3.34Å; Q232-P234 WeakPolarHBondContact O-CD 3.46Å
233	H	39.2	Very low	57.2	Low	152 Å²	152	111.9 Å²	111.9	70%	0.704	59%	0.592	S	S	*	*			trans	-78.3	120.3	160.6	-77.7	-79.7	0	0	0	106.5	K231 T235	K231-H233 PolarHBondContact O-N 3.09Å; H233-T235 PolarHBondContact O-N 2.82Å
234	P	39.3	Very low	55.1	Low	122 Å²	122	121 Å²	121	79%	0.792	62%	0.62	S	S	*	*			trans	-68.7	93.4	167	28.2	-28.6	0	0	0	106.2	Q232 D236	Q232-P234 WeakPolarHBondContact O-CD 3.46Å; P234-D236 PolarHBondContact O-N 3.1Å
235	T	38	Very low	53.6	Low	125 Å²	125	127.5 Å²	127.5	77%	0.767	66%	0.656	S	S	*	*			trans	-83.7	112	167.8	-16.2	0	0	0	0	106.1	H233 A237	H233-T235 PolarHBondContact O-N 2.82Å; T235-A237 VanDerWaalsContact C-N 3.28Å; T235-A237 PolarHBondContact O-N 2.65Å
236	D	42.4	Very low	52.5	Low	167 Å²	167	131.1 Å²	131.1	89%	0.893	67%	0.674	S	S	*	*	S	Bend	trans	-59.1	92.2	166.1	-80.1	-32.2	0	0	0	108.9	P234	P234-D236 PolarHBondContact O-N 3.1Å
237	A	38.6	Very low	52.1	Low	84 Å²	84	135 Å²	135	69%	0.694	69%	0.692	S	S	*	*	S	Bend	trans	175	125	147.9	0	0	0	0	0	108.5	T235 Q239	T235-A237 VanDerWaalsContact C-N 3.28Å; T235-A237 PolarHBondContact O-N 2.65Å; A237-Q239 PolarHBondContact O-N 3.03Å
238	G	43.8	Very low	51.9	Low	87 Å²	87	134.6 Å²	134.6	90%	0.897	70%	0.695	S	S	*	*			trans	-59.9	98.9	175.6	0	0	0	0	0	112.2
239	Q	36.7	Very low	52.3	Low	180 Å²	180	131.5 Å²	131.5	84%	0.841	68%	0.675	S	S	*	*			trans	-135.7	130.6	147.8	-86.9	176.6	-3.7	0	0	105.7	A237 G241	A237-Q239 PolarHBondContact O-N 3.03Å; Q239-G241 PolarHBondContact O-N 3.47Å
240	Y	40	Very low	53.1	Low	245 Å²	245	125.6 Å²	125.6	96%	0.961	66%	0.659	S	S	*	*			trans	-58	82.3	171.4	-78.3	-92.7	0	0	0	109.4	R242	Y240-R242 PolarHBondContact O-N 2.9Å
241	G	36.3	Very low	54.2	Low	69 Å²	69	126 Å²	126	71%	0.711	66%	0.661	S	S	*	*			trans	-74.2	105.4	175	0	0	0	0	0	108.2	Q239 V243	Q239-G241 PolarHBondContact O-N 3.47Å; G241-V243 PolarHBondContact O-N 3.36Å
242	R	40.5	Very low	55.9	Low	231 Å²	231	124.1 Å²	124.1	87%	0.872	65%	0.654	S	S	*	*			trans	-48.7	126.9	167.7	-72.9	-178.2	-176.2	-172	0.8	108.7	Y240 R244	Y240-R242 PolarHBondContact O-N 2.9Å; R242-R244 PolarHBondContact O-N 3.34Å
243	V	40.1	Very low	58.1	Low	116 Å²	116	115 Å²	115	70%	0.703	61%	0.612	S	S	*	*			trans	-46.1	114.4	162.4	-179.9	0	0	0	0	106.9	G241 D245	G241-V243 PolarHBondContact O-N 3.36Å; V243-D245 PolarHBondContact O-N 3.2Å
244	R	46.7	Very low	60.6	Low	209 Å²	209	111.1 Å²	111.1	79%	0.789	59%	0.594	S	S	*	*			trans	-81.8	100.3	171.9	-77.7	-171.2	178.1	-173.5	0.8	106.2	R242 I246	R242-R244 PolarHBondContact O-N 3.34Å; R244-I246 PolarHBondContact O-N 3.25Å
245	D	60.7	Low	63.1	Low	138 Å²	138	108.8 Å²	108.8	74%	0.738	58%	0.579	S	S	*	*			trans	-55.5	114.4	173.9	-69.4	-37.2	0	0	0	109.7	V243 Q247	V243-D245 PolarHBondContact O-N 3.2Å; D245-Q247 PolarHBondContact O-N 3.45Å
246	I	70	Confident	65.8	Low	75 Å²	75	104.1 Å²	104.1	39%	0.385	55%	0.549	S	S	.	.			trans	-61.7	114.7	173.3	-63.2	172.3	0	0	0	107	P228 E230 R244	P228-I246 WeakPolarHBondContact O-CD1 3.26Å; E230-I246 HydrophobicContact CB-CD1 4.13Å; R244-I246 PolarHBondContact O-N 3.25Å
247	Q	81.2	Confident	68.2	Low	90 Å²	90	96.1 Å²	96.1	42%	0.421	51%	0.506	S	S	.	.			trans	-62.1	135.1	-179.8	-69.6	-176.2	-9.6	0	0	110.5	D245 V249	D245-Q247 PolarHBondContact O-N 3.45Å; Q247-V249 VanDerWaalsContact C-N 3.27Å; Q247-V249 PolarHBondContact O-N 3.45Å
248	P	82.9	Confident	70.9	Confident	37 Å²	37	95.1 Å²	95.1	24%	0.24	49%	0.489	C	S	.	.	S	Bend	trans	-58.6	-39.2	179.7	-24.5	32.5	0	0	0	113.2	A224 M279	A224-P248 WeakPolarHBondContact CA-O 3.35Å; A224-P248 HydrophobicContact CB-CB 4.2Å; P248-M279 HydrophobicContact CB-CB 3.96Å; P248-M279 HydrophobicContact CB-CG 4Å; P248-M279 HydrophobicContact CG-CB 4.44Å; P248-M279 VanDerWaalsContact CG-O 3.25Å; P248-M279 WeakPolarHBondContact CG-O 3.21Å
249	V	87.8	Confident	73.3	Confident	5 Å²	5	96.6 Å²	96.6	3%	0.03	48%	0.476	C	S	.	.	S	Bend	trans	-143.6	143.9	177.7	176.6	0	0	0	0	107.7	C220 A224 Q247 Q251 L253 Q254 L257 M279	C220-V249 HydrophobicContact CB-CG2 4.34Å; A224-V249 HydrophobicContact CB-CG2 4.06Å; Q247-V249 VanDerWaalsContact C-N 3.27Å; Q247-V249 PolarHBondContact O-N 3.45Å; V249-Q251 PolarHBondContact O-N 3.03Å; V249-L253 HydrophobicContact CG1-CB 3.85Å; V249-L253 HydrophobicContact CG1-CD1 4.05Å; V249-Q254 PolarHBondContact O-NE2 2.98Å; V249-L257 HydrophobicContact CG1-CD1 3.94Å; V249-M279 HydrophobicContact CB-CG 4.45Å; V249-M279 HydrophobicContact CB-SD 3.78Å; V249-M279 HydrophobicContact CG2-CG 3.71Å; V249-M279 HydrophobicContact CG2-SD 3.53Å; V249-M279 VanDerWaalsContact CG2-SD 3.53Å
250	P	88.4	Confident	76	Confident	48 Å²	48	88.5 Å²	88.5	31%	0.312	44%	0.44	S	S	.	.			trans	-49.9	134.9	175.7	-28.2	34.3	0	0	0	113.1	I198 E252 L253	I198-P250 HydrophobicContact CD1-CB 4.09Å; I198-P250 HydrophobicContact CD1-CG 3.75Å; I198-P250 HydrophobicContact CG1-CG 4.04Å; I198-P250 HydrophobicContact CG2-CB 4.39Å; P250-E252 PolarHBondContact O-N 3.34Å; P250-E252 VanDerWaalsContact O-N 3.07Å; P250-L253 HydrophobicContact CB-CG 4.5Å; P250-L253 HydrophobicContact CG-CD1 4.37Å; P250-L253 PolarHBondContact O-N 3.37Å
251	Q	87	Confident	78.7	Confident	128 Å²	128	77 Å²	77	60%	0.598	39%	0.394	S	S	*	.	G	3₁₀ helix	trans	-47.6	-38.7	-179.8	-89.3	169.9	-1.1	0	0	113.8	V249 L253 Q254 P255	V249-Q251 PolarHBondContact O-N 3.03Å; Q251-L253 PolarHBondContact O-N 3.27Å; Q251-Q254 PolarHBondContact O-N 3.19Å; Q251-P255 VanDerWaalsContact O-CD 3.29Å; Q251-P255 WeakPolarHBondContact O-CD 3.38Å
252	E	89.1	Confident	81.5	Confident	105 Å²	105	78.4 Å²	78.4	49%	0.491	39%	0.386	S	S	.	.	G	3₁₀ helix	trans	-64.4	-24.5	-178.2	-61.2	180	-148.3	0	0	114.4	K202 P250	K202-E252 IonicContact NZ-OE2 3.82Å; K202-E252 PolarHBondContact NZ-OE2 3.1Å; P250-E252 PolarHBondContact O-N 3.34Å; P250-E252 VanDerWaalsContact O-N 3.07Å
253	L	91.9	Very high	84.1	Confident	1 Å²	1	68.2 Å²	68.2	1%	0.005	35%	0.349	C	S	.	.	G	3₁₀ helix	trans	-89.8	-21.3	-179.4	-58.8	179.3	0	0	0	112	I198 L201 K202 L205 V249 P250 Q251 L256 L257	I198-L253 HydrophobicContact CG2-CD1 4.35Å; I198-L253 HydrophobicContact CG2-CD2 4.32Å; I198-L253 HydrophobicContact CG2-CG 4.25Å; L201-L253 HydrophobicContact CB-CD1 4.04Å; L201-L253 HydrophobicContact CB-CD2 4.2Å; L201-L253 HydrophobicContact CD1-CD1 3.88Å; K202-L253 HydrophobicContact CB-CD2 4.02Å; L205-L253 HydrophobicContact CD1-CD2 4.08Å; V249-L253 HydrophobicContact CG1-CB 3.85Å; V249-L253 HydrophobicContact CG1-CD1 4.05Å; P250-L253 HydrophobicContact CB-CG 4.5Å; P250-L253 HydrophobicContact CG-CD1 4.37Å; P250-L253 PolarHBondContact O-N 3.37Å; Q251-L253 PolarHBondContact O-N 3.27Å; L253-L256 PolarHBondContact O-N 3.39Å; L253-L256 VanDerWaalsContact O-N 3.14Å; L253-L257 WeakPolarHBondContact O-CG 3.36Å; L253-L257 PolarHBondContact O-N 3.03Å
254	Q	91.1	Very high	86.7	Confident	71 Å²	71	68.4 Å²	68.4	33%	0.332	35%	0.352	S	S	.	.	H	α-helix	trans	-58.7	-44.7	-175.1	-60.8	179.5	7.4	0	0	113.4	V249 Q251 L256 L257 L258	V249-Q254 PolarHBondContact O-NE2 2.98Å; Q251-Q254 PolarHBondContact O-N 3.19Å; Q254-L256 VanDerWaalsContact C-N 3.3Å; Q254-L256 PolarHBondContact O-N 2.68Å; Q254-L257 PolarHBondContact O-N 2.75Å; Q254-L258 PolarHBondContact O-N 3.2Å
255	P	93	Very high	89	Confident	73 Å²	73	60.7 Å²	60.7	47%	0.474	33%	0.328	S	S	.	.	H	α-helix	trans	-62.3	-37.3	176.9	-23	34.3	0	0	0	112.7	Q251 L258 L259	Q251-P255 VanDerWaalsContact O-CD 3.29Å; Q251-P255 WeakPolarHBondContact O-CD 3.38Å; P255-L258 PolarHBondContact O-N 2.91Å; P255-L259 WeakPolarHBondContact O-CG 3.47Å; P255-L259 PolarHBondContact O-N 3.4Å
256	L	93.3	Very high	90.6	Very high	27 Å²	27	61.1 Å²	61.1	14%	0.141	32%	0.323	C	S	.	.	H	α-helix	trans	-69.3	-36.9	178.7	-60.5	179	0	0	0	111.7	K202 L205 K206 L253 Q254 L258 L259 A260	K202-L256 HydrophobicContact CG-CD1 3.82Å; L205-L256 HydrophobicContact CB-CB 4.37Å; L205-L256 HydrophobicContact CB-CD1 4.27Å; L205-L256 HydrophobicContact CD1-CB 3.84Å; L205-L256 HydrophobicContact CD1-CD1 4.1Å; K206-L256 VanDerWaalsContact CE-CD2 3.46Å; K206-L256 HydrophobicContact CG-CD2 4.41Å; L253-L256 PolarHBondContact O-N 3.39Å; L253-L256 VanDerWaalsContact O-N 3.14Å; Q254-L256 VanDerWaalsContact C-N 3.3Å; Q254-L256 PolarHBondContact O-N 2.68Å; L256-L258 VanDerWaalsContact C-N 3.35Å; L256-L259 HydrophobicContact CD2-CD1 4.44Å; L256-L259 PolarHBondContact O-N 3.36Å; L256-A260 WeakPolarHBondContact O-CB 2.87Å; L256-A260 PolarHBondContact O-N 3.39Å
257	L	94	Very high	91.7	Very high	0 Å²	0	60.8 Å²	60.8	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-68.4	-33.5	175	-67.3	173.9	0	0	0	112.5	L205 I217 C220 V249 L253 Q254 M279	L205-L257 HydrophobicContact CD1-CD2 4.4Å; L205-L257 HydrophobicContact CD2-CD2 4.11Å; I217-L257 HydrophobicContact CB-CD2 4.35Å; I217-L257 HydrophobicContact CG1-CD2 3.97Å; I217-L257 HydrophobicContact CG2-CD2 4.1Å; C220-L257 HydrophobicContact CB-CD1 4.28Å; C220-L257 HydrophobicContact CB-CD2 4.34Å; V249-L257 HydrophobicContact CG1-CD1 3.94Å; L253-L257 WeakPolarHBondContact O-CG 3.36Å; L253-L257 PolarHBondContact O-N 3.03Å; Q254-L257 PolarHBondContact O-N 2.75Å; L257-M279 HydrophobicContact CD1-CE 4.4Å; L257-M279 HydrophobicContact CD1-SD 3.96Å
258	L	93.8	Very high	92.3	Very high	63 Å²	63	56.5 Å²	56.5	33%	0.33	30%	0.298	S	S	.	.	H	α-helix	trans	-70.5	-41.5	173.2	-73	170.8	0	0	0	111.8	Q254 P255 L256 A260 L261 D283	Q254-L258 PolarHBondContact O-N 3.2Å; P255-L258 PolarHBondContact O-N 2.91Å; L256-L258 VanDerWaalsContact C-N 3.35Å; L258-A260 PolarHBondContact O-N 3.14Å; L258-L261 HydrophobicContact CD2-CD1 4.17Å; L258-L261 WeakPolarHBondContact O-CB 3.22Å; L258-L261 PolarHBondContact O-N 3.07Å; L258-D283 HydrophobicContact CD2-CB 4.49Å
259	L	93.9	Very high	93	Very high	118 Å²	118	57.1 Å²	57.1	62%	0.618	30%	0.297	S	S	*	.	H	α-helix	trans	-62.2	-33.5	174.3	-73.1	169.3	0	0	0	112.2	P255 L256 L261 D262	P255-L259 WeakPolarHBondContact O-CG 3.47Å; P255-L259 PolarHBondContact O-N 3.4Å; L256-L259 HydrophobicContact CD2-CD1 4.44Å; L256-L259 PolarHBondContact O-N 3.36Å; L259-L261 PolarHBondContact O-N 3.47Å; L259-D262 PolarHBondContact O-N 3.4Å; L259-D262 VanDerWaalsContact O-N 3.11Å
260	A	94.9	Very high	93.3	Very high	10 Å²	10	57.2 Å²	57.2	8%	0.083	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	-66.9	-13.4	178.4	0	0	0	0	0	114.3	I217 L256 L258 D262 D263 V268 A272	I217-A260 HydrophobicContact CD1-CB 3.7Å; L256-A260 WeakPolarHBondContact O-CB 2.87Å; L256-A260 PolarHBondContact O-N 3.39Å; L258-A260 PolarHBondContact O-N 3.14Å; A260-D262 PolarHBondContact O-N 3.14Å; A260-D263 WeakPolarHBondContact O-CB 3.4Å; A260-D263 PolarHBondContact O-N 3.31Å; A260-V268 HydrophobicContact CB-CG1 4.48Å; A260-A272 HydrophobicContact CB-CB 3.81Å
261	L	95.3	Very high	93.7	Very high	2 Å²	2	54.9 Å²	54.9	1%	0.01	28%	0.282	C	S	.	.	G	3₁₀ helix	trans	-66.6	-26.9	171.5	-66.9	169.7	0	0	0	112.1	L258 L259 Q269 A272 A273 Q276 D283 R285 A286 I289	L258-L261 HydrophobicContact CD2-CD1 4.17Å; L258-L261 WeakPolarHBondContact O-CB 3.22Å; L258-L261 PolarHBondContact O-N 3.07Å; L259-L261 PolarHBondContact O-N 3.47Å; L261-Q269 WeakPolarHBondContact O-CG 3.4Å; L261-A272 HydrophobicContact CD2-CB 3.77Å; L261-A272 HydrophobicContact CG-CB 4.17Å; L261-A273 HydrophobicContact CD2-CB 4.22Å; L261-Q276 HydrophobicContact CD1-CG 4.33Å; L261-Q276 HydrophobicContact CD2-CG 4.4Å; L261-D283 HydrophobicContact CD1-CB 3.98Å; L261-R285 HydrophobicContact CD1-CB 4.45Å; L261-A286 HydrophobicContact CD1-CB 4.49Å; L261-A286 HydrophobicContact CD2-CB 3.87Å; L261-I289 HydrophobicContact CB-CD1 4.43Å; L261-I289 HydrophobicContact CD2-CD1 3.93Å
262	D	95	Very high	94.1	Very high	100 Å²	100	48.8 Å²	48.8	54%	0.535	25%	0.254	S	S	.	.	G	3₁₀ helix	trans	-103.4	17.2	179.6	-58.5	-52.3	0	0	0	111.8	L259 A260 R285	L259-D262 PolarHBondContact O-N 3.4Å; L259-D262 VanDerWaalsContact O-N 3.11Å; A260-D262 PolarHBondContact O-N 3.14Å; D262-R285 IonicContact OD2-CZ 3.75Å; D262-R285 IonicContact OD2-NH1 3.44Å; D262-R285 PolarHBondContact OD2-NH1 2.86Å
263	D	96.3	Very high	94.5	Very high	17 Å²	17	43.8 Å²	43.8	9%	0.091	23%	0.231	C	C	.	.			trans	-60.6	142.3	178.2	-169.2	-77	0	0	0	111.1	R213 A260 V265 V268 Q269	R213-D263 IonicContact CZ-OD1 2.78Å; R213-D263 IonicContact CZ-OD2 2.79Å; R213-D263 IonicContact NE-OD2 3.28Å; R213-D263 PolarHBondContact NE-OD2 2.89Å; R213-D263 VanDerWaalsContact NH2-CG 3.34Å; R213-D263 IonicContact NH2-OD1 3.36Å; R213-D263 PolarHBondContact NH2-OD1 3.34Å; R213-D263 IonicContact NH2-OD2 3.55Å; R213-D263 PolarHBondContact NH2-OD2 3.41Å; A260-D263 WeakPolarHBondContact O-CB 3.4Å; A260-D263 PolarHBondContact O-N 3.31Å; D263-V265 PolarHBondContact O-N 2.95Å; D263-V265 WeakPolarHBondContact OD1-CB 3.39Å; D263-V265 PolarHBondContact OD1-N 2.88Å; D263-V268 HydrophobicContact CB-CB 3.94Å; D263-V268 HydrophobicContact CB-CG1 3.76Å; D263-V268 WeakPolarHBondContact OD2-CG1 3.29Å; D263-Q269 HydrophobicContact CB-CG 4.27Å; D263-Q269 VanDerWaalsContact O-CD 3.31Å; D263-Q269 VanDerWaalsContact O-CG 3.24Å; D263-Q269 WeakPolarHBondContact O-CG 3.48Å; D263-Q269 PolarHBondContact O-NE2 3.45Å
264	P	94.1	Very high	94.7	Very high	119 Å²	119	43.8 Å²	43.8	77%	0.773	23%	0.23	S	C	*	.	S	Bend	trans	-59.2	-22.7	178.8	23.4	-36	0	0	0	113.9
265	V	95.4	Very high	94.9	Very high	48 Å²	48	40.4 Å²	40.4	29%	0.291	21%	0.214	S	C	.	.	S	Bend	trans	-98	114.4	-178.3	-177.7	0	0	0	0	110.6	Y210 D263 R267 V268 Q269	Y210-V265 HydrophobicContact CD2-CG1 4.18Å; Y210-V265 HydrophobicContact CG-CG1 4.32Å; Y210-V265 HydrophobicContact CG-CG2 4.4Å; D263-V265 PolarHBondContact O-N 2.95Å; D263-V265 WeakPolarHBondContact OD1-CB 3.39Å; D263-V265 PolarHBondContact OD1-N 2.88Å; V265-R267 HydrophobicContact CG1-CB 4.27Å; V265-R267 PolarHBondContact O-N 3.07Å; V265-V268 HydrophobicContact CB-CB 4.39Å; V265-V268 HydrophobicContact CB-CG2 3.95Å; V265-V268 HydrophobicContact CG1-CG2 4.16Å; V265-V268 WeakPolarHBondContact O-CA 3.38Å; V265-V268 WeakPolarHBondContact O-CB 3.24Å; V265-V268 PolarHBondContact O-N 3.49Å; V265-Q269 PolarHBondContact O-N 3.3Å; V265-Q269 VanDerWaalsContact O-N 3.15Å
266	K	93.8	Very high	95.1	Very high	146 Å²	146	37.2 Å²	37.2	64%	0.635	19%	0.193	S	C	*	.	H	α-helix	trans	-49.1	-35.7	179	-65.6	-176.3	179	180	0	114.5	Q269 M270	K266-Q269 WeakPolarHBondContact O-CB 3.27Å; K266-Q269 PolarHBondContact O-N 3.2Å; K266-M270 WeakPolarHBondContact O-CB 3.27Å; K266-M270 PolarHBondContact O-N 3.05Å
267	R	92.8	Very high	95.1	Very high	69 Å²	69	36.3 Å²	36.3	26%	0.26	19%	0.188	S	C	.	.	H	α-helix	trans	-70.2	-32	179.3	-168.4	168.8	173.6	-162.8	-13	112.9	L214 V265 A271	L214-R267 HydrophobicContact CD1-CG 4.28Å; L214-R267 HydrophobicContact CD2-CG 4.07Å; V265-R267 HydrophobicContact CG1-CB 4.27Å; V265-R267 PolarHBondContact O-N 3.07Å; R267-A271 PolarHBondContact O-N 3.38Å; R267-A271 VanDerWaalsContact O-N 3.11Å
268	V	95.1	Very high	95.1	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-71.9	-42.3	173.1	-178.3	0	0	0	0	109.5	R213 L214 I217 A260 D263 V265 M270 A271 A272	R213-V268 HydrophobicContact CB-CG1 4.33Å; L214-V268 HydrophobicContact CB-CG2 4.44Å; I217-V268 HydrophobicContact CD1-CG1 3.52Å; A260-V268 HydrophobicContact CB-CG1 4.48Å; D263-V268 HydrophobicContact CB-CB 3.94Å; D263-V268 HydrophobicContact CB-CG1 3.76Å; D263-V268 WeakPolarHBondContact OD2-CG1 3.29Å; V265-V268 HydrophobicContact CB-CB 4.39Å; V265-V268 HydrophobicContact CB-CG2 3.95Å; V265-V268 HydrophobicContact CG1-CG2 4.16Å; V265-V268 WeakPolarHBondContact O-CA 3.38Å; V265-V268 WeakPolarHBondContact O-CB 3.24Å; V265-V268 PolarHBondContact O-N 3.49Å; V268-M270 VanDerWaalsContact C-N 3.3Å; V268-M270 PolarHBondContact O-N 3.37Å; V268-A271 WeakPolarHBondContact O-CB 3.27Å; V268-A271 PolarHBondContact O-N 2.88Å; V268-A272 WeakPolarHBondContact O-CB 3.37Å; V268-A272 PolarHBondContact O-N 3.08Å
269	Q	96.3	Very high	95	Very high	50 Å²	50	33.7 Å²	33.7	23%	0.234	18%	0.175	C	C	.	.	H	α-helix	trans	-56.4	-44.5	172.4	-57	-179.3	-22.2	0	0	111.6	L261 D263 V265 K266 A272 A273 I289	L261-Q269 WeakPolarHBondContact O-CG 3.4Å; D263-Q269 HydrophobicContact CB-CG 4.27Å; D263-Q269 VanDerWaalsContact O-CD 3.31Å; D263-Q269 VanDerWaalsContact O-CG 3.24Å; D263-Q269 WeakPolarHBondContact O-CG 3.48Å; D263-Q269 PolarHBondContact O-NE2 3.45Å; V265-Q269 PolarHBondContact O-N 3.3Å; V265-Q269 VanDerWaalsContact O-N 3.15Å; K266-Q269 WeakPolarHBondContact O-CB 3.27Å; K266-Q269 PolarHBondContact O-N 3.2Å; Q269-A272 WeakPolarHBondContact O-CB 3.37Å; Q269-A272 PolarHBondContact O-N 3.39Å; Q269-A273 WeakPolarHBondContact O-CB 3.44Å; Q269-A273 PolarHBondContact O-N 3.4Å; Q269-I289 HydrophobicContact CB-CD1 3.96Å
270	M	95.9	Very high	94.7	Very high	6 Å²	6	30.7 Å²	30.7	3%	0.03	17%	0.172	C	C	.	.	H	α-helix	trans	-61.1	-45.3	177.1	-177.1	51.8	149.5	0	0	112.2	K266 V268 A272 A273 V274 I289 L290 A293 D304 V307 A308	K266-M270 WeakPolarHBondContact O-CB 3.27Å; K266-M270 PolarHBondContact O-N 3.05Å; V268-M270 VanDerWaalsContact C-N 3.3Å; V268-M270 PolarHBondContact O-N 3.37Å; M270-A272 VanDerWaalsContact C-N 3.33Å; M270-A272 PolarHBondContact O-N 2.85Å; M270-A273 PolarHBondContact O-N 3.16Å; M270-V274 WeakPolarHBondContact O-CG2 3.28Å; M270-V274 PolarHBondContact O-N 3.31Å; M270-V274 HydrophobicContact SD-CG2 4.43Å; M270-I289 HydrophobicContact SD-CG2 4.16Å; M270-L290 HydrophobicContact CE-CD2 4.08Å; M270-L290 HydrophobicContact SD-CD2 3.59Å; M270-L290 VanDerWaalsContact SD-CD2 3.59Å; M270-A293 HydrophobicContact CE-CB 3.42Å; M270-A293 VanDerWaalsContact CE-CB 3.42Å; M270-A293 HydrophobicContact SD-CB 4.31Å; M270-D304 VanDerWaalsContact CE-C 3.46Å; M270-D304 HydrophobicContact CE-CB 3.5Å; M270-D304 WeakPolarHBondContact CE-O 3.49Å; M270-V307 HydrophobicContact CE-CG1 4.18Å; M270-A308 HydrophobicContact CE-CB 4.2Å
271	A	96	Very high	94.2	Very high	0 Å²	0	34 Å²	34	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-61.8	-41.8	175.3	0	0	0	0	0	112.4	W183 L214 I217 R267 V268 A273 V274 C275	W183-A271 HydrophobicContact CH2-CB 3.57Å; W183-A271 HydrophobicContact CZ2-CB 4.21Å; L214-A271 HydrophobicContact CD1-CB 3.38Å; I217-A271 HydrophobicContact CB-CB 4.17Å; I217-A271 HydrophobicContact CG2-CB 3.82Å; I217-A271 VanDerWaalsContact CG2-O 3.25Å; I217-A271 WeakPolarHBondContact CG2-O 3.44Å; R267-A271 PolarHBondContact O-N 3.38Å; R267-A271 VanDerWaalsContact O-N 3.11Å; V268-A271 WeakPolarHBondContact O-CB 3.27Å; V268-A271 PolarHBondContact O-N 2.88Å; A271-A273 VanDerWaalsContact C-N 3.34Å; A271-V274 PolarHBondContact O-N 2.92Å; A271-C275 WeakPolarHBondContact O-CB 3.35Å; A271-C275 PolarHBondContact O-N 3.26Å
272	A	96.2	Very high	93.7	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-62.5	-43.7	176.9	0	0	0	0	0	110.5	I217 A260 L261 V268 Q269 M270 C275 Q276	I217-A272 HydrophobicContact CD1-CB 4.39Å; A260-A272 HydrophobicContact CB-CB 3.81Å; L261-A272 HydrophobicContact CD2-CB 3.77Å; L261-A272 HydrophobicContact CG-CB 4.17Å; V268-A272 WeakPolarHBondContact O-CB 3.37Å; V268-A272 PolarHBondContact O-N 3.08Å; Q269-A272 WeakPolarHBondContact O-CB 3.37Å; Q269-A272 PolarHBondContact O-N 3.39Å; M270-A272 VanDerWaalsContact C-N 3.33Å; M270-A272 PolarHBondContact O-N 2.85Å; A272-C275 WeakPolarHBondContact O-CB 3.48Å; A272-C275 PolarHBondContact O-N 3.05Å; A272-Q276 WeakPolarHBondContact O-CG 3.33Å; A272-Q276 PolarHBondContact O-N 3.36Å
273	A	97	Very high	93.5	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-60.9	-48.8	176.2	0	0	0	0	0	112.2	L261 Q269 M270 A271 C275 Q276 Y277 A286 I289 L290	L261-A273 HydrophobicContact CD2-CB 4.22Å; Q269-A273 WeakPolarHBondContact O-CB 3.44Å; Q269-A273 PolarHBondContact O-N 3.4Å; M270-A273 PolarHBondContact O-N 3.16Å; A271-A273 VanDerWaalsContact C-N 3.34Å; A273-C275 VanDerWaalsContact C-N 3.26Å; A273-C275 PolarHBondContact O-N 3.49Å; A273-Q276 PolarHBondContact O-N 2.85Å; A273-Q276 VanDerWaalsContact O-N 3.15Å; A273-Y277 WeakPolarHBondContact O-CD2 3.42Å; A273-Y277 PolarHBondContact O-N 2.94Å; A273-A286 HydrophobicContact CB-CB 3.9Å; A273-I289 HydrophobicContact CB-CB 4.04Å; A273-I289 HydrophobicContact CB-CD1 4.38Å; A273-I289 HydrophobicContact CB-CG2 3.91Å; A273-L290 HydrophobicContact CB-CD2 3.9Å; A273-L290 HydrophobicContact CB-CG 4.13Å
274	V	96.4	Very high	93.4	Very high	0 Å²	0	37 Å²	37	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-58.4	-40	174.7	172.7	0	0	0	0	111.1	V180 W183 M270 A271 Y277 A278 L290 V307	V180-V274 HydrophobicContact CG2-CG1 3.94Å; W183-V274 HydrophobicContact CE3-CG1 4.3Å; M270-V274 WeakPolarHBondContact O-CG2 3.28Å; M270-V274 PolarHBondContact O-N 3.31Å; M270-V274 HydrophobicContact SD-CG2 4.43Å; A271-V274 PolarHBondContact O-N 2.92Å; V274-Y277 PolarHBondContact O-N 3.34Å; V274-A278 WeakPolarHBondContact O-CB 3.35Å; V274-A278 PolarHBondContact O-N 2.84Å; V274-L290 HydrophobicContact CG2-CD2 4.2Å; V274-V307 HydrophobicContact CG1-CG2 3.99Å; V274-V307 HydrophobicContact CG2-CG1 3.72Å; V274-V307 HydrophobicContact CG2-CG2 3.98Å
275	C	95.4	Very high	93.4	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-63.3	-40.8	176.7	-167.2	0	0	0	0	112.3	I217 A221 A271 A272 A273 Y277 A278 M279	I217-C275 HydrophobicContact CG2-CB 3.77Å; A221-C275 HydrophobicContact CB-CB 3.97Å; A271-C275 WeakPolarHBondContact O-CB 3.35Å; A271-C275 PolarHBondContact O-N 3.26Å; A272-C275 WeakPolarHBondContact O-CB 3.48Å; A272-C275 PolarHBondContact O-N 3.05Å; A273-C275 VanDerWaalsContact C-N 3.26Å; A273-C275 PolarHBondContact O-N 3.49Å; C275-Y277 VanDerWaalsContact C-N 3.34Å; C275-Y277 PolarHBondContact O-N 3.17Å; C275-A278 WeakPolarHBondContact O-CB 3.4Å; C275-A278 PolarHBondContact O-N 3.01Å; C275-M279 VanDerWaalsContact O-CG 3.27Å; C275-M279 WeakPolarHBondContact O-CG 3.36Å; C275-M279 PolarHBondContact O-N 3.24Å
276	Q	95.4	Very high	93.4	Very high	6 Å²	6	33.2 Å²	33.2	3%	0.028	18%	0.182	C	C	.	.	H	α-helix	trans	-60.4	-42.5	175.8	-66.5	-60.5	-27.7	0	0	112.1	L261 A272 A273 M279 G280 T281 A286	L261-Q276 HydrophobicContact CD1-CG 4.33Å; L261-Q276 HydrophobicContact CD2-CG 4.4Å; A272-Q276 WeakPolarHBondContact O-CG 3.33Å; A272-Q276 PolarHBondContact O-N 3.36Å; A273-Q276 PolarHBondContact O-N 2.85Å; A273-Q276 VanDerWaalsContact O-N 3.15Å; Q276-M279 VanDerWaalsContact CD-CE 3.4Å; Q276-M279 HydrophobicContact CG-CE 4.45Å; Q276-M279 PolarHBondContact O-N 3.44Å; Q276-G280 PolarHBondContact O-N 2.83Å; Q276-G280 VanDerWaalsContact O-N 3.16Å; Q276-T281 PolarHBondContact O-N 3.47Å; Q276-T281 PolarHBondContact OE1-O 2.78Å; Q276-A286 HydrophobicContact CB-CB 4.07Å; Q276-A286 HydrophobicContact CG-CB 4.19Å
277	Y	94.5	Very high	93.4	Very high	8 Å²	8	29.9 Å²	29.9	3%	0.031	17%	0.166	C	C	.	.	H	α-helix	trans	-69.2	-36.3	175.8	-82.6	-102.1	0	0	0	112.6	A273 V274 C275 M279 G280 P282 A286 R287 L290 C311 L312 E315	A273-Y277 WeakPolarHBondContact O-CD2 3.42Å; A273-Y277 PolarHBondContact O-N 2.94Å; V274-Y277 PolarHBondContact O-N 3.34Å; C275-Y277 VanDerWaalsContact C-N 3.34Å; C275-Y277 PolarHBondContact O-N 3.17Å; Y277-M279 VanDerWaalsContact C-N 3.29Å; Y277-M279 PolarHBondContact O-N 3.06Å; Y277-G280 PolarHBondContact O-N 3.21Å; Y277-P282 HydrophobicContact CD2-CB 4.39Å; Y277-P282 HydrophobicContact CE1-CB 4.23Å; Y277-P282 HydrophobicContact CE2-CB 4.02Å; Y277-A286 HydrophobicContact CE2-CB 4.27Å; Y277-R287 WeakPolarHBondContact OH-CB 3.35Å; Y277-L290 HydrophobicContact CD1-CD1 4.36Å; Y277-L290 HydrophobicContact CD2-CD1 3.51Å; Y277-L290 HydrophobicContact CE1-CD1 4.27Å; Y277-L290 HydrophobicContact CE2-CD1 3.41Å; Y277-L290 VanDerWaalsContact CE2-CD1 3.41Å; Y277-L290 HydrophobicContact CE2-CG 4.29Å; Y277-L290 HydrophobicContact CG-CD1 4Å; Y277-C311 HydrophobicContact CD1-CB 3.75Å; Y277-C311 VanDerWaalsContact CD1-O 3.31Å; Y277-C311 WeakPolarHBondContact CD1-O 3.44Å; Y277-C311 HydrophobicContact CE1-CB 4.47Å; Y277-C311 HydrophobicContact CG-CB 3.82Å; Y277-L312 HydrophobicContact CE1-CD2 4.19Å; Y277-L312 VanDerWaalsContact OH-CD2 3.31Å; Y277-L312 WeakPolarHBondContact OH-CD2 3.44Å; Y277-E315 HydrophobicContact CD1-CB 4.11Å; Y277-E315 HydrophobicContact CE1-CB 3.7Å; Y277-E315 HydrophobicContact CE1-CG 4.01Å
278	A	93.6	Very high	93.6	Very high	1 Å²	1	30.5 Å²	30.5	1%	0.008	18%	0.177	C	C	.	.	H	α-helix	trans	-63.4	-34.6	172.9	0	0	0	0	0	112.8	V180 A221 A224 V225 V274 C275 G280	V180-A278 HydrophobicContact CG2-CB 4.19Å; A221-A278 HydrophobicContact CB-CB 4.16Å; A224-A278 HydrophobicContact CB-CB 4.18Å; V225-A278 HydrophobicContact CG1-CB 3.73Å; V274-A278 WeakPolarHBondContact O-CB 3.35Å; V274-A278 PolarHBondContact O-N 2.84Å; C275-A278 WeakPolarHBondContact O-CB 3.4Å; C275-A278 PolarHBondContact O-N 3.01Å; A278-G280 VanDerWaalsContact C-N 3.32Å
279	M	90.8	Very high	93.6	Very high	8 Å²	8	31.8 Å²	31.8	4%	0.039	18%	0.184	C	C	.	.	H	α-helix	trans	-73.3	-24.2	175.2	-68.1	-172.5	-49.3	0	0	112.8	A224 P248 V249 L257 C275 Q276 Y277	A224-M279 HydrophobicContact CB-CG 4.13Å; P248-M279 HydrophobicContact CB-CB 3.96Å; P248-M279 HydrophobicContact CB-CG 4Å; P248-M279 HydrophobicContact CG-CB 4.44Å; P248-M279 VanDerWaalsContact CG-O 3.25Å; P248-M279 WeakPolarHBondContact CG-O 3.21Å; V249-M279 HydrophobicContact CB-CG 4.45Å; V249-M279 HydrophobicContact CB-SD 3.78Å; V249-M279 HydrophobicContact CG2-CG 3.71Å; V249-M279 HydrophobicContact CG2-SD 3.53Å; V249-M279 VanDerWaalsContact CG2-SD 3.53Å; L257-M279 HydrophobicContact CD1-CE 4.4Å; L257-M279 HydrophobicContact CD1-SD 3.96Å; C275-M279 VanDerWaalsContact O-CG 3.27Å; C275-M279 WeakPolarHBondContact O-CG 3.36Å; C275-M279 PolarHBondContact O-N 3.24Å; Q276-M279 VanDerWaalsContact CD-CE 3.4Å; Q276-M279 HydrophobicContact CG-CE 4.45Å; Q276-M279 PolarHBondContact O-N 3.44Å; Y277-M279 VanDerWaalsContact C-N 3.29Å; Y277-M279 PolarHBondContact O-N 3.06Å
280	G	87.6	Confident	93.6	Very high	54 Å²	54	29.4 Å²	29.4	56%	0.557	17%	0.172	S	C	*	.	T	Hydrogen-bonded Turn	trans	83.9	14.2	-175.3	0	0	0	0	0	113.9	Q276 Y277 A278 P282	Q276-G280 PolarHBondContact O-N 2.83Å; Q276-G280 VanDerWaalsContact O-N 3.16Å; Y277-G280 PolarHBondContact O-N 3.21Å; A278-G280 VanDerWaalsContact C-N 3.32Å; G280-P282 VanDerWaalsContact C-CD 3.46Å; G280-P282 WeakPolarHBondContact O-CD 3.45Å
281	T	85.6	Confident	93.5	Very high	81 Å²	81	30.6 Å²	30.6	50%	0.497	18%	0.181	S	C	.	.			trans	-119.9	71.4	177.7	54.5	0	0	0	0	109.6	Q276 D283	Q276-T281 PolarHBondContact O-N 3.47Å; Q276-T281 PolarHBondContact OE1-O 2.78Å; T281-D283 PolarHBondContact O-N 3.24Å
282	P	84.9	Confident	93.4	Very high	55 Å²	55	34.3 Å²	34.3	36%	0.357	20%	0.201	S	C	.	.			trans	-66.8	125.8	-174.8	27.8	-34.3	0	0	0	111.5	Y277 G280 E315	Y277-P282 HydrophobicContact CD2-CB 4.39Å; Y277-P282 HydrophobicContact CE1-CB 4.23Å; Y277-P282 HydrophobicContact CE2-CB 4.02Å; G280-P282 VanDerWaalsContact C-CD 3.46Å; G280-P282 WeakPolarHBondContact O-CD 3.45Å; P282-E315 HydrophobicContact CG-CG 4.12Å
283	D	91.3	Very high	93.3	Very high	34 Å²	34	35.1 Å²	35.1	18%	0.182	21%	0.207	C	C	.	.			trans	-87.5	148.9	171.8	-175.1	-75.7	0	0	0	110.2	L258 L261 T281 R285 A286 R287	L258-D283 HydrophobicContact CD2-CB 4.49Å; L261-D283 HydrophobicContact CD1-CB 3.98Å; T281-D283 PolarHBondContact O-N 3.24Å; D283-R285 VanDerWaalsContact C-N 3.29Å; D283-R285 PolarHBondContact O-N 3.36Å; D283-R285 WeakPolarHBondContact OD1-CB 3.07Å; D283-R285 WeakPolarHBondContact OD1-CG 3.23Å; D283-R285 IonicContact OD1-CZ 2.7Å; D283-R285 PolarHBondContact OD1-N 3.02Å; D283-R285 IonicContact OD1-NE 3.18Å; D283-R285 PolarHBondContact OD1-NE 3.01Å; D283-R285 IonicContact OD1-NH2 2.82Å; D283-R285 IonicContact OD2-CZ 3.77Å; D283-R285 IonicContact OD2-NE 2.97Å; D283-R285 IonicContact OD2-NH2 2.82Å; D283-R285 PolarHBondContact OD2-NH2 2.95Å; D283-A286 HydrophobicContact CB-CB 4.12Å; D283-A286 WeakPolarHBondContact O-CB 3.4Å; D283-A286 PolarHBondContact O-N 3.1Å; D283-A286 VanDerWaalsContact O-N 3.14Å; D283-R287 PolarHBondContact O-N 2.82Å
284	S	92.6	Very high	93.1	Very high	91 Å²	91	35.9 Å²	35.9	64%	0.636	21%	0.212	S	C	*	.	H	α-helix	trans	-61.3	-36.2	179.2	57.5	0	0	0	0	112.5	R287 V288	S284-R287 PolarHBondContact O-N 3.23Å; S284-V288 WeakPolarHBondContact O-CG2 3.35Å; S284-V288 PolarHBondContact O-N 2.97Å; S284-V288 VanDerWaalsContact O-N 3.1Å
285	R	94.6	Very high	92.8	Very high	88 Å²	88	42.2 Å²	42.2	33%	0.332	24%	0.241	S	C	.	.	H	α-helix	trans	-66.6	-41.3	174.3	-61.7	167.6	-70.9	174.6	-4.5	111.1	L261 D262 D283 R287 V288 I289	L261-R285 HydrophobicContact CD1-CB 4.45Å; D262-R285 IonicContact OD2-CZ 3.75Å; D262-R285 IonicContact OD2-NH1 3.44Å; D262-R285 PolarHBondContact OD2-NH1 2.86Å; D283-R285 VanDerWaalsContact C-N 3.29Å; D283-R285 PolarHBondContact O-N 3.36Å; D283-R285 WeakPolarHBondContact OD1-CB 3.07Å; D283-R285 WeakPolarHBondContact OD1-CG 3.23Å; D283-R285 IonicContact OD1-CZ 2.7Å; D283-R285 PolarHBondContact OD1-N 3.02Å; D283-R285 IonicContact OD1-NE 3.18Å; D283-R285 PolarHBondContact OD1-NE 3.01Å; D283-R285 IonicContact OD1-NH2 2.82Å; D283-R285 IonicContact OD2-CZ 3.77Å; D283-R285 IonicContact OD2-NE 2.97Å; D283-R285 IonicContact OD2-NH2 2.82Å; D283-R285 PolarHBondContact OD2-NH2 2.95Å; R285-R287 VanDerWaalsContact C-N 3.31Å; R285-R287 PolarHBondContact O-N 3.4Å; R285-V288 PolarHBondContact O-N 3.41Å; R285-I289 WeakPolarHBondContact O-CG1 3.28Å; R285-I289 PolarHBondContact O-N 2.98Å
286	A	95.1	Very high	92.5	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-59.3	-43.4	175.2	0	0	0	0	0	111.2	L261 A273 Q276 Y277 D283 V288 I289 L290	L261-A286 HydrophobicContact CD1-CB 4.49Å; L261-A286 HydrophobicContact CD2-CB 3.87Å; A273-A286 HydrophobicContact CB-CB 3.9Å; Q276-A286 HydrophobicContact CB-CB 4.07Å; Q276-A286 HydrophobicContact CG-CB 4.19Å; Y277-A286 HydrophobicContact CE2-CB 4.27Å; D283-A286 HydrophobicContact CB-CB 4.12Å; D283-A286 WeakPolarHBondContact O-CB 3.4Å; D283-A286 PolarHBondContact O-N 3.1Å; D283-A286 VanDerWaalsContact O-N 3.14Å; A286-V288 PolarHBondContact O-N 3.35Å; A286-I289 PolarHBondContact O-N 3.35Å; A286-L290 WeakPolarHBondContact O-CG 3.46Å; A286-L290 PolarHBondContact O-N 3.2Å
287	R	95.2	Very high	92	Very high	76 Å²	76	49.8 Å²	49.8	29%	0.287	28%	0.277	S	S	.	.	H	α-helix	trans	-58.6	-46.7	174.2	-174.5	-178.3	-68.1	-96	3.4	111.7	Y277 D283 S284 R285 I289 L290 C291 L312 E315 D317	Y277-R287 WeakPolarHBondContact OH-CB 3.35Å; D283-R287 PolarHBondContact O-N 2.82Å; S284-R287 PolarHBondContact O-N 3.23Å; R285-R287 VanDerWaalsContact C-N 3.31Å; R285-R287 PolarHBondContact O-N 3.4Å; R287-I289 VanDerWaalsContact C-N 3.33Å; R287-I289 PolarHBondContact O-N 2.91Å; R287-L290 PolarHBondContact O-N 2.96Å; R287-C291 WeakPolarHBondContact O-CB 3.35Å; R287-C291 PolarHBondContact O-N 2.82Å; R287-C291 PolarHBondContact O-SG 2.7Å; R287-C291 VanDerWaalsContact O-SG 3.34Å; R287-L312 HydrophobicContact CG-CD2 4.07Å; R287-E315 IonicContact CZ-OE2 3.08Å; R287-E315 IonicContact NH1-OE2 3.43Å; R287-E315 PolarHBondContact NH1-OE2 2.85Å; R287-E315 IonicContact NH2-OE1 2.92Å; R287-E315 PolarHBondContact NH2-OE1 3.38Å; R287-E315 IonicContact NH2-OE2 2.76Å; R287-E315 PolarHBondContact NH2-OE2 3.22Å; R287-D317 IonicContact NH1-OD2 3.67Å; R287-D317 PolarHBondContact NH1-OD2 3.36Å
288	V	95.6	Very high	91.2	Very high	83 Å²	83	55.6 Å²	55.6	50%	0.503	32%	0.319	S	S	.	.	H	α-helix	trans	-59.9	-42.7	178.2	172.2	0	0	0	0	111.5	S284 R285 A286 C291 N292	S284-V288 WeakPolarHBondContact O-CG2 3.35Å; S284-V288 PolarHBondContact O-N 2.97Å; S284-V288 VanDerWaalsContact O-N 3.1Å; R285-V288 PolarHBondContact O-N 3.41Å; A286-V288 PolarHBondContact O-N 3.35Å; V288-C291 PolarHBondContact O-N 2.66Å; V288-N292 WeakPolarHBondContact O-CB 3.38Å; V288-N292 PolarHBondContact O-N 3.03Å; V288-N292 PolarHBondContact O-ND2 2.96Å
289	I	96	Very high	90.4	Very high	26 Å²	26	59.2 Å²	59.2	13%	0.133	35%	0.349	C	S	.	.	H	α-helix	trans	-60.8	-48.2	177.1	-67.7	158.5	0	0	0	111	L261 Q269 M270 A273 R285 A286 R287 N292 A293	L261-I289 HydrophobicContact CB-CD1 4.43Å; L261-I289 HydrophobicContact CD2-CD1 3.93Å; Q269-I289 HydrophobicContact CB-CD1 3.96Å; M270-I289 HydrophobicContact SD-CG2 4.16Å; A273-I289 HydrophobicContact CB-CB 4.04Å; A273-I289 HydrophobicContact CB-CD1 4.38Å; A273-I289 HydrophobicContact CB-CG2 3.91Å; R285-I289 WeakPolarHBondContact O-CG1 3.28Å; R285-I289 PolarHBondContact O-N 2.98Å; A286-I289 PolarHBondContact O-N 3.35Å; R287-I289 VanDerWaalsContact C-N 3.33Å; R287-I289 PolarHBondContact O-N 2.91Å; I289-N292 PolarHBondContact O-N 3.43Å; I289-A293 PolarHBondContact O-N 3.4Å
290	L	96.1	Very high	89.8	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-63.3	-43	178	-64.8	-169.6	0	0	0	111.9	M270 A273 V274 Y277 A286 R287 N292 A293 L294 A308 C311 L312	M270-L290 HydrophobicContact CE-CD2 4.08Å; M270-L290 HydrophobicContact SD-CD2 3.59Å; M270-L290 VanDerWaalsContact SD-CD2 3.59Å; A273-L290 HydrophobicContact CB-CD2 3.9Å; A273-L290 HydrophobicContact CB-CG 4.13Å; V274-L290 HydrophobicContact CG2-CD2 4.2Å; Y277-L290 HydrophobicContact CD1-CD1 4.36Å; Y277-L290 HydrophobicContact CD2-CD1 3.51Å; Y277-L290 HydrophobicContact CE1-CD1 4.27Å; Y277-L290 HydrophobicContact CE2-CD1 3.41Å; Y277-L290 VanDerWaalsContact CE2-CD1 3.41Å; Y277-L290 HydrophobicContact CE2-CG 4.29Å; Y277-L290 HydrophobicContact CG-CD1 4Å; A286-L290 WeakPolarHBondContact O-CG 3.46Å; A286-L290 PolarHBondContact O-N 3.2Å; R287-L290 PolarHBondContact O-N 2.96Å; L290-N292 PolarHBondContact O-N 3.25Å; L290-A293 WeakPolarHBondContact O-CB 3.27Å; L290-A293 PolarHBondContact O-N 3.04Å; L290-L294 PolarHBondContact O-N 3.27Å; L290-L294 VanDerWaalsContact O-N 3.17Å; L290-A308 HydrophobicContact CB-CB 3.94Å; L290-A308 HydrophobicContact CD2-CB 4.02Å; L290-A308 HydrophobicContact CG-CB 4.45Å; L290-C311 HydrophobicContact CD1-CB 3.76Å; L290-L312 HydrophobicContact CB-CD1 3.93Å; L290-L312 HydrophobicContact CB-CD2 4.39Å; L290-L312 HydrophobicContact CB-CG 4.14Å; L290-L312 HydrophobicContact CD1-CD2 4.41Å; L290-L312 HydrophobicContact CD1-CG 4.15Å
291	C	94.2	Very high	89.6	Confident	31 Å²	31	61 Å²	61	21%	0.209	35%	0.351	C	S	.	.	H	α-helix	trans	-61.2	-43.4	175.4	-72.5	0	0	0	0	111.6	R287 V288 A293 L294 H295	R287-C291 WeakPolarHBondContact O-CB 3.35Å; R287-C291 PolarHBondContact O-N 2.82Å; R287-C291 PolarHBondContact O-SG 2.7Å; R287-C291 VanDerWaalsContact O-SG 3.34Å; V288-C291 PolarHBondContact O-N 2.66Å; C291-A293 VanDerWaalsContact C-N 3.3Å; C291-A293 PolarHBondContact O-N 3.4Å; C291-L294 WeakPolarHBondContact O-CB 3.26Å; C291-L294 PolarHBondContact O-N 3.34Å; C291-L294 VanDerWaalsContact O-N 3.14Å; C291-H295 PolarHBondContact O-N 3.1Å; C291-H295 VanDerWaalsContact O-N 3.15Å; C291-H295 PolarHBondContact O-ND1 3.26Å
292	N	93.8	Very high	89.8	Confident	79 Å²	79	58.4 Å²	58.4	42%	0.422	34%	0.341	S	S	.	.	H	α-helix	trans	-62.3	-38.2	176.9	-73.1	-18.5	0	0	0	111.9	V288 I289 L290 L294 H295 Q296	V288-N292 WeakPolarHBondContact O-CB 3.38Å; V288-N292 PolarHBondContact O-N 3.03Å; V288-N292 PolarHBondContact O-ND2 2.96Å; I289-N292 PolarHBondContact O-N 3.43Å; L290-N292 PolarHBondContact O-N 3.25Å; N292-L294 VanDerWaalsContact C-N 3.28Å; N292-L294 PolarHBondContact O-N 3.03Å; N292-H295 PolarHBondContact O-N 3.37Å; N292-Q296 WeakPolarHBondContact O-CB 3.41Å; N292-Q296 VanDerWaalsContact O-CG 3.27Å; N292-Q296 WeakPolarHBondContact O-CG 3.39Å; N292-Q296 PolarHBondContact O-N 3.48Å
293	A	93.8	Very high	90.1	Very high	16 Å²	16	57.3 Å²	57.3	13%	0.132	34%	0.336	C	S	.	.	H	α-helix	trans	-63	-33.2	175.2	0	0	0	0	0	112.7	M270 I289 L290 C291 D297 A308	M270-A293 HydrophobicContact CE-CB 3.42Å; M270-A293 VanDerWaalsContact CE-CB 3.42Å; M270-A293 HydrophobicContact SD-CB 4.31Å; I289-A293 PolarHBondContact O-N 3.4Å; L290-A293 WeakPolarHBondContact O-CB 3.27Å; L290-A293 PolarHBondContact O-N 3.04Å; C291-A293 VanDerWaalsContact C-N 3.3Å; C291-A293 PolarHBondContact O-N 3.4Å; A293-D297 PolarHBondContact O-N 3.11Å; A293-A308 HydrophobicContact CB-CB 4.39Å
294	L	93.1	Very high	90.2	Very high	17 Å²	17	57.5 Å²	57.5	9%	0.089	34%	0.337	C	S	.	.	H	α-helix	trans	-68.3	-43.8	173.2	-66.9	177.4	0	0	0	112.3	L290 C291 N292 Q296 D297 S305 A308 A309 L312 P321 V322 R325	L290-L294 PolarHBondContact O-N 3.27Å; L290-L294 VanDerWaalsContact O-N 3.17Å; C291-L294 WeakPolarHBondContact O-CB 3.26Å; C291-L294 PolarHBondContact O-N 3.34Å; C291-L294 VanDerWaalsContact O-N 3.14Å; N292-L294 VanDerWaalsContact C-N 3.28Å; N292-L294 PolarHBondContact O-N 3.03Å; L294-Q296 VanDerWaalsContact C-N 3.34Å; L294-Q296 PolarHBondContact O-N 2.74Å; L294-D297 PolarHBondContact O-N 3Å; L294-S305 VanDerWaalsContact CD2-O 3.22Å; L294-S305 WeakPolarHBondContact CD2-O 3.43Å; L294-A308 HydrophobicContact CD2-CB 4.08Å; L294-A308 HydrophobicContact CG-CB 4.11Å; L294-A309 HydrophobicContact CD2-CB 3.89Å; L294-L312 HydrophobicContact CD1-CD1 3.6Å; L294-L312 HydrophobicContact CG-CD1 4.49Å; L294-P321 HydrophobicContact CB-CB 4.48Å; L294-P321 HydrophobicContact CD1-CB 4.37Å; L294-V322 HydrophobicContact CD1-CG2 3.74Å; L294-R325 HydrophobicContact CD2-CB 4.04Å; L294-R325 HydrophobicContact CD2-CG 3.9Å
295	H	89.7	Confident	90.3	Very high	132 Å²	132	53.3 Å²	53.3	61%	0.611	31%	0.307	S	S	*	.	H	α-helix	trans	-71.3	-28.9	-178.3	-66.9	93.6	0	0	0	113	C291 N292	C291-H295 PolarHBondContact O-N 3.1Å; C291-H295 VanDerWaalsContact O-N 3.15Å; C291-H295 PolarHBondContact O-ND1 3.26Å; N292-H295 PolarHBondContact O-N 3.37Å
296	Q	89.1	Confident	90.3	Very high	134 Å²	134	50.1 Å²	50.1	63%	0.626	30%	0.296	S	S	*	.	H	α-helix	trans	-77.9	-21.1	179.1	-72.3	172	15.6	0	0	113.2	N292 L294 S298	N292-Q296 WeakPolarHBondContact O-CB 3.41Å; N292-Q296 VanDerWaalsContact O-CG 3.27Å; N292-Q296 WeakPolarHBondContact O-CG 3.39Å; N292-Q296 PolarHBondContact O-N 3.48Å; L294-Q296 VanDerWaalsContact C-N 3.34Å; L294-Q296 PolarHBondContact O-N 2.74Å; Q296-S298 PolarHBondContact O-N 3.44Å
297	D	85.6	Confident	90.3	Very high	32 Å²	32	50.2 Å²	50.2	17%	0.171	30%	0.296	C	S	.	.			trans	-89.4	79.6	178.7	-177.1	23.7	0	0	0	111.8	A293 L294 A299 G300 V301 G302 S305 R325	A293-D297 PolarHBondContact O-N 3.11Å; L294-D297 PolarHBondContact O-N 3Å; D297-A299 PolarHBondContact O-N 2.85Å; D297-A299 PolarHBondContact OD1-N 3.25Å; D297-G300 VanDerWaalsContact CG-N 3.29Å; D297-G300 PolarHBondContact O-N 3.36Å; D297-G300 PolarHBondContact OD1-N 3.37Å; D297-G300 WeakPolarHBondContact OD2-CA 3.38Å; D297-G300 PolarHBondContact OD2-N 2.93Å; D297-V301 PolarHBondContact OD2-N 3.39Å; D297-V301 VanDerWaalsContact OD2-N 3.08Å; D297-G302 PolarHBondContact OD2-N 2.96Å; D297-S305 VanDerWaalsContact OD2-CB 3.29Å; D297-S305 WeakPolarHBondContact OD2-CB 3.5Å; D297-S305 PolarHBondContact OD2-OG 3.44Å; D297-R325 IonicContact OD2-NE 2.78Å; D297-R325 PolarHBondContact OD2-NE 3.23Å
298	S	76.8	Confident	90.4	Very high	129 Å²	129	46.6 Å²	46.6	90%	0.902	28%	0.282	S	S	*	.	S	Bend	trans	-65.9	-23.7	175.8	61.7	0	0	0	0	113.4	Q296	Q296-S298 PolarHBondContact O-N 3.44Å
299	A	76.7	Confident	90.4	Very high	78 Å²	78	42.6 Å²	42.6	65%	0.645	26%	0.258	S	S	*	.	S	Bend	trans	-81.5	-25.4	179.8	0	0	0	0	0	112.3	D297 V301	D297-A299 PolarHBondContact O-N 2.85Å; D297-A299 PolarHBondContact OD1-N 3.25Å; A299-V301 VanDerWaalsContact C-N 3.31Å; A299-V301 PolarHBondContact O-N 3.18Å
300	G	79.1	Confident	90.4	Very high	9 Å²	9	41.4 Å²	41.4	9%	0.093	25%	0.252	C	S	.	.	S	Bend	trans	70.3	26.4	179.7	0	0	0	0	0	113.6	D297 R325 S328	D297-G300 VanDerWaalsContact CG-N 3.29Å; D297-G300 PolarHBondContact O-N 3.36Å; D297-G300 PolarHBondContact OD1-N 3.37Å; D297-G300 WeakPolarHBondContact OD2-CA 3.38Å; D297-G300 PolarHBondContact OD2-N 2.93Å; G300-R325 VanDerWaalsContact C-CZ 3.48Å; G300-R325 PolarHBondContact O-NE 2.99Å; G300-R325 PolarHBondContact O-NH1 3.42Å; G300-R325 VanDerWaalsContact O-NH1 3.07Å; G300-R325 PolarHBondContact O-NH2 2.96Å; G300-S328 PolarHBondContact O-OG 3.49Å
301	V	83.2	Confident	90.3	Very high	91 Å²	91	41.4 Å²	41.4	55%	0.552	25%	0.252	S	S	*	.			trans	-124.4	-7.1	-177.4	-170.9	0	0	0	0	111.9	D297 A299	D297-V301 PolarHBondContact OD2-N 3.39Å; D297-V301 VanDerWaalsContact OD2-N 3.08Å; A299-V301 VanDerWaalsContact C-N 3.31Å; A299-V301 PolarHBondContact O-N 3.18Å
302	G	89.5	Confident	90.4	Very high	26 Å²	26	40 Å²	40	27%	0.268	24%	0.242	S	C	.	.			trans	-62.2	141.9	-177.8	0	0	0	0	0	113.1	D297 D304 S305 W306 R325	D297-G302 PolarHBondContact OD2-N 2.96Å; G302-D304 VanDerWaalsContact C-N 3.31Å; G302-S305 PolarHBondContact O-OG 3.19Å; G302-W306 WeakPolarHBondContact O-CB 3.35Å; G302-W306 PolarHBondContact O-N 2.95Å; G302-R325 PolarHBondContact O-NH2 3.25Å
303	A	90.9	Very high	90.4	Very high	31 Å²	31	36.6 Å²	36.6	26%	0.256	23%	0.225	S	C	.	.	H	α-helix	trans	-67	-35	174.1	0	0	0	0	0	111.9	A186 W306 V307	A186-A303 HydrophobicContact CB-CB 3.66Å; A303-W306 PolarHBondContact O-N 3.48Å; A303-V307 PolarHBondContact O-N 3.19Å
304	D	93.8	Very high	90.4	Very high	39 Å²	39	38.8 Å²	38.8	21%	0.209	24%	0.237	C	C	.	.	H	α-helix	trans	-68.7	-46	178.5	-84.3	-0	0	0	0	112	W183 W187 M270 G302 W306 V307 A308	W183-D304 PolarHBondContact NE1-OD1 2.95Å; W187-D304 WeakPolarHBondContact CZ2-OD1 3.48Å; W187-D304 WeakPolarHBondContact CZ2-OD2 3.3Å; W187-D304 PolarHBondContact NE1-OD1 3.37Å; M270-D304 VanDerWaalsContact CE-C 3.46Å; M270-D304 HydrophobicContact CE-CB 3.5Å; M270-D304 WeakPolarHBondContact CE-O 3.49Å; G302-D304 VanDerWaalsContact C-N 3.31Å; D304-W306 VanDerWaalsContact C-N 3.31Å; D304-W306 PolarHBondContact O-N 2.8Å; D304-V307 VanDerWaalsContact O-CG1 3.26Å; D304-V307 WeakPolarHBondContact O-CG1 3.43Å; D304-A308 VanDerWaalsContact O-CB 3.28Å; D304-A308 WeakPolarHBondContact O-CB 3.44Å; D304-A308 PolarHBondContact O-N 3.03Å
305	S	94.4	Very high	90.3	Very high	2 Å²	2	41.9 Å²	41.9	1%	0.014	25%	0.251	C	S	.	.	H	α-helix	trans	-66.5	-33.8	173.5	61.9	0	0	0	0	112.1	L294 D297 G302 A308 A309 R325	L294-S305 VanDerWaalsContact CD2-O 3.22Å; L294-S305 WeakPolarHBondContact CD2-O 3.43Å; D297-S305 VanDerWaalsContact OD2-CB 3.29Å; D297-S305 WeakPolarHBondContact OD2-CB 3.5Å; D297-S305 PolarHBondContact OD2-OG 3.44Å; G302-S305 PolarHBondContact O-OG 3.19Å; S305-A308 PolarHBondContact O-N 3.26Å; S305-A309 WeakPolarHBondContact O-CB 3.41Å; S305-A309 PolarHBondContact O-N 3.3Å; S305-R325 PolarHBondContact OG-NE 2.89Å
306	W	94.3	Very high	90.3	Very high	22 Å²	22	36.7 Å²	36.7	8%	0.083	23%	0.233	C	C	.	.	H	α-helix	trans	-64.3	-48.4	176.3	-179.8	-136.2	0	0	0	112.3	G302 A303 D304 A308 Q310 L326 Q329 Q341	G302-W306 WeakPolarHBondContact O-CB 3.35Å; G302-W306 PolarHBondContact O-N 2.95Å; A303-W306 PolarHBondContact O-N 3.48Å; D304-W306 VanDerWaalsContact C-N 3.31Å; D304-W306 PolarHBondContact O-N 2.8Å; W306-A308 VanDerWaalsContact C-N 3.34Å; W306-Q310 HydrophobicContact CD2-CG 4.26Å; W306-Q310 VanDerWaalsContact CE2-CD 3.45Å; W306-Q310 HydrophobicContact CE3-CG 4.27Å; W306-Q310 HydrophobicContact CH2-CG 3.95Å; W306-Q310 VanDerWaalsContact CZ2-CD 3.45Å; W306-Q310 HydrophobicContact CZ2-CG 3.98Å; W306-Q310 HydrophobicContact CZ3-CG 4.13Å; W306-Q310 VanDerWaalsContact NE1-NE2 3.12Å; W306-Q310 WeakPolarHBondContact O-CG 3.37Å; W306-Q310 PolarHBondContact O-N 3.49Å; W306-Q310 PolarHBondContact O-NE2 3.23Å; W306-Q310 VanDerWaalsContact O-NE2 3.09Å; W306-L326 HydrophobicContact CE3-CD2 4.38Å; W306-L326 HydrophobicContact CH2-CD2 4.01Å; W306-L326 HydrophobicContact CZ3-CD2 3.49Å; W306-L326 VanDerWaalsContact CZ3-CD2 3.49Å; W306-Q329 HydrophobicContact CD2-CB 4.4Å; W306-Q329 HydrophobicContact CD2-CG 3.91Å; W306-Q329 HydrophobicContact CE3-CB 3.71Å; W306-Q329 HydrophobicContact CE3-CG 3.73Å; W306-Q329 HydrophobicContact CH2-CB 4.02Å; W306-Q329 HydrophobicContact CH2-CG 3.82Å; W306-Q329 HydrophobicContact CZ2-CG 3.94Å; W306-Q329 HydrophobicContact CZ3-CB 3.48Å; W306-Q329 VanDerWaalsContact CZ3-CB 3.48Å; W306-Q329 HydrophobicContact CZ3-CG 3.67Å; W306-Q341 HydrophobicContact CZ2-CG 4.25Å
307	V	95.5	Very high	90.4	Very high	1 Å²	1	31.6 Å²	31.6	1%	0.006	21%	0.21	C	C	.	.	H	α-helix	trans	-67.3	-37.9	177.1	72.1	0	0	0	0	111.1	A179 W183 M270 V274 A303 D304 Q310 C311	A179-V307 HydrophobicContact CB-CG2 4.21Å; W183-V307 HydrophobicContact CB-CB 3.89Å; W183-V307 HydrophobicContact CB-CG1 4.3Å; W183-V307 HydrophobicContact CB-CG2 3.88Å; W183-V307 HydrophobicContact CD2-CG1 4.42Å; W183-V307 HydrophobicContact CG-CB 3.94Å; W183-V307 HydrophobicContact CG-CG1 3.79Å; W183-V307 HydrophobicContact CG-CG2 4.09Å; M270-V307 HydrophobicContact CE-CG1 4.18Å; V274-V307 HydrophobicContact CG1-CG2 3.99Å; V274-V307 HydrophobicContact CG2-CG1 3.72Å; V274-V307 HydrophobicContact CG2-CG2 3.98Å; A303-V307 PolarHBondContact O-N 3.19Å; D304-V307 VanDerWaalsContact O-CG1 3.26Å; D304-V307 WeakPolarHBondContact O-CG1 3.43Å; V307-Q310 PolarHBondContact O-N 3.02Å; V307-C311 WeakPolarHBondContact O-CB 3.35Å; V307-C311 PolarHBondContact O-N 3.09Å; V307-C311 PolarHBondContact O-SG 2.9Å; V307-C311 VanDerWaalsContact O-SG 3.38Å
308	A	96.3	Very high	90.7	Very high	0 Å²	0	34 Å²	34	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-58.7	-50.1	176.2	0	0	0	0	0	111.9	M270 L290 A293 L294 D304 S305 W306 Q310 C311 L312	M270-A308 HydrophobicContact CE-CB 4.2Å; L290-A308 HydrophobicContact CB-CB 3.94Å; L290-A308 HydrophobicContact CD2-CB 4.02Å; L290-A308 HydrophobicContact CG-CB 4.45Å; A293-A308 HydrophobicContact CB-CB 4.39Å; L294-A308 HydrophobicContact CD2-CB 4.08Å; L294-A308 HydrophobicContact CG-CB 4.11Å; D304-A308 VanDerWaalsContact O-CB 3.28Å; D304-A308 WeakPolarHBondContact O-CB 3.44Å; D304-A308 PolarHBondContact O-N 3.03Å; S305-A308 PolarHBondContact O-N 3.26Å; W306-A308 VanDerWaalsContact C-N 3.34Å; A308-Q310 VanDerWaalsContact C-N 3.3Å; A308-Q310 PolarHBondContact O-N 2.91Å; A308-C311 PolarHBondContact O-N 3.41Å; A308-L312 VanDerWaalsContact O-CB 3.31Å; A308-L312 WeakPolarHBondContact O-CB 3.46Å; A308-L312 WeakPolarHBondContact O-CD1 3.43Å; A308-L312 VanDerWaalsContact O-CG 3.26Å; A308-L312 WeakPolarHBondContact O-CG 3.27Å; A308-L312 PolarHBondContact O-N 3.37Å
309	A	96.1	Very high	91.5	Very high	0 Å²	0	30 Å²	30	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-58.9	-42.6	178.8	0	0	0	0	0	111.6	L294 S305 A313 V322 R325 L326	L294-A309 HydrophobicContact CD2-CB 3.89Å; S305-A309 WeakPolarHBondContact O-CB 3.41Å; S305-A309 PolarHBondContact O-N 3.3Å; A309-A313 WeakPolarHBondContact O-CB 3.3Å; A309-A313 PolarHBondContact O-N 3.31Å; A309-V322 WeakPolarHBondContact O-CG1 3.49Å; A309-R325 HydrophobicContact CB-CB 3.98Å; A309-R325 HydrophobicContact CB-CG 3.8Å; A309-L326 HydrophobicContact CB-CD2 4.04Å; A309-L326 HydrophobicContact CB-CG 4.35Å
310	Q	95.6	Very high	92.3	Very high	1 Å²	1	33.1 Å²	33.1	1%	0.005	18%	0.184	C	C	.	.	H	α-helix	trans	-67.4	-45.9	179	-68.5	175.1	91.2	0	0	112.5	A179 W306 V307 A308 A313 V314 L326 L345	A179-Q310 HydrophobicContact CB-CB 3.77Å; A179-Q310 HydrophobicContact CB-CG 4.33Å; W306-Q310 HydrophobicContact CD2-CG 4.26Å; W306-Q310 VanDerWaalsContact CE2-CD 3.45Å; W306-Q310 HydrophobicContact CE3-CG 4.27Å; W306-Q310 HydrophobicContact CH2-CG 3.95Å; W306-Q310 VanDerWaalsContact CZ2-CD 3.45Å; W306-Q310 HydrophobicContact CZ2-CG 3.98Å; W306-Q310 HydrophobicContact CZ3-CG 4.13Å; W306-Q310 VanDerWaalsContact NE1-NE2 3.12Å; W306-Q310 WeakPolarHBondContact O-CG 3.37Å; W306-Q310 PolarHBondContact O-N 3.49Å; W306-Q310 PolarHBondContact O-NE2 3.23Å; W306-Q310 VanDerWaalsContact O-NE2 3.09Å; V307-Q310 PolarHBondContact O-N 3.02Å; A308-Q310 VanDerWaalsContact C-N 3.3Å; A308-Q310 PolarHBondContact O-N 2.91Å; Q310-A313 PolarHBondContact O-N 3.4Å; Q310-V314 WeakPolarHBondContact O-CG2 3.35Å; Q310-V314 PolarHBondContact O-N 3.31Å; Q310-L326 HydrophobicContact CG-CD2 4.33Å; Q310-L345 HydrophobicContact CB-CD1 4.16Å; Q310-L345 HydrophobicContact CG-CD1 3.75Å
311	C	95.2	Very high	92.9	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-60.7	-46.5	177.7	-75.3	0	0	0	0	111.6	Y277 L290 V307 A308 V314 E315	Y277-C311 HydrophobicContact CD1-CB 3.75Å; Y277-C311 VanDerWaalsContact CD1-O 3.31Å; Y277-C311 WeakPolarHBondContact CD1-O 3.44Å; Y277-C311 HydrophobicContact CE1-CB 4.47Å; Y277-C311 HydrophobicContact CG-CB 3.82Å; L290-C311 HydrophobicContact CD1-CB 3.76Å; V307-C311 WeakPolarHBondContact O-CB 3.35Å; V307-C311 PolarHBondContact O-N 3.09Å; V307-C311 PolarHBondContact O-SG 2.9Å; V307-C311 VanDerWaalsContact O-SG 3.38Å; A308-C311 PolarHBondContact O-N 3.41Å; C311-V314 PolarHBondContact O-N 3.02Å; C311-E315 PolarHBondContact O-N 3.03Å
312	L	95.6	Very high	93.5	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-64.1	-43.1	177.5	-71.6	168.5	0	0	0	111.7	Y277 R287 L290 L294 A308 V314 E315 G316 D317 V322	Y277-L312 HydrophobicContact CE1-CD2 4.19Å; Y277-L312 VanDerWaalsContact OH-CD2 3.31Å; Y277-L312 WeakPolarHBondContact OH-CD2 3.44Å; R287-L312 HydrophobicContact CG-CD2 4.07Å; L290-L312 HydrophobicContact CB-CD1 3.93Å; L290-L312 HydrophobicContact CB-CD2 4.39Å; L290-L312 HydrophobicContact CB-CG 4.14Å; L290-L312 HydrophobicContact CD1-CD2 4.41Å; L290-L312 HydrophobicContact CD1-CG 4.15Å; L294-L312 HydrophobicContact CD1-CD1 3.6Å; L294-L312 HydrophobicContact CG-CD1 4.49Å; A308-L312 VanDerWaalsContact O-CB 3.31Å; A308-L312 WeakPolarHBondContact O-CB 3.46Å; A308-L312 WeakPolarHBondContact O-CD1 3.43Å; A308-L312 VanDerWaalsContact O-CG 3.26Å; A308-L312 WeakPolarHBondContact O-CG 3.27Å; A308-L312 PolarHBondContact O-N 3.37Å; L312-V314 PolarHBondContact O-N 3.46Å; L312-E315 PolarHBondContact O-N 2.97Å; L312-G316 PolarHBondContact O-N 3.27Å; L312-G316 VanDerWaalsContact O-N 3.12Å; L312-D317 HydrophobicContact CB-CB 3.94Å; L312-D317 HydrophobicContact CD2-CB 4.39Å; L312-D317 WeakPolarHBondContact O-CB 3.48Å; L312-D317 PolarHBondContact O-N 3.37Å; L312-V322 HydrophobicContact CB-CG2 3.84Å; L312-V322 HydrophobicContact CD1-CG2 3.96Å
313	A	94.6	Very high	93.7	Very high	8 Å²	8	29.3 Å²	29.3	7%	0.066	16%	0.155	C	C	.	.	H	α-helix	trans	-62.3	-41.2	177.3	0	0	0	0	0	113.5	A309 Q310 E315 G316 V322 L326 L345 I349	A309-A313 WeakPolarHBondContact O-CB 3.3Å; A309-A313 PolarHBondContact O-N 3.31Å; Q310-A313 PolarHBondContact O-N 3.4Å; A313-E315 VanDerWaalsContact C-N 3.33Å; A313-G316 PolarHBondContact O-N 3.04Å; A313-V322 HydrophobicContact CB-CG1 4.01Å; A313-L326 HydrophobicContact CB-CD1 4.13Å; A313-L345 HydrophobicContact CB-CD2 4.37Å; A313-I349 HydrophobicContact CB-CD1 3.85Å
314	V	92.9	Very high	93.8	Very high	62 Å²	62	33 Å²	33	38%	0.376	17%	0.167	S	C	.	.	H	α-helix	trans	-67.8	-35.4	178.6	171.6	0	0	0	0	111.3	L176 Q310 C311 L312 G316 L345	L176-V314 HydrophobicContact CD1-CG1 3.94Å; L176-V314 HydrophobicContact CD2-CB 4.1Å; L176-V314 HydrophobicContact CD2-CG1 4.19Å; L176-V314 HydrophobicContact CD2-CG2 4.19Å; L176-V314 HydrophobicContact CG-CB 4.29Å; L176-V314 HydrophobicContact CG-CG1 3.89Å; L176-V314 HydrophobicContact CG-CG2 4.26Å; Q310-V314 WeakPolarHBondContact O-CG2 3.35Å; Q310-V314 PolarHBondContact O-N 3.31Å; C311-V314 PolarHBondContact O-N 3.02Å; L312-V314 PolarHBondContact O-N 3.46Å; V314-G316 VanDerWaalsContact C-N 3.29Å; V314-L345 HydrophobicContact CG2-CD2 3.82Å
315	E	91.2	Very high	93.8	Very high	83 Å²	83	31.8 Å²	31.8	39%	0.388	16%	0.159	S	C	.	.	H	α-helix	trans	-72.2	-25	177.5	-168.1	-81.2	172.9	0	0	112.8	Y277 P282 R287 C311 L312 A313	Y277-E315 HydrophobicContact CD1-CB 4.11Å; Y277-E315 HydrophobicContact CE1-CB 3.7Å; Y277-E315 HydrophobicContact CE1-CG 4.01Å; P282-E315 HydrophobicContact CG-CG 4.12Å; R287-E315 IonicContact CZ-OE2 3.08Å; R287-E315 IonicContact NH1-OE2 3.43Å; R287-E315 PolarHBondContact NH1-OE2 2.85Å; R287-E315 IonicContact NH2-OE1 2.92Å; R287-E315 PolarHBondContact NH2-OE1 3.38Å; R287-E315 IonicContact NH2-OE2 2.76Å; R287-E315 PolarHBondContact NH2-OE2 3.22Å; C311-E315 PolarHBondContact O-N 3.03Å; L312-E315 PolarHBondContact O-N 2.97Å; A313-E315 VanDerWaalsContact C-N 3.33Å
316	G	90	Very high	93.7	Very high	22 Å²	22	31.7 Å²	31.7	23%	0.227	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	114.7	19.2	177	0	0	0	0	0	114.5	L312 A313 V314 Y318	L312-G316 PolarHBondContact O-N 3.27Å; L312-G316 VanDerWaalsContact O-N 3.12Å; A313-G316 PolarHBondContact O-N 3.04Å; V314-G316 VanDerWaalsContact C-N 3.29Å; G316-Y318 WeakPolarHBondContact CA-OH 3.32Å; G316-Y318 WeakPolarHBondContact O-CD2 3.49Å; G316-Y318 WeakPolarHBondContact O-CE2 3.37Å; G316-Y318 PolarHBondContact O-N 3.41Å
317	D	91.3	Very high	93.6	Very high	27 Å²	27	30.9 Å²	30.9	14%	0.144	16%	0.156	C	C	.	.			trans	-78.3	115.6	170.6	-164.5	-39.7	0	0	0	110.4	R287 L312 S319 V322	R287-D317 IonicContact NH1-OD2 3.67Å; R287-D317 PolarHBondContact NH1-OD2 3.36Å; L312-D317 HydrophobicContact CB-CB 3.94Å; L312-D317 HydrophobicContact CD2-CB 4.39Å; L312-D317 WeakPolarHBondContact O-CB 3.48Å; L312-D317 PolarHBondContact O-N 3.37Å; D317-S319 WeakPolarHBondContact OD1-CB 3.39Å; D317-S319 PolarHBondContact OD1-N 3.11Å; D317-S319 PolarHBondContact OD1-OG 3.22Å; D317-V322 HydrophobicContact CB-CG2 4.48Å
318	Y	92.4	Very high	93.4	Very high	84 Å²	84	32.3 Å²	32.3	33%	0.329	17%	0.166	S	C	.	.			trans	-108.9	23.6	-178.2	-44.2	-52	0	0	0	112.7	G316 I323 I349 K352 T353	G316-Y318 WeakPolarHBondContact CA-OH 3.32Å; G316-Y318 WeakPolarHBondContact O-CD2 3.49Å; G316-Y318 WeakPolarHBondContact O-CE2 3.37Å; G316-Y318 PolarHBondContact O-N 3.41Å; Y318-I323 WeakPolarHBondContact O-CD1 3.48Å; Y318-I349 HydrophobicContact CD1-CB 4.13Å; Y318-I349 HydrophobicContact CD1-CG1 3.91Å; Y318-I349 HydrophobicContact CD1-CG2 3.56Å; Y318-I349 HydrophobicContact CE1-CB 4.48Å; Y318-I349 HydrophobicContact CE1-CG1 4.14Å; Y318-I349 HydrophobicContact CE1-CG2 4.34Å; Y318-I349 HydrophobicContact CG-CG2 4.17Å; Y318-K352 HydrophobicContact CD2-CB 4.01Å; Y318-K352 HydrophobicContact CE1-CB 4.26Å; Y318-K352 HydrophobicContact CE1-CG 4.34Å; Y318-K352 HydrophobicContact CE2-CB 3.6Å; Y318-K352 HydrophobicContact CE2-CG 4Å; Y318-T353 HydrophobicContact CG-CG2 4.43Å
319	S	92.7	Very high	93	Very high	43 Å²	43	33.4 Å²	33.4	30%	0.301	17%	0.171	S	C	.	.			trans	-66	156.4	179.8	61.6	0	0	0	0	112.6	D317 V322 I323	D317-S319 WeakPolarHBondContact OD1-CB 3.39Å; D317-S319 PolarHBondContact OD1-N 3.11Å; D317-S319 PolarHBondContact OD1-OG 3.22Å; S319-V322 PolarHBondContact O-N 2.85Å; S319-V322 WeakPolarHBondContact OG-CG2 3.45Å; S319-I323 PolarHBondContact O-N 2.76Å
320	R	93.3	Very high	92.7	Very high	145 Å²	145	33.9 Å²	33.9	55%	0.547	17%	0.173	S	C	.	.	H	α-helix	trans	-54.9	-45.1	179.3	-172.5	-179.2	-176.2	-175.3	4.1	113.2	V322 I323 Q324 L355	R320-V322 VanDerWaalsContact C-N 3.32Å; R320-V322 PolarHBondContact O-N 3.36Å; R320-I323 PolarHBondContact O-N 2.83Å; R320-Q324 VanDerWaalsContact O-CB 3.25Å; R320-Q324 WeakPolarHBondContact O-CB 3.5Å; R320-Q324 PolarHBondContact O-N 2.89Å; R320-L355 HydrophobicContact CB-CD2 4.03Å
321	P	93.2	Very high	92.2	Very high	46 Å²	46	35.7 Å²	35.7	30%	0.299	18%	0.181	S	C	.	.	H	α-helix	trans	-60.8	-39	-179.8	-24.6	36	0	0	0	113.3	L294 R325	L294-P321 HydrophobicContact CB-CB 4.48Å; L294-P321 HydrophobicContact CD1-CB 4.37Å; P321-R325 WeakPolarHBondContact O-CB 3.5Å; P321-R325 PolarHBondContact O-N 2.87Å
322	V	94.6	Very high	91.7	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-63.1	-53.7	177.2	174.2	0	0	0	0	110.1	L294 A309 L312 A313 D317 S319 R320 Q324 R325 L326	L294-V322 HydrophobicContact CD1-CG2 3.74Å; A309-V322 WeakPolarHBondContact O-CG1 3.49Å; L312-V322 HydrophobicContact CB-CG2 3.84Å; L312-V322 HydrophobicContact CD1-CG2 3.96Å; A313-V322 HydrophobicContact CB-CG1 4.01Å; D317-V322 HydrophobicContact CB-CG2 4.48Å; S319-V322 PolarHBondContact O-N 2.85Å; S319-V322 WeakPolarHBondContact OG-CG2 3.45Å; R320-V322 VanDerWaalsContact C-N 3.32Å; R320-V322 PolarHBondContact O-N 3.36Å; V322-Q324 VanDerWaalsContact C-N 3.35Å; V322-Q324 PolarHBondContact O-N 2.72Å; V322-R325 PolarHBondContact O-N 3.11Å; V322-L326 HydrophobicContact CG1-CD1 4.39Å; V322-L326 WeakPolarHBondContact O-CG 3.37Å; V322-L326 PolarHBondContact O-N 2.88Å
323	I	94.8	Very high	90.8	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-63	-42.8	-177.5	-62.3	167.7	0	0	0	110.9	Y318 S319 R320 R325 L326 L327 L346 I349 T353 L355 V356 L359	Y318-I323 WeakPolarHBondContact O-CD1 3.48Å; S319-I323 PolarHBondContact O-N 2.76Å; R320-I323 PolarHBondContact O-N 2.83Å; I323-R325 VanDerWaalsContact C-N 3.34Å; I323-R325 PolarHBondContact O-N 3.22Å; I323-L326 PolarHBondContact O-N 3.04Å; I323-L327 HydrophobicContact CG2-CD1 4Å; I323-L327 HydrophobicContact CG2-CG 4.39Å; I323-L327 WeakPolarHBondContact O-CG 3.31Å; I323-L327 PolarHBondContact O-N 3.31Å; I323-L346 HydrophobicContact CG2-CD2 3.98Å; I323-I349 HydrophobicContact CD1-CG2 4.1Å; I323-I349 HydrophobicContact CG1-CG2 4.26Å; I323-T353 HydrophobicContact CD1-CG2 4.13Å; I323-L355 HydrophobicContact CD1-CB 4.09Å; I323-L355 HydrophobicContact CD1-CD2 3.91Å; I323-L355 HydrophobicContact CD1-CG 3.99Å; I323-V356 HydrophobicContact CD1-CG2 3.81Å; I323-V356 HydrophobicContact CG1-CG2 4.15Å; I323-V356 HydrophobicContact CG2-CG2 3.94Å; I323-L359 HydrophobicContact CB-CD1 4.2Å; I323-L359 HydrophobicContact CG2-CD1 3.69Å
324	Q	92.6	Very high	89.8	Confident	109 Å²	109	49.7 Å²	49.7	51%	0.509	25%	0.253	S	S	.	.	H	α-helix	trans	-63	-40.1	179.1	-174.3	171.8	-10.2	0	0	111.8	R320 V322 L327 S328	R320-Q324 VanDerWaalsContact O-CB 3.25Å; R320-Q324 WeakPolarHBondContact O-CB 3.5Å; R320-Q324 PolarHBondContact O-N 2.89Å; V322-Q324 VanDerWaalsContact C-N 3.35Å; V322-Q324 PolarHBondContact O-N 2.72Å; Q324-L327 PolarHBondContact O-N 3.14Å; Q324-S328 PolarHBondContact O-N 3.27Å
325	R	92.8	Very high	89.1	Confident	12 Å²	12	50.4 Å²	50.4	5%	0.045	26%	0.257	C	S	.	.	H	α-helix	trans	-68.5	-35.6	175.8	-176.8	63	-170.5	85.7	-5.2	112.7	L294 D297 G300 G302 S305 A309 P321 V322 I323 S328 Q329	L294-R325 HydrophobicContact CD2-CB 4.04Å; L294-R325 HydrophobicContact CD2-CG 3.9Å; D297-R325 IonicContact OD2-NE 2.78Å; D297-R325 PolarHBondContact OD2-NE 3.23Å; G300-R325 VanDerWaalsContact C-CZ 3.48Å; G300-R325 PolarHBondContact O-NE 2.99Å; G300-R325 PolarHBondContact O-NH1 3.42Å; G300-R325 VanDerWaalsContact O-NH1 3.07Å; G300-R325 PolarHBondContact O-NH2 2.96Å; G302-R325 PolarHBondContact O-NH2 3.25Å; S305-R325 PolarHBondContact OG-NE 2.89Å; A309-R325 HydrophobicContact CB-CB 3.98Å; A309-R325 HydrophobicContact CB-CG 3.8Å; P321-R325 WeakPolarHBondContact O-CB 3.5Å; P321-R325 PolarHBondContact O-N 2.87Å; V322-R325 PolarHBondContact O-N 3.11Å; I323-R325 VanDerWaalsContact C-N 3.34Å; I323-R325 PolarHBondContact O-N 3.22Å; R325-S328 PolarHBondContact NH1-OG 3.45Å; R325-S328 PolarHBondContact O-OG 2.93Å; R325-Q329 PolarHBondContact O-N 3.28Å; R325-Q329 VanDerWaalsContact O-N 3.15Å
326	L	93.9	Very high	88.4	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-64.4	-42.2	172.9	-66.9	179	0	0	0	111.6	W306 A309 Q310 A313 V322 I323 Q329 H330 L345 L346 I349	W306-L326 HydrophobicContact CE3-CD2 4.38Å; W306-L326 HydrophobicContact CH2-CD2 4.01Å; W306-L326 HydrophobicContact CZ3-CD2 3.49Å; W306-L326 VanDerWaalsContact CZ3-CD2 3.49Å; A309-L326 HydrophobicContact CB-CD2 4.04Å; A309-L326 HydrophobicContact CB-CG 4.35Å; Q310-L326 HydrophobicContact CG-CD2 4.33Å; A313-L326 HydrophobicContact CB-CD1 4.13Å; V322-L326 HydrophobicContact CG1-CD1 4.39Å; V322-L326 WeakPolarHBondContact O-CG 3.37Å; V322-L326 PolarHBondContact O-N 2.88Å; I323-L326 PolarHBondContact O-N 3.04Å; L326-Q329 PolarHBondContact O-N 3.06Å; L326-H330 WeakPolarHBondContact O-CB 3.4Å; L326-H330 PolarHBondContact O-N 3.33Å; L326-H330 VanDerWaalsContact O-N 3.08Å; L326-L345 HydrophobicContact CD1-CB 4.03Å; L326-L345 HydrophobicContact CD2-CD1 3.98Å; L326-L346 HydrophobicContact CB-CD2 3.96Å; L326-L346 HydrophobicContact CB-CG 4.2Å; L326-L346 HydrophobicContact CD1-CD2 4.17Å; L326-L346 HydrophobicContact CD1-CG 4.44Å; L326-I349 HydrophobicContact CD1-CD1 3.64Å
327	L	92	Very high	88	Confident	6 Å²	6	54.5 Å²	54.5	3%	0.031	28%	0.275	C	S	.	.	H	α-helix	trans	-66	-42.2	175.8	-71.2	171.6	0	0	0	112.1	I323 Q324 Q329 H330 F331 L346 L359 L360	I323-L327 HydrophobicContact CG2-CD1 4Å; I323-L327 HydrophobicContact CG2-CG 4.39Å; I323-L327 WeakPolarHBondContact O-CG 3.31Å; I323-L327 PolarHBondContact O-N 3.31Å; Q324-L327 PolarHBondContact O-N 3.14Å; L327-Q329 VanDerWaalsContact C-N 3.31Å; L327-Q329 PolarHBondContact O-N 3.09Å; L327-H330 WeakPolarHBondContact O-CB 3.48Å; L327-H330 PolarHBondContact O-N 3.17Å; L327-H330 VanDerWaalsContact O-N 3.09Å; L327-F331 HydrophobicContact CB-CD2 4.48Å; L327-F331 HydrophobicContact CB-CE2 4.05Å; L327-F331 HydrophobicContact CD2-CE2 4.24Å; L327-F331 HydrophobicContact CD2-CZ 4.25Å; L327-F331 WeakPolarHBondContact O-CD2 3.31Å; L327-F331 WeakPolarHBondContact O-CG 3.42Å; L327-F331 PolarHBondContact O-N 3.15Å; L327-L346 HydrophobicContact CD2-CD1 3.64Å; L327-L346 HydrophobicContact CD2-CD2 4.23Å; L327-L346 HydrophobicContact CG-CD1 4.31Å; L327-L346 HydrophobicContact CG-CD2 4.23Å; L327-L359 HydrophobicContact CD1-CB 3.64Å; L327-L359 HydrophobicContact CD1-CD1 4.19Å; L327-L360 HydrophobicContact CD2-CD2 3.46Å; L327-L360 VanDerWaalsContact CD2-CD2 3.46Å; L327-L360 HydrophobicContact CD2-CG 3.85Å
328	S	89.5	Confident	87.8	Confident	30 Å²	30	54.2 Å²	54.2	21%	0.21	27%	0.274	C	S	.	.	H	α-helix	trans	-59.9	-43.1	177.2	77.9	0	0	0	0	111.3	G300 Q324 R325 H330 F331 V332	G300-S328 PolarHBondContact O-OG 3.49Å; Q324-S328 PolarHBondContact O-N 3.27Å; R325-S328 PolarHBondContact NH1-OG 3.45Å; R325-S328 PolarHBondContact O-OG 2.93Å; S328-H330 VanDerWaalsContact C-N 3.33Å; S328-H330 PolarHBondContact O-N 3.43Å; S328-F331 PolarHBondContact O-N 3.43Å; S328-V332 WeakPolarHBondContact O-CB 3.49Å; S328-V332 VanDerWaalsContact O-CG2 3.28Å; S328-V332 WeakPolarHBondContact O-CG2 3.25Å; S328-V332 PolarHBondContact O-N 3.38Å; S328-V332 VanDerWaalsContact O-N 3.09Å
329	Q	89.6	Confident	87.4	Confident	24 Å²	24	51.6 Å²	51.6	11%	0.112	27%	0.266	C	S	.	.	H	α-helix	trans	-61.5	-43.7	174.3	-163.9	66.6	22.1	0	0	111.3	W306 R325 L326 L327 F331 V332 S333 D338	W306-Q329 HydrophobicContact CD2-CB 4.4Å; W306-Q329 HydrophobicContact CD2-CG 3.91Å; W306-Q329 HydrophobicContact CE3-CB 3.71Å; W306-Q329 HydrophobicContact CE3-CG 3.73Å; W306-Q329 HydrophobicContact CH2-CB 4.02Å; W306-Q329 HydrophobicContact CH2-CG 3.82Å; W306-Q329 HydrophobicContact CZ2-CG 3.94Å; W306-Q329 HydrophobicContact CZ3-CB 3.48Å; W306-Q329 VanDerWaalsContact CZ3-CB 3.48Å; W306-Q329 HydrophobicContact CZ3-CG 3.67Å; R325-Q329 PolarHBondContact O-N 3.28Å; R325-Q329 VanDerWaalsContact O-N 3.15Å; L326-Q329 PolarHBondContact O-N 3.06Å; L327-Q329 VanDerWaalsContact C-N 3.31Å; L327-Q329 PolarHBondContact O-N 3.09Å; Q329-F331 VanDerWaalsContact C-N 3.3Å; Q329-F331 PolarHBondContact O-N 3.41Å; Q329-V332 PolarHBondContact O-N 3.35Å; Q329-S333 WeakPolarHBondContact O-CB 3.2Å; Q329-S333 PolarHBondContact O-N 2.83Å; Q329-D338 HydrophobicContact CG-CB 4.33Å; Q329-D338 PolarHBondContact NE2-OD2 3.09Å
330	H	88.3	Confident	87.1	Confident	9 Å²	9	55.8 Å²	55.8	4%	0.042	28%	0.278	C	S	.	.	H	α-helix	trans	-63.5	-34	-176.4	-171.3	78.5	0	0	0	113.1	L326 L327 S328 N339 S342 T378	L326-H330 WeakPolarHBondContact O-CB 3.4Å; L326-H330 PolarHBondContact O-N 3.33Å; L326-H330 VanDerWaalsContact O-N 3.08Å; L327-H330 WeakPolarHBondContact O-CB 3.48Å; L327-H330 PolarHBondContact O-N 3.17Å; L327-H330 VanDerWaalsContact O-N 3.09Å; S328-H330 VanDerWaalsContact C-N 3.33Å; S328-H330 PolarHBondContact O-N 3.43Å; H330-N339 PolarHBondContact ND1-O 3.45Å; H330-N339 PolarHBondContact O-OD1 3.38Å; H330-S342 WeakPolarHBondContact CB-OG 3.3Å; H330-S342 PolarHBondContact ND1-OG 3.28Å; H330-T378 PolarHBondContact CE1-OG1 3.44Å; H330-T378 PolarHBondContact NE2-OG1 3Å
331	F	86.5	Confident	86.9	Confident	40 Å²	40	49.8 Å²	49.8	18%	0.175	26%	0.256	C	S	.	.	H	α-helix	trans	-88.7	-26.6	-179.8	-60.2	-46.8	0	0	0	114.1	L327 S328 Q329 L360 E363 T371 L374 A375	L327-F331 HydrophobicContact CB-CD2 4.48Å; L327-F331 HydrophobicContact CB-CE2 4.05Å; L327-F331 HydrophobicContact CD2-CE2 4.24Å; L327-F331 HydrophobicContact CD2-CZ 4.25Å; L327-F331 WeakPolarHBondContact O-CD2 3.31Å; L327-F331 WeakPolarHBondContact O-CG 3.42Å; L327-F331 PolarHBondContact O-N 3.15Å; S328-F331 PolarHBondContact O-N 3.43Å; Q329-F331 VanDerWaalsContact C-N 3.3Å; Q329-F331 PolarHBondContact O-N 3.41Å; F331-L360 HydrophobicContact CZ-CD2 4.06Å; F331-E363 HydrophobicContact CE2-CB 4.23Å; F331-E363 HydrophobicContact CE2-CG 3.57Å; F331-E363 HydrophobicContact CZ-CB 3.99Å; F331-E363 HydrophobicContact CZ-CG 3.79Å; F331-T371 HydrophobicContact CD1-CG2 3.96Å; F331-T371 HydrophobicContact CD2-CG2 4.17Å; F331-T371 HydrophobicContact CE1-CG2 4.01Å; F331-T371 HydrophobicContact CE2-CG2 4.23Å; F331-T371 HydrophobicContact CG-CG2 4.04Å; F331-T371 HydrophobicContact CZ-CG2 4.15Å; F331-L374 HydrophobicContact CD1-CB 3.84Å; F331-L374 HydrophobicContact CD1-CD1 3.99Å; F331-L374 HydrophobicContact CE1-CB 3.84Å; F331-A375 HydrophobicContact CE1-CB 4.43Å; F331-A375 HydrophobicContact CZ-CB 4.44Å
332	V	83.3	Confident	86.8	Confident	94 Å²	94	47.6 Å²	47.6	57%	0.57	24%	0.242	S	C	*	.	H	α-helix	trans	-93	-32.5	-177.3	176.6	0	0	0	0	112.3	S328 Q329 E334	S328-V332 WeakPolarHBondContact O-CB 3.49Å; S328-V332 VanDerWaalsContact O-CG2 3.28Å; S328-V332 WeakPolarHBondContact O-CG2 3.25Å; S328-V332 PolarHBondContact O-N 3.38Å; S328-V332 VanDerWaalsContact O-N 3.09Å; Q329-V332 PolarHBondContact O-N 3.35Å; V332-E334 PolarHBondContact O-N 3.26Å
333	S	78.5	Confident	86.6	Confident	16 Å²	16	47.9 Å²	47.9	11%	0.112	24%	0.244	C	C	.	.			trans	-74.9	123.6	-172.8	-167.9	0	0	0	0	112.3	Q329 V335 D338 N339	Q329-S333 WeakPolarHBondContact O-CB 3.2Å; Q329-S333 PolarHBondContact O-N 2.83Å; S333-V335 WeakPolarHBondContact OG-CB 3.44Å; S333-V335 PolarHBondContact OG-N 3.32Å; S333-V335 VanDerWaalsContact OG-N 3.17Å; S333-D338 WeakPolarHBondContact OG-CB 3.25Å; S333-D338 PolarHBondContact OG-OD2 2.9Å; S333-N339 PolarHBondContact O-ND2 2.93Å; S333-N339 PolarHBondContact O-OD1 3.03Å
334	E	72.5	Confident	86.4	Confident	192 Å²	192	50.5 Å²	50.5	90%	0.897	27%	0.266	S	S	*	.			trans	-80.1	-11.6	167.5	-60.3	-171.7	162.7	0	0	111.8	V332 H336	V332-E334 PolarHBondContact O-N 3.26Å; E334-H336 PolarHBondContact O-N 2.93Å
335	V	78	Confident	86.4	Confident	77 Å²	77	45.7 Å²	45.7	47%	0.467	24%	0.244	S	C	.	.			trans	-78	113.4	-178.1	-172	0	0	0	0	109.3	S333 T337 D338 N339	S333-V335 WeakPolarHBondContact OG-CB 3.44Å; S333-V335 PolarHBondContact OG-N 3.32Å; S333-V335 VanDerWaalsContact OG-N 3.17Å; V335-T337 VanDerWaalsContact CG1-OG1 3.28Å; V335-T337 WeakPolarHBondContact CG1-OG1 3.14Å; V335-T337 PolarHBondContact O-N 2.94Å; V335-T337 VanDerWaalsContact O-N 3.09Å; V335-D338 HydrophobicContact CB-CB 4.42Å; V335-D338 WeakPolarHBondContact O-CB 3.35Å; V335-D338 PolarHBondContact O-N 2.97Å; V335-N339 PolarHBondContact O-N 3.36Å
336	H	76.1	Confident	86.5	Confident	119 Å²	119	45.1 Å²	45.1	55%	0.551	24%	0.242	S	C	*	.	H	α-helix	trans	-57.1	-30	-176.4	-174	67.9	0	0	0	114.1	E334 K340	E334-H336 PolarHBondContact O-N 2.93Å; H336-K340 PolarHBondContact CD2-NZ 3.32Å; H336-K340 WeakPolarHBondContact NE2-CE 3.28Å; H336-K340 PolarHBondContact NE2-NZ 2.96Å; H336-K340 PolarHBondContact O-N 3.08Å
337	T	82.9	Confident	86.3	Confident	71 Å²	71	45.8 Å²	45.8	44%	0.436	25%	0.247	S	C	.	.	H	α-helix	trans	-70.6	-37.6	177.6	55.6	0	0	0	0	112.7	Y178 V335 N339 K340 Q341	Y178-T337 VanDerWaalsContact OH-C 3.29Å; Y178-T337 WeakPolarHBondContact OH-CB 3.29Å; Y178-T337 PolarHBondContact OH-OG1 3.32Å; V335-T337 VanDerWaalsContact CG1-OG1 3.28Å; V335-T337 WeakPolarHBondContact CG1-OG1 3.14Å; V335-T337 PolarHBondContact O-N 2.94Å; V335-T337 VanDerWaalsContact O-N 3.09Å; T337-N339 VanDerWaalsContact C-N 3.32Å; T337-N339 PolarHBondContact O-N 3.48Å; T337-K340 PolarHBondContact O-N 3.33Å; T337-Q341 WeakPolarHBondContact O-CB 3.2Å; T337-Q341 PolarHBondContact O-N 3.44Å
338	D	85.4	Confident	86.2	Confident	22 Å²	22	49 Å²	49	12%	0.118	27%	0.27	C	S	.	.	H	α-helix	trans	-64.7	-39.9	175.6	-77.5	-9.8	0	0	0	111.1	Y178 Q329 S333 V335 Q341 S342	Y178-D338 PolarHBondContact OH-N 3.49Å; Y178-D338 VanDerWaalsContact OH-N 3.14Å; Y178-D338 PolarHBondContact OH-OD1 3.46Å; Q329-D338 HydrophobicContact CG-CB 4.33Å; Q329-D338 PolarHBondContact NE2-OD2 3.09Å; S333-D338 WeakPolarHBondContact OG-CB 3.25Å; S333-D338 PolarHBondContact OG-OD2 2.9Å; V335-D338 HydrophobicContact CB-CB 4.42Å; V335-D338 WeakPolarHBondContact O-CB 3.35Å; V335-D338 PolarHBondContact O-N 2.97Å; D338-Q341 PolarHBondContact O-N 3.07Å; D338-S342 WeakPolarHBondContact O-CB 3.34Å; D338-S342 PolarHBondContact O-N 3.03Å; D338-S342 PolarHBondContact O-OG 2.91Å
339	N	84.3	Confident	86.3	Confident	29 Å²	29	47.6 Å²	47.6	16%	0.155	26%	0.26	C	S	.	.	H	α-helix	trans	-67.1	-38.3	179.4	-68.8	-14.5	0	0	0	111.7	H330 S333 V335 T337 S342 A343	H330-N339 PolarHBondContact ND1-O 3.45Å; H330-N339 PolarHBondContact O-OD1 3.38Å; S333-N339 PolarHBondContact O-ND2 2.93Å; S333-N339 PolarHBondContact O-OD1 3.03Å; V335-N339 PolarHBondContact O-N 3.36Å; T337-N339 VanDerWaalsContact C-N 3.32Å; T337-N339 PolarHBondContact O-N 3.48Å; N339-S342 WeakPolarHBondContact CA-OG 3.48Å; N339-S342 PolarHBondContact O-OG 3.27Å; N339-S342 VanDerWaalsContact O-OG 3.09Å; N339-A343 WeakPolarHBondContact O-CB 2.78Å; N339-A343 PolarHBondContact O-N 3.45Å
340	K	86.4	Confident	86.4	Confident	130 Å²	130	46.6 Å²	46.6	57%	0.565	26%	0.256	S	S	*	.	H	α-helix	trans	-64.7	-45.9	172.9	-80.9	176.1	160.8	162.4	0	112	H336 T337 A344	H336-K340 PolarHBondContact CD2-NZ 3.32Å; H336-K340 WeakPolarHBondContact NE2-CE 3.28Å; H336-K340 PolarHBondContact NE2-NZ 2.96Å; H336-K340 PolarHBondContact O-N 3.08Å; T337-K340 PolarHBondContact O-N 3.33Å; K340-A344 WeakPolarHBondContact O-CB 3.5Å; K340-A344 PolarHBondContact O-N 3.48Å
341	Q	90.2	Very high	86.4	Confident	19 Å²	19	49.2 Å²	49.2	9%	0.089	28%	0.275	C	S	.	.	H	α-helix	trans	-64.5	-49.3	-179.6	178.1	71	-10.3	0	0	112	S175 Y178 W306 T337 D338 A343 A344 L345	S175-Q341 PolarHBondContact O-NE2 3.36Å; Y178-Q341 HydrophobicContact CD1-CB 3.93Å; Y178-Q341 HydrophobicContact CD1-CG 3.52Å; Y178-Q341 HydrophobicContact CE1-CB 3.83Å; Y178-Q341 HydrophobicContact CE1-CG 3.82Å; Y178-Q341 HydrophobicContact CG-CG 4.31Å; W306-Q341 HydrophobicContact CZ2-CG 4.25Å; T337-Q341 WeakPolarHBondContact O-CB 3.2Å; T337-Q341 PolarHBondContact O-N 3.44Å; D338-Q341 PolarHBondContact O-N 3.07Å; Q341-A343 PolarHBondContact O-N 3.41Å; Q341-A344 PolarHBondContact O-N 3.29Å; Q341-L345 HydrophobicContact CG-CD1 4.26Å; Q341-L345 WeakPolarHBondContact O-CG 3.25Å; Q341-L345 PolarHBondContact O-N 3.04Å
342	S	91.5	Very high	86.5	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-60.8	-45	177.9	53.7	0	0	0	0	111.5	H330 D338 N339 A344 L345 L346	H330-S342 WeakPolarHBondContact CB-OG 3.3Å; H330-S342 PolarHBondContact ND1-OG 3.28Å; D338-S342 WeakPolarHBondContact O-CB 3.34Å; D338-S342 PolarHBondContact O-N 3.03Å; D338-S342 PolarHBondContact O-OG 2.91Å; N339-S342 WeakPolarHBondContact CA-OG 3.48Å; N339-S342 PolarHBondContact O-OG 3.27Å; N339-S342 VanDerWaalsContact O-OG 3.09Å; S342-A344 PolarHBondContact O-N 3.37Å; S342-L345 PolarHBondContact O-N 3.33Å; S342-L346 WeakPolarHBondContact O-CB 3.34Å; S342-L346 WeakPolarHBondContact O-CG 3.3Å; S342-L346 PolarHBondContact O-N 3.49Å
343	A	89.5	Confident	86.9	Confident	6 Å²	6	51.4 Å²	51.4	5%	0.05	28%	0.28	C	S	.	.	H	α-helix	trans	-61.3	-42.7	176.8	0	0	0	0	0	112.4	N339 Q341 L346 A347	N339-A343 WeakPolarHBondContact O-CB 2.78Å; N339-A343 PolarHBondContact O-N 3.45Å; Q341-A343 PolarHBondContact O-N 3.41Å; A343-L346 PolarHBondContact O-N 3.43Å; A343-A347 VanDerWaalsContact O-CB 3.28Å; A343-A347 WeakPolarHBondContact O-CB 3.33Å; A343-A347 PolarHBondContact O-N 2.86Å
344	A	90.5	Very high	87.4	Confident	55 Å²	55	55.4 Å²	55.4	46%	0.455	30%	0.304	S	S	.	.	H	α-helix	trans	-62.8	-43.9	177.8	0	0	0	0	0	112.3	K340 Q341 S342 A347 S348	K340-A344 WeakPolarHBondContact O-CB 3.5Å; K340-A344 PolarHBondContact O-N 3.48Å; Q341-A344 PolarHBondContact O-N 3.29Å; S342-A344 PolarHBondContact O-N 3.37Å; A344-A347 PolarHBondContact O-N 2.88Å; A344-S348 PolarHBondContact O-N 3.34Å
345	L	92.7	Very high	88.3	Confident	9 Å²	9	48.5 Å²	48.5	5%	0.047	27%	0.273	C	S	.	.	H	α-helix	trans	-65.5	-46.9	176.4	-69.9	172.6	0	0	0	111.4	Q310 A313 V314 L326 Q341 S342 A347 S348 I349	Q310-L345 HydrophobicContact CB-CD1 4.16Å; Q310-L345 HydrophobicContact CG-CD1 3.75Å; A313-L345 HydrophobicContact CB-CD2 4.37Å; V314-L345 HydrophobicContact CG2-CD2 3.82Å; L326-L345 HydrophobicContact CD1-CB 4.03Å; L326-L345 HydrophobicContact CD2-CD1 3.98Å; Q341-L345 HydrophobicContact CG-CD1 4.26Å; Q341-L345 WeakPolarHBondContact O-CG 3.25Å; Q341-L345 PolarHBondContact O-N 3.04Å; S342-L345 PolarHBondContact O-N 3.33Å; L345-A347 VanDerWaalsContact C-N 3.31Å; L345-A347 PolarHBondContact O-N 2.85Å; L345-S348 WeakPolarHBondContact O-CB 3.35Å; L345-S348 PolarHBondContact O-N 3.39Å; L345-S348 VanDerWaalsContact O-N 3.15Å; L345-I349 VanDerWaalsContact O-CG1 3.24Å; L345-I349 WeakPolarHBondContact O-CG1 3.41Å; L345-I349 PolarHBondContact O-N 3.39Å
346	L	93.9	Very high	89	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-59.7	-41.4	176.7	-71.1	168.5	0	0	0	111.8	I323 L326 L327 S342 A343 I349 S350 V356 T378	I323-L346 HydrophobicContact CG2-CD2 3.98Å; L326-L346 HydrophobicContact CB-CD2 3.96Å; L326-L346 HydrophobicContact CB-CG 4.2Å; L326-L346 HydrophobicContact CD1-CD2 4.17Å; L326-L346 HydrophobicContact CD1-CG 4.44Å; L327-L346 HydrophobicContact CD2-CD1 3.64Å; L327-L346 HydrophobicContact CD2-CD2 4.23Å; L327-L346 HydrophobicContact CG-CD1 4.31Å; L327-L346 HydrophobicContact CG-CD2 4.23Å; S342-L346 WeakPolarHBondContact O-CB 3.34Å; S342-L346 WeakPolarHBondContact O-CG 3.3Å; S342-L346 PolarHBondContact O-N 3.49Å; A343-L346 PolarHBondContact O-N 3.43Å; L346-I349 PolarHBondContact O-N 3.11Å; L346-S350 VanDerWaalsContact O-CB 3.3Å; L346-S350 WeakPolarHBondContact O-CB 3.48Å; L346-S350 PolarHBondContact O-N 2.92Å; L346-V356 HydrophobicContact CB-CG1 4.29Å; L346-V356 HydrophobicContact CD2-CG1 4.1Å; L346-V356 HydrophobicContact CD2-CG2 4.4Å; L346-T378 HydrophobicContact CD1-CG2 4.2Å
347	A	90.6	Very high	89.7	Confident	13 Å²	13	40.6 Å²	40.6	11%	0.107	23%	0.23	C	C	.	.	H	α-helix	trans	-63.6	-41.7	175.4	0	0	0	0	0	111.9	A343 A344 L345 S350	A343-A347 VanDerWaalsContact O-CB 3.28Å; A343-A347 WeakPolarHBondContact O-CB 3.33Å; A343-A347 PolarHBondContact O-N 2.86Å; A344-A347 PolarHBondContact O-N 2.88Å; L345-A347 VanDerWaalsContact C-N 3.31Å; L345-A347 PolarHBondContact O-N 2.85Å; A347-S350 PolarHBondContact O-N 3.37Å; A347-S350 PolarHBondContact O-OG 2.86Å
348	S	90.1	Very high	90	Very high	73 Å²	73	40.6 Å²	40.6	51%	0.51	23%	0.233	S	C	.	.	H	α-helix	trans	-60.4	-51.6	174.4	-171.1	0	0	0	0	111.4	A344 L345 S350 S351	A344-S348 PolarHBondContact O-N 3.34Å; L345-S348 WeakPolarHBondContact O-CB 3.35Å; L345-S348 PolarHBondContact O-N 3.39Å; L345-S348 VanDerWaalsContact O-N 3.15Å; S348-S350 VanDerWaalsContact C-N 3.29Å; S348-S350 PolarHBondContact O-N 3.48Å; S348-S351 PolarHBondContact O-N 3.4Å; S348-S351 PolarHBondContact O-OG 3.35Å
349	I	92.1	Very high	90.4	Very high	2 Å²	2	40.4 Å²	40.4	1%	0.01	23%	0.231	C	C	.	.	H	α-helix	trans	-60.9	-37.1	179.6	-64.6	168	0	0	0	111.5	A313 Y318 I323 L326 L345 L346 S351 K352 T353 V356	A313-I349 HydrophobicContact CB-CD1 3.85Å; Y318-I349 HydrophobicContact CD1-CB 4.13Å; Y318-I349 HydrophobicContact CD1-CG1 3.91Å; Y318-I349 HydrophobicContact CD1-CG2 3.56Å; Y318-I349 HydrophobicContact CE1-CB 4.48Å; Y318-I349 HydrophobicContact CE1-CG1 4.14Å; Y318-I349 HydrophobicContact CE1-CG2 4.34Å; Y318-I349 HydrophobicContact CG-CG2 4.17Å; I323-I349 HydrophobicContact CD1-CG2 4.1Å; I323-I349 HydrophobicContact CG1-CG2 4.26Å; L326-I349 HydrophobicContact CD1-CD1 3.64Å; L345-I349 VanDerWaalsContact O-CG1 3.24Å; L345-I349 WeakPolarHBondContact O-CG1 3.41Å; L345-I349 PolarHBondContact O-N 3.39Å; L346-I349 PolarHBondContact O-N 3.11Å; I349-S351 PolarHBondContact O-N 3.4Å; I349-K352 PolarHBondContact O-N 2.91Å; I349-T353 HydrophobicContact CG2-CG2 3.48Å; I349-T353 VanDerWaalsContact CG2-CG2 3.48Å; I349-T353 PolarHBondContact O-N 3.04Å; I349-T353 VanDerWaalsContact O-N 3.14Å; I349-V356 HydrophobicContact CB-CG2 4.14Å; I349-V356 HydrophobicContact CG2-CG2 3.56Å
350	S	91	Very high	90.8	Very high	3 Å²	3	39 Å²	39	2%	0.021	22%	0.224	C	C	.	.	H	α-helix	trans	-61.9	-18.2	-177.7	75.9	0	0	0	0	114.9	L346 A347 S348 K352 R357 K383	L346-S350 VanDerWaalsContact O-CB 3.3Å; L346-S350 WeakPolarHBondContact O-CB 3.48Å; L346-S350 PolarHBondContact O-N 2.92Å; A347-S350 PolarHBondContact O-N 3.37Å; A347-S350 PolarHBondContact O-OG 2.86Å; S348-S350 VanDerWaalsContact C-N 3.29Å; S348-S350 PolarHBondContact O-N 3.48Å; S350-K352 VanDerWaalsContact C-N 3.28Å; S350-R357 PolarHBondContact O-NH1 2.93Å; S350-K383 PolarHBondContact OG-N 3.09Å; S350-K383 VanDerWaalsContact OG-N 3.11Å
351	S	87.9	Confident	91	Very high	64 Å²	64	34.2 Å²	34.2	45%	0.448	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-16.8	173.4	71.3	0	0	0	0	113.3	S348 I349	S348-S351 PolarHBondContact O-N 3.4Å; S348-S351 PolarHBondContact O-OG 3.35Å; I349-S351 PolarHBondContact O-N 3.4Å
352	K	89.6	Confident	91.1	Very high	146 Å²	146	39 Å²	39	64%	0.635	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-111.7	-25	-175	-56.7	-60.8	-175.2	177.6	0	113.2	Y318 I349 S350	Y318-K352 HydrophobicContact CD2-CB 4.01Å; Y318-K352 HydrophobicContact CE1-CB 4.26Å; Y318-K352 HydrophobicContact CE1-CG 4.34Å; Y318-K352 HydrophobicContact CE2-CB 3.6Å; Y318-K352 HydrophobicContact CE2-CG 4Å; I349-K352 PolarHBondContact O-N 2.91Å; S350-K352 VanDerWaalsContact C-N 3.28Å
353	T	90.3	Very high	91.2	Very high	34 Å²	34	41.8 Å²	41.8	21%	0.209	24%	0.244	C	C	.	.			trans	-139.3	150	-179.8	-178.5	0	0	0	0	112.6	Y318 I323 I349 L355 V356	Y318-T353 HydrophobicContact CG-CG2 4.43Å; I323-T353 HydrophobicContact CD1-CG2 4.13Å; I349-T353 HydrophobicContact CG2-CG2 3.48Å; I349-T353 VanDerWaalsContact CG2-CG2 3.48Å; I349-T353 PolarHBondContact O-N 3.04Å; I349-T353 VanDerWaalsContact O-N 3.14Å; T353-L355 HydrophobicContact CG2-CB 4.41Å; T353-L355 WeakPolarHBondContact OG1-CB 3.49Å; T353-L355 PolarHBondContact OG1-N 3.21Å; T353-L355 VanDerWaalsContact OG1-N 3.13Å; T353-V356 HydrophobicContact CG2-CG2 4.2Å
354	T	89.3	Confident	91.4	Very high	100 Å²	100	41.5 Å²	41.5	61%	0.613	24%	0.242	S	C	*	.	S	Bend	trans	-82.6	-15.6	171.6	53.1	0	0	0	0	112.7	V356 R357 S358	T354-V356 VanDerWaalsContact C-N 3.28Å; T354-V356 PolarHBondContact O-N 3.22Å; T354-R357 WeakPolarHBondContact O-CB 3.28Å; T354-R357 PolarHBondContact O-N 3.41Å; T354-S358 PolarHBondContact O-N 3.41Å; T354-S358 VanDerWaalsContact O-N 3.16Å
355	L	91.6	Very high	91.6	Very high	47 Å²	47	43.8 Å²	43.8	25%	0.246	25%	0.247	C	C	.	.	H	α-helix	trans	-59.2	-36.5	-173.6	-178.1	56.4	0	0	0	113.1	R320 I323 T353 R357 S358 L359	R320-L355 HydrophobicContact CB-CD2 4.03Å; I323-L355 HydrophobicContact CD1-CB 4.09Å; I323-L355 HydrophobicContact CD1-CD2 3.91Å; I323-L355 HydrophobicContact CD1-CG 3.99Å; T353-L355 HydrophobicContact CG2-CB 4.41Å; T353-L355 WeakPolarHBondContact OG1-CB 3.49Å; T353-L355 PolarHBondContact OG1-N 3.21Å; T353-L355 VanDerWaalsContact OG1-N 3.13Å; L355-R357 VanDerWaalsContact C-N 3.27Å; L355-R357 PolarHBondContact O-N 3.18Å; L355-S358 PolarHBondContact O-N 3.27Å; L355-L359 HydrophobicContact CD1-CD1 4.13Å; L355-L359 HydrophobicContact CD1-CD2 4.48Å; L355-L359 HydrophobicContact CD1-CG 4Å; L355-L359 HydrophobicContact CG-CD1 4.07Å; L355-L359 HydrophobicContact CG-CG 4.38Å; L355-L359 WeakPolarHBondContact O-CG 3.16Å; L355-L359 PolarHBondContact O-N 3.4Å
356	V	92.3	Very high	91.6	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-56.3	-43.4	174.6	176.2	0	0	0	0	111.1	I323 L346 I349 T353 T354 L360 L382	I323-V356 HydrophobicContact CD1-CG2 3.81Å; I323-V356 HydrophobicContact CG1-CG2 4.15Å; I323-V356 HydrophobicContact CG2-CG2 3.94Å; L346-V356 HydrophobicContact CB-CG1 4.29Å; L346-V356 HydrophobicContact CD2-CG1 4.1Å; L346-V356 HydrophobicContact CD2-CG2 4.4Å; I349-V356 HydrophobicContact CB-CG2 4.14Å; I349-V356 HydrophobicContact CG2-CG2 3.56Å; T353-V356 HydrophobicContact CG2-CG2 4.2Å; T354-V356 VanDerWaalsContact C-N 3.28Å; T354-V356 PolarHBondContact O-N 3.22Å; V356-L360 HydrophobicContact CG1-CD1 3.8Å; V356-L360 WeakPolarHBondContact O-CB 3.49Å; V356-L360 WeakPolarHBondContact O-CD1 3.35Å; V356-L360 WeakPolarHBondContact O-CG 3.28Å; V356-L360 PolarHBondContact O-N 3.5Å; V356-L382 HydrophobicContact CG1-CD1 4.18Å; V356-L382 HydrophobicContact CG1-CD2 4.07Å
357	R	90.4	Very high	91.5	Very high	30 Å²	30	49.8 Å²	49.8	11%	0.113	29%	0.294	C	S	.	.	H	α-helix	trans	-68.2	-43.3	178.6	-67.3	179.7	177	78.9	-0.9	111.4	S350 T354 L355 L359 L360 A361 L382 K383 G384 P385	S350-R357 PolarHBondContact O-NH1 2.93Å; T354-R357 WeakPolarHBondContact O-CB 3.28Å; T354-R357 PolarHBondContact O-N 3.41Å; L355-R357 VanDerWaalsContact C-N 3.27Å; L355-R357 PolarHBondContact O-N 3.18Å; R357-L359 PolarHBondContact O-N 2.85Å; R357-L360 PolarHBondContact O-N 3.46Å; R357-A361 VanDerWaalsContact O-CB 3.26Å; R357-A361 WeakPolarHBondContact O-CB 3.47Å; R357-A361 PolarHBondContact O-N 3.5Å; R357-L382 HydrophobicContact CG-CD1 3.73Å; R357-K383 PolarHBondContact NH2-O 3.3Å; R357-G384 VanDerWaalsContact NH2-CA 3.33Å; R357-G384 PolarHBondContact NH2-O 3.16Å; R357-P385 PolarHBondContact NE-O 2.93Å
358	S	90.7	Very high	91.6	Very high	71 Å²	71	52.7 Å²	52.7	50%	0.497	31%	0.308	S	S	.	.	H	α-helix	trans	-60.8	-45.3	-179.9	-58.8	0	0	0	0	111.7	T354 L355 A361 E362	T354-S358 PolarHBondContact O-N 3.41Å; T354-S358 VanDerWaalsContact O-N 3.16Å; L355-S358 PolarHBondContact O-N 3.27Å; S358-A361 PolarHBondContact O-N 2.9Å; S358-E362 PolarHBondContact O-N 3.32Å; S358-E362 VanDerWaalsContact O-N 3.14Å
359	L	92.6	Very high	91.7	Very high	17 Å²	17	52 Å²	52	9%	0.089	29%	0.294	C	S	.	.	H	α-helix	trans	-67.4	-43.6	177.4	-65.7	174.8	0	0	0	111.5	I323 L327 L355 R357 A361 E362 E363	I323-L359 HydrophobicContact CB-CD1 4.2Å; I323-L359 HydrophobicContact CG2-CD1 3.69Å; L327-L359 HydrophobicContact CD1-CB 3.64Å; L327-L359 HydrophobicContact CD1-CD1 4.19Å; L355-L359 HydrophobicContact CD1-CD1 4.13Å; L355-L359 HydrophobicContact CD1-CD2 4.48Å; L355-L359 HydrophobicContact CD1-CG 4Å; L355-L359 HydrophobicContact CG-CD1 4.07Å; L355-L359 HydrophobicContact CG-CG 4.38Å; L355-L359 WeakPolarHBondContact O-CG 3.16Å; L355-L359 PolarHBondContact O-N 3.4Å; R357-L359 PolarHBondContact O-N 2.85Å; L359-A361 VanDerWaalsContact C-N 3.27Å; L359-A361 PolarHBondContact O-N 3.38Å; L359-E362 VanDerWaalsContact O-CB 3.31Å; L359-E362 WeakPolarHBondContact O-CB 3.35Å; L359-E362 PolarHBondContact O-N 3.28Å; L359-E362 VanDerWaalsContact O-N 3.16Å; L359-E363 WeakPolarHBondContact O-CG 3.45Å; L359-E363 PolarHBondContact O-N 3.06Å
360	L	92.8	Very high	91.7	Very high	0 Å²	0	59.4 Å²	59.4	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-63.1	-33	174.6	-76.9	165.9	0	0	0	113	L327 F331 V356 R357 E362 E363 L364 A375 T378 I379 L382	L327-L360 HydrophobicContact CD2-CD2 3.46Å; L327-L360 VanDerWaalsContact CD2-CD2 3.46Å; L327-L360 HydrophobicContact CD2-CG 3.85Å; F331-L360 HydrophobicContact CZ-CD2 4.06Å; V356-L360 HydrophobicContact CG1-CD1 3.8Å; V356-L360 WeakPolarHBondContact O-CB 3.49Å; V356-L360 WeakPolarHBondContact O-CD1 3.35Å; V356-L360 WeakPolarHBondContact O-CG 3.28Å; V356-L360 PolarHBondContact O-N 3.5Å; R357-L360 PolarHBondContact O-N 3.46Å; L360-E362 VanDerWaalsContact C-N 3.32Å; L360-E363 WeakPolarHBondContact O-CB 3.41Å; L360-E363 PolarHBondContact O-N 3.36Å; L360-L364 PolarHBondContact O-N 3.29Å; L360-A375 HydrophobicContact CD2-CB 4.25Å; L360-T378 HydrophobicContact CD1-CG2 3.83Å; L360-T378 HydrophobicContact CD2-CG2 4.25Å; L360-I379 HydrophobicContact CB-CD1 4.13Å; L360-I379 HydrophobicContact CB-CG1 3.91Å; L360-I379 HydrophobicContact CD1-CG1 4.12Å; L360-L382 HydrophobicContact CD1-CD1 3.79Å; L360-L382 HydrophobicContact CD1-CD2 4.42Å
361	A	92	Very high	91.8	Very high	30 Å²	30	60 Å²	60	25%	0.248	33%	0.325	C	S	.	.	H	α-helix	trans	-67.6	-33.2	175.7	0	0	0	0	0	112.1	R357 S358 L359 E363 L364 N365 L390	R357-A361 VanDerWaalsContact O-CB 3.26Å; R357-A361 WeakPolarHBondContact O-CB 3.47Å; R357-A361 PolarHBondContact O-N 3.5Å; S358-A361 PolarHBondContact O-N 2.9Å; L359-A361 VanDerWaalsContact C-N 3.27Å; L359-A361 PolarHBondContact O-N 3.38Å; A361-E363 VanDerWaalsContact C-N 3.35Å; A361-L364 WeakPolarHBondContact O-CB 3.39Å; A361-L364 PolarHBondContact O-N 2.94Å; A361-N365 PolarHBondContact O-ND2 3.43Å; A361-L390 HydrophobicContact CB-CD1 3.93Å
362	E	92.2	Very high	92.1	Very high	120 Å²	120	57.6 Å²	57.6	56%	0.561	31%	0.307	S	S	*	.	H	α-helix	trans	-61.9	-45.1	170.9	-168.3	175.8	170	0	0	110.5	S358 L359 L360 L364 N365	S358-E362 PolarHBondContact O-N 3.32Å; S358-E362 VanDerWaalsContact O-N 3.14Å; L359-E362 VanDerWaalsContact O-CB 3.31Å; L359-E362 WeakPolarHBondContact O-CB 3.35Å; L359-E362 PolarHBondContact O-N 3.28Å; L359-E362 VanDerWaalsContact O-N 3.16Å; L360-E362 VanDerWaalsContact C-N 3.32Å; E362-L364 PolarHBondContact O-N 3.35Å; E362-N365 WeakPolarHBondContact O-CB 3.35Å; E362-N365 PolarHBondContact O-N 3.18Å; E362-N365 PolarHBondContact O-ND2 2.95Å
363	E	93	Very high	92.3	Very high	57 Å²	57	52.4 Å²	52.4	27%	0.266	29%	0.285	S	S	.	.	H	α-helix	trans	-64.5	-23	179.6	-62.1	-65.3	162.8	0	0	113.9	F331 L359 L360 A361 N365 C366 T371 A375	F331-E363 HydrophobicContact CE2-CB 4.23Å; F331-E363 HydrophobicContact CE2-CG 3.57Å; F331-E363 HydrophobicContact CZ-CB 3.99Å; F331-E363 HydrophobicContact CZ-CG 3.79Å; L359-E363 WeakPolarHBondContact O-CG 3.45Å; L359-E363 PolarHBondContact O-N 3.06Å; L360-E363 WeakPolarHBondContact O-CB 3.41Å; L360-E363 PolarHBondContact O-N 3.36Å; A361-E363 VanDerWaalsContact C-N 3.35Å; E363-N365 PolarHBondContact O-N 2.96Å; E363-C366 WeakPolarHBondContact O-CB 3.27Å; E363-C366 PolarHBondContact O-N 2.89Å; E363-T371 HydrophobicContact CB-CG2 4.24Å; E363-T371 VanDerWaalsContact OE2-CG2 3.25Å; E363-T371 WeakPolarHBondContact OE2-CG2 3.35Å; E363-A375 HydrophobicContact CB-CB 4.14Å
364	L	94.5	Very high	92.4	Very high	0 Å²	0	53 Å²	53	0%	0	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-13.7	170.5	-67.2	-178.2	0	0	0	113.3	L360 A361 E362 R372 A375 I379 L390 K393 L394 L397	L360-L364 PolarHBondContact O-N 3.29Å; A361-L364 WeakPolarHBondContact O-CB 3.39Å; A361-L364 PolarHBondContact O-N 2.94Å; E362-L364 PolarHBondContact O-N 3.35Å; L364-R372 WeakPolarHBondContact O-CD 3.27Å; L364-A375 HydrophobicContact CD2-CB 3.77Å; L364-A375 HydrophobicContact CG-CB 4.44Å; L364-I379 HydrophobicContact CD1-CD1 3.78Å; L364-I379 HydrophobicContact CD2-CD1 4.05Å; L364-I379 HydrophobicContact CG-CD1 4.01Å; L364-L390 HydrophobicContact CD1-CD1 3.49Å; L364-L390 VanDerWaalsContact CD1-CD1 3.49Å; L364-K393 HydrophobicContact CB-CG 4.26Å; L364-K393 HydrophobicContact CD1-CG 3.94Å; L364-L394 HydrophobicContact CD1-CD2 4.01Å; L364-L394 HydrophobicContact CD1-CG 4.47Å; L364-L394 HydrophobicContact CD2-CD2 4.46Å; L364-L397 HydrophobicContact CB-CD1 4.05Å; L364-L397 HydrophobicContact CD1-CD1 4.38Å; L364-L397 HydrophobicContact CD2-CD1 3.87Å; L364-L397 HydrophobicContact CG-CD1 4.33Å
365	N	93.6	Very high	92.6	Very high	104 Å²	104	48.2 Å²	48.2	56%	0.556	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.5	0.3	174.2	-56.1	-67.6	0	0	0	112.9	A361 E362 E363 K393	A361-N365 PolarHBondContact O-ND2 3.43Å; E362-N365 WeakPolarHBondContact O-CB 3.35Å; E362-N365 PolarHBondContact O-N 3.18Å; E362-N365 PolarHBondContact O-ND2 2.95Å; E363-N365 PolarHBondContact O-N 2.96Å; N365-K393 VanDerWaalsContact OD1-CE 3.26Å; N365-K393 WeakPolarHBondContact OD1-CE 3.4Å; N365-K393 PolarHBondContact OD1-NZ 3.21Å
366	C	92.8	Very high	92.8	Very high	40 Å²	40	46 Å²	46	27%	0.27	25%	0.246	S	C	.	.			trans	-62.1	141	-179.4	-170.6	0	0	0	0	111.3	E363 N368 T371 R372	E363-C366 WeakPolarHBondContact O-CB 3.27Å; E363-C366 PolarHBondContact O-N 2.89Å; C366-N368 PolarHBondContact O-N 3.21Å; C366-T371 HydrophobicContact CB-CG2 3.96Å; C366-R372 HydrophobicContact CB-CG 4.5Å; C366-R372 WeakPolarHBondContact O-CD 3.36Å; C366-R372 WeakPolarHBondContact O-CG 3.31Å; C366-R372 PolarHBondContact O-NH1 3.35Å
367	A	91.8	Very high	92.7	Very high	94 Å²	94	48.4 Å²	48.4	78%	0.777	26%	0.259	S	S	*	.	S	Bend	trans	-62.9	-33.7	176.8	0	0	0	0	0	111.9	W369 R372	A367-W369 PolarHBondContact O-N 3.44Å; A367-R372 PolarHBondContact O-NH1 2.7Å
368	N	92.3	Very high	92.8	Very high	74 Å²	74	47.1 Å²	47.1	40%	0.396	25%	0.254	S	S	.	.			trans	-72.7	116.3	178.1	-174.1	-0.5	0	0	0	111.2	C366 R370 T371 R372	C366-N368 PolarHBondContact O-N 3.21Å; N368-R370 PolarHBondContact O-N 3.3Å; N368-R370 WeakPolarHBondContact OD1-CB 3.25Å; N368-R370 PolarHBondContact OD1-N 2.92Å; N368-T371 PolarHBondContact ND2-OG1 3.34Å; N368-T371 WeakPolarHBondContact O-CB 3.36Å; N368-T371 PolarHBondContact O-N 2.53Å; N368-R372 PolarHBondContact O-N 2.85Å
369	W	93.5	Very high	92.9	Very high	60 Å²	60	43.8 Å²	43.8	23%	0.227	23%	0.231	C	C	.	.	H	α-helix	trans	-63.2	-29.3	178.9	71.7	-87.6	0	0	0	113.2	A367 R372 L373 W402 N405 V406	A367-W369 PolarHBondContact O-N 3.44Å; W369-R372 PolarHBondContact O-N 2.85Å; W369-L373 HydrophobicContact CE3-CD2 4.45Å; W369-L373 HydrophobicContact CZ3-CD2 3.85Å; W369-L373 WeakPolarHBondContact O-CB 3.46Å; W369-L373 PolarHBondContact O-N 3.2Å; W369-W402 HydrophobicContact CB-CH2 4.23Å; W369-W402 HydrophobicContact CB-CZ2 3.57Å; W369-W402 AromaticContact CD1-CH2 3.37Å; W369-W402 AromaticContact CD1-CZ2 3.32Å; W369-W402 AromaticContact CG-CH2 3.82Å; W369-W402 HydrophobicContact CG-CH2 3.82Å; W369-W402 AromaticContact CG-CZ2 3.61Å; W369-W402 HydrophobicContact CG-CZ2 3.61Å; W369-W402 AromaticContact NE1-CH2 3.9Å; W369-N405 HydrophobicContact CZ3-CB 4.25Å; W369-V406 HydrophobicContact CB-CG2 4.26Å; W369-V406 HydrophobicContact CE3-CG2 4.4Å; W369-V406 WeakPolarHBondContact O-CG2 3.32Å
370	R	92	Very high	92.8	Very high	157 Å²	157	43.6 Å²	43.6	59%	0.592	23%	0.231	S	C	*	.	H	α-helix	trans	-66.4	-40.6	177.2	-68.1	-172.1	175.7	125.5	-3.8	111.3	N368 L373 L374	N368-R370 PolarHBondContact O-N 3.3Å; N368-R370 WeakPolarHBondContact OD1-CB 3.25Å; N368-R370 PolarHBondContact OD1-N 2.92Å; R370-L373 WeakPolarHBondContact O-CB 3.33Å; R370-L373 PolarHBondContact O-N 3.15Å; R370-L374 WeakPolarHBondContact O-CG 3.47Å; R370-L374 PolarHBondContact O-N 3.1Å
371	T	92.7	Very high	92.6	Very high	14 Å²	14	48.2 Å²	48.2	9%	0.086	25%	0.253	C	S	.	.	H	α-helix	trans	-62.1	-46.9	174.9	-54.1	0	0	0	0	110.7	F331 E363 C366 N368 L373 L374 A375	F331-T371 HydrophobicContact CD1-CG2 3.96Å; F331-T371 HydrophobicContact CD2-CG2 4.17Å; F331-T371 HydrophobicContact CE1-CG2 4.01Å; F331-T371 HydrophobicContact CE2-CG2 4.23Å; F331-T371 HydrophobicContact CG-CG2 4.04Å; F331-T371 HydrophobicContact CZ-CG2 4.15Å; E363-T371 HydrophobicContact CB-CG2 4.24Å; E363-T371 VanDerWaalsContact OE2-CG2 3.25Å; E363-T371 WeakPolarHBondContact OE2-CG2 3.35Å; C366-T371 HydrophobicContact CB-CG2 3.96Å; N368-T371 PolarHBondContact ND2-OG1 3.34Å; N368-T371 WeakPolarHBondContact O-CB 3.36Å; N368-T371 PolarHBondContact O-N 2.53Å; T371-L373 VanDerWaalsContact C-N 3.33Å; T371-L373 PolarHBondContact O-N 3.41Å; T371-L374 PolarHBondContact O-N 2.9Å; T371-A375 WeakPolarHBondContact O-CB 3.32Å; T371-A375 PolarHBondContact O-N 3.4Å
372	R	94.9	Very high	92.4	Very high	15 Å²	15	47.5 Å²	47.5	6%	0.057	25%	0.245	C	C	.	.	H	α-helix	trans	-60	-41.4	175.5	-61	-162.8	-57.6	-79.4	0.1	112.5	L364 C366 A367 N368 W369 A375 C376 D401 W402 V406	L364-R372 WeakPolarHBondContact O-CD 3.27Å; C366-R372 HydrophobicContact CB-CG 4.5Å; C366-R372 WeakPolarHBondContact O-CD 3.36Å; C366-R372 WeakPolarHBondContact O-CG 3.31Å; C366-R372 PolarHBondContact O-NH1 3.35Å; A367-R372 PolarHBondContact O-NH1 2.7Å; N368-R372 PolarHBondContact O-N 2.85Å; W369-R372 PolarHBondContact O-N 2.85Å; R372-A375 PolarHBondContact O-N 3.5Å; R372-C376 PolarHBondContact O-N 2.97Å; R372-C376 PolarHBondContact O-SG 2.93Å; R372-C376 VanDerWaalsContact O-SG 3.37Å; R372-D401 IonicContact CZ-OD1 3.46Å; R372-D401 IonicContact CZ-OD2 3.51Å; R372-D401 IonicContact NE-OD2 3.24Å; R372-D401 PolarHBondContact NE-OD2 3.08Å; R372-D401 VanDerWaalsContact NH2-CG 3.26Å; R372-D401 IonicContact NH2-OD1 2.82Å; R372-D401 PolarHBondContact NH2-OD1 3.21Å; R372-D401 IonicContact NH2-OD2 2.84Å; R372-D401 PolarHBondContact NH2-OD2 3.35Å; R372-W402 VanDerWaalsContact NH2-NE1 3.13Å; R372-V406 HydrophobicContact CB-CG1 4.14Å; R372-V406 HydrophobicContact CB-CG2 4.3Å
373	L	93.6	Very high	91.8	Very high	36 Å²	36	48.2 Å²	48.2	19%	0.188	25%	0.246	C	C	.	.	H	α-helix	trans	-59.8	-50.7	176	172.2	61.5	0	0	0	111.7	W369 R370 T371 A375 C376 N377 N405 V406 A409	W369-L373 HydrophobicContact CE3-CD2 4.45Å; W369-L373 HydrophobicContact CZ3-CD2 3.85Å; W369-L373 WeakPolarHBondContact O-CB 3.46Å; W369-L373 PolarHBondContact O-N 3.2Å; R370-L373 WeakPolarHBondContact O-CB 3.33Å; R370-L373 PolarHBondContact O-N 3.15Å; T371-L373 VanDerWaalsContact C-N 3.33Å; T371-L373 PolarHBondContact O-N 3.41Å; L373-A375 VanDerWaalsContact C-N 3.33Å; L373-A375 PolarHBondContact O-N 2.95Å; L373-C376 PolarHBondContact O-N 3.37Å; L373-N377 PolarHBondContact O-N 3.42Å; L373-N377 PolarHBondContact O-ND2 2.83Å; L373-N405 HydrophobicContact CD1-CB 4.45Å; L373-N405 HydrophobicContact CD2-CB 4.33Å; L373-V406 HydrophobicContact CB-CG2 4.09Å; L373-A409 HydrophobicContact CD1-CB 3.4Å; L373-A409 VanDerWaalsContact CD1-CB 3.4Å
374	L	91.8	Very high	90.9	Very high	46 Å²	46	47.7 Å²	47.7	24%	0.241	26%	0.256	C	S	.	.	H	α-helix	trans	-63.3	-40.5	178.2	-70.5	173.4	0	0	0	111.3	F331 R370 T371 N377 T378	F331-L374 HydrophobicContact CD1-CB 3.84Å; F331-L374 HydrophobicContact CD1-CD1 3.99Å; F331-L374 HydrophobicContact CE1-CB 3.84Å; R370-L374 WeakPolarHBondContact O-CG 3.47Å; R370-L374 PolarHBondContact O-N 3.1Å; T371-L374 PolarHBondContact O-N 2.9Å; L374-N377 PolarHBondContact O-N 3.31Å; L374-T378 WeakPolarHBondContact O-CB 3.38Å; L374-T378 PolarHBondContact O-N 2.98Å; L374-T378 PolarHBondContact O-OG1 3.03Å; L374-T378 VanDerWaalsContact O-OG1 3.11Å
375	A	94.1	Very high	90	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-60.1	-48.3	175.1	0	0	0	0	0	111.8	F331 L360 E363 L364 T371 R372 L373 N377 T378 I379	F331-A375 HydrophobicContact CE1-CB 4.43Å; F331-A375 HydrophobicContact CZ-CB 4.44Å; L360-A375 HydrophobicContact CD2-CB 4.25Å; E363-A375 HydrophobicContact CB-CB 4.14Å; L364-A375 HydrophobicContact CD2-CB 3.77Å; L364-A375 HydrophobicContact CG-CB 4.44Å; T371-A375 WeakPolarHBondContact O-CB 3.32Å; T371-A375 PolarHBondContact O-N 3.4Å; R372-A375 PolarHBondContact O-N 3.5Å; L373-A375 VanDerWaalsContact C-N 3.33Å; L373-A375 PolarHBondContact O-N 2.95Å; A375-N377 VanDerWaalsContact C-N 3.35Å; A375-N377 PolarHBondContact O-N 2.98Å; A375-T378 PolarHBondContact O-N 3.49Å; A375-I379 WeakPolarHBondContact O-CB 3.1Å; A375-I379 WeakPolarHBondContact O-CD1 3.16Å; A375-I379 WeakPolarHBondContact O-CG1 3.29Å; A375-I379 PolarHBondContact O-N 2.82Å
376	C	94.6	Very high	89.4	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-56.4	-46.9	174.5	-73.7	0	0	0	0	112.1	R372 L373 T378 I379 S380 A409	R372-C376 PolarHBondContact O-N 2.97Å; R372-C376 PolarHBondContact O-SG 2.93Å; R372-C376 VanDerWaalsContact O-SG 3.37Å; L373-C376 PolarHBondContact O-N 3.37Å; C376-T378 PolarHBondContact O-N 3.37Å; C376-I379 PolarHBondContact O-N 3.14Å; C376-S380 PolarHBondContact O-N 2.87Å; C376-S380 VanDerWaalsContact O-N 3.13Å; C376-A409 HydrophobicContact CB-CB 3.82Å
377	N	92	Very high	89.1	Confident	51 Å²	51	51.9 Å²	51.9	27%	0.273	28%	0.282	S	S	.	.	H	α-helix	trans	-62.9	-43.3	179.9	-74.6	-24.8	0	0	0	112.1	L373 L374 A375 S380	L373-N377 PolarHBondContact O-N 3.42Å; L373-N377 PolarHBondContact O-ND2 2.83Å; L374-N377 PolarHBondContact O-N 3.31Å; A375-N377 VanDerWaalsContact C-N 3.35Å; A375-N377 PolarHBondContact O-N 2.98Å; N377-S380 WeakPolarHBondContact O-CB 3.21Å; N377-S380 PolarHBondContact O-N 2.55Å; N377-S380 PolarHBondContact O-OG 3.14Å
378	T	91.4	Very high	89	Confident	3 Å²	3	55.7 Å²	55.7	2%	0.018	28%	0.281	C	S	.	.	H	α-helix	trans	-70.4	-41.2	-180	-63.9	0	0	0	0	111.5	H330 L346 L360 L374 A375 C376 S380 Q381 L382	H330-T378 PolarHBondContact CE1-OG1 3.44Å; H330-T378 PolarHBondContact NE2-OG1 3Å; L346-T378 HydrophobicContact CD1-CG2 4.2Å; L360-T378 HydrophobicContact CD1-CG2 3.83Å; L360-T378 HydrophobicContact CD2-CG2 4.25Å; L374-T378 WeakPolarHBondContact O-CB 3.38Å; L374-T378 PolarHBondContact O-N 2.98Å; L374-T378 PolarHBondContact O-OG1 3.03Å; L374-T378 VanDerWaalsContact O-OG1 3.11Å; A375-T378 PolarHBondContact O-N 3.49Å; C376-T378 PolarHBondContact O-N 3.37Å; T378-S380 PolarHBondContact O-N 3.17Å; T378-Q381 PolarHBondContact O-N 2.95Å; T378-L382 HydrophobicContact CG2-CD2 4.39Å; T378-L382 WeakPolarHBondContact O-CG 3.28Å; T378-L382 PolarHBondContact O-N 3.03Å
379	I	92.8	Very high	88.9	Confident	2 Å²	2	57.9 Å²	57.9	1%	0.01	29%	0.293	C	S	.	.	H	α-helix	trans	-54.7	-40.2	173	-72.1	162.6	0	0	0	110.8	L360 L364 A375 C376 Q381 L382 L390 L394 L417	L360-I379 HydrophobicContact CB-CD1 4.13Å; L360-I379 HydrophobicContact CB-CG1 3.91Å; L360-I379 HydrophobicContact CD1-CG1 4.12Å; L364-I379 HydrophobicContact CD1-CD1 3.78Å; L364-I379 HydrophobicContact CD2-CD1 4.05Å; L364-I379 HydrophobicContact CG-CD1 4.01Å; A375-I379 WeakPolarHBondContact O-CB 3.1Å; A375-I379 WeakPolarHBondContact O-CD1 3.16Å; A375-I379 WeakPolarHBondContact O-CG1 3.29Å; A375-I379 PolarHBondContact O-N 2.82Å; C376-I379 PolarHBondContact O-N 3.14Å; I379-Q381 PolarHBondContact O-N 2.82Å; I379-Q381 VanDerWaalsContact O-N 3.14Å; I379-L382 PolarHBondContact O-N 2.94Å; I379-L390 HydrophobicContact CD1-CD1 4.13Å; I379-L390 HydrophobicContact CG2-CD2 4.1Å; I379-L394 HydrophobicContact CG2-CD1 4.31Å; I379-L417 HydrophobicContact CG2-CD1 3.73Å
380	S	90.1	Very high	88.8	Confident	13 Å²	13	55.2 Å²	55.2	9%	0.091	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-14.4	179.6	85.9	0	0	0	0	115.1	C376 N377 T378	C376-S380 PolarHBondContact O-N 2.87Å; C376-S380 VanDerWaalsContact O-N 3.13Å; N377-S380 WeakPolarHBondContact O-CB 3.21Å; N377-S380 PolarHBondContact O-N 2.55Å; N377-S380 PolarHBondContact O-OG 3.14Å; T378-S380 PolarHBondContact O-N 3.17Å
381	Q	89.3	Confident	88.7	Confident	97 Å²	97	48.2 Å²	48.2	45%	0.453	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.4	-7.2	-179.6	-61.3	176.4	17.6	0	0	112.8	T378 I379	T378-Q381 PolarHBondContact O-N 2.95Å; I379-Q381 PolarHBondContact O-N 2.82Å; I379-Q381 VanDerWaalsContact O-N 3.14Å
382	L	87.7	Confident	88.7	Confident	14 Å²	14	52.2 Å²	52.2	7%	0.073	28%	0.279	C	S	.	.			trans	-73.2	149.5	-177.9	-54.4	-176.7	0	0	0	111.3	V356 R357 L360 T378 I379	V356-L382 HydrophobicContact CG1-CD1 4.18Å; V356-L382 HydrophobicContact CG1-CD2 4.07Å; R357-L382 HydrophobicContact CG-CD1 3.73Å; L360-L382 HydrophobicContact CD1-CD1 3.79Å; L360-L382 HydrophobicContact CD1-CD2 4.42Å; T378-L382 HydrophobicContact CG2-CD2 4.39Å; T378-L382 WeakPolarHBondContact O-CG 3.28Å; T378-L382 PolarHBondContact O-N 3.03Å; I379-L382 PolarHBondContact O-N 2.94Å
383	K	80.3	Confident	88.7	Confident	135 Å²	135	54.1 Å²	54.1	59%	0.587	29%	0.288	S	S	*	.			trans	-97.5	125.7	-178.2	-68	-176.9	179.3	179.4	0	111.3	S350 R357	S350-K383 PolarHBondContact OG-N 3.09Å; S350-K383 VanDerWaalsContact OG-N 3.11Å; R357-K383 PolarHBondContact NH2-O 3.3Å
384	G	74	Confident	88.8	Confident	46 Å²	46	52.4 Å²	52.4	47%	0.474	28%	0.279	S	S	.	.	S	Bend	trans	112.9	167.9	174.9	0	0	0	0	0	113.4	R357	R357-G384 VanDerWaalsContact NH2-CA 3.33Å; R357-G384 PolarHBondContact NH2-O 3.16Å
385	P	74.2	Confident	88.9	Confident	123 Å²	123	52 Å²	52	80%	0.799	28%	0.277	S	S	*	.	P	Polyproline II helix	trans	-64.4	153.9	-170.8	28	-35.4	0	0	0	112.4	R357	R357-P385 PolarHBondContact NE-O 2.93Å
386	I	82.6	Confident	89	Confident	22 Å²	22	58.2 Å²	58.2	11%	0.113	30%	0.301	C	S	.	.	P	Polyproline II helix	trans	-95.3	145.4	174.2	78.6	174.3	0	0	0	109.9	A391 L417 M419	I386-A391 HydrophobicContact CD1-CB 3.5Å; I386-A391 HydrophobicContact CG1-CB 4.18Å; I386-L417 HydrophobicContact CD1-CB 4.32Å; I386-L417 HydrophobicContact CD1-CD1 4.31Å; I386-L417 HydrophobicContact CG2-CB 3.86Å; I386-L417 HydrophobicContact CG2-CD1 3.69Å; I386-L417 HydrophobicContact CG2-CD2 3.6Å; I386-L417 HydrophobicContact CG2-CG 3.87Å; I386-M419 HydrophobicContact CD1-CE 3.97Å; I386-M419 HydrophobicContact CD1-CG 3.85Å; I386-M419 HydrophobicContact CG1-CE 3.68Å
387	N	86.6	Confident	89.1	Confident	88 Å²	88	58.5 Å²	58.5	47%	0.471	30%	0.303	S	S	.	.	P	Polyproline II helix	trans	-75.2	158.9	169.6	66.7	-13.7	0	0	0	110.4	D389 L390 A391	N387-D389 VanDerWaalsContact C-N 3.28Å; N387-D389 PolarHBondContact O-N 3.06Å; N387-L390 PolarHBondContact O-N 3.4Å; N387-L390 WeakPolarHBondContact OD1-CB 3.43Å; N387-L390 PolarHBondContact OD1-N 2.86Å; N387-L390 VanDerWaalsContact OD1-N 3.15Å; N387-A391 PolarHBondContact O-N 3.44Å; N387-A391 VanDerWaalsContact O-N 3.16Å
388	K	88	Confident	89.2	Confident	174 Å²	174	56.1 Å²	56.1	76%	0.757	29%	0.29	S	S	*	.	H	α-helix	trans	-61.5	-36.7	-179	-68.6	-178.4	177.5	179.4	0	112.3	A391 N392	K388-A391 WeakPolarHBondContact O-CB 3.4Å; K388-A391 PolarHBondContact O-N 2.48Å; K388-N392 WeakPolarHBondContact O-CB 3.32Å; K388-N392 PolarHBondContact O-N 3.15Å; K388-N392 PolarHBondContact O-ND2 3.35Å
389	D	90.2	Very high	89.3	Confident	119 Å²	119	57.5 Å²	57.5	64%	0.636	30%	0.295	S	S	*	.	H	α-helix	trans	-66	-41.6	-178.6	-56.1	-42.2	0	0	0	112.4	N387 N392 K393	N387-D389 VanDerWaalsContact C-N 3.28Å; N387-D389 PolarHBondContact O-N 3.06Å; D389-N392 PolarHBondContact O-N 3.46Å; D389-K393 WeakPolarHBondContact O-CB 3.14Å; D389-K393 PolarHBondContact O-N 3.4Å
390	L	91.4	Very high	89.4	Confident	5 Å²	5	62 Å²	62	3%	0.026	32%	0.319	C	S	.	.	H	α-helix	trans	-66.8	-39.9	174.9	-175.2	60	0	0	0	111.3	A361 L364 I379 N387 K393 L394	A361-L390 HydrophobicContact CB-CD1 3.93Å; L364-L390 HydrophobicContact CD1-CD1 3.49Å; L364-L390 VanDerWaalsContact CD1-CD1 3.49Å; I379-L390 HydrophobicContact CD1-CD1 4.13Å; I379-L390 HydrophobicContact CG2-CD2 4.1Å; N387-L390 PolarHBondContact O-N 3.4Å; N387-L390 WeakPolarHBondContact OD1-CB 3.43Å; N387-L390 PolarHBondContact OD1-N 2.86Å; N387-L390 VanDerWaalsContact OD1-N 3.15Å; L390-K393 PolarHBondContact O-N 2.9Å; L390-L394 HydrophobicContact CG-CD1 4.35Å; L390-L394 WeakPolarHBondContact O-CG 3.38Å; L390-L394 PolarHBondContact O-N 2.95Å
391	A	91.5	Very high	89.6	Confident	9 Å²	9	61.9 Å²	61.9	7%	0.074	32%	0.317	C	S	.	.	H	α-helix	trans	-57.3	-50.5	174.1	0	0	0	0	0	110.7	I386 N387 K388 K393 L394 I395	I386-A391 HydrophobicContact CD1-CB 3.5Å; I386-A391 HydrophobicContact CG1-CB 4.18Å; N387-A391 PolarHBondContact O-N 3.44Å; N387-A391 VanDerWaalsContact O-N 3.16Å; K388-A391 WeakPolarHBondContact O-CB 3.4Å; K388-A391 PolarHBondContact O-N 2.48Å; A391-K393 VanDerWaalsContact C-N 3.33Å; A391-K393 PolarHBondContact O-N 3.32Å; A391-L394 PolarHBondContact O-N 3.09Å; A391-I395 VanDerWaalsContact O-CG1 3.31Å; A391-I395 WeakPolarHBondContact O-CG1 3.26Å; A391-I395 PolarHBondContact O-N 2.9Å
392	N	92.6	Very high	89.8	Confident	98 Å²	98	65.8 Å²	65.8	52%	0.524	33%	0.328	S	S	.	.	H	α-helix	trans	-61.6	-40	178.2	-69.6	-18.1	0	0	0	111.8	K388 D389 I395 Y396	K388-N392 WeakPolarHBondContact O-CB 3.32Å; K388-N392 PolarHBondContact O-N 3.15Å; K388-N392 PolarHBondContact O-ND2 3.35Å; D389-N392 PolarHBondContact O-N 3.46Å; N392-I395 PolarHBondContact O-N 3.37Å; N392-Y396 WeakPolarHBondContact O-CB 3.47Å; N392-Y396 PolarHBondContact O-N 3.11Å
393	K	94.8	Very high	90.1	Very high	56 Å²	56	65.7 Å²	65.7	24%	0.243	33%	0.328	C	S	.	.	H	α-helix	trans	-64	-43.3	175.7	-178.9	64.6	-174	-170.6	0	111.9	L364 N365 D389 L390 A391 Y396 L397	L364-K393 HydrophobicContact CB-CG 4.26Å; L364-K393 HydrophobicContact CD1-CG 3.94Å; N365-K393 VanDerWaalsContact OD1-CE 3.26Å; N365-K393 WeakPolarHBondContact OD1-CE 3.4Å; N365-K393 PolarHBondContact OD1-NZ 3.21Å; D389-K393 WeakPolarHBondContact O-CB 3.14Å; D389-K393 PolarHBondContact O-N 3.4Å; L390-K393 PolarHBondContact O-N 2.9Å; A391-K393 VanDerWaalsContact C-N 3.33Å; A391-K393 PolarHBondContact O-N 3.32Å; K393-Y396 WeakPolarHBondContact O-CB 3.39Å; K393-Y396 PolarHBondContact O-N 3.5Å; K393-L397 WeakPolarHBondContact O-CG 3.46Å; K393-L397 PolarHBondContact O-N 2.88Å
394	L	95.6	Very high	90.7	Very high	0 Å²	0	61.1 Å²	61.1	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-65.3	-41.1	176	-70.8	172.8	0	0	0	111.5	L364 I379 L390 A391 Y396 L397 M398 A410 A413 L414 L417	L364-L394 HydrophobicContact CD1-CD2 4.01Å; L364-L394 HydrophobicContact CD1-CG 4.47Å; L364-L394 HydrophobicContact CD2-CD2 4.46Å; I379-L394 HydrophobicContact CG2-CD1 4.31Å; L390-L394 HydrophobicContact CG-CD1 4.35Å; L390-L394 WeakPolarHBondContact O-CG 3.38Å; L390-L394 PolarHBondContact O-N 2.95Å; A391-L394 PolarHBondContact O-N 3.09Å; L394-Y396 VanDerWaalsContact C-N 3.31Å; L394-Y396 PolarHBondContact O-N 3.08Å; L394-L397 PolarHBondContact O-N 3.31Å; L394-M398 WeakPolarHBondContact O-CB 3.1Å; L394-M398 PolarHBondContact O-N 3.49Å; L394-A410 HydrophobicContact CD2-CB 4.35Å; L394-A413 HydrophobicContact CD1-CB 4.32Å; L394-L414 HydrophobicContact CB-CD1 4.14Å; L394-L414 HydrophobicContact CB-CD2 3.81Å; L394-L414 HydrophobicContact CB-CG 3.84Å; L394-L414 HydrophobicContact CD1-CD2 4.17Å; L394-L414 HydrophobicContact CD1-CG 4.39Å; L394-L417 HydrophobicContact CD1-CD1 4.05Å
395	I	94.3	Very high	91.6	Very high	36 Å²	36	62.9 Å²	62.9	19%	0.185	32%	0.318	C	S	.	.	H	α-helix	trans	-61.3	-42.1	173.9	-68.5	166.3	0	0	0	110.3	A391 N392 M398 W399 L414	A391-I395 VanDerWaalsContact O-CG1 3.31Å; A391-I395 WeakPolarHBondContact O-CG1 3.26Å; A391-I395 PolarHBondContact O-N 2.9Å; N392-I395 PolarHBondContact O-N 3.37Å; I395-M398 WeakPolarHBondContact O-CB 3.3Å; I395-M398 PolarHBondContact O-N 2.65Å; I395-W399 VanDerWaalsContact O-CD1 3.24Å; I395-W399 PolarHBondContact O-N 3.29Å; I395-L414 HydrophobicContact CB-CD1 4.44Å; I395-L414 HydrophobicContact CG1-CD1 3.6Å; I395-L414 HydrophobicContact CG1-CD2 4.11Å
396	Y	94.9	Very high	92.6	Very high	132 Å²	132	57 Å²	57	52%	0.518	28%	0.28	S	S	.	.	H	α-helix	trans	-61.4	-47.5	175.8	177.9	-91	0	0	0	111.8	N392 K393 L394 M398 W399 N400	N392-Y396 WeakPolarHBondContact O-CB 3.47Å; N392-Y396 PolarHBondContact O-N 3.11Å; K393-Y396 WeakPolarHBondContact O-CB 3.39Å; K393-Y396 PolarHBondContact O-N 3.5Å; L394-Y396 VanDerWaalsContact C-N 3.31Å; L394-Y396 PolarHBondContact O-N 3.08Å; Y396-M398 VanDerWaalsContact C-N 3.35Å; Y396-M398 PolarHBondContact O-N 3.33Å; Y396-W399 PolarHBondContact O-N 3.41Å; Y396-N400 HydrophobicContact CD1-CB 4.38Å; Y396-N400 HydrophobicContact CD2-CB 4.39Å; Y396-N400 VanDerWaalsContact CD2-ND2 3.3Å; Y396-N400 WeakPolarHBondContact CD2-ND2 3.17Å; Y396-N400 HydrophobicContact CE1-CB 3.98Å; Y396-N400 HydrophobicContact CE2-CB 3.99Å; Y396-N400 WeakPolarHBondContact CE2-ND2 3.19Å; Y396-N400 WeakPolarHBondContact O-CB 3.27Å; Y396-N400 PolarHBondContact O-N 3.39Å; Y396-N400 PolarHBondContact O-ND2 3.44Å
397	L	96.4	Very high	93.2	Very high	6 Å²	6	57.3 Å²	57.3	3%	0.031	28%	0.28	C	S	.	.	H	α-helix	trans	-64.3	-38.6	178.1	-71.3	177.7	0	0	0	112.3	L364 K393 L394 W399 D401 A410	L364-L397 HydrophobicContact CB-CD1 4.05Å; L364-L397 HydrophobicContact CD1-CD1 4.38Å; L364-L397 HydrophobicContact CD2-CD1 3.87Å; L364-L397 HydrophobicContact CG-CD1 4.33Å; K393-L397 WeakPolarHBondContact O-CG 3.46Å; K393-L397 PolarHBondContact O-N 2.88Å; L394-L397 PolarHBondContact O-N 3.31Å; L397-W399 PolarHBondContact O-N 3Å; L397-W399 VanDerWaalsContact O-N 3.16Å; L397-D401 HydrophobicContact CD2-CB 4.4Å; L397-D401 WeakPolarHBondContact O-CB 3.38Å; L397-D401 PolarHBondContact O-N 2.96Å; L397-D401 VanDerWaalsContact O-N 3.14Å; L397-A410 HydrophobicContact CB-CB 4.11Å
398	M	95.3	Very high	93.5	Very high	1 Å²	1	55.6 Å²	55.6	1%	0.005	27%	0.269	C	S	.	.	H	α-helix	trans	-53.3	-35	176.1	177	174.6	83	0	0	112.3	L394 I395 Y396 K407 A410 A411 L414 V423 L445	L394-M398 WeakPolarHBondContact O-CB 3.1Å; L394-M398 PolarHBondContact O-N 3.49Å; I395-M398 WeakPolarHBondContact O-CB 3.3Å; I395-M398 PolarHBondContact O-N 2.65Å; Y396-M398 VanDerWaalsContact C-N 3.35Å; Y396-M398 PolarHBondContact O-N 3.33Å; M398-K407 VanDerWaalsContact O-CB 3.31Å; M398-K407 WeakPolarHBondContact O-CB 3.43Å; M398-K407 WeakPolarHBondContact O-CD 3.43Å; M398-K407 VanDerWaalsContact O-CG 3.31Å; M398-K407 WeakPolarHBondContact O-CG 3.03Å; M398-A410 HydrophobicContact CB-CB 4.16Å; M398-A411 HydrophobicContact CG-CB 3.85Å; M398-A411 HydrophobicContact SD-CB 3.51Å; M398-A411 VanDerWaalsContact SD-CB 3.51Å; M398-L414 HydrophobicContact SD-CD1 4.01Å; M398-V423 HydrophobicContact SD-CG1 4.09Å; M398-V423 HydrophobicContact SD-CG2 4.2Å; M398-L445 HydrophobicContact CE-CD2 4.44Å; M398-L445 HydrophobicContact CG-CD2 3.55Å; M398-L445 HydrophobicContact SD-CD2 3.77Å
399	W	93.4	Very high	93.9	Very high	32 Å²	32	47.4 Å²	47.4	12%	0.121	24%	0.235	C	C	.	.	H	α-helix	trans	-100.2	-39.2	-177.5	-68.4	121.3	0	0	0	114.3	I395 Y396 L397 K407 E426 L427 K430 E441 A442 L445	I395-W399 VanDerWaalsContact O-CD1 3.24Å; I395-W399 PolarHBondContact O-N 3.29Å; Y396-W399 PolarHBondContact O-N 3.41Å; L397-W399 PolarHBondContact O-N 3Å; L397-W399 VanDerWaalsContact O-N 3.16Å; W399-K407 WeakPolarHBondContact O-CE 3.46Å; W399-K407 PolarHBondContact O-NZ 2.86Å; W399-E426 HydrophobicContact CZ2-CB 4.15Å; W399-L427 HydrophobicContact CH2-CD2 3.87Å; W399-L427 HydrophobicContact CZ2-CD2 4.35Å; W399-K430 HydrophobicContact CH2-CB 4.25Å; W399-K430 HydrophobicContact CH2-CG 3.84Å; W399-K430 HydrophobicContact CZ2-CG 3.82Å; W399-K430 HydrophobicContact CZ3-CG 4.49Å; W399-E441 HydrophobicContact CZ3-CB 4.2Å; W399-A442 HydrophobicContact CH2-CB 4.03Å; W399-A442 HydrophobicContact CZ3-CB 4.35Å; W399-L445 HydrophobicContact CH2-CD2 4.27Å; W399-L445 HydrophobicContact CZ3-CD2 4.41Å
400	N	93.3	Very high	94.2	Very high	96 Å²	96	41.8 Å²	41.8	51%	0.513	20%	0.204	S	C	.	.	H	α-helix	trans	-109.6	-5.4	-163.8	-56.3	-74.9	0	0	0	114.1	Y396	Y396-N400 HydrophobicContact CD1-CB 4.38Å; Y396-N400 HydrophobicContact CD2-CB 4.39Å; Y396-N400 VanDerWaalsContact CD2-ND2 3.3Å; Y396-N400 WeakPolarHBondContact CD2-ND2 3.17Å; Y396-N400 HydrophobicContact CE1-CB 3.98Å; Y396-N400 HydrophobicContact CE2-CB 3.99Å; Y396-N400 WeakPolarHBondContact CE2-ND2 3.19Å; Y396-N400 WeakPolarHBondContact O-CB 3.27Å; Y396-N400 PolarHBondContact O-N 3.39Å; Y396-N400 PolarHBondContact O-ND2 3.44Å
401	D	96	Very high	94.3	Very high	10 Å²	10	41.6 Å²	41.6	5%	0.053	20%	0.204	C	C	.	.			trans	-67.4	141.8	175.7	-158.4	-73.2	0	0	0	110.8	R372 L397 S403 V406 K407	R372-D401 IonicContact CZ-OD1 3.46Å; R372-D401 IonicContact CZ-OD2 3.51Å; R372-D401 IonicContact NE-OD2 3.24Å; R372-D401 PolarHBondContact NE-OD2 3.08Å; R372-D401 VanDerWaalsContact NH2-CG 3.26Å; R372-D401 IonicContact NH2-OD1 2.82Å; R372-D401 PolarHBondContact NH2-OD1 3.21Å; R372-D401 IonicContact NH2-OD2 2.84Å; R372-D401 PolarHBondContact NH2-OD2 3.35Å; L397-D401 HydrophobicContact CD2-CB 4.4Å; L397-D401 WeakPolarHBondContact O-CB 3.38Å; L397-D401 PolarHBondContact O-N 2.96Å; L397-D401 VanDerWaalsContact O-N 3.14Å; D401-S403 VanDerWaalsContact C-N 3.28Å; D401-S403 PolarHBondContact O-N 3.05Å; D401-S403 WeakPolarHBondContact OD1-CB 3.44Å; D401-S403 PolarHBondContact OD1-N 2.95Å; D401-V406 HydrophobicContact CB-CB 4.14Å; D401-V406 HydrophobicContact CB-CG1 4.04Å; D401-V406 WeakPolarHBondContact OD2-CG1 3.33Å; D401-K407 HydrophobicContact CB-CG 4.17Å; D401-K407 WeakPolarHBondContact O-CE 3.33Å
402	W	93.1	Very high	94.4	Very high	180 Å²	180	44.7 Å²	44.7	68%	0.682	22%	0.216	S	C	*	.	S	Bend	trans	-72.3	-24.7	177.8	67.1	-93.4	0	0	0	112.5	W369 R372	W369-W402 HydrophobicContact CB-CH2 4.23Å; W369-W402 HydrophobicContact CB-CZ2 3.57Å; W369-W402 AromaticContact CD1-CH2 3.37Å; W369-W402 AromaticContact CD1-CZ2 3.32Å; W369-W402 AromaticContact CG-CH2 3.82Å; W369-W402 HydrophobicContact CG-CH2 3.82Å; W369-W402 AromaticContact CG-CZ2 3.61Å; W369-W402 HydrophobicContact CG-CZ2 3.61Å; W369-W402 AromaticContact NE1-CH2 3.9Å; R372-W402 VanDerWaalsContact NH2-NE1 3.13Å
403	S	94.3	Very high	94.4	Very high	11 Å²	11	40 Å²	40	8%	0.077	19%	0.192	C	C	.	.			trans	-91.6	117.9	179.3	179.3	0	0	0	0	111	D401 N405 V406 K407	D401-S403 VanDerWaalsContact C-N 3.28Å; D401-S403 PolarHBondContact O-N 3.05Å; D401-S403 WeakPolarHBondContact OD1-CB 3.44Å; D401-S403 PolarHBondContact OD1-N 2.95Å; S403-N405 PolarHBondContact O-N 3.47Å; S403-V406 PolarHBondContact O-N 3Å; S403-K407 PolarHBondContact O-N 3.35Å; S403-K407 VanDerWaalsContact O-N 3.09Å
404	G	91.3	Very high	94.4	Very high	39 Å²	39	37.3 Å²	37.3	40%	0.402	18%	0.18	S	C	.	.	H	α-helix	trans	-58	-30.3	175.8	0	0	0	0	0	113.7	K407 Q408	G404-K407 PolarHBondContact O-N 2.94Å; G404-Q408 PolarHBondContact O-N 3.22Å
405	N	93.6	Very high	94.1	Very high	83 Å²	83	39.2 Å²	39.2	44%	0.444	20%	0.199	S	C	.	.	H	α-helix	trans	-66.5	-39.6	175.6	-66.4	-25.4	0	0	0	111.7	W369 L373 S403 A409	W369-N405 HydrophobicContact CZ3-CB 4.25Å; L373-N405 HydrophobicContact CD1-CB 4.45Å; L373-N405 HydrophobicContact CD2-CB 4.33Å; S403-N405 PolarHBondContact O-N 3.47Å; N405-A409 WeakPolarHBondContact O-CB 3.34Å; N405-A409 PolarHBondContact O-N 3.49Å
406	V	96	Very high	93.9	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-69.1	-41.7	176.8	-179.8	0	0	0	0	110.2	W369 R372 L373 D401 S403 Q408 A409 A410	W369-V406 HydrophobicContact CB-CG2 4.26Å; W369-V406 HydrophobicContact CE3-CG2 4.4Å; W369-V406 WeakPolarHBondContact O-CG2 3.32Å; R372-V406 HydrophobicContact CB-CG1 4.14Å; R372-V406 HydrophobicContact CB-CG2 4.3Å; L373-V406 HydrophobicContact CB-CG2 4.09Å; D401-V406 HydrophobicContact CB-CB 4.14Å; D401-V406 HydrophobicContact CB-CG1 4.04Å; D401-V406 WeakPolarHBondContact OD2-CG1 3.33Å; S403-V406 PolarHBondContact O-N 3Å; V406-Q408 VanDerWaalsContact C-N 3.32Å; V406-Q408 PolarHBondContact O-N 2.86Å; V406-A409 PolarHBondContact O-N 3.49Å; V406-A410 VanDerWaalsContact O-CB 3.32Å; V406-A410 WeakPolarHBondContact O-CB 3.43Å; V406-A410 PolarHBondContact O-N 2.99Å
407	K	94.9	Very high	93.6	Very high	29 Å²	29	39.1 Å²	39.1	13%	0.126	20%	0.201	C	C	.	.	H	α-helix	trans	-54.7	-49	174.4	-65.3	-168.1	-172.6	-168.7	0	111.6	M398 W399 D401 S403 G404 A410 A411 E441	M398-K407 VanDerWaalsContact O-CB 3.31Å; M398-K407 WeakPolarHBondContact O-CB 3.43Å; M398-K407 WeakPolarHBondContact O-CD 3.43Å; M398-K407 VanDerWaalsContact O-CG 3.31Å; M398-K407 WeakPolarHBondContact O-CG 3.03Å; W399-K407 WeakPolarHBondContact O-CE 3.46Å; W399-K407 PolarHBondContact O-NZ 2.86Å; D401-K407 HydrophobicContact CB-CG 4.17Å; D401-K407 WeakPolarHBondContact O-CE 3.33Å; S403-K407 PolarHBondContact O-N 3.35Å; S403-K407 VanDerWaalsContact O-N 3.09Å; G404-K407 PolarHBondContact O-N 2.94Å; K407-A410 PolarHBondContact O-N 3.41Å; K407-A411 PolarHBondContact O-N 2.96Å; K407-A411 VanDerWaalsContact O-N 3.11Å; K407-E441 IonicContact NZ-OE1 2.95Å; K407-E441 PolarHBondContact NZ-OE1 3.04Å; K407-E441 IonicContact NZ-OE2 3.96Å; K407-E441 PolarHBondContact NZ-OE2 3.4Å
408	Q	93.1	Very high	93.1	Very high	51 Å²	51	41.9 Å²	41.9	24%	0.238	23%	0.231	C	C	.	.	H	α-helix	trans	-62.6	-48.2	178.1	-175.8	-176.3	15.5	0	0	111.9	G404 V406 A410 A411 Q412 H448	G404-Q408 PolarHBondContact O-N 3.22Å; V406-Q408 VanDerWaalsContact C-N 3.32Å; V406-Q408 PolarHBondContact O-N 2.86Å; Q408-A410 VanDerWaalsContact C-N 3.33Å; Q408-A410 PolarHBondContact O-N 2.86Å; Q408-A411 PolarHBondContact O-N 3.48Å; Q408-Q412 HydrophobicContact CG-CG 4.48Å; Q408-Q412 WeakPolarHBondContact O-CG 3.49Å; Q408-Q412 PolarHBondContact O-N 3.36Å; Q408-H448 HydrophobicContact CG-CB 4.13Å; Q408-H448 PolarHBondContact NE2-O 2.97Å
409	A	95.1	Very high	92.8	Very high	3 Å²	3	44.4 Å²	44.4	3%	0.025	24%	0.244	C	C	.	.	H	α-helix	trans	-63.9	-37.8	-179.5	0	0	0	0	0	112.4	L373 C376 N405 V406 Q412 A413	L373-A409 HydrophobicContact CD1-CB 3.4Å; L373-A409 VanDerWaalsContact CD1-CB 3.4Å; C376-A409 HydrophobicContact CB-CB 3.82Å; N405-A409 WeakPolarHBondContact O-CB 3.34Å; N405-A409 PolarHBondContact O-N 3.49Å; V406-A409 PolarHBondContact O-N 3.49Å; A409-Q412 PolarHBondContact O-N 3.36Å; A409-A413 VanDerWaalsContact O-CB 3.28Å; A409-A413 WeakPolarHBondContact O-CB 3.29Å; A409-A413 PolarHBondContact O-N 3.32Å
410	A	96.3	Very high	92.6	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-63.4	-44.3	175.2	0	0	0	0	0	111.6	L394 L397 M398 V406 K407 Q408 A413 L414	L394-A410 HydrophobicContact CD2-CB 4.35Å; L397-A410 HydrophobicContact CB-CB 4.11Å; M398-A410 HydrophobicContact CB-CB 4.16Å; V406-A410 VanDerWaalsContact O-CB 3.32Å; V406-A410 WeakPolarHBondContact O-CB 3.43Å; V406-A410 PolarHBondContact O-N 2.99Å; K407-A410 PolarHBondContact O-N 3.41Å; Q408-A410 VanDerWaalsContact C-N 3.33Å; Q408-A410 PolarHBondContact O-N 2.86Å; A410-A413 PolarHBondContact O-N 3.27Å; A410-L414 WeakPolarHBondContact O-CG 3.38Å; A410-L414 PolarHBondContact O-N 3.16Å
411	A	94.5	Very high	92.4	Very high	2 Å²	2	49.1 Å²	49.1	2%	0.017	27%	0.265	C	S	.	.	H	α-helix	trans	-65.1	-42	176.1	0	0	0	0	0	113	M398 K407 Q408 A413 L414 G415 L445 L449	M398-A411 HydrophobicContact CG-CB 3.85Å; M398-A411 HydrophobicContact SD-CB 3.51Å; M398-A411 VanDerWaalsContact SD-CB 3.51Å; K407-A411 PolarHBondContact O-N 2.96Å; K407-A411 VanDerWaalsContact O-N 3.11Å; Q408-A411 PolarHBondContact O-N 3.48Å; A411-A413 VanDerWaalsContact C-N 3.32Å; A411-A413 PolarHBondContact O-N 3.21Å; A411-L414 PolarHBondContact O-N 3.14Å; A411-G415 PolarHBondContact O-N 3.4Å; A411-L445 HydrophobicContact CB-CD1 3.87Å; A411-L445 HydrophobicContact CB-CD2 4.3Å; A411-L445 HydrophobicContact CB-CG 4.46Å; A411-L449 HydrophobicContact CB-CD1 3.8Å; A411-L449 HydrophobicContact CB-CD2 3.88Å; A411-L449 HydrophobicContact CB-CG 4.29Å
412	Q	93.4	Very high	92.1	Very high	73 Å²	73	52 Å²	52	34%	0.341	28%	0.28	S	S	.	.	H	α-helix	trans	-63.7	-38.6	174.7	-73	177.4	-10	0	0	111.8	Q408 A409 G415 K416 L449	Q408-Q412 HydrophobicContact CG-CG 4.48Å; Q408-Q412 WeakPolarHBondContact O-CG 3.49Å; Q408-Q412 PolarHBondContact O-N 3.36Å; A409-Q412 PolarHBondContact O-N 3.36Å; Q412-G415 PolarHBondContact O-N 3.25Å; Q412-K416 WeakPolarHBondContact O-CG 3.19Å; Q412-K416 PolarHBondContact O-N 2.72Å; Q412-L449 HydrophobicContact CG-CD2 3.68Å
413	A	93.4	Very high	92	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-61.9	-49.4	174.7	0	0	0	0	0	110.9	L394 A409 A410 A411 G415 K416 L417	L394-A413 HydrophobicContact CD1-CB 4.32Å; A409-A413 VanDerWaalsContact O-CB 3.28Å; A409-A413 WeakPolarHBondContact O-CB 3.29Å; A409-A413 PolarHBondContact O-N 3.32Å; A410-A413 PolarHBondContact O-N 3.27Å; A411-A413 VanDerWaalsContact C-N 3.32Å; A411-A413 PolarHBondContact O-N 3.21Å; A413-G415 VanDerWaalsContact C-N 3.3Å; A413-G415 PolarHBondContact O-N 2.82Å; A413-K416 PolarHBondContact O-N 3.21Å; A413-L417 HydrophobicContact CB-CD1 4.42Å; A413-L417 WeakPolarHBondContact O-CB 3.45Å; A413-L417 VanDerWaalsContact O-CD1 3.29Å; A413-L417 WeakPolarHBondContact O-CD1 3.5Å; A413-L417 WeakPolarHBondContact O-CG 3.14Å; A413-L417 PolarHBondContact O-N 2.88Å
414	L	93.3	Very high	91.9	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-56	-44	175.4	-72.5	166.5	0	0	0	112.2	L394 I395 M398 A410 A411 L417 G418 M419 V423	L394-L414 HydrophobicContact CB-CD1 4.14Å; L394-L414 HydrophobicContact CB-CD2 3.81Å; L394-L414 HydrophobicContact CB-CG 3.84Å; L394-L414 HydrophobicContact CD1-CD2 4.17Å; L394-L414 HydrophobicContact CD1-CG 4.39Å; I395-L414 HydrophobicContact CB-CD1 4.44Å; I395-L414 HydrophobicContact CG1-CD1 3.6Å; I395-L414 HydrophobicContact CG1-CD2 4.11Å; M398-L414 HydrophobicContact SD-CD1 4.01Å; A410-L414 WeakPolarHBondContact O-CG 3.38Å; A410-L414 PolarHBondContact O-N 3.16Å; A411-L414 PolarHBondContact O-N 3.14Å; L414-L417 PolarHBondContact O-N 3.38Å; L414-G418 PolarHBondContact O-N 3.34Å; L414-M419 HydrophobicContact CB-CB 4.29Å; L414-M419 HydrophobicContact CD2-CB 4.09Å; L414-M419 HydrophobicContact CD2-CG 4.42Å; L414-M419 WeakPolarHBondContact O-CA 3.18Å; L414-M419 WeakPolarHBondContact O-CB 3.42Å; L414-M419 PolarHBondContact O-N 3.4Å; L414-V423 HydrophobicContact CB-CG2 3.52Å; L414-V423 HydrophobicContact CD1-CG2 3.78Å; L414-V423 HydrophobicContact CG-CG2 4.28Å
415	G	89.9	Confident	92	Very high	39 Å²	39	45.5 Å²	45.5	40%	0.402	25%	0.248	S	C	.	.	H	α-helix	trans	-59.6	-49.4	176.4	0	0	0	0	0	113.1	A411 Q412 A413 L417 G418	A411-G415 PolarHBondContact O-N 3.4Å; Q412-G415 PolarHBondContact O-N 3.25Å; A413-G415 VanDerWaalsContact C-N 3.3Å; A413-G415 PolarHBondContact O-N 2.82Å; G415-L417 VanDerWaalsContact C-N 3.26Å; G415-L417 PolarHBondContact O-N 3.33Å; G415-G418 PolarHBondContact O-N 2.9Å
416	K	89.4	Confident	91.9	Very high	135 Å²	135	44.8 Å²	44.8	59%	0.587	24%	0.242	S	C	*	.	H	α-helix	trans	-65.1	-28.1	178.4	-74.9	173.7	174.7	178.3	0	113.4	Q412 A413 G418	Q412-K416 WeakPolarHBondContact O-CG 3.19Å; Q412-K416 PolarHBondContact O-N 2.72Å; A413-K416 PolarHBondContact O-N 3.21Å; K416-G418 PolarHBondContact O-N 3.29Å
417	L	88.8	Confident	91.9	Very high	31 Å²	31	44.8 Å²	44.8	16%	0.162	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.7	8.9	179	-63.3	164.7	0	0	0	112.9	I379 I386 L394 A413 L414 G415 M419	I379-L417 HydrophobicContact CG2-CD1 3.73Å; I386-L417 HydrophobicContact CD1-CB 4.32Å; I386-L417 HydrophobicContact CD1-CD1 4.31Å; I386-L417 HydrophobicContact CG2-CB 3.86Å; I386-L417 HydrophobicContact CG2-CD1 3.69Å; I386-L417 HydrophobicContact CG2-CD2 3.6Å; I386-L417 HydrophobicContact CG2-CG 3.87Å; L394-L417 HydrophobicContact CD1-CD1 4.05Å; A413-L417 HydrophobicContact CB-CD1 4.42Å; A413-L417 WeakPolarHBondContact O-CB 3.45Å; A413-L417 VanDerWaalsContact O-CD1 3.29Å; A413-L417 WeakPolarHBondContact O-CD1 3.5Å; A413-L417 WeakPolarHBondContact O-CG 3.14Å; A413-L417 PolarHBondContact O-N 2.88Å; L414-L417 PolarHBondContact O-N 3.38Å; G415-L417 VanDerWaalsContact C-N 3.26Å; G415-L417 PolarHBondContact O-N 3.33Å; L417-M419 VanDerWaalsContact C-N 3.33Å
418	G	87.3	Confident	91.9	Very high	64 Å²	64	48 Å²	48	66%	0.66	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	83	3.5	177.2	0	0	0	0	0	114.9	L414 G415 K416 G420	L414-G418 PolarHBondContact O-N 3.34Å; G415-G418 PolarHBondContact O-N 2.9Å; K416-G418 PolarHBondContact O-N 3.29Å; G418-G420 PolarHBondContact O-N 3.5Å
419	M	88.6	Confident	92	Very high	54 Å²	54	49.7 Å²	49.7	27%	0.266	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.8	23.5	178.6	-56.5	-59.8	173.9	0	0	112.5	I386 L414 L417 R421 D422 V423	I386-M419 HydrophobicContact CD1-CE 3.97Å; I386-M419 HydrophobicContact CD1-CG 3.85Å; I386-M419 HydrophobicContact CG1-CE 3.68Å; L414-M419 HydrophobicContact CB-CB 4.29Å; L414-M419 HydrophobicContact CD2-CB 4.09Å; L414-M419 HydrophobicContact CD2-CG 4.42Å; L414-M419 WeakPolarHBondContact O-CA 3.18Å; L414-M419 WeakPolarHBondContact O-CB 3.42Å; L414-M419 PolarHBondContact O-N 3.4Å; L417-M419 VanDerWaalsContact C-N 3.33Å; M419-R421 PolarHBondContact O-N 2.9Å; M419-D422 PolarHBondContact O-N 2.9Å; M419-D422 VanDerWaalsContact O-N 3.13Å; M419-V423 PolarHBondContact O-N 3.3Å
420	G	88.3	Confident	92	Very high	33 Å²	33	51 Å²	51	34%	0.34	27%	0.267	S	S	.	.	H	α-helix	trans	-61.4	-29.4	-180	0	0	0	0	0	113.3	G418 H424	G418-G420 PolarHBondContact O-N 3.5Å; G420-H424 WeakPolarHBondContact O-CB 3.45Å; G420-H424 PolarHBondContact O-N 3.38Å
421	R	89.9	Confident	92	Very high	195 Å²	195	51.2 Å²	51.2	74%	0.736	27%	0.268	S	S	*	.	H	α-helix	trans	-63.8	-41.8	174.6	-178.8	179.6	174.7	-175	-4.6	111.7	M419 H424 N425	M419-R421 PolarHBondContact O-N 2.9Å; R421-H424 PolarHBondContact O-N 3.48Å; R421-N425 WeakPolarHBondContact O-CB 3.27Å; R421-N425 PolarHBondContact O-N 2.87Å; R421-N425 PolarHBondContact O-ND2 3.42Å
422	D	89.4	Confident	92	Very high	69 Å²	69	54.3 Å²	54.3	37%	0.369	28%	0.282	S	S	.	.	H	α-helix	trans	-71	-43.2	-178.9	-56.8	-54.4	0	0	0	110.8	M419 H424 N425 E426	M419-D422 PolarHBondContact O-N 2.9Å; M419-D422 VanDerWaalsContact O-N 3.13Å; D422-H424 VanDerWaalsContact C-N 3.28Å; D422-H424 PolarHBondContact O-N 2.87Å; D422-N425 PolarHBondContact O-N 3.09Å; D422-E426 WeakPolarHBondContact O-CB 3.38Å; D422-E426 WeakPolarHBondContact O-CG 3.4Å; D422-E426 PolarHBondContact O-N 2.83Å
423	V	91.8	Very high	91.8	Very high	7 Å²	7	57.6 Å²	57.6	4%	0.042	30%	0.298	C	S	.	.	H	α-helix	trans	-56.6	-45.1	172.4	176.3	0	0	0	0	110.8	M398 L414 M419 E426 L427 L449	M398-V423 HydrophobicContact SD-CG1 4.09Å; M398-V423 HydrophobicContact SD-CG2 4.2Å; L414-V423 HydrophobicContact CB-CG2 3.52Å; L414-V423 HydrophobicContact CD1-CG2 3.78Å; L414-V423 HydrophobicContact CG-CG2 4.28Å; M419-V423 PolarHBondContact O-N 3.3Å; V423-E426 PolarHBondContact O-N 3.41Å; V423-L427 HydrophobicContact CG1-CD1 4.02Å; V423-L427 WeakPolarHBondContact O-CB 3.18Å; V423-L427 VanDerWaalsContact O-CG 3.27Å; V423-L427 WeakPolarHBondContact O-CG 3.37Å; V423-L427 PolarHBondContact O-N 2.59Å; V423-L449 HydrophobicContact CG1-CD1 4.31Å
424	H	92.6	Very high	91.6	Very high	29 Å²	29	57.9 Å²	57.9	13%	0.134	30%	0.3	C	S	.	.	H	α-helix	trans	-64.6	-46.2	179.2	177.6	-79.7	0	0	0	112.7	G420 R421 D422 E426 L427 R428 T453 L456	G420-H424 WeakPolarHBondContact O-CB 3.45Å; G420-H424 PolarHBondContact O-N 3.38Å; R421-H424 PolarHBondContact O-N 3.48Å; D422-H424 VanDerWaalsContact C-N 3.28Å; D422-H424 PolarHBondContact O-N 2.87Å; H424-E426 VanDerWaalsContact C-N 3.35Å; H424-L427 PolarHBondContact O-N 3.27Å; H424-R428 WeakPolarHBondContact O-CB 3.46Å; H424-R428 PolarHBondContact O-N 3.47Å; H424-T453 PolarHBondContact CD2-OG1 3.39Å; H424-T453 PolarHBondContact NE2-OG1 2.88Å; H424-L456 WeakPolarHBondContact NE2-CG 3.14Å
425	N	91.9	Very high	91.7	Very high	58 Å²	58	61 Å²	61	31%	0.31	32%	0.321	S	S	.	.	H	α-helix	trans	-62	-43.7	177.5	-73.9	-21.2	0	0	0	111.2	R421 D422 R428 M429	R421-N425 WeakPolarHBondContact O-CB 3.27Å; R421-N425 PolarHBondContact O-N 2.87Å; R421-N425 PolarHBondContact O-ND2 3.42Å; D422-N425 PolarHBondContact O-N 3.09Å; N425-R428 PolarHBondContact O-N 3.06Å; N425-M429 WeakPolarHBondContact O-CB 3.46Å; N425-M429 WeakPolarHBondContact O-CG 3.36Å; N425-M429 PolarHBondContact O-N 3.5Å
426	E	92.8	Very high	91.9	Very high	68 Å²	68	60 Å²	60	32%	0.318	31%	0.309	S	S	.	.	H	α-helix	trans	-60.8	-48.5	175.8	-78.4	-62.3	138.3	0	0	111.4	W399 D422 V423 H424 R428 M429 K430	W399-E426 HydrophobicContact CZ2-CB 4.15Å; D422-E426 WeakPolarHBondContact O-CB 3.38Å; D422-E426 WeakPolarHBondContact O-CG 3.4Å; D422-E426 PolarHBondContact O-N 2.83Å; V423-E426 PolarHBondContact O-N 3.41Å; H424-E426 VanDerWaalsContact C-N 3.35Å; E426-R428 VanDerWaalsContact C-N 3.28Å; E426-R428 PolarHBondContact O-N 3.42Å; E426-M429 PolarHBondContact O-N 3.31Å; E426-K430 WeakPolarHBondContact O-CB 3.4Å; E426-K430 WeakPolarHBondContact O-CG 3.42Å; E426-K430 PolarHBondContact O-N 3.02Å
427	L	95.3	Very high	92.2	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-55.6	-44.6	175.3	-76.5	168.4	0	0	0	111.8	W399 V423 H424 K430 L431 A442 L445 I446 I451 L456	W399-L427 HydrophobicContact CH2-CD2 3.87Å; W399-L427 HydrophobicContact CZ2-CD2 4.35Å; V423-L427 HydrophobicContact CG1-CD1 4.02Å; V423-L427 WeakPolarHBondContact O-CB 3.18Å; V423-L427 VanDerWaalsContact O-CG 3.27Å; V423-L427 WeakPolarHBondContact O-CG 3.37Å; V423-L427 PolarHBondContact O-N 2.59Å; H424-L427 PolarHBondContact O-N 3.27Å; L427-K430 PolarHBondContact O-N 2.87Å; L427-L431 VanDerWaalsContact O-CG 3.29Å; L427-L431 WeakPolarHBondContact O-CG 3.47Å; L427-L431 PolarHBondContact O-N 3.27Å; L427-A442 HydrophobicContact CD2-CB 4.03Å; L427-L445 HydrophobicContact CD2-CB 4.24Å; L427-L445 HydrophobicContact CD2-CD2 4.05Å; L427-L445 HydrophobicContact CD2-CG 4.38Å; L427-I446 HydrophobicContact CD1-CG1 4.09Å; L427-I446 HydrophobicContact CD2-CD1 4.32Å; L427-I446 HydrophobicContact CD2-CG1 3.95Å; L427-I451 HydrophobicContact CD1-CD1 3.45Å; L427-I451 VanDerWaalsContact CD1-CD1 3.45Å; L427-I451 HydrophobicContact CD1-CG1 4.49Å; L427-L456 HydrophobicContact CB-CD2 3.98Å
428	R	95.6	Very high	92.5	Very high	98 Å²	98	61.6 Å²	61.6	37%	0.37	32%	0.32	S	S	.	.	H	α-helix	trans	-62.3	-51.9	178.4	-176.2	-177.5	175.2	-143.6	-11.1	111.6	H424 N425 E426 K430 L431 E432 L456 P459	H424-R428 WeakPolarHBondContact O-CB 3.46Å; H424-R428 PolarHBondContact O-N 3.47Å; N425-R428 PolarHBondContact O-N 3.06Å; E426-R428 VanDerWaalsContact C-N 3.28Å; E426-R428 PolarHBondContact O-N 3.42Å; R428-K430 VanDerWaalsContact C-N 3.31Å; R428-K430 PolarHBondContact O-N 3.46Å; R428-L431 PolarHBondContact O-N 2.9Å; R428-E432 HydrophobicContact CG-CG 4.4Å; R428-E432 IonicContact CZ-OE1 2.82Å; R428-E432 IonicContact CZ-OE2 3.89Å; R428-E432 IonicContact NE-OE1 3.96Å; R428-E432 PolarHBondContact NE-OE1 2.68Å; R428-E432 IonicContact NE-OE2 2.87Å; R428-E432 PolarHBondContact NE-OE2 3.04Å; R428-E432 IonicContact NH2-OE1 3.45Å; R428-E432 PolarHBondContact NH2-OE1 3.11Å; R428-E432 VanDerWaalsContact NH2-OE1 3.09Å; R428-E432 IonicContact NH2-OE2 2.74Å; R428-E432 PolarHBondContact NH2-OE2 3.36Å; R428-E432 PolarHBondContact O-N 2.95Å; R428-L456 HydrophobicContact CB-CD2 3.88Å; R428-P459 HydrophobicContact CG-CG 4.5Å
429	M	94.8	Very high	92.9	Very high	85 Å²	85	60.1 Å²	60.1	42%	0.419	30%	0.295	S	S	.	.	H	α-helix	trans	-56.6	-45.2	178.7	-75.2	-64.1	-59.4	0	0	111.4	N425 E426 L431 E432 E433	N425-M429 WeakPolarHBondContact O-CB 3.46Å; N425-M429 WeakPolarHBondContact O-CG 3.36Å; N425-M429 PolarHBondContact O-N 3.5Å; E426-M429 PolarHBondContact O-N 3.31Å; M429-L431 VanDerWaalsContact C-N 3.34Å; M429-L431 PolarHBondContact O-N 3.44Å; M429-E432 PolarHBondContact O-N 3.16Å; M429-E433 WeakPolarHBondContact CE-OE2 3.28Å; M429-E433 PolarHBondContact O-N 2.71Å
430	K	94.8	Very high	93.3	Very high	30 Å²	30	59 Å²	59	13%	0.13	29%	0.29	C	S	.	.	H	α-helix	trans	-64.7	-36	179.6	-65.3	-68.7	178.9	179.9	0	112.5	W399 E426 L427 R428 G434 W438 R439 A442	W399-K430 HydrophobicContact CH2-CB 4.25Å; W399-K430 HydrophobicContact CH2-CG 3.84Å; W399-K430 HydrophobicContact CZ2-CG 3.82Å; W399-K430 HydrophobicContact CZ3-CG 4.49Å; E426-K430 WeakPolarHBondContact O-CB 3.4Å; E426-K430 WeakPolarHBondContact O-CG 3.42Å; E426-K430 PolarHBondContact O-N 3.02Å; L427-K430 PolarHBondContact O-N 2.87Å; R428-K430 VanDerWaalsContact C-N 3.31Å; R428-K430 PolarHBondContact O-N 3.46Å; K430-G434 WeakPolarHBondContact O-CA 3.22Å; K430-G434 PolarHBondContact O-N 3Å; K430-W438 HydrophobicContact CB-CB 4.4Å; K430-W438 HydrophobicContact CD-CB 3.95Å; K430-W438 HydrophobicContact CD-CD2 3.54Å; K430-W438 HydrophobicContact CD-CE3 3.16Å; K430-W438 HydrophobicContact CD-CG 3.91Å; K430-W438 HydrophobicContact CD-CZ3 3.87Å; K430-W438 VanDerWaalsContact NZ-CD2 3.34Å; K430-R439 WeakPolarHBondContact O-CG 3.47Å; K430-A442 HydrophobicContact CB-CB 4.06Å
431	L	95.8	Very high	93.6	Very high	5 Å²	5	60.5 Å²	60.5	3%	0.026	29%	0.289	C	S	.	.	H	α-helix	trans	-73.1	-39	175.3	-70	175.8	0	0	0	113	L427 R428 M429 R439 A442 L443 I446 L456 P459	L427-L431 VanDerWaalsContact O-CG 3.29Å; L427-L431 WeakPolarHBondContact O-CG 3.47Å; L427-L431 PolarHBondContact O-N 3.27Å; R428-L431 PolarHBondContact O-N 2.9Å; M429-L431 VanDerWaalsContact C-N 3.34Å; M429-L431 PolarHBondContact O-N 3.44Å; L431-R439 VanDerWaalsContact O-CD 3.25Å; L431-R439 WeakPolarHBondContact O-CD 3.31Å; L431-A442 HydrophobicContact CD2-CB 3.8Å; L431-A442 HydrophobicContact CG-CB 3.97Å; L431-L443 HydrophobicContact CD2-CD2 3.92Å; L431-L443 HydrophobicContact CD2-CG 3.83Å; L431-I446 HydrophobicContact CD1-CD1 3.67Å; L431-L456 HydrophobicContact CD1-CD2 4.27Å; L431-P459 HydrophobicContact CB-CB 3.9Å; L431-P459 HydrophobicContact CD1-CB 4.46Å; L431-P459 HydrophobicContact CD1-CG 4.45Å
432	E	94.1	Very high	93.9	Very high	67 Å²	67	51.2 Å²	51.2	31%	0.313	25%	0.254	S	S	.	.	H	α-helix	trans	-77.7	-46.7	-175.7	-73.7	177.9	178.3	0	0	112.6	R428 M429 P459	R428-E432 HydrophobicContact CG-CG 4.4Å; R428-E432 IonicContact CZ-OE1 2.82Å; R428-E432 IonicContact CZ-OE2 3.89Å; R428-E432 IonicContact NE-OE1 3.96Å; R428-E432 PolarHBondContact NE-OE1 2.68Å; R428-E432 IonicContact NE-OE2 2.87Å; R428-E432 PolarHBondContact NE-OE2 3.04Å; R428-E432 IonicContact NH2-OE1 3.45Å; R428-E432 PolarHBondContact NH2-OE1 3.11Å; R428-E432 VanDerWaalsContact NH2-OE1 3.09Å; R428-E432 IonicContact NH2-OE2 2.74Å; R428-E432 PolarHBondContact NH2-OE2 3.36Å; R428-E432 PolarHBondContact O-N 2.95Å; M429-E432 PolarHBondContact O-N 3.16Å; E432-P459 HydrophobicContact CG-CB 3.61Å; E432-P459 HydrophobicContact CG-CG 4.16Å
433	E	89.8	Confident	94.3	Very high	143 Å²	143	47.9 Å²	47.9	67%	0.668	24%	0.236	S	C	*	.	H	α-helix	trans	-120.6	-12.3	-166.9	-59.6	-177	176.8	0	0	113.7	M429	M429-E433 WeakPolarHBondContact CE-OE2 3.28Å; M429-E433 PolarHBondContact O-N 2.71Å
434	G	90.1	Very high	94.4	Very high	5 Å²	5	49.8 Å²	49.8	5%	0.052	25%	0.245	C	C	.	.	S	Bend	trans	-71.4	155.8	-176.4	0	0	0	0	0	113.7	K430 R439	K430-G434 WeakPolarHBondContact O-CA 3.22Å; K430-G434 PolarHBondContact O-N 3Å; G434-R439 PolarHBondContact O-NH1 2.8Å
435	P	94.9	Very high	94.5	Very high	67 Å²	67	48.8 Å²	48.8	44%	0.435	24%	0.241	S	C	.	.			trans	-60.3	165.2	166.5	28.5	-36.5	0	0	0	111.5	S437 W438 R439	P435-S437 PolarHBondContact O-N 2.81Å; P435-S437 VanDerWaalsContact O-N 3.1Å; P435-W438 VanDerWaalsContact CD-CD2 3.48Å; P435-W438 VanDerWaalsContact CD-CE3 3.45Å; P435-W438 HydrophobicContact CG-CB 4.17Å; P435-W438 HydrophobicContact CG-CD2 3.81Å; P435-W438 HydrophobicContact CG-CE3 4.28Å; P435-W438 HydrophobicContact CG-CG 3.73Å; P435-W438 WeakPolarHBondContact O-CB 3.1Å; P435-W438 PolarHBondContact O-N 2.66Å; P435-R439 PolarHBondContact O-N 2.72Å; P435-R439 VanDerWaalsContact O-N 3.11Å
436	A	94.9	Very high	94.7	Very high	18 Å²	18	46 Å²	46	15%	0.149	23%	0.226	C	C	.	.	H	α-helix	trans	-54.4	-35.9	-176.1	0	0	0	0	0	113.7	R439 V440 F468 V471	A436-R439 PolarHBondContact O-N 3.34Å; A436-V440 WeakPolarHBondContact O-CG2 3.44Å; A436-V440 PolarHBondContact O-N 3.02Å; A436-F468 HydrophobicContact CB-CB 3.94Å; A436-F468 HydrophobicContact CB-CD1 3.94Å; A436-F468 HydrophobicContact CB-CD2 3.56Å; A436-F468 HydrophobicContact CB-CE1 4.32Å; A436-F468 HydrophobicContact CB-CE2 3.97Å; A436-F468 HydrophobicContact CB-CG 3.52Å; A436-F468 HydrophobicContact CB-CZ 4.32Å; A436-V471 HydrophobicContact CB-CG2 3.9Å
437	S	94.3	Very high	94.8	Very high	73 Å²	73	43.2 Å²	43.2	51%	0.51	22%	0.215	S	C	.	.	H	α-helix	trans	-60.6	-44.8	175.1	53.9	0	0	0	0	112.4	P435 V440 E441	P435-S437 PolarHBondContact O-N 2.81Å; P435-S437 VanDerWaalsContact O-N 3.1Å; S437-V440 PolarHBondContact O-N 2.81Å; S437-E441 WeakPolarHBondContact O-CG 3.31Å; S437-E441 PolarHBondContact O-N 3.13Å
438	W	94.8	Very high	94.6	Very high	125 Å²	125	47.5 Å²	47.5	47%	0.473	24%	0.235	S	C	.	.	H	α-helix	trans	-66.5	-38.9	177.8	-71.5	8.3	0	0	0	111.9	K430 P435 E441 A442	K430-W438 HydrophobicContact CB-CB 4.4Å; K430-W438 HydrophobicContact CD-CB 3.95Å; K430-W438 HydrophobicContact CD-CD2 3.54Å; K430-W438 HydrophobicContact CD-CE3 3.16Å; K430-W438 HydrophobicContact CD-CG 3.91Å; K430-W438 HydrophobicContact CD-CZ3 3.87Å; K430-W438 VanDerWaalsContact NZ-CD2 3.34Å; P435-W438 VanDerWaalsContact CD-CD2 3.48Å; P435-W438 VanDerWaalsContact CD-CE3 3.45Å; P435-W438 HydrophobicContact CG-CB 4.17Å; P435-W438 HydrophobicContact CG-CD2 3.81Å; P435-W438 HydrophobicContact CG-CE3 4.28Å; P435-W438 HydrophobicContact CG-CG 3.73Å; P435-W438 WeakPolarHBondContact O-CB 3.1Å; P435-W438 PolarHBondContact O-N 2.66Å; W438-E441 PolarHBondContact O-N 2.78Å; W438-A442 VanDerWaalsContact O-CB 3.28Å; W438-A442 WeakPolarHBondContact O-CB 3.4Å; W438-A442 PolarHBondContact O-N 3.46Å
439	R	96.9	Very high	94.4	Very high	34 Å²	34	44.4 Å²	44.4	13%	0.128	23%	0.225	C	C	.	.	H	α-helix	trans	-63.2	-44.9	176	-62.3	-163.6	-62.7	-87.6	5.9	111.5	K430 L431 G434 P435 A436 A442 L443 D466 V471	K430-R439 WeakPolarHBondContact O-CG 3.47Å; L431-R439 VanDerWaalsContact O-CD 3.25Å; L431-R439 WeakPolarHBondContact O-CD 3.31Å; G434-R439 PolarHBondContact O-NH1 2.8Å; P435-R439 PolarHBondContact O-N 2.72Å; P435-R439 VanDerWaalsContact O-N 3.11Å; A436-R439 PolarHBondContact O-N 3.34Å; R439-A442 PolarHBondContact O-N 2.84Å; R439-L443 WeakPolarHBondContact O-CB 3.33Å; R439-L443 WeakPolarHBondContact O-CG 3.42Å; R439-L443 PolarHBondContact O-N 3.44Å; R439-D466 IonicContact CZ-OD1 2.74Å; R439-D466 IonicContact CZ-OD2 3.56Å; R439-D466 IonicContact NE-OD2 3.5Å; R439-D466 PolarHBondContact NE-OD2 3.18Å; R439-D466 IonicContact NH2-OD1 3.98Å; R439-D466 PolarHBondContact NH2-OD1 3.1Å; R439-D466 IonicContact NH2-OD2 3.59Å; R439-D466 PolarHBondContact NH2-OD2 2.65Å; R439-V471 HydrophobicContact CB-CG1 4.15Å; R439-V471 HydrophobicContact CB-CG2 4.14Å
440	V	96.5	Very high	94.3	Very high	29 Å²	29	45.6 Å²	45.6	18%	0.176	23%	0.23	C	C	.	.	H	α-helix	trans	-59.2	-49.7	175.1	171	0	0	0	0	111	A436 S437 A442 L443 I444 A470 V471 Q474	A436-V440 WeakPolarHBondContact O-CG2 3.44Å; A436-V440 PolarHBondContact O-N 3.02Å; S437-V440 PolarHBondContact O-N 2.81Å; V440-A442 VanDerWaalsContact C-N 3.35Å; V440-A442 PolarHBondContact O-N 3.43Å; V440-L443 PolarHBondContact O-N 3.32Å; V440-I444 HydrophobicContact CG1-CD1 3.87Å; V440-I444 HydrophobicContact CG1-CG1 4.49Å; V440-I444 WeakPolarHBondContact O-CG1 3.47Å; V440-I444 PolarHBondContact O-N 3.08Å; V440-A470 HydrophobicContact CG2-CB 4.1Å; V440-V471 HydrophobicContact CG2-CB 4.46Å; V440-V471 HydrophobicContact CG2-CG2 3.88Å; V440-Q474 HydrophobicContact CG1-CB 4.3Å; V440-Q474 HydrophobicContact CG1-CG 4.14Å; V440-Q474 HydrophobicContact CG2-CB 4.42Å
441	E	94.5	Very high	94.2	Very high	65 Å²	65	46.8 Å²	46.8	30%	0.304	24%	0.237	S	C	.	.	H	α-helix	trans	-61.8	-41.3	179	-71.5	-71.5	168.3	0	0	112.3	W399 K407 S437 W438 L443 I444 L445	W399-E441 HydrophobicContact CZ3-CB 4.2Å; K407-E441 IonicContact NZ-OE1 2.95Å; K407-E441 PolarHBondContact NZ-OE1 3.04Å; K407-E441 IonicContact NZ-OE2 3.96Å; K407-E441 PolarHBondContact NZ-OE2 3.4Å; S437-E441 WeakPolarHBondContact O-CG 3.31Å; S437-E441 PolarHBondContact O-N 3.13Å; W438-E441 PolarHBondContact O-N 2.78Å; E441-L443 VanDerWaalsContact C-N 3.34Å; E441-L443 PolarHBondContact O-N 3.37Å; E441-I444 PolarHBondContact O-N 3.26Å; E441-L445 WeakPolarHBondContact O-CB 3.35Å; E441-L445 PolarHBondContact O-N 2.76Å
442	A	96.3	Very high	94.1	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-62	-42.1	175.8	0	0	0	0	0	111.7	W399 L427 K430 L431 W438 R439 V440 L445 I446	W399-A442 HydrophobicContact CH2-CB 4.03Å; W399-A442 HydrophobicContact CZ3-CB 4.35Å; L427-A442 HydrophobicContact CD2-CB 4.03Å; K430-A442 HydrophobicContact CB-CB 4.06Å; L431-A442 HydrophobicContact CD2-CB 3.8Å; L431-A442 HydrophobicContact CG-CB 3.97Å; W438-A442 VanDerWaalsContact O-CB 3.28Å; W438-A442 WeakPolarHBondContact O-CB 3.4Å; W438-A442 PolarHBondContact O-N 3.46Å; R439-A442 PolarHBondContact O-N 2.84Å; V440-A442 VanDerWaalsContact C-N 3.35Å; V440-A442 PolarHBondContact O-N 3.43Å; A442-L445 PolarHBondContact O-N 2.93Å; A442-I446 WeakPolarHBondContact O-CB 3.41Å; A442-I446 WeakPolarHBondContact O-CD1 3.47Å; A442-I446 VanDerWaalsContact O-CG1 3.25Å; A442-I446 WeakPolarHBondContact O-CG1 3.39Å; A442-I446 PolarHBondContact O-N 3.4Å
443	L	97.1	Very high	94	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-65.9	-39	176.3	-69.8	169.1	0	0	0	112.6	L431 R439 V440 E441 A447 F460 C463 V471 Q474 A475 T478	L431-L443 HydrophobicContact CD2-CD2 3.92Å; L431-L443 HydrophobicContact CD2-CG 3.83Å; R439-L443 WeakPolarHBondContact O-CB 3.33Å; R439-L443 WeakPolarHBondContact O-CG 3.42Å; R439-L443 PolarHBondContact O-N 3.44Å; V440-L443 PolarHBondContact O-N 3.32Å; E441-L443 VanDerWaalsContact C-N 3.34Å; E441-L443 PolarHBondContact O-N 3.37Å; L443-A447 WeakPolarHBondContact O-CB 3.44Å; L443-A447 PolarHBondContact O-N 3.08Å; L443-F460 HydrophobicContact CD2-CD2 3.44Å; L443-F460 VanDerWaalsContact CD2-CD2 3.44Å; L443-F460 HydrophobicContact CD2-CE2 3.73Å; L443-C463 HydrophobicContact CD1-CB 4.15Å; L443-V471 HydrophobicContact CD1-CG1 4.1Å; L443-Q474 HydrophobicContact CB-CB 4.41Å; L443-Q474 HydrophobicContact CB-CG 3.51Å; L443-Q474 HydrophobicContact CD1-CB 4.02Å; L443-Q474 HydrophobicContact CD1-CG 4.03Å; L443-Q474 HydrophobicContact CG-CG 4.43Å; L443-A475 HydrophobicContact CD1-CB 4.2Å; L443-T478 HydrophobicContact CD2-CG2 4.49Å; L443-T478 PolarHBondContact O-OG1 2.97Å
444	I	95.3	Very high	94.1	Very high	46 Å²	46	45.8 Å²	45.8	24%	0.236	25%	0.252	C	S	.	.	H	α-helix	trans	-62.1	-47.8	173.7	-69.9	168.5	0	0	0	109.8	V440 E441 I446 A447 H448 Q474	V440-I444 HydrophobicContact CG1-CD1 3.87Å; V440-I444 HydrophobicContact CG1-CG1 4.49Å; V440-I444 WeakPolarHBondContact O-CG1 3.47Å; V440-I444 PolarHBondContact O-N 3.08Å; E441-I444 PolarHBondContact O-N 3.26Å; I444-I446 PolarHBondContact O-N 2.94Å; I444-A447 WeakPolarHBondContact O-CB 3.42Å; I444-A447 PolarHBondContact O-N 3.48Å; I444-H448 WeakPolarHBondContact CG2-CE1 3.09Å; I444-H448 PolarHBondContact O-N 2.95Å; I444-Q474 VanDerWaalsContact CG1-CD 3.43Å; I444-Q474 HydrophobicContact CG1-CG 4.01Å
445	L	94.3	Very high	94.2	Very high	8 Å²	8	51.9 Å²	51.9	4%	0.042	28%	0.277	C	S	.	.	H	α-helix	trans	-65.2	-40.6	-179.1	-170.8	61	0	0	0	111.6	M398 W399 A411 L427 E441 A442 A447 H448 L449	M398-L445 HydrophobicContact CE-CD2 4.44Å; M398-L445 HydrophobicContact CG-CD2 3.55Å; M398-L445 HydrophobicContact SD-CD2 3.77Å; W399-L445 HydrophobicContact CH2-CD2 4.27Å; W399-L445 HydrophobicContact CZ3-CD2 4.41Å; A411-L445 HydrophobicContact CB-CD1 3.87Å; A411-L445 HydrophobicContact CB-CD2 4.3Å; A411-L445 HydrophobicContact CB-CG 4.46Å; L427-L445 HydrophobicContact CD2-CB 4.24Å; L427-L445 HydrophobicContact CD2-CD2 4.05Å; L427-L445 HydrophobicContact CD2-CG 4.38Å; E441-L445 WeakPolarHBondContact O-CB 3.35Å; E441-L445 PolarHBondContact O-N 2.76Å; A442-L445 PolarHBondContact O-N 2.93Å; L445-A447 VanDerWaalsContact C-N 3.33Å; L445-A447 PolarHBondContact O-N 3.42Å; L445-H448 PolarHBondContact O-N 3.36Å; L445-L449 HydrophobicContact CD1-CD1 4.05Å; L445-L449 HydrophobicContact CD1-CG 4.12Å; L445-L449 HydrophobicContact CD2-CD1 4.41Å; L445-L449 HydrophobicContact CG-CD1 3.79Å; L445-L449 HydrophobicContact CG-CG 4.27Å; L445-L449 VanDerWaalsContact O-CB 3.31Å; L445-L449 WeakPolarHBondContact O-CB 3.17Å; L445-L449 VanDerWaalsContact O-CG 3.27Å; L445-L449 WeakPolarHBondContact O-CG 3.17Å; L445-L449 PolarHBondContact O-N 3.49Å
446	I	95.8	Very high	94.2	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-56.2	-46.2	171.5	-79.6	165.9	0	0	0	111.4	L427 L431 A442 I444 L449 Q450 I451 M452 L456 T478 L482	L427-I446 HydrophobicContact CD1-CG1 4.09Å; L427-I446 HydrophobicContact CD2-CD1 4.32Å; L427-I446 HydrophobicContact CD2-CG1 3.95Å; L431-I446 HydrophobicContact CD1-CD1 3.67Å; A442-I446 WeakPolarHBondContact O-CB 3.41Å; A442-I446 WeakPolarHBondContact O-CD1 3.47Å; A442-I446 VanDerWaalsContact O-CG1 3.25Å; A442-I446 WeakPolarHBondContact O-CG1 3.39Å; A442-I446 PolarHBondContact O-N 3.4Å; I444-I446 PolarHBondContact O-N 2.94Å; I446-L449 PolarHBondContact O-N 2.94Å; I446-Q450 PolarHBondContact O-N 3Å; I446-I451 HydrophobicContact CG1-CG1 4.46Å; I446-I451 WeakPolarHBondContact CG2-O 3.49Å; I446-I451 PolarHBondContact O-N 2.86Å; I446-M452 HydrophobicContact CG2-CE 4.19Å; I446-L456 HydrophobicContact CD1-CD1 4.4Å; I446-T478 HydrophobicContact CB-CG2 4.34Å; I446-T478 HydrophobicContact CG2-CG2 3.61Å; I446-L482 HydrophobicContact CG2-CD1 3.98Å
447	A	95.1	Very high	94.2	Very high	9 Å²	9	49.8 Å²	49.8	7%	0.074	26%	0.259	C	S	.	.	H	α-helix	trans	-63.6	-42	177.9	0	0	0	0	0	111.8	L443 I444 L445 Q450 T478 A481	L443-A447 WeakPolarHBondContact O-CB 3.44Å; L443-A447 PolarHBondContact O-N 3.08Å; I444-A447 WeakPolarHBondContact O-CB 3.42Å; I444-A447 PolarHBondContact O-N 3.48Å; L445-A447 VanDerWaalsContact C-N 3.33Å; L445-A447 PolarHBondContact O-N 3.42Å; A447-Q450 PolarHBondContact O-N 2.91Å; A447-Q450 PolarHBondContact O-NE2 2.94Å; A447-T478 HydrophobicContact CB-CG2 4.11Å; A447-A481 HydrophobicContact CB-CB 3.86Å
448	H	91.7	Very high	94.3	Very high	91 Å²	91	50.1 Å²	50.1	42%	0.421	26%	0.26	S	S	.	.	H	α-helix	trans	-72.7	-33	179.4	-68.2	157.6	0	0	0	113.9	Q408 I444 L445 Q450	Q408-H448 HydrophobicContact CG-CB 4.13Å; Q408-H448 PolarHBondContact NE2-O 2.97Å; I444-H448 WeakPolarHBondContact CG2-CE1 3.09Å; I444-H448 PolarHBondContact O-N 2.95Å; L445-H448 PolarHBondContact O-N 3.36Å; H448-Q450 VanDerWaalsContact C-N 3.34Å
449	L	90.8	Very high	94.4	Very high	33 Å²	33	44.5 Å²	44.5	17%	0.173	24%	0.239	C	C	.	.	H	α-helix	trans	-83.2	-13.5	177.1	-68.2	177.4	0	0	0	112.9	A411 Q412 V423 L445 I446 I451	A411-L449 HydrophobicContact CB-CD1 3.8Å; A411-L449 HydrophobicContact CB-CD2 3.88Å; A411-L449 HydrophobicContact CB-CG 4.29Å; Q412-L449 HydrophobicContact CG-CD2 3.68Å; V423-L449 HydrophobicContact CG1-CD1 4.31Å; L445-L449 HydrophobicContact CD1-CD1 4.05Å; L445-L449 HydrophobicContact CD1-CG 4.12Å; L445-L449 HydrophobicContact CD2-CD1 4.41Å; L445-L449 HydrophobicContact CG-CD1 3.79Å; L445-L449 HydrophobicContact CG-CG 4.27Å; L445-L449 VanDerWaalsContact O-CB 3.31Å; L445-L449 WeakPolarHBondContact O-CB 3.17Å; L445-L449 VanDerWaalsContact O-CG 3.27Å; L445-L449 WeakPolarHBondContact O-CG 3.17Å; L445-L449 PolarHBondContact O-N 3.49Å; I446-L449 PolarHBondContact O-N 2.94Å; L449-I451 VanDerWaalsContact C-N 3.29Å; L449-I451 HydrophobicContact CB-CD1 3.91Å; L449-I451 HydrophobicContact CB-CG1 3.79Å; L449-I451 HydrophobicContact CB-CG2 4.26Å; L449-I451 HydrophobicContact CD1-CD1 3.73Å; L449-I451 HydrophobicContact CD1-CG1 4.48Å; L449-I451 PolarHBondContact O-N 2.77Å
450	Q	93.2	Very high	94.4	Very high	109 Å²	109	42.9 Å²	42.9	51%	0.509	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	57	40.6	-178.1	-64.8	-73.6	-46.7	0	0	112.8	I446 A447 H448 A481 L482	I446-Q450 PolarHBondContact O-N 3Å; A447-Q450 PolarHBondContact O-N 2.91Å; A447-Q450 PolarHBondContact O-NE2 2.94Å; H448-Q450 VanDerWaalsContact C-N 3.34Å; Q450-A481 PolarHBondContact NE2-O 3.19Å; Q450-A481 PolarHBondContact OE1-O 3.38Å; Q450-L482 HydrophobicContact CB-CD2 4.31Å
451	I	91.8	Very high	94.4	Very high	56 Å²	56	43.1 Å²	43.1	29%	0.287	23%	0.233	S	C	.	.			trans	-111.6	124.3	-176.8	54.5	178.2	0	0	0	111.8	L427 I446 L449	L427-I451 HydrophobicContact CD1-CD1 3.45Å; L427-I451 VanDerWaalsContact CD1-CD1 3.45Å; L427-I451 HydrophobicContact CD1-CG1 4.49Å; I446-I451 HydrophobicContact CG1-CG1 4.46Å; I446-I451 WeakPolarHBondContact CG2-O 3.49Å; I446-I451 PolarHBondContact O-N 2.86Å; L449-I451 VanDerWaalsContact C-N 3.29Å; L449-I451 HydrophobicContact CB-CD1 3.91Å; L449-I451 HydrophobicContact CB-CG1 3.79Å; L449-I451 HydrophobicContact CB-CG2 4.26Å; L449-I451 HydrophobicContact CD1-CD1 3.73Å; L449-I451 HydrophobicContact CD1-CG1 4.48Å; L449-I451 PolarHBondContact O-N 2.77Å
452	M	94.1	Very high	94.5	Very high	54 Å²	54	47 Å²	47	27%	0.266	25%	0.249	S	C	.	.			trans	-137.9	117.8	168.2	-174.1	58.8	65	0	0	108.8	I446 L456 L457 F460 L482 M484	I446-M452 HydrophobicContact CG2-CE 4.19Å; M452-L456 HydrophobicContact SD-CB 4.19Å; M452-L457 HydrophobicContact SD-CB 4.25Å; M452-L457 HydrophobicContact SD-CD1 4.34Å; M452-F460 HydrophobicContact CE-CB 4.13Å; M452-F460 HydrophobicContact CE-CD1 3.66Å; M452-F460 HydrophobicContact CE-CD2 3.97Å; M452-F460 HydrophobicContact CE-CE1 4.01Å; M452-F460 HydrophobicContact CE-CE2 4.31Å; M452-F460 HydrophobicContact CE-CG 3.63Å; M452-F460 HydrophobicContact CE-CZ 4.32Å; M452-F460 HydrophobicContact SD-CB 4.37Å; M452-F460 HydrophobicContact SD-CD1 4.34Å; M452-F460 HydrophobicContact SD-CG 4.4Å; M452-L482 HydrophobicContact CB-CD1 4.26Å; M452-L482 HydrophobicContact CE-CD1 3.61Å; M452-M484 HydrophobicContact CE-CE 4.14Å; M452-M484 HydrophobicContact CE-SD 3.99Å; M452-M484 HydrophobicContact CG-CE 3.73Å; M452-M484 HydrophobicContact SD-CE 4.38Å
453	T	91.6	Very high	94.6	Very high	51 Å²	51	47 Å²	47	31%	0.313	25%	0.249	S	C	.	.			trans	-116.7	159.9	-177.9	62.3	0	0	0	0	109.8	H424 K455 L456 L457	H424-T453 PolarHBondContact CD2-OG1 3.39Å; H424-T453 PolarHBondContact NE2-OG1 2.88Å; T453-K455 PolarHBondContact O-N 3.26Å; T453-L456 PolarHBondContact O-N 3.07Å; T453-L456 WeakPolarHBondContact OG1-CG 3.45Å; T453-L456 PolarHBondContact OG1-N 3.06Å; T453-L457 PolarHBondContact O-N 3.01Å
454	A	91.5	Very high	94.6	Very high	89 Å²	89	47 Å²	47	74%	0.736	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.2	-28.2	176.7	0	0	0	0	0	113.4	P458	A454-P458 WeakPolarHBondContact O-CD 3.28Å
455	K	92.8	Very high	94.6	Very high	132 Å²	132	49.8 Å²	49.8	57%	0.574	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.1	-26.7	176.9	-67.6	-177	-180	-179.5	0	114	T453 P459	T453-K455 PolarHBondContact O-N 3.26Å; K455-P459 WeakPolarHBondContact O-CD 3.48Å
456	L	95.8	Very high	94.7	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.3	-23.7	175.6	-69.4	172.2	0	0	0	112.1	H424 L427 R428 L431 I446 M452 T453 P459 F460	H424-L456 WeakPolarHBondContact NE2-CG 3.14Å; L427-L456 HydrophobicContact CB-CD2 3.98Å; R428-L456 HydrophobicContact CB-CD2 3.88Å; L431-L456 HydrophobicContact CD1-CD2 4.27Å; I446-L456 HydrophobicContact CD1-CD1 4.4Å; M452-L456 HydrophobicContact SD-CB 4.19Å; T453-L456 PolarHBondContact O-N 3.07Å; T453-L456 WeakPolarHBondContact OG1-CG 3.45Å; T453-L456 PolarHBondContact OG1-N 3.06Å; L456-P459 WeakPolarHBondContact O-CD 3.32Å; L456-P459 VanDerWaalsContact O-CG 3.28Å; L456-P459 WeakPolarHBondContact O-CG 3.4Å; L456-F460 WeakPolarHBondContact O-CB 3.48Å; L456-F460 PolarHBondContact O-N 2.88Å
457	L	95.3	Very high	94.7	Very high	42 Å²	42	57.4 Å²	57.4	22%	0.22	31%	0.305	C	S	.	.	H	α-helix	trans	-60.1	-47.2	-176.5	179.8	66.5	0	0	0	113.1	M452 T453 F460 L461 M484 V489	M452-L457 HydrophobicContact SD-CB 4.25Å; M452-L457 HydrophobicContact SD-CD1 4.34Å; T453-L457 PolarHBondContact O-N 3.01Å; L457-F460 HydrophobicContact CD1-CD1 4.26Å; L457-F460 WeakPolarHBondContact O-CB 3.36Å; L457-F460 PolarHBondContact O-N 3.02Å; L457-L461 HydrophobicContact CD1-CD1 4.19Å; L457-L461 HydrophobicContact CD1-CG 4.07Å; L457-L461 HydrophobicContact CG-CD1 4.06Å; L457-L461 HydrophobicContact CG-CG 4.38Å; L457-L461 WeakPolarHBondContact O-CB 3.32Å; L457-L461 WeakPolarHBondContact O-CG 3.2Å; L457-L461 PolarHBondContact O-N 2.89Å; L457-M484 HydrophobicContact CD1-CE 4.07Å; L457-V489 HydrophobicContact CD1-CG2 4.4Å
458	P	95.7	Very high	94.8	Very high	80 Å²	80	62.5 Å²	62.5	52%	0.519	33%	0.326	S	S	.	.	H	α-helix	trans	-59.4	-51.5	176.9	-22.5	32	0	0	0	114.4	A454 F460 L461 K462	A454-P458 WeakPolarHBondContact O-CD 3.28Å; P458-F460 VanDerWaalsContact C-N 3.29Å; P458-F460 PolarHBondContact O-N 3.36Å; P458-L461 PolarHBondContact O-N 3.15Å; P458-K462 PolarHBondContact O-N 3.11Å; P458-K462 VanDerWaalsContact O-N 3.11Å
459	P	96.8	Very high	95	Very high	7 Å²	7	60.9 Å²	60.9	5%	0.045	32%	0.323	C	S	.	.	H	α-helix	trans	-67.6	-30	177.5	25.6	-33.5	0	0	0	112.9	R428 L431 E432 K455 L456 K462 C463	R428-P459 HydrophobicContact CG-CG 4.5Å; L431-P459 HydrophobicContact CB-CB 3.9Å; L431-P459 HydrophobicContact CD1-CB 4.46Å; L431-P459 HydrophobicContact CD1-CG 4.45Å; E432-P459 HydrophobicContact CG-CB 3.61Å; E432-P459 HydrophobicContact CG-CG 4.16Å; K455-P459 WeakPolarHBondContact O-CD 3.48Å; L456-P459 WeakPolarHBondContact O-CD 3.32Å; L456-P459 VanDerWaalsContact O-CG 3.28Å; L456-P459 WeakPolarHBondContact O-CG 3.4Å; P459-K462 PolarHBondContact O-N 3.47Å; P459-C463 PolarHBondContact O-N 3.46Å; P459-C463 PolarHBondContact O-SG 3.03Å
460	F	97.3	Very high	95.4	Very high	0 Å²	0	62.1 Å²	62.1	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-61.9	-46.2	170.2	173.7	-108.9	0	0	0	112.2	L443 M452 L456 L457 P458 K462 C463 F464 A475 T478 A479 M484 V489	L443-F460 HydrophobicContact CD2-CD2 3.44Å; L443-F460 VanDerWaalsContact CD2-CD2 3.44Å; L443-F460 HydrophobicContact CD2-CE2 3.73Å; M452-F460 HydrophobicContact CE-CB 4.13Å; M452-F460 HydrophobicContact CE-CD1 3.66Å; M452-F460 HydrophobicContact CE-CD2 3.97Å; M452-F460 HydrophobicContact CE-CE1 4.01Å; M452-F460 HydrophobicContact CE-CE2 4.31Å; M452-F460 HydrophobicContact CE-CG 3.63Å; M452-F460 HydrophobicContact CE-CZ 4.32Å; M452-F460 HydrophobicContact SD-CB 4.37Å; M452-F460 HydrophobicContact SD-CD1 4.34Å; M452-F460 HydrophobicContact SD-CG 4.4Å; L456-F460 WeakPolarHBondContact O-CB 3.48Å; L456-F460 PolarHBondContact O-N 2.88Å; L457-F460 HydrophobicContact CD1-CD1 4.26Å; L457-F460 WeakPolarHBondContact O-CB 3.36Å; L457-F460 PolarHBondContact O-N 3.02Å; P458-F460 VanDerWaalsContact C-N 3.29Å; P458-F460 PolarHBondContact O-N 3.36Å; F460-K462 VanDerWaalsContact C-N 3.27Å; F460-K462 PolarHBondContact O-N 2.99Å; F460-C463 VanDerWaalsContact O-CB 3.25Å; F460-C463 WeakPolarHBondContact O-CB 3.48Å; F460-C463 PolarHBondContact O-N 3.23Å; F460-F464 HydrophobicContact CD1-CE2 4.21Å; F460-F464 AromaticContact CE1-CE2 3.65Å; F460-F464 HydrophobicContact CE1-CE2 3.65Å; F460-F464 AromaticContact CE1-CZ 3.92Å; F460-F464 HydrophobicContact CE1-CZ 3.92Å; F460-F464 AromaticContact CZ-CE2 3.87Å; F460-F464 HydrophobicContact CZ-CE2 3.87Å; F460-F464 AromaticContact CZ-CZ 3.74Å; F460-F464 HydrophobicContact CZ-CZ 3.74Å; F460-A475 HydrophobicContact CE2-CB 4.48Å; F460-T478 HydrophobicContact CE2-CG2 3.78Å; F460-T478 HydrophobicContact CZ-CG2 4.39Å; F460-A479 HydrophobicContact CZ-CB 4.08Å; F460-M484 HydrophobicContact CD1-SD 4.32Å; F460-M484 HydrophobicContact CE1-CE 4.14Å; F460-M484 HydrophobicContact CE1-SD 3.49Å; F460-M484 WeakPolarHBondContact CE1-SD 3.45Å; F460-M484 HydrophobicContact CZ-SD 3.91Å; F460-V489 HydrophobicContact CE1-CG2 4.21Å
461	L	96.8	Very high	95.6	Very high	34 Å²	34	57 Å²	57	18%	0.178	31%	0.313	C	S	.	.	H	α-helix	trans	-61.9	-36.6	177.9	-74.4	171.3	0	0	0	111.9	L457 P458 C463 F464 M488 V489 Q492	L457-L461 HydrophobicContact CD1-CD1 4.19Å; L457-L461 HydrophobicContact CD1-CG 4.07Å; L457-L461 HydrophobicContact CG-CD1 4.06Å; L457-L461 HydrophobicContact CG-CG 4.38Å; L457-L461 WeakPolarHBondContact O-CB 3.32Å; L457-L461 WeakPolarHBondContact O-CG 3.2Å; L457-L461 PolarHBondContact O-N 2.89Å; P458-L461 PolarHBondContact O-N 3.15Å; L461-C463 PolarHBondContact O-N 3.09Å; L461-F464 HydrophobicContact CD2-CD2 4.37Å; L461-F464 HydrophobicContact CD2-CE2 4.27Å; L461-F464 WeakPolarHBondContact O-CD2 3.39Å; L461-F464 PolarHBondContact O-N 3.32Å; L461-M488 HydrophobicContact CD2-CB 4.47Å; L461-V489 HydrophobicContact CD2-CG2 3.79Å; L461-Q492 HydrophobicContact CD2-CG 4.19Å
462	K	96.1	Very high	95.9	Very high	145 Å²	145	55.3 Å²	55.3	63%	0.63	30%	0.303	S	S	*	.	H	α-helix	trans	-60.2	-30.9	174.7	-169.1	179.5	177.7	-174.7	0	112.4	P458 P459 F460 F464 N465	P458-K462 PolarHBondContact O-N 3.11Å; P458-K462 VanDerWaalsContact O-N 3.11Å; P459-K462 PolarHBondContact O-N 3.47Å; F460-K462 VanDerWaalsContact C-N 3.27Å; F460-K462 PolarHBondContact O-N 2.99Å; K462-F464 PolarHBondContact O-N 3.49Å; K462-N465 PolarHBondContact O-N 2.98Å
463	C	97.2	Very high	96.1	Very high	2 Å²	2	56 Å²	56	1%	0.014	31%	0.305	C	S	.	.	G	3₁₀ helix	trans	-65.9	-20.1	-179.8	-64.2	0	0	0	0	113.8	L443 P459 F460 L461 N465 D466 V471 A475	L443-C463 HydrophobicContact CD1-CB 4.15Å; P459-C463 PolarHBondContact O-N 3.46Å; P459-C463 PolarHBondContact O-SG 3.03Å; F460-C463 VanDerWaalsContact O-CB 3.25Å; F460-C463 WeakPolarHBondContact O-CB 3.48Å; F460-C463 PolarHBondContact O-N 3.23Å; L461-C463 PolarHBondContact O-N 3.09Å; C463-N465 VanDerWaalsContact C-N 3.29Å; C463-D466 WeakPolarHBondContact O-CB 3.35Å; C463-V471 HydrophobicContact CB-CG1 3.84Å; C463-A475 HydrophobicContact CB-CB 3.87Å
464	F	97.2	Very high	96.4	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	-69.5	-28.2	172.7	-68.8	-73.1	0	0	0	112.3	F460 L461 K462 R472 A475 A479 V489 Q492 L493 L496	F460-F464 HydrophobicContact CD1-CE2 4.21Å; F460-F464 AromaticContact CE1-CE2 3.65Å; F460-F464 HydrophobicContact CE1-CE2 3.65Å; F460-F464 AromaticContact CE1-CZ 3.92Å; F460-F464 HydrophobicContact CE1-CZ 3.92Å; F460-F464 AromaticContact CZ-CE2 3.87Å; F460-F464 HydrophobicContact CZ-CE2 3.87Å; F460-F464 AromaticContact CZ-CZ 3.74Å; F460-F464 HydrophobicContact CZ-CZ 3.74Å; L461-F464 HydrophobicContact CD2-CD2 4.37Å; L461-F464 HydrophobicContact CD2-CE2 4.27Å; L461-F464 WeakPolarHBondContact O-CD2 3.39Å; L461-F464 PolarHBondContact O-N 3.32Å; K462-F464 PolarHBondContact O-N 3.49Å; F464-R472 WeakPolarHBondContact O-CD 3.41Å; F464-R472 WeakPolarHBondContact O-CG 3.24Å; F464-A475 HydrophobicContact CD1-CB 3.92Å; F464-A475 HydrophobicContact CE1-CB 3.9Å; F464-A475 HydrophobicContact CG-CB 4.34Å; F464-A475 HydrophobicContact CZ-CB 4.26Å; F464-A479 HydrophobicContact CZ-CB 4.1Å; F464-V489 HydrophobicContact CE2-CG1 4.27Å; F464-V489 HydrophobicContact CZ-CG1 3.96Å; F464-Q492 HydrophobicContact CB-CB 4.11Å; F464-Q492 HydrophobicContact CB-CG 4.48Å; F464-Q492 HydrophobicContact CD1-CB 4.42Å; F464-Q492 HydrophobicContact CD2-CB 3.86Å; F464-Q492 HydrophobicContact CD2-CG 4.18Å; F464-Q492 HydrophobicContact CE2-CB 4.41Å; F464-Q492 HydrophobicContact CG-CB 3.87Å; F464-Q492 HydrophobicContact CG-CG 4.48Å; F464-L493 HydrophobicContact CD1-CD2 4.39Å; F464-L493 HydrophobicContact CE1-CD2 3.65Å; F464-L493 HydrophobicContact CE1-CG 4.14Å; F464-L493 HydrophobicContact CZ-CD2 4.4Å; F464-L496 HydrophobicContact CB-CD1 4.02Å; F464-L496 HydrophobicContact CD1-CD1 3.57Å; F464-L496 HydrophobicContact CG-CD1 4.26Å; F464-L496 WeakPolarHBondContact O-CD2 3.38Å
465	N	95.6	Very high	96.7	Very high	103 Å²	103	50.9 Å²	50.9	55%	0.551	26%	0.262	S	S	*	.	G	3₁₀ helix	trans	-106.2	26.3	179.5	-60.8	-60.7	0	0	0	111.9	K462 C463 Q492	K462-N465 PolarHBondContact O-N 2.98Å; C463-N465 VanDerWaalsContact C-N 3.29Å; N465-Q492 PolarHBondContact ND2-OE1 3.39Å
466	D	96.8	Very high	97	Very high	20 Å²	20	44.6 Å²	44.6	11%	0.107	24%	0.235	C	C	.	.			trans	-72.4	144.9	-178.2	-161.2	-75.5	0	0	0	111.9	R439 C463 F468 V471 R472	R439-D466 IonicContact CZ-OD1 2.74Å; R439-D466 IonicContact CZ-OD2 3.56Å; R439-D466 IonicContact NE-OD2 3.5Å; R439-D466 PolarHBondContact NE-OD2 3.18Å; R439-D466 IonicContact NH2-OD1 3.98Å; R439-D466 PolarHBondContact NH2-OD1 3.1Å; R439-D466 IonicContact NH2-OD2 3.59Å; R439-D466 PolarHBondContact NH2-OD2 2.65Å; C463-D466 WeakPolarHBondContact O-CB 3.35Å; D466-F468 PolarHBondContact O-N 3.46Å; D466-F468 WeakPolarHBondContact OD1-CD2 3.49Å; D466-F468 PolarHBondContact OD1-N 3.48Å; D466-V471 HydrophobicContact CB-CB 3.81Å; D466-V471 HydrophobicContact CB-CG1 3.67Å; D466-R472 HydrophobicContact CB-CG 4.03Å; D466-R472 VanDerWaalsContact O-CD 3.23Å; D466-R472 WeakPolarHBondContact O-CD 3.46Å; D466-R472 WeakPolarHBondContact O-CG 3.43Å; D466-R472 PolarHBondContact O-NH1 3Å
467	N	95.3	Very high	97.1	Very high	149 Å²	149	48 Å²	48	80%	0.797	25%	0.253	S	S	*	.	S	Bend	trans	-59.4	-30.7	176.9	-65.9	-21.4	0	0	0	112.4	R472	N467-R472 PolarHBondContact O-NH1 3.14Å
468	F	96.8	Very high	97.2	Very high	116 Å²	116	46 Å²	46	51%	0.509	24%	0.242	S	C	.	.	S	Bend	trans	-93.3	124.3	-176	-64.7	-91.5	0	0	0	112.1	A436 D466 A470 V471 R472	A436-F468 HydrophobicContact CB-CB 3.94Å; A436-F468 HydrophobicContact CB-CD1 3.94Å; A436-F468 HydrophobicContact CB-CD2 3.56Å; A436-F468 HydrophobicContact CB-CE1 4.32Å; A436-F468 HydrophobicContact CB-CE2 3.97Å; A436-F468 HydrophobicContact CB-CG 3.52Å; A436-F468 HydrophobicContact CB-CZ 4.32Å; D466-F468 PolarHBondContact O-N 3.46Å; D466-F468 WeakPolarHBondContact OD1-CD2 3.49Å; D466-F468 PolarHBondContact OD1-N 3.48Å; F468-A470 PolarHBondContact O-N 2.95Å; F468-V471 HydrophobicContact CB-CG2 4.01Å; F468-V471 PolarHBondContact O-N 3.01Å; F468-R472 PolarHBondContact O-N 2.9Å
469	V	97.4	Very high	97.3	Very high	57 Å²	57	42.2 Å²	42.2	35%	0.345	22%	0.218	S	C	.	.	H	α-helix	trans	-53	-40.5	177.8	174.7	0	0	0	0	112.3	V471 R472 K473 A502 V505	V469-V471 VanDerWaalsContact C-N 3.31Å; V469-V471 PolarHBondContact O-N 3.24Å; V469-R472 PolarHBondContact O-N 2.87Å; V469-K473 HydrophobicContact CG1-CD 3.88Å; V469-K473 HydrophobicContact CG1-CG 4.28Å; V469-K473 WeakPolarHBondContact O-CG 3Å; V469-K473 PolarHBondContact O-N 3.24Å; V469-A502 HydrophobicContact CG1-CB 4.1Å; V469-A502 HydrophobicContact CG2-CB 3.97Å; V469-V505 HydrophobicContact CG1-CG2 3.82Å
470	A	97.6	Very high	97.3	Very high	59 Å²	59	42.3 Å²	42.3	49%	0.488	22%	0.219	S	C	.	.	H	α-helix	trans	-60.4	-39.7	179.5	0	0	0	0	0	112.6	V440 F468 Q474	V440-A470 HydrophobicContact CG2-CB 4.1Å; F468-A470 PolarHBondContact O-N 2.95Å; A470-Q474 WeakPolarHBondContact O-CB 3.16Å; A470-Q474 PolarHBondContact O-N 3.35Å
471	V	98	Very high	97.3	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-68.6	-47	179.2	-179.3	0	0	0	0	110.2	A436 R439 V440 L443 C463 D466 F468 V469 K473 Q474 A475	A436-V471 HydrophobicContact CB-CG2 3.9Å; R439-V471 HydrophobicContact CB-CG1 4.15Å; R439-V471 HydrophobicContact CB-CG2 4.14Å; V440-V471 HydrophobicContact CG2-CB 4.46Å; V440-V471 HydrophobicContact CG2-CG2 3.88Å; L443-V471 HydrophobicContact CD1-CG1 4.1Å; C463-V471 HydrophobicContact CB-CG1 3.84Å; D466-V471 HydrophobicContact CB-CB 3.81Å; D466-V471 HydrophobicContact CB-CG1 3.67Å; F468-V471 HydrophobicContact CB-CG2 4.01Å; F468-V471 PolarHBondContact O-N 3.01Å; V469-V471 VanDerWaalsContact C-N 3.31Å; V469-V471 PolarHBondContact O-N 3.24Å; V471-K473 PolarHBondContact O-N 3.13Å; V471-Q474 PolarHBondContact O-N 3.26Å; V471-A475 WeakPolarHBondContact O-CB 3.33Å; V471-A475 PolarHBondContact O-N 3.41Å
472	R	98.1	Very high	97.3	Very high	21 Å²	21	44.2 Å²	44.2	8%	0.079	24%	0.235	C	C	.	.	H	α-helix	trans	-61	-43.9	178.6	-59	-162.2	-58.5	-89.9	10.5	112.5	F464 D466 N467 F468 V469 Q474 A475 C476 D500 V505	F464-R472 WeakPolarHBondContact O-CD 3.41Å; F464-R472 WeakPolarHBondContact O-CG 3.24Å; D466-R472 HydrophobicContact CB-CG 4.03Å; D466-R472 VanDerWaalsContact O-CD 3.23Å; D466-R472 WeakPolarHBondContact O-CD 3.46Å; D466-R472 WeakPolarHBondContact O-CG 3.43Å; D466-R472 PolarHBondContact O-NH1 3Å; N467-R472 PolarHBondContact O-NH1 3.14Å; F468-R472 PolarHBondContact O-N 2.9Å; V469-R472 PolarHBondContact O-N 2.87Å; R472-Q474 PolarHBondContact O-N 3.15Å; R472-A475 PolarHBondContact O-N 2.74Å; R472-C476 PolarHBondContact O-N 3.27Å; R472-C476 VanDerWaalsContact O-N 3.16Å; R472-C476 PolarHBondContact O-SG 3.43Å; R472-D500 IonicContact CZ-OD1 3.67Å; R472-D500 IonicContact CZ-OD2 2.89Å; R472-D500 VanDerWaalsContact CZ-OD2 3.31Å; R472-D500 IonicContact NE-OD1 3.21Å; R472-D500 IonicContact NE-OD2 2.75Å; R472-D500 PolarHBondContact NE-OD2 2.91Å; R472-D500 IonicContact NH2-OD1 3.43Å; R472-D500 PolarHBondContact NH2-OD1 3.23Å; R472-D500 IonicContact NH2-OD2 3.46Å; R472-D500 PolarHBondContact NH2-OD2 3.47Å; R472-D500 VanDerWaalsContact NH2-OD2 3.15Å; R472-V505 HydrophobicContact CB-CG1 4.11Å; R472-V505 HydrophobicContact CB-CG2 4.27Å
473	K	98.1	Very high	97.2	Very high	70 Å²	70	42 Å²	42	30%	0.304	23%	0.23	S	C	.	.	H	α-helix	trans	-58.3	-48.5	173.5	-73.1	176.5	69.3	176.3	0	111	V469 V471 A475 C476 L477 E504 V505 V508	V469-K473 HydrophobicContact CG1-CD 3.88Å; V469-K473 HydrophobicContact CG1-CG 4.28Å; V469-K473 WeakPolarHBondContact O-CG 3Å; V469-K473 PolarHBondContact O-N 3.24Å; V471-K473 PolarHBondContact O-N 3.13Å; K473-A475 VanDerWaalsContact C-N 3.32Å; K473-A475 PolarHBondContact O-N 3.24Å; K473-C476 WeakPolarHBondContact O-CB 3.26Å; K473-C476 PolarHBondContact O-N 3.2Å; K473-L477 WeakPolarHBondContact O-CG 3.35Å; K473-L477 PolarHBondContact O-N 3.2Å; K473-E504 HydrophobicContact CD-CB 4.01Å; K473-V505 HydrophobicContact CG-CB 4.5Å; K473-V505 HydrophobicContact CG-CG2 3.86Å; K473-V508 HydrophobicContact CG-CG2 4.44Å
474	Q	98.1	Very high	97	Very high	31 Å²	31	42.2 Å²	42.2	15%	0.145	23%	0.23	C	C	.	.	H	α-helix	trans	-65.9	-36.4	-178.5	-171.5	58.1	48.5	0	0	111.8	V440 L443 I444 A470 V471 R472 C476 L477 T478	V440-Q474 HydrophobicContact CG1-CB 4.3Å; V440-Q474 HydrophobicContact CG1-CG 4.14Å; V440-Q474 HydrophobicContact CG2-CB 4.42Å; L443-Q474 HydrophobicContact CB-CB 4.41Å; L443-Q474 HydrophobicContact CB-CG 3.51Å; L443-Q474 HydrophobicContact CD1-CB 4.02Å; L443-Q474 HydrophobicContact CD1-CG 4.03Å; L443-Q474 HydrophobicContact CG-CG 4.43Å; I444-Q474 VanDerWaalsContact CG1-CD 3.43Å; I444-Q474 HydrophobicContact CG1-CG 4.01Å; A470-Q474 WeakPolarHBondContact O-CB 3.16Å; A470-Q474 PolarHBondContact O-N 3.35Å; V471-Q474 PolarHBondContact O-N 3.26Å; R472-Q474 PolarHBondContact O-N 3.15Å; Q474-C476 VanDerWaalsContact C-N 3.31Å; Q474-C476 PolarHBondContact O-N 3.02Å; Q474-L477 PolarHBondContact O-N 3.35Å; Q474-T478 PolarHBondContact NE2-OG1 3.14Å; Q474-T478 WeakPolarHBondContact O-CB 3.28Å; Q474-T478 PolarHBondContact O-N 2.91Å; Q474-T478 PolarHBondContact O-OG1 3.4Å; Q474-T478 VanDerWaalsContact O-OG1 3.05Å
475	A	98.1	Very high	96.8	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-59.6	-42.5	175	0	0	0	0	0	111.5	L443 F460 C463 F464 V471 R472 K473 T478 A479	L443-A475 HydrophobicContact CD1-CB 4.2Å; F460-A475 HydrophobicContact CE2-CB 4.48Å; C463-A475 HydrophobicContact CB-CB 3.87Å; F464-A475 HydrophobicContact CD1-CB 3.92Å; F464-A475 HydrophobicContact CE1-CB 3.9Å; F464-A475 HydrophobicContact CG-CB 4.34Å; F464-A475 HydrophobicContact CZ-CB 4.26Å; V471-A475 WeakPolarHBondContact O-CB 3.33Å; V471-A475 PolarHBondContact O-N 3.41Å; R472-A475 PolarHBondContact O-N 2.74Å; K473-A475 VanDerWaalsContact C-N 3.32Å; K473-A475 PolarHBondContact O-N 3.24Å; A475-T478 PolarHBondContact O-N 3.32Å; A475-A479 PolarHBondContact O-N 3.34Å
476	C	98.1	Very high	96.6	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-63.1	-44.3	174.5	-61.8	0	0	0	0	112.4	R472 K473 Q474 T478 A479 A480 L493 V508 A512	R472-C476 PolarHBondContact O-N 3.27Å; R472-C476 VanDerWaalsContact O-N 3.16Å; R472-C476 PolarHBondContact O-SG 3.43Å; K473-C476 WeakPolarHBondContact O-CB 3.26Å; K473-C476 PolarHBondContact O-N 3.2Å; Q474-C476 VanDerWaalsContact C-N 3.31Å; Q474-C476 PolarHBondContact O-N 3.02Å; C476-T478 VanDerWaalsContact C-N 3.34Å; C476-T478 PolarHBondContact O-N 3.45Å; C476-A479 PolarHBondContact O-N 3.42Å; C476-A480 PolarHBondContact O-N 2.89Å; C476-L493 HydrophobicContact CB-CD2 3.91Å; C476-L493 VanDerWaalsContact SG-CD2 3.59Å; C476-V508 HydrophobicContact CB-CB 4.48Å; C476-V508 HydrophobicContact CB-CG1 3.66Å; C476-A512 HydrophobicContact CB-CB 4.34Å; C476-A512 WeakPolarHBondContact O-CB 3.2Å
477	L	98.1	Very high	96.3	Very high	72 Å²	72	53.8 Å²	53.8	38%	0.377	28%	0.282	S	S	.	.	H	α-helix	trans	-62.1	-42.4	176.5	-69.1	173.7	0	0	0	111.8	K473 Q474 A480 A481 V508	K473-L477 WeakPolarHBondContact O-CG 3.35Å; K473-L477 PolarHBondContact O-N 3.2Å; Q474-L477 PolarHBondContact O-N 3.35Å; L477-A480 PolarHBondContact O-N 3.27Å; L477-A481 WeakPolarHBondContact O-CB 3.44Å; L477-A481 PolarHBondContact O-N 3.37Å; L477-V508 HydrophobicContact CD2-CG1 3.7Å; L477-V508 HydrophobicContact CG-CG1 3.71Å
478	T	98.1	Very high	96.2	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-65.3	-42.6	177.8	-62.8	0	0	0	0	111.3	L443 I446 A447 F460 Q474 A475 C476 A480 A481 L482	L443-T478 HydrophobicContact CD2-CG2 4.49Å; L443-T478 PolarHBondContact O-OG1 2.97Å; I446-T478 HydrophobicContact CB-CG2 4.34Å; I446-T478 HydrophobicContact CG2-CG2 3.61Å; A447-T478 HydrophobicContact CB-CG2 4.11Å; F460-T478 HydrophobicContact CE2-CG2 3.78Å; F460-T478 HydrophobicContact CZ-CG2 4.39Å; Q474-T478 PolarHBondContact NE2-OG1 3.14Å; Q474-T478 WeakPolarHBondContact O-CB 3.28Å; Q474-T478 PolarHBondContact O-N 2.91Å; Q474-T478 PolarHBondContact O-OG1 3.4Å; Q474-T478 VanDerWaalsContact O-OG1 3.05Å; A475-T478 PolarHBondContact O-N 3.32Å; C476-T478 VanDerWaalsContact C-N 3.34Å; C476-T478 PolarHBondContact O-N 3.45Å; T478-A480 VanDerWaalsContact C-N 3.29Å; T478-A480 PolarHBondContact O-N 3.43Å; T478-A481 PolarHBondContact O-N 3.13Å; T478-L482 HydrophobicContact CG2-CD1 3.9Å; T478-L482 HydrophobicContact CG2-CG 4.44Å; T478-L482 WeakPolarHBondContact O-CB 3.46Å; T478-L482 VanDerWaalsContact O-CG 3.3Å; T478-L482 WeakPolarHBondContact O-CG 3.22Å; T478-L482 PolarHBondContact O-N 3.03Å
479	A	97.7	Very high	96.1	Very high	0 Å²	0	47 Å²	47	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-58.5	-41.1	173.5	0	0	0	0	0	112.6	F460 F464 A475 C476 I483 M484 V489 L493	F460-A479 HydrophobicContact CZ-CB 4.08Å; F464-A479 HydrophobicContact CZ-CB 4.1Å; A475-A479 PolarHBondContact O-N 3.34Å; C476-A479 PolarHBondContact O-N 3.42Å; A479-I483 PolarHBondContact O-N 3.49Å; A479-I483 VanDerWaalsContact O-N 3.1Å; A479-M484 PolarHBondContact O-N 3.21Å; A479-V489 HydrophobicContact CB-CG1 3.86Å; A479-L493 HydrophobicContact CB-CD1 4.24Å
480	A	96.9	Very high	96	Very high	10 Å²	10	45.1 Å²	45.1	8%	0.083	24%	0.237	C	C	.	.	H	α-helix	trans	-67.7	-43.1	176.7	0	0	0	0	0	112.3	C476 L477 T478 L482 I483 A512 K515	C476-A480 PolarHBondContact O-N 2.89Å; L477-A480 PolarHBondContact O-N 3.27Å; T478-A480 VanDerWaalsContact C-N 3.29Å; T478-A480 PolarHBondContact O-N 3.43Å; A480-L482 VanDerWaalsContact C-N 3.27Å; A480-L482 PolarHBondContact O-N 3.25Å; A480-I483 PolarHBondContact O-N 3.33Å; A480-I483 VanDerWaalsContact O-N 3.11Å; A480-A512 HydrophobicContact CB-CB 3.8Å; A480-K515 HydrophobicContact CB-CB 4.29Å; A480-K515 HydrophobicContact CB-CD 4.21Å
481	A	97.1	Very high	95.8	Very high	44 Å²	44	46.6 Å²	46.6	36%	0.364	24%	0.236	S	C	.	.	H	α-helix	trans	-64.2	-32.9	179.3	0	0	0	0	0	112.5	A447 Q450 L477 T478	A447-A481 HydrophobicContact CB-CB 3.86Å; Q450-A481 PolarHBondContact NE2-O 3.19Å; Q450-A481 PolarHBondContact OE1-O 3.38Å; L477-A481 WeakPolarHBondContact O-CB 3.44Å; L477-A481 PolarHBondContact O-N 3.37Å; T478-A481 PolarHBondContact O-N 3.13Å
482	L	96.1	Very high	95.7	Very high	29 Å²	29	48.3 Å²	48.3	15%	0.152	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.3	-4.7	175.8	-64.9	174.4	0	0	0	113.2	I446 Q450 M452 T478 A480 M484	I446-L482 HydrophobicContact CG2-CD1 3.98Å; Q450-L482 HydrophobicContact CB-CD2 4.31Å; M452-L482 HydrophobicContact CB-CD1 4.26Å; M452-L482 HydrophobicContact CE-CD1 3.61Å; T478-L482 HydrophobicContact CG2-CD1 3.9Å; T478-L482 HydrophobicContact CG2-CG 4.44Å; T478-L482 WeakPolarHBondContact O-CB 3.46Å; T478-L482 VanDerWaalsContact O-CG 3.3Å; T478-L482 WeakPolarHBondContact O-CG 3.22Å; T478-L482 PolarHBondContact O-N 3.03Å; A480-L482 VanDerWaalsContact C-N 3.27Å; A480-L482 PolarHBondContact O-N 3.25Å; L482-M484 VanDerWaalsContact C-N 3.31Å; L482-M484 HydrophobicContact CB-CG 3.6Å; L482-M484 HydrophobicContact CB-SD 4.29Å; L482-M484 HydrophobicContact CD1-CG 4.31Å; L482-M484 HydrophobicContact CD1-SD 3.9Å; L482-M484 PolarHBondContact O-N 3.16Å
483	I	95.4	Very high	95.6	Very high	99 Å²	99	47.3 Å²	47.3	51%	0.508	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.7	51	-175.6	-46.8	179.5	0	0	0	110.9	A479 A480 K485	A479-I483 PolarHBondContact O-N 3.49Å; A479-I483 VanDerWaalsContact O-N 3.1Å; A480-I483 PolarHBondContact O-N 3.33Å; A480-I483 VanDerWaalsContact O-N 3.11Å; I483-K485 PolarHBondContact O-N 2.97Å; I483-K485 VanDerWaalsContact O-N 3.15Å
484	M	92.9	Very high	95.4	Very high	6 Å²	6	44.6 Å²	44.6	3%	0.03	23%	0.229	C	C	.	.			trans	-74.5	107.4	-172.8	-63.1	-168.7	75	0	0	112.4	M452 L457 F460 A479 L482 Y486 V489	M452-M484 HydrophobicContact CE-CE 4.14Å; M452-M484 HydrophobicContact CE-SD 3.99Å; M452-M484 HydrophobicContact CG-CE 3.73Å; M452-M484 HydrophobicContact SD-CE 4.38Å; L457-M484 HydrophobicContact CD1-CE 4.07Å; F460-M484 HydrophobicContact CD1-SD 4.32Å; F460-M484 HydrophobicContact CE1-CE 4.14Å; F460-M484 HydrophobicContact CE1-SD 3.49Å; F460-M484 WeakPolarHBondContact CE1-SD 3.45Å; F460-M484 HydrophobicContact CZ-SD 3.91Å; A479-M484 PolarHBondContact O-N 3.21Å; L482-M484 VanDerWaalsContact C-N 3.31Å; L482-M484 HydrophobicContact CB-CG 3.6Å; L482-M484 HydrophobicContact CB-SD 4.29Å; L482-M484 HydrophobicContact CD1-CG 4.31Å; L482-M484 HydrophobicContact CD1-SD 3.9Å; L482-M484 PolarHBondContact O-N 3.16Å; M484-Y486 HydrophobicContact CB-CD2 4.49Å; M484-Y486 HydrophobicContact CE-CD2 3.73Å; M484-Y486 HydrophobicContact CE-CE2 4.14Å; M484-V489 HydrophobicContact CB-CB 4.43Å; M484-V489 HydrophobicContact CB-CG1 4.05Å; M484-V489 HydrophobicContact CE-CG2 3.83Å; M484-V489 HydrophobicContact SD-CG1 4.48Å; M484-V489 HydrophobicContact SD-CG2 4.3Å
485	K	92.2	Very high	95.2	Very high	134 Å²	134	47.5 Å²	47.5	58%	0.583	24%	0.242	S	C	*	.			trans	-90.7	5	178	-57.1	-172.2	175.5	179.7	0	114.4	I483 S487 I516 C518	I483-K485 PolarHBondContact O-N 2.97Å; I483-K485 VanDerWaalsContact O-N 3.15Å; K485-S487 PolarHBondContact O-N 3.34Å; K485-I516 HydrophobicContact CG-CG2 4.02Å; K485-C518 VanDerWaalsContact CG-SG 3.56Å
486	Y	91.1	Very high	95.1	Very high	152 Å²	152	47.9 Å²	47.9	60%	0.596	24%	0.244	S	C	*	.			trans	-64.2	130	-179.9	-65.6	-74.9	0	0	0	110.9	M484 M488 V489 L490	M484-Y486 HydrophobicContact CB-CD2 4.49Å; M484-Y486 HydrophobicContact CE-CD2 3.73Å; M484-Y486 HydrophobicContact CE-CE2 4.14Å; Y486-M488 PolarHBondContact O-N 2.95Å; Y486-V489 PolarHBondContact O-N 3.27Å; Y486-L490 PolarHBondContact O-N 3.4Å
487	S	91	Very high	94.9	Very high	80 Å²	80	48.4 Å²	48.4	56%	0.559	25%	0.248	S	C	*	.	H	α-helix	trans	-53.6	-40.2	-177.4	56.4	0	0	0	0	112.9	K485 V489 L490 N491	K485-S487 PolarHBondContact O-N 3.34Å; S487-V489 VanDerWaalsContact C-N 3.35Å; S487-V489 PolarHBondContact O-N 3.16Å; S487-L490 PolarHBondContact O-N 3.36Å; S487-N491 VanDerWaalsContact O-CB 3.32Å; S487-N491 WeakPolarHBondContact O-CB 3.38Å; S487-N491 PolarHBondContact O-N 3.38Å; S487-N491 PolarHBondContact O-ND2 3.38Å; S487-N491 PolarHBondContact O-OD1 3.15Å
488	M	93.4	Very high	94.5	Very high	122 Å²	122	47.7 Å²	47.7	60%	0.601	24%	0.243	S	C	*	.	H	α-helix	trans	-59.3	-43.7	176.5	-64.3	179	179.4	0	0	112.2	L461 Y486 Q492	L461-M488 HydrophobicContact CD2-CB 4.47Å; Y486-M488 PolarHBondContact O-N 2.95Å; M488-Q492 WeakPolarHBondContact O-CG 3.22Å; M488-Q492 PolarHBondContact O-N 3.3Å; M488-Q492 VanDerWaalsContact O-N 3.08Å
489	V	94.7	Very high	94.3	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-71.2	-42.7	179.2	176.7	0	0	0	0	110.9	L457 F460 L461 F464 A479 M484 Y486 S487 N491 Q492 L493	L457-V489 HydrophobicContact CD1-CG2 4.4Å; F460-V489 HydrophobicContact CE1-CG2 4.21Å; L461-V489 HydrophobicContact CD2-CG2 3.79Å; F464-V489 HydrophobicContact CE2-CG1 4.27Å; F464-V489 HydrophobicContact CZ-CG1 3.96Å; A479-V489 HydrophobicContact CB-CG1 3.86Å; M484-V489 HydrophobicContact CB-CB 4.43Å; M484-V489 HydrophobicContact CB-CG1 4.05Å; M484-V489 HydrophobicContact CE-CG2 3.83Å; M484-V489 HydrophobicContact SD-CG1 4.48Å; M484-V489 HydrophobicContact SD-CG2 4.3Å; Y486-V489 PolarHBondContact O-N 3.27Å; S487-V489 VanDerWaalsContact C-N 3.35Å; S487-V489 PolarHBondContact O-N 3.16Å; V489-N491 VanDerWaalsContact C-N 3.31Å; V489-N491 PolarHBondContact O-N 3.46Å; V489-Q492 PolarHBondContact O-N 2.84Å; V489-L493 HydrophobicContact CG1-CD1 4.17Å; V489-L493 HydrophobicContact CG1-CG 4.47Å; V489-L493 WeakPolarHBondContact O-CG 3.39Å; V489-L493 PolarHBondContact O-N 3.33Å
490	L	94.3	Very high	94.2	Very high	19 Å²	19	53.7 Å²	53.7	10%	0.099	28%	0.275	C	S	.	.	H	α-helix	trans	-60.1	-42.8	176.1	-66.8	177.4	0	0	0	111.4	Y486 S487 L493 I494 L513 I516 C518	Y486-L490 PolarHBondContact O-N 3.4Å; S487-L490 PolarHBondContact O-N 3.36Å; L490-L493 PolarHBondContact O-N 3.39Å; L490-I494 WeakPolarHBondContact O-CB 3.43Å; L490-I494 VanDerWaalsContact O-CG1 3.27Å; L490-I494 WeakPolarHBondContact O-CG1 3.34Å; L490-I494 PolarHBondContact O-N 3.28Å; L490-L513 HydrophobicContact CD2-CD2 3.88Å; L490-I516 HydrophobicContact CD2-CD1 4.3Å; L490-I516 HydrophobicContact CD2-CG2 4.04Å; L490-C518 HydrophobicContact CD1-CB 3.99Å; L490-C518 HydrophobicContact CD2-CB 4.36Å
491	N	93.8	Very high	94.1	Very high	90 Å²	90	59.1 Å²	59.1	48%	0.481	31%	0.309	S	S	.	.	H	α-helix	trans	-63.7	-42.6	176.7	-71	-13	0	0	0	111.7	S487 V489 I494 Q495	S487-N491 VanDerWaalsContact O-CB 3.32Å; S487-N491 WeakPolarHBondContact O-CB 3.38Å; S487-N491 PolarHBondContact O-N 3.38Å; S487-N491 PolarHBondContact O-ND2 3.38Å; S487-N491 PolarHBondContact O-OD1 3.15Å; V489-N491 VanDerWaalsContact C-N 3.31Å; V489-N491 PolarHBondContact O-N 3.46Å; N491-I494 PolarHBondContact O-N 2.88Å; N491-Q495 WeakPolarHBondContact O-CB 3.38Å; N491-Q495 VanDerWaalsContact O-CG 3.3Å; N491-Q495 WeakPolarHBondContact O-CG 3.28Å; N491-Q495 PolarHBondContact O-N 2.93Å
492	Q	95.8	Very high	94.1	Very high	36 Å²	36	57.7 Å²	57.7	17%	0.168	30%	0.297	C	S	.	.	H	α-helix	trans	-61.5	-44	174.6	-71.8	-56.9	-59.1	0	0	111.8	L461 F464 N465 M488 V489 Q495 L496	L461-Q492 HydrophobicContact CD2-CG 4.19Å; F464-Q492 HydrophobicContact CB-CB 4.11Å; F464-Q492 HydrophobicContact CB-CG 4.48Å; F464-Q492 HydrophobicContact CD1-CB 4.42Å; F464-Q492 HydrophobicContact CD2-CB 3.86Å; F464-Q492 HydrophobicContact CD2-CG 4.18Å; F464-Q492 HydrophobicContact CE2-CB 4.41Å; F464-Q492 HydrophobicContact CG-CB 3.87Å; F464-Q492 HydrophobicContact CG-CG 4.48Å; N465-Q492 PolarHBondContact ND2-OE1 3.39Å; M488-Q492 WeakPolarHBondContact O-CG 3.22Å; M488-Q492 PolarHBondContact O-N 3.3Å; M488-Q492 VanDerWaalsContact O-N 3.08Å; V489-Q492 PolarHBondContact O-N 2.84Å; Q492-Q495 PolarHBondContact O-N 3.33Å; Q492-L496 WeakPolarHBondContact O-CG 3.34Å; Q492-L496 PolarHBondContact O-N 3.35Å
493	L	96.3	Very high	94.1	Very high	0 Å²	0	60.2 Å²	60.2	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-61.2	-46.9	176	-72.9	171.7	0	0	0	111.6	F464 C476 A479 V489 L490 Q495 L496 T497 A509 A512 L513 I516	F464-L493 HydrophobicContact CD1-CD2 4.39Å; F464-L493 HydrophobicContact CE1-CD2 3.65Å; F464-L493 HydrophobicContact CE1-CG 4.14Å; F464-L493 HydrophobicContact CZ-CD2 4.4Å; C476-L493 HydrophobicContact CB-CD2 3.91Å; C476-L493 VanDerWaalsContact SG-CD2 3.59Å; A479-L493 HydrophobicContact CB-CD1 4.24Å; V489-L493 HydrophobicContact CG1-CD1 4.17Å; V489-L493 HydrophobicContact CG1-CG 4.47Å; V489-L493 WeakPolarHBondContact O-CG 3.39Å; V489-L493 PolarHBondContact O-N 3.33Å; L490-L493 PolarHBondContact O-N 3.39Å; L493-Q495 VanDerWaalsContact C-N 3.35Å; L493-Q495 PolarHBondContact O-N 2.92Å; L493-L496 PolarHBondContact O-N 3.28Å; L493-T497 WeakPolarHBondContact O-CG2 3.1Å; L493-T497 PolarHBondContact O-N 3.37Å; L493-A509 HydrophobicContact CD2-CB 4.4Å; L493-A512 HydrophobicContact CD1-CB 4.46Å; L493-A512 HydrophobicContact CD2-CB 4.18Å; L493-L513 HydrophobicContact CB-CD1 4.03Å; L493-L513 HydrophobicContact CB-CD2 3.69Å; L493-L513 HydrophobicContact CB-CG 3.85Å; L493-L513 HydrophobicContact CD1-CD2 3.88Å; L493-L513 HydrophobicContact CD1-CG 4.21Å; L493-L513 HydrophobicContact CG-CD2 4.45Å; L493-I516 HydrophobicContact CD1-CD1 3.52Å
494	I	94.6	Very high	94.1	Very high	13 Å²	13	58.4 Å²	58.4	7%	0.067	29%	0.294	C	S	.	.	H	α-helix	trans	-60.1	-44.9	177.3	-70.1	166.4	0	0	0	110.6	L490 N491 L496 T497 Q498 L513 L523	L490-I494 WeakPolarHBondContact O-CB 3.43Å; L490-I494 VanDerWaalsContact O-CG1 3.27Å; L490-I494 WeakPolarHBondContact O-CG1 3.34Å; L490-I494 PolarHBondContact O-N 3.28Å; N491-I494 PolarHBondContact O-N 2.88Å; I494-L496 VanDerWaalsContact C-N 3.29Å; I494-L496 PolarHBondContact O-N 3.41Å; I494-T497 PolarHBondContact O-N 3.32Å; I494-T497 VanDerWaalsContact O-N 3.1Å; I494-T497 PolarHBondContact O-OG1 3.01Å; I494-Q498 VanDerWaalsContact CG2-NE2 3.34Å; I494-Q498 PolarHBondContact O-N 2.86Å; I494-L513 HydrophobicContact CG1-CD1 4.07Å; I494-L513 HydrophobicContact CG1-CD2 4.32Å; I494-L523 HydrophobicContact CD1-CB 4.48Å; I494-L523 HydrophobicContact CG1-CD1 4.39Å
495	Q	94.4	Very high	94.4	Very high	91 Å²	91	58.1 Å²	58.1	43%	0.425	29%	0.293	S	S	.	.	H	α-helix	trans	-57.8	-41.3	176	-77.2	179.3	-25.8	0	0	112.2	N491 Q492 L493 Q498 N499	N491-Q495 WeakPolarHBondContact O-CB 3.38Å; N491-Q495 VanDerWaalsContact O-CG 3.3Å; N491-Q495 WeakPolarHBondContact O-CG 3.28Å; N491-Q495 PolarHBondContact O-N 2.93Å; Q492-Q495 PolarHBondContact O-N 3.33Å; L493-Q495 VanDerWaalsContact C-N 3.35Å; L493-Q495 PolarHBondContact O-N 2.92Å; Q495-Q498 PolarHBondContact O-N 3.36Å; Q495-N499 WeakPolarHBondContact O-CB 3.48Å; Q495-N499 PolarHBondContact O-N 3.11Å; Q495-N499 PolarHBondContact O-ND2 2.99Å
496	L	95.6	Very high	94.6	Very high	8 Å²	8	53 Å²	53	4%	0.042	27%	0.271	C	S	.	.	H	α-helix	trans	-66.4	-36.3	176	-70.9	176.8	0	0	0	112.8	F464 Q492 L493 I494 Q498 D500 V505 A509	F464-L496 HydrophobicContact CB-CD1 4.02Å; F464-L496 HydrophobicContact CD1-CD1 3.57Å; F464-L496 HydrophobicContact CG-CD1 4.26Å; F464-L496 WeakPolarHBondContact O-CD2 3.38Å; Q492-L496 WeakPolarHBondContact O-CG 3.34Å; Q492-L496 PolarHBondContact O-N 3.35Å; L493-L496 PolarHBondContact O-N 3.28Å; I494-L496 VanDerWaalsContact C-N 3.29Å; I494-L496 PolarHBondContact O-N 3.41Å; L496-Q498 PolarHBondContact O-N 2.75Å; L496-D500 HydrophobicContact CD2-CB 4.21Å; L496-D500 WeakPolarHBondContact CD2-OD2 3.29Å; L496-D500 VanDerWaalsContact O-CB 3.22Å; L496-D500 WeakPolarHBondContact O-CB 3.35Å; L496-D500 PolarHBondContact O-N 3.36Å; L496-V505 HydrophobicContact CB-CG1 4.34Å; L496-V505 HydrophobicContact CD1-CG1 4.17Å; L496-V505 HydrophobicContact CD2-CG1 4.31Å; L496-A509 HydrophobicContact CB-CB 4.12Å
497	T	93.5	Very high	94.9	Very high	11 Å²	11	47.4 Å²	47.4	7%	0.067	25%	0.252	C	S	.	.	H	α-helix	trans	-61.8	-33.3	176.6	64.8	0	0	0	0	112.9	L493 I494 K506 A509 I510 L513	L493-T497 WeakPolarHBondContact O-CG2 3.1Å; L493-T497 PolarHBondContact O-N 3.37Å; I494-T497 PolarHBondContact O-N 3.32Å; I494-T497 VanDerWaalsContact O-N 3.1Å; I494-T497 PolarHBondContact O-OG1 3.01Å; T497-K506 WeakPolarHBondContact O-CD 3.26Å; T497-A509 HydrophobicContact CG2-CB 3.7Å; T497-I510 HydrophobicContact CG2-CB 4.44Å; T497-I510 HydrophobicContact CG2-CG1 3.51Å; T497-L513 HydrophobicContact CG2-CD1 3.72Å
498	Q	90.4	Very high	95.2	Very high	58 Å²	58	44.6 Å²	44.6	27%	0.271	23%	0.232	S	C	.	.	H	α-helix	trans	-85	-52.6	-178.4	-64.1	160.6	4.8	0	0	111.3	I494 Q495 L496 K506 H526	I494-Q498 VanDerWaalsContact CG2-NE2 3.34Å; I494-Q498 PolarHBondContact O-N 2.86Å; Q495-Q498 PolarHBondContact O-N 3.36Å; L496-Q498 PolarHBondContact O-N 2.75Å; Q498-K506 PolarHBondContact O-NZ 3.4Å; Q498-H526 PolarHBondContact NE2-CD2 3.29Å; Q498-H526 PolarHBondContact NE2-CE1 2.99Å; Q498-H526 PolarHBondContact NE2-ND1 3.43Å; Q498-H526 PolarHBondContact NE2-NE2 2.8Å
499	N	93.1	Very high	95.4	Very high	118 Å²	118	38.8 Å²	38.8	63%	0.631	20%	0.203	S	C	*	.	H	α-helix	trans	-108.3	-8	-156.7	-56	-48.5	0	0	0	114.1	Q495	Q495-N499 WeakPolarHBondContact O-CB 3.48Å; Q495-N499 PolarHBondContact O-N 3.11Å; Q495-N499 PolarHBondContact O-ND2 2.99Å
500	D	96.5	Very high	95.6	Very high	8 Å²	8	38.9 Å²	38.9	4%	0.043	20%	0.204	C	C	.	.			trans	-68.9	131.2	-177.6	-161.1	-69.8	0	0	0	111.3	R472 L496 A502 V505 K506	R472-D500 IonicContact CZ-OD1 3.67Å; R472-D500 IonicContact CZ-OD2 2.89Å; R472-D500 VanDerWaalsContact CZ-OD2 3.31Å; R472-D500 IonicContact NE-OD1 3.21Å; R472-D500 IonicContact NE-OD2 2.75Å; R472-D500 PolarHBondContact NE-OD2 2.91Å; R472-D500 IonicContact NH2-OD1 3.43Å; R472-D500 PolarHBondContact NH2-OD1 3.23Å; R472-D500 IonicContact NH2-OD2 3.46Å; R472-D500 PolarHBondContact NH2-OD2 3.47Å; R472-D500 VanDerWaalsContact NH2-OD2 3.15Å; L496-D500 HydrophobicContact CD2-CB 4.21Å; L496-D500 WeakPolarHBondContact CD2-OD2 3.29Å; L496-D500 VanDerWaalsContact O-CB 3.22Å; L496-D500 WeakPolarHBondContact O-CB 3.35Å; L496-D500 PolarHBondContact O-N 3.36Å; D500-A502 VanDerWaalsContact C-N 3.25Å; D500-A502 PolarHBondContact O-N 2.57Å; D500-A502 WeakPolarHBondContact OD1-CA 3.44Å; D500-A502 WeakPolarHBondContact OD1-CB 3.43Å; D500-A502 PolarHBondContact OD1-N 3.42Å; D500-V505 HydrophobicContact CB-CB 4.15Å; D500-V505 HydrophobicContact CB-CG1 4.22Å; D500-V505 WeakPolarHBondContact OD2-CG1 3.44Å; D500-K506 HydrophobicContact CB-CG 4.25Å; D500-K506 WeakPolarHBondContact O-CE 2.89Å
501	P	94.3	Very high	95.7	Very high	124 Å²	124	39.9 Å²	39.9	81%	0.805	21%	0.212	S	C	*	.	S	Bend	trans	-67.1	-26	178.7	26.7	-35.8	0	0	0	113.2
502	A	96.4	Very high	95.8	Very high	14 Å²	14	35.7 Å²	35.7	12%	0.116	19%	0.19	C	C	.	.			trans	-93.1	116.2	-179.6	0	0	0	0	0	110.7	V469 D500 E504 V505 K506	V469-A502 HydrophobicContact CG1-CB 4.1Å; V469-A502 HydrophobicContact CG2-CB 3.97Å; D500-A502 VanDerWaalsContact C-N 3.25Å; D500-A502 PolarHBondContact O-N 2.57Å; D500-A502 WeakPolarHBondContact OD1-CA 3.44Å; D500-A502 WeakPolarHBondContact OD1-CB 3.43Å; D500-A502 PolarHBondContact OD1-N 3.42Å; A502-E504 PolarHBondContact O-N 2.94Å; A502-V505 HydrophobicContact CB-CG2 3.92Å; A502-V505 WeakPolarHBondContact O-CB 3.25Å; A502-V505 PolarHBondContact O-N 2.89Å; A502-K506 PolarHBondContact O-N 2.8Å
503	W	95.4	Very high	95.8	Very high	81 Å²	81	34.1 Å²	34.1	31%	0.307	18%	0.182	S	C	.	.	H	α-helix	trans	-59.8	-29.5	179	68.6	-89.8	0	0	0	112.3	V505 K506 V507 K536 Q538 V539	W503-V505 VanDerWaalsContact C-N 3.26Å; W503-V505 PolarHBondContact O-N 2.72Å; W503-K506 PolarHBondContact O-N 3.47Å; W503-V507 HydrophobicContact CE3-CG2 3.92Å; W503-V507 HydrophobicContact CZ3-CG2 4.19Å; W503-V507 WeakPolarHBondContact O-CG2 3.39Å; W503-V507 PolarHBondContact O-N 3.1Å; W503-K536 HydrophobicContact CB-CB 4.12Å; W503-K536 HydrophobicContact CB-CG 3.77Å; W503-K536 HydrophobicContact CG-CB 4.4Å; W503-K536 HydrophobicContact CG-CG 3.98Å; W503-Q538 HydrophobicContact CE3-CB 3.71Å; W503-Q538 HydrophobicContact CE3-CG 4.14Å; W503-Q538 HydrophobicContact CH2-CB 4.37Å; W503-Q538 HydrophobicContact CH2-CG 3.96Å; W503-Q538 HydrophobicContact CZ3-CB 3.45Å; W503-Q538 VanDerWaalsContact CZ3-CB 3.45Å; W503-Q538 HydrophobicContact CZ3-CG 3.52Å; W503-V539 HydrophobicContact CB-CG2 3.96Å
504	E	97.2	Very high	95.8	Very high	61 Å²	61	34.1 Å²	34.1	29%	0.285	18%	0.183	S	C	.	.	H	α-helix	trans	-62.5	-34.8	176	-61.9	85.9	164.6	0	0	111.8	K473 A502 V508	K473-E504 HydrophobicContact CD-CB 4.01Å; A502-E504 PolarHBondContact O-N 2.94Å; E504-V508 VanDerWaalsContact O-CG2 3.28Å; E504-V508 WeakPolarHBondContact O-CG2 3.36Å; E504-V508 PolarHBondContact O-N 2.95Å
505	V	97.8	Very high	95.8	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-71.2	-46.2	176.1	-176.6	0	0	0	0	109.4	V469 R472 K473 L496 D500 A502 W503 V507 V508 A509	V469-V505 HydrophobicContact CG1-CG2 3.82Å; R472-V505 HydrophobicContact CB-CG1 4.11Å; R472-V505 HydrophobicContact CB-CG2 4.27Å; K473-V505 HydrophobicContact CG-CB 4.5Å; K473-V505 HydrophobicContact CG-CG2 3.86Å; L496-V505 HydrophobicContact CB-CG1 4.34Å; L496-V505 HydrophobicContact CD1-CG1 4.17Å; L496-V505 HydrophobicContact CD2-CG1 4.31Å; D500-V505 HydrophobicContact CB-CB 4.15Å; D500-V505 HydrophobicContact CB-CG1 4.22Å; D500-V505 WeakPolarHBondContact OD2-CG1 3.44Å; A502-V505 HydrophobicContact CB-CG2 3.92Å; A502-V505 WeakPolarHBondContact O-CB 3.25Å; A502-V505 PolarHBondContact O-N 2.89Å; W503-V505 VanDerWaalsContact C-N 3.26Å; W503-V505 PolarHBondContact O-N 2.72Å; V505-V507 VanDerWaalsContact C-N 3.3Å; V505-V507 PolarHBondContact O-N 3.18Å; V505-V508 PolarHBondContact O-N 3.03Å; V505-V508 VanDerWaalsContact O-N 3.13Å; V505-A509 WeakPolarHBondContact O-CB 3.22Å; V505-A509 PolarHBondContact O-N 3.33Å
506	K	97.1	Very high	95.9	Very high	27 Å²	27	35.6 Å²	35.6	12%	0.117	19%	0.187	C	C	.	.	H	α-helix	trans	-53.8	-47.2	176.7	-60.5	-168.8	-179.5	-158.7	0	111.6	T497 Q498 D500 A502 W503 V508 A509 I510 E534 V539	T497-K506 WeakPolarHBondContact O-CD 3.26Å; Q498-K506 PolarHBondContact O-NZ 3.4Å; D500-K506 HydrophobicContact CB-CG 4.25Å; D500-K506 WeakPolarHBondContact O-CE 2.89Å; A502-K506 PolarHBondContact O-N 2.8Å; W503-K506 PolarHBondContact O-N 3.47Å; K506-V508 PolarHBondContact O-N 3.28Å; K506-A509 PolarHBondContact O-N 3.31Å; K506-I510 WeakPolarHBondContact O-CB 3.03Å; K506-I510 VanDerWaalsContact O-CG1 3.26Å; K506-I510 WeakPolarHBondContact O-CG1 3.36Å; K506-I510 PolarHBondContact O-N 2.69Å; K506-E534 WeakPolarHBondContact CD-OE1 3.45Å; K506-E534 IonicContact NZ-OE1 2.81Å; K506-E534 PolarHBondContact NZ-OE1 3.37Å; K506-E534 IonicContact NZ-OE2 3.61Å; K506-V539 HydrophobicContact CB-CG1 4.24Å; K506-V539 HydrophobicContact CB-CG2 4.19Å
507	V	97.4	Very high	95.7	Very high	34 Å²	34	37.4 Å²	37.4	21%	0.206	21%	0.208	C	C	.	.	H	α-helix	trans	-57.3	-49.5	177	167.5	0	0	0	0	111.7	W503 V505 I510 S511 Q538 V539 A542	W503-V507 HydrophobicContact CE3-CG2 3.92Å; W503-V507 HydrophobicContact CZ3-CG2 4.19Å; W503-V507 WeakPolarHBondContact O-CG2 3.39Å; W503-V507 PolarHBondContact O-N 3.1Å; V505-V507 VanDerWaalsContact C-N 3.3Å; V505-V507 PolarHBondContact O-N 3.18Å; V507-I510 PolarHBondContact O-N 3.25Å; V507-S511 WeakPolarHBondContact O-CB 3.25Å; V507-S511 PolarHBondContact O-N 2.66Å; V507-Q538 HydrophobicContact CG2-CB 3.92Å; V507-V539 HydrophobicContact CG2-CB 4.44Å; V507-V539 HydrophobicContact CG2-CG2 3.92Å; V507-A542 HydrophobicContact CB-CB 4.37Å; V507-A542 HydrophobicContact CG1-CB 4.06Å; V507-A542 HydrophobicContact CG2-CB 4.31Å
508	V	97.9	Very high	95.4	Very high	22 Å²	22	38.3 Å²	38.3	13%	0.133	22%	0.215	C	C	.	.	H	α-helix	trans	-67.9	-38.7	-178.2	178.1	0	0	0	0	111	K473 C476 L477 E504 V505 K506 S511 A512	K473-V508 HydrophobicContact CG-CG2 4.44Å; C476-V508 HydrophobicContact CB-CB 4.48Å; C476-V508 HydrophobicContact CB-CG1 3.66Å; L477-V508 HydrophobicContact CD2-CG1 3.7Å; L477-V508 HydrophobicContact CG-CG1 3.71Å; E504-V508 VanDerWaalsContact O-CG2 3.28Å; E504-V508 WeakPolarHBondContact O-CG2 3.36Å; E504-V508 PolarHBondContact O-N 2.95Å; V505-V508 PolarHBondContact O-N 3.03Å; V505-V508 VanDerWaalsContact O-N 3.13Å; K506-V508 PolarHBondContact O-N 3.28Å; V508-S511 PolarHBondContact O-N 2.91Å; V508-A512 VanDerWaalsContact O-CB 3.27Å; V508-A512 WeakPolarHBondContact O-CB 3.17Å; V508-A512 PolarHBondContact O-N 3.25Å
509	A	97.6	Very high	95.3	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-64.2	-45.4	176.2	0	0	0	0	0	111.9	L493 L496 T497 V505 K506 A512 L513	L493-A509 HydrophobicContact CD2-CB 4.4Å; L496-A509 HydrophobicContact CB-CB 4.12Å; T497-A509 HydrophobicContact CG2-CB 3.7Å; V505-A509 WeakPolarHBondContact O-CB 3.22Å; V505-A509 PolarHBondContact O-N 3.33Å; K506-A509 PolarHBondContact O-N 3.31Å; A509-A512 WeakPolarHBondContact O-CB 3.4Å; A509-A512 PolarHBondContact O-N 3.34Å; A509-L513 WeakPolarHBondContact O-CG 3.26Å; A509-L513 PolarHBondContact O-N 3.48Å
510	I	97.3	Very high	95.1	Very high	2 Å²	2	35.5 Å²	35.5	1%	0.01	20%	0.203	C	C	.	.	H	α-helix	trans	-60.6	-47.2	174.2	-69.5	169.7	0	0	0	110.6	T497 K506 V507 A512 L513 G514 L527 A530 V539 A542 A546	T497-I510 HydrophobicContact CG2-CB 4.44Å; T497-I510 HydrophobicContact CG2-CG1 3.51Å; K506-I510 WeakPolarHBondContact O-CB 3.03Å; K506-I510 VanDerWaalsContact O-CG1 3.26Å; K506-I510 WeakPolarHBondContact O-CG1 3.36Å; K506-I510 PolarHBondContact O-N 2.69Å; V507-I510 PolarHBondContact O-N 3.25Å; I510-A512 VanDerWaalsContact C-N 3.27Å; I510-A512 PolarHBondContact O-N 3.21Å; I510-L513 PolarHBondContact O-N 3.46Å; I510-G514 PolarHBondContact O-N 3.37Å; I510-L527 HydrophobicContact CG1-CD2 4.4Å; I510-L527 HydrophobicContact CG2-CD2 3.71Å; I510-A530 HydrophobicContact CD1-CB 4.45Å; I510-V539 HydrophobicContact CD1-CG1 3.71Å; I510-A542 HydrophobicContact CB-CB 4.2Å; I510-A542 VanDerWaalsContact CG2-C 3.48Å; I510-A542 HydrophobicContact CG2-CB 3.94Å; I510-A542 WeakPolarHBondContact CG2-O 3.5Å; I510-A546 HydrophobicContact CG2-CB 3.63Å
511	S	96.7	Very high	94.7	Very high	40 Å²	40	40 Å²	40	28%	0.28	23%	0.233	S	C	.	.	H	α-helix	trans	-61.4	-36.6	176.3	174.5	0	0	0	0	112	V507 V508 K515	V507-S511 WeakPolarHBondContact O-CB 3.25Å; V507-S511 PolarHBondContact O-N 2.66Å; V508-S511 PolarHBondContact O-N 2.91Å; S511-K515 WeakPolarHBondContact O-CG 3.42Å; S511-K515 PolarHBondContact O-N 2.57Å
512	A	97.1	Very high	94.5	Very high	1 Å²	1	37.6 Å²	37.6	1%	0.008	22%	0.216	C	C	.	.	H	α-helix	trans	-65.9	-47.3	177.7	0	0	0	0	0	110.9	C476 A480 L493 V508 A509 I510 G514 K515 I516	C476-A512 HydrophobicContact CB-CB 4.34Å; C476-A512 WeakPolarHBondContact O-CB 3.2Å; A480-A512 HydrophobicContact CB-CB 3.8Å; L493-A512 HydrophobicContact CD1-CB 4.46Å; L493-A512 HydrophobicContact CD2-CB 4.18Å; V508-A512 VanDerWaalsContact O-CB 3.27Å; V508-A512 WeakPolarHBondContact O-CB 3.17Å; V508-A512 PolarHBondContact O-N 3.25Å; A509-A512 WeakPolarHBondContact O-CB 3.4Å; A509-A512 PolarHBondContact O-N 3.34Å; I510-A512 VanDerWaalsContact C-N 3.27Å; I510-A512 PolarHBondContact O-N 3.21Å; A512-G514 VanDerWaalsContact C-N 3.32Å; A512-G514 PolarHBondContact O-N 2.78Å; A512-K515 PolarHBondContact O-N 3.12Å; A512-K515 VanDerWaalsContact O-N 3.14Å; A512-I516 VanDerWaalsContact O-CG1 3.26Å; A512-I516 WeakPolarHBondContact O-CG1 3.31Å; A512-I516 PolarHBondContact O-N 3.42Å
513	L	96.2	Very high	94.3	Very high	3 Å²	3	37 Å²	37	2%	0.016	21%	0.211	C	C	.	.	H	α-helix	trans	-59.1	-42.9	176.2	-71.1	163.9	0	0	0	111.8	L490 L493 I494 T497 A509 I510 K515 I516 G517 L523	L490-L513 HydrophobicContact CD2-CD2 3.88Å; L493-L513 HydrophobicContact CB-CD1 4.03Å; L493-L513 HydrophobicContact CB-CD2 3.69Å; L493-L513 HydrophobicContact CB-CG 3.85Å; L493-L513 HydrophobicContact CD1-CD2 3.88Å; L493-L513 HydrophobicContact CD1-CG 4.21Å; L493-L513 HydrophobicContact CG-CD2 4.45Å; I494-L513 HydrophobicContact CG1-CD1 4.07Å; I494-L513 HydrophobicContact CG1-CD2 4.32Å; T497-L513 HydrophobicContact CG2-CD1 3.72Å; A509-L513 WeakPolarHBondContact O-CG 3.26Å; A509-L513 PolarHBondContact O-N 3.48Å; I510-L513 PolarHBondContact O-N 3.46Å; L513-K515 PolarHBondContact O-N 3.45Å; L513-I516 PolarHBondContact O-N 2.94Å; L513-G517 PolarHBondContact O-N 3.16Å; L513-G517 VanDerWaalsContact O-N 3.14Å; L513-L523 HydrophobicContact CB-CD1 4.25Å; L513-L523 HydrophobicContact CB-CD2 4.07Å; L513-L523 HydrophobicContact CD1-CD1 3.66Å; L513-L523 HydrophobicContact CD2-CD2 4.46Å; L513-L523 HydrophobicContact CG-CD1 4.4Å
514	G	95.4	Very high	94.2	Very high	1 Å²	1	35.5 Å²	35.5	1%	0.01	21%	0.207	C	C	.	.	H	α-helix	trans	-59	-44.3	173.6	0	0	0	0	0	113.1	I510 A512 G517 I549	I510-G514 PolarHBondContact O-N 3.37Å; A512-G514 VanDerWaalsContact C-N 3.32Å; A512-G514 PolarHBondContact O-N 2.78Å; G514-G517 PolarHBondContact O-N 2.79Å; G514-I549 VanDerWaalsContact O-CG2 3.27Å; G514-I549 WeakPolarHBondContact O-CG2 3.25Å
515	K	95.4	Very high	94	Very high	129 Å²	129	36.6 Å²	36.6	56%	0.561	22%	0.215	S	C	*	.	H	α-helix	trans	-69	-37.8	178	-74.6	178.8	-178.2	-179	0	113.5	A480 S511 A512 L513 G517	A480-K515 HydrophobicContact CB-CB 4.29Å; A480-K515 HydrophobicContact CB-CD 4.21Å; S511-K515 WeakPolarHBondContact O-CG 3.42Å; S511-K515 PolarHBondContact O-N 2.57Å; A512-K515 PolarHBondContact O-N 3.12Å; A512-K515 VanDerWaalsContact O-N 3.14Å; L513-K515 PolarHBondContact O-N 3.45Å; K515-G517 PolarHBondContact O-N 3.22Å
516	I	95.5	Very high	93.7	Very high	5 Å²	5	39.3 Å²	39.3	3%	0.026	23%	0.227	C	C	.	.	H	α-helix	trans	-64.6	-32.1	177.1	-67	162.7	0	0	0	110.4	K485 L490 L493 A512 L513 C518	K485-I516 HydrophobicContact CG-CG2 4.02Å; L490-I516 HydrophobicContact CD2-CD1 4.3Å; L490-I516 HydrophobicContact CD2-CG2 4.04Å; L493-I516 HydrophobicContact CD1-CD1 3.52Å; A512-I516 VanDerWaalsContact O-CG1 3.26Å; A512-I516 WeakPolarHBondContact O-CG1 3.31Å; A512-I516 PolarHBondContact O-N 3.42Å; L513-I516 PolarHBondContact O-N 2.94Å; I516-C518 HydrophobicContact CG2-CB 4.35Å
517	G	91.8	Very high	93.6	Very high	47 Å²	47	38.1 Å²	38.1	49%	0.485	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	80.2	17.5	170.3	0	0	0	0	0	114.5	L513 G514 K515	L513-G517 PolarHBondContact O-N 3.16Å; L513-G517 VanDerWaalsContact O-N 3.14Å; G514-G517 PolarHBondContact O-N 2.79Å; K515-G517 PolarHBondContact O-N 3.22Å
518	C	86.7	Confident	93.5	Very high	29 Å²	29	36.9 Å²	36.9	20%	0.196	21%	0.214	C	C	.	.			trans	-98.3	95.2	178.8	-72.9	0	0	0	0	110.7	K485 L490 I516 T520 L523	K485-C518 VanDerWaalsContact CG-SG 3.56Å; L490-C518 HydrophobicContact CD1-CB 3.99Å; L490-C518 HydrophobicContact CD2-CB 4.36Å; I516-C518 HydrophobicContact CG2-CB 4.35Å; C518-T520 PolarHBondContact O-N 2.79Å; C518-L523 WeakPolarHBondContact O-CD2 3.2Å
519	L	88.3	Confident	93.4	Very high	71 Å²	71	41.7 Å²	41.7	37%	0.372	23%	0.23	S	C	.	.			trans	-80.7	111.4	174.2	-174.5	69.1	0	0	0	110.2	Q524 L550 V552	L519-Q524 HydrophobicContact CD1-CB 4.05Å; L519-L550 HydrophobicContact CD1-CB 4.38Å; L519-L550 HydrophobicContact CD1-CD1 4.04Å; L519-V552 HydrophobicContact CD1-CG2 3.77Å; L519-V552 HydrophobicContact CD2-CG2 3.87Å
520	T	88.4	Confident	93.3	Very high	46 Å²	46	42 Å²	42	28%	0.282	23%	0.233	S	C	.	.			trans	-101.3	154.7	165.5	60.2	0	0	0	0	109.5	C518 T522 L523 Q524	C518-T520 PolarHBondContact O-N 2.79Å; T520-T522 PolarHBondContact O-N 3.36Å; T520-T522 PolarHBondContact OG1-OG1 3.41Å; T520-L523 WeakPolarHBondContact O-CB 3.48Å; T520-L523 PolarHBondContact O-N 3.13Å; T520-L523 VanDerWaalsContact OG1-CB 3.28Å; T520-L523 WeakPolarHBondContact OG1-CB 3.3Å; T520-L523 PolarHBondContact OG1-N 2.96Å; T520-L523 VanDerWaalsContact OG1-N 3.08Å; T520-Q524 PolarHBondContact O-N 2.98Å
521	P	89.7	Confident	93.1	Very high	103 Å²	103	42 Å²	42	67%	0.669	23%	0.233	S	C	*	.	H	α-helix	trans	-54.3	-44	174.2	-26.5	35	0	0	0	111.7	L523 Q524 D525	P521-L523 VanDerWaalsContact C-N 3.34Å; P521-L523 PolarHBondContact O-N 3.29Å; P521-Q524 WeakPolarHBondContact O-CB 3.49Å; P521-Q524 PolarHBondContact O-N 3.48Å; P521-Q524 VanDerWaalsContact O-N 3.09Å; P521-D525 VanDerWaalsContact O-CG 3.25Å; P521-D525 PolarHBondContact O-N 3.04Å
522	T	89.5	Confident	92.9	Very high	74 Å²	74	42 Å²	42	45%	0.454	23%	0.228	S	C	.	.	H	α-helix	trans	-55	-47.7	173.3	52.3	0	0	0	0	111.9	T520 Q524 D525 H526	T520-T522 PolarHBondContact O-N 3.36Å; T520-T522 PolarHBondContact OG1-OG1 3.41Å; T522-Q524 VanDerWaalsContact C-N 3.33Å; T522-Q524 PolarHBondContact O-N 2.91Å; T522-D525 PolarHBondContact O-N 3.45Å; T522-H526 PolarHBondContact O-CE1 3.24Å; T522-H526 PolarHBondContact O-N 3.21Å; T522-H526 VanDerWaalsContact O-N 3.07Å; T522-H526 PolarHBondContact O-ND1 2.97Å
523	L	91.4	Very high	92.6	Very high	1 Å²	1	47 Å²	47	1%	0.005	25%	0.252	C	S	.	.	H	α-helix	trans	-62.5	-41.7	178	177.8	59.2	0	0	0	111.6	I494 L513 C518 T520 P521 H526 L527 L550	I494-L523 HydrophobicContact CD1-CB 4.48Å; I494-L523 HydrophobicContact CG1-CD1 4.39Å; L513-L523 HydrophobicContact CB-CD1 4.25Å; L513-L523 HydrophobicContact CB-CD2 4.07Å; L513-L523 HydrophobicContact CD1-CD1 3.66Å; L513-L523 HydrophobicContact CD2-CD2 4.46Å; L513-L523 HydrophobicContact CG-CD1 4.4Å; C518-L523 WeakPolarHBondContact O-CD2 3.2Å; T520-L523 WeakPolarHBondContact O-CB 3.48Å; T520-L523 PolarHBondContact O-N 3.13Å; T520-L523 VanDerWaalsContact OG1-CB 3.28Å; T520-L523 WeakPolarHBondContact OG1-CB 3.3Å; T520-L523 PolarHBondContact OG1-N 2.96Å; T520-L523 VanDerWaalsContact OG1-N 3.08Å; P521-L523 VanDerWaalsContact C-N 3.34Å; P521-L523 PolarHBondContact O-N 3.29Å; L523-H526 PolarHBondContact O-N 3.14Å; L523-L527 HydrophobicContact CD1-CD1 4.12Å; L523-L527 HydrophobicContact CD1-CD2 4.33Å; L523-L527 HydrophobicContact CD1-CG 3.93Å; L523-L527 HydrophobicContact CG-CD1 3.94Å; L523-L527 HydrophobicContact CG-CG 4.22Å; L523-L527 WeakPolarHBondContact O-CB 3.41Å; L523-L527 VanDerWaalsContact O-CG 3.24Å; L523-L527 WeakPolarHBondContact O-CG 3.33Å; L523-L527 PolarHBondContact O-N 3.4Å; L523-L550 HydrophobicContact CD2-CD1 3.96Å
524	Q	94	Very high	92.5	Very high	50 Å²	50	47.8 Å²	47.8	23%	0.234	26%	0.255	C	S	.	.	H	α-helix	trans	-57.2	-51.7	177.3	-177.3	173.3	-46	0	0	111	L519 T520 P521 T522 H526 L527 L528 V552	L519-Q524 HydrophobicContact CD1-CB 4.05Å; T520-Q524 PolarHBondContact O-N 2.98Å; P521-Q524 WeakPolarHBondContact O-CB 3.49Å; P521-Q524 PolarHBondContact O-N 3.48Å; P521-Q524 VanDerWaalsContact O-N 3.09Å; T522-Q524 VanDerWaalsContact C-N 3.33Å; T522-Q524 PolarHBondContact O-N 2.91Å; Q524-H526 VanDerWaalsContact C-N 3.28Å; Q524-H526 PolarHBondContact O-N 3.36Å; Q524-L527 PolarHBondContact O-N 3.24Å; Q524-L527 VanDerWaalsContact O-N 3.11Å; Q524-L528 HydrophobicContact CG-CD1 4.15Å; Q524-L528 HydrophobicContact CG-CG 4.47Å; Q524-L528 WeakPolarHBondContact O-CG 3.48Å; Q524-L528 PolarHBondContact O-N 3.34Å; Q524-V552 HydrophobicContact CG-CG1 4.07Å
525	D	92.9	Very high	92.4	Very high	84 Å²	84	55.5 Å²	55.5	45%	0.449	29%	0.291	S	S	.	.	H	α-helix	trans	-58.8	-42.7	-179.7	-58.6	-20.1	0	0	0	110.9	P521 T522 L528 W529	P521-D525 VanDerWaalsContact O-CG 3.25Å; P521-D525 PolarHBondContact O-N 3.04Å; T522-D525 PolarHBondContact O-N 3.45Å; D525-L528 PolarHBondContact O-N 2.76Å; D525-W529 VanDerWaalsContact O-CB 3.29Å; D525-W529 WeakPolarHBondContact O-CB 3.32Å; D525-W529 PolarHBondContact O-N 2.75Å
526	H	91.5	Very high	92.4	Very high	56 Å²	56	53.9 Å²	53.9	26%	0.259	28%	0.284	S	S	.	.	H	α-helix	trans	-67.3	-36.4	177.1	-69.9	102.7	0	0	0	113.3	Q498 T522 L523 Q524 A530	Q498-H526 PolarHBondContact NE2-CD2 3.29Å; Q498-H526 PolarHBondContact NE2-CE1 2.99Å; Q498-H526 PolarHBondContact NE2-ND1 3.43Å; Q498-H526 PolarHBondContact NE2-NE2 2.8Å; T522-H526 PolarHBondContact O-CE1 3.24Å; T522-H526 PolarHBondContact O-N 3.21Å; T522-H526 VanDerWaalsContact O-N 3.07Å; T522-H526 PolarHBondContact O-ND1 2.97Å; L523-H526 PolarHBondContact O-N 3.14Å; Q524-H526 VanDerWaalsContact C-N 3.28Å; Q524-H526 PolarHBondContact O-N 3.36Å; H526-A530 WeakPolarHBondContact O-CB 3.37Å; H526-A530 PolarHBondContact O-N 2.95Å
527	L	95.4	Very high	92.4	Very high	3 Å²	3	54.7 Å²	54.7	2%	0.016	29%	0.289	C	S	.	.	H	α-helix	trans	-69.1	-39	176.2	-69.8	175.3	0	0	0	111.7	I510 L523 Q524 L531 A543 A546 L547 L550	I510-L527 HydrophobicContact CG1-CD2 4.4Å; I510-L527 HydrophobicContact CG2-CD2 3.71Å; L523-L527 HydrophobicContact CD1-CD1 4.12Å; L523-L527 HydrophobicContact CD1-CD2 4.33Å; L523-L527 HydrophobicContact CD1-CG 3.93Å; L523-L527 HydrophobicContact CG-CD1 3.94Å; L523-L527 HydrophobicContact CG-CG 4.22Å; L523-L527 WeakPolarHBondContact O-CB 3.41Å; L523-L527 VanDerWaalsContact O-CG 3.24Å; L523-L527 WeakPolarHBondContact O-CG 3.33Å; L523-L527 PolarHBondContact O-N 3.4Å; Q524-L527 PolarHBondContact O-N 3.24Å; Q524-L527 VanDerWaalsContact O-N 3.11Å; L527-L531 WeakPolarHBondContact O-CB 3.34Å; L527-L531 PolarHBondContact O-N 2.9Å; L527-A543 HydrophobicContact CD2-CB 4.39Å; L527-A546 HydrophobicContact CD1-CB 4.17Å; L527-A546 HydrophobicContact CD2-CB 3.94Å; L527-L547 HydrophobicContact CB-CD1 4.44Å; L527-L547 HydrophobicContact CB-CD2 3.72Å; L527-L547 HydrophobicContact CB-CG 3.96Å; L527-L547 HydrophobicContact CD1-CD2 4.06Å; L527-L547 HydrophobicContact CD1-CG 4.34Å; L527-L550 HydrophobicContact CD1-CD1 3.65Å
528	L	95.3	Very high	92.6	Very high	7 Å²	7	56.2 Å²	56.2	4%	0.037	28%	0.284	C	S	.	.	H	α-helix	trans	-63.8	-47.2	173.5	-66.8	177.1	0	0	0	110.6	Q524 D525 A530 L531 H532 L547 E556 L557 L560	Q524-L528 HydrophobicContact CG-CD1 4.15Å; Q524-L528 HydrophobicContact CG-CG 4.47Å; Q524-L528 WeakPolarHBondContact O-CG 3.48Å; Q524-L528 PolarHBondContact O-N 3.34Å; D525-L528 PolarHBondContact O-N 2.76Å; L528-A530 PolarHBondContact O-N 2.89Å; L528-L531 PolarHBondContact O-N 3.46Å; L528-H532 PolarHBondContact O-N 3.43Å; L528-H532 VanDerWaalsContact O-N 3.08Å; L528-L547 HydrophobicContact CD2-CD1 4.39Å; L528-L547 HydrophobicContact CD2-CD2 4.35Å; L528-E556 HydrophobicContact CD1-CG 4.1Å; L528-L557 HydrophobicContact CD2-CB 4.27Å; L528-L557 HydrophobicContact CD2-CD1 3.63Å; L528-L560 HydrophobicContact CB-CD1 4.19Å; L528-L560 HydrophobicContact CD2-CD1 4.48Å
529	W	94.9	Very high	93.1	Very high	124 Å²	124	54.8 Å²	54.8	47%	0.47	27%	0.274	S	S	.	.	H	α-helix	trans	-58.6	-48.2	175.4	-175.1	94.7	0	0	0	111.7	D525 L531 H532 H533 E534	D525-W529 VanDerWaalsContact O-CB 3.29Å; D525-W529 WeakPolarHBondContact O-CB 3.32Å; D525-W529 PolarHBondContact O-N 2.75Å; W529-L531 VanDerWaalsContact C-N 3.31Å; W529-L531 PolarHBondContact O-N 3.25Å; W529-H532 PolarHBondContact O-N 2.91Å; W529-H532 VanDerWaalsContact O-N 3.12Å; W529-H533 AromaticContact CD1-CD2 3.38Å; W529-H533 HydrophobicContact CD2-CB 4.23Å; W529-H533 AromaticContact CE2-CD2 3.96Å; W529-H533 AromaticContact CG-CD2 3.9Å; W529-H533 HydrophobicContact CH2-CB 4.42Å; W529-H533 HydrophobicContact CZ2-CB 3.95Å; W529-H533 AromaticContact NE1-CD2 3.4Å; W529-H533 PolarHBondContact NE1-CD2 3.2Å; W529-H533 PolarHBondContact O-N 3.38Å; W529-E534 HydrophobicContact CE3-CG 4.45Å; W529-E534 HydrophobicContact CZ3-CG 3.82Å
530	A	94.9	Very high	93.5	Very high	7 Å²	7	52 Å²	52	6%	0.058	26%	0.259	C	S	.	.	H	α-helix	trans	-63.1	-37.3	179.7	0	0	0	0	0	111.8	I510 H526 L528 H532 E534 R540 A543	I510-A530 HydrophobicContact CD1-CB 4.45Å; H526-A530 WeakPolarHBondContact O-CB 3.37Å; H526-A530 PolarHBondContact O-N 2.95Å; L528-A530 PolarHBondContact O-N 2.89Å; A530-H532 VanDerWaalsContact C-N 3.32Å; A530-H532 PolarHBondContact O-N 3.2Å; A530-E534 HydrophobicContact CB-CG 4.03Å; A530-E534 VanDerWaalsContact O-CB 3.25Å; A530-E534 WeakPolarHBondContact O-CB 3.32Å; A530-E534 PolarHBondContact O-N 2.71Å; A530-R540 WeakPolarHBondContact O-CG 3.28Å; A530-A543 HydrophobicContact CB-CB 4.01Å
531	L	94.8	Very high	93.8	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-66.6	-34.8	175.7	179.9	57.8	0	0	0	112.4	L527 L528 W529 R540 A543 C544 L547 L560 L561 I577	L527-L531 WeakPolarHBondContact O-CB 3.34Å; L527-L531 PolarHBondContact O-N 2.9Å; L528-L531 PolarHBondContact O-N 3.46Å; W529-L531 VanDerWaalsContact C-N 3.31Å; W529-L531 PolarHBondContact O-N 3.25Å; L531-R540 HydrophobicContact CD1-CB 4.33Å; L531-R540 VanDerWaalsContact O-CD 3.27Å; L531-R540 WeakPolarHBondContact O-CD 3.13Å; L531-A543 HydrophobicContact CB-CB 4.26Å; L531-C544 HydrophobicContact CD1-CB 4.11Å; L531-L547 HydrophobicContact CD2-CD1 3.86Å; L531-L560 HydrophobicContact CB-CD2 4.25Å; L531-L560 HydrophobicContact CD2-CD2 3.58Å; L531-L560 HydrophobicContact CG-CD2 3.9Å; L531-L561 HydrophobicContact CD2-CD2 3.69Å; L531-I577 HydrophobicContact CD1-CD1 4.36Å; L531-I577 HydrophobicContact CD1-CG1 4.35Å
532	H	91.9	Very high	94.2	Very high	41 Å²	41	46 Å²	46	19%	0.19	22%	0.22	C	C	.	.	H	α-helix	trans	-88.5	-40.3	-174.4	-170.8	63.4	0	0	0	113.3	L528 W529 A530 L560 E563 R564	L528-H532 PolarHBondContact O-N 3.43Å; L528-H532 VanDerWaalsContact O-N 3.08Å; W529-H532 PolarHBondContact O-N 2.91Å; W529-H532 VanDerWaalsContact O-N 3.12Å; A530-H532 VanDerWaalsContact C-N 3.32Å; A530-H532 PolarHBondContact O-N 3.2Å; H532-L560 HydrophobicContact CB-CD1 3.94Å; H532-L560 HydrophobicContact CB-CG 4.32Å; H532-E563 IonicContact CE1-OE1 3.4Å; H532-R564 PolarHBondContact O-NH1 3.45Å
533	H	91.4	Very high	94.5	Very high	107 Å²	107	42.5 Å²	42.5	50%	0.495	20%	0.199	S	C	.	.	H	α-helix	trans	-114.3	-19.4	-166.2	-63	-65.1	0	0	0	115.8	W529 E535	W529-H533 AromaticContact CD1-CD2 3.38Å; W529-H533 HydrophobicContact CD2-CB 4.23Å; W529-H533 AromaticContact CE2-CD2 3.96Å; W529-H533 AromaticContact CG-CD2 3.9Å; W529-H533 HydrophobicContact CH2-CB 4.42Å; W529-H533 HydrophobicContact CZ2-CB 3.95Å; W529-H533 AromaticContact NE1-CD2 3.4Å; W529-H533 PolarHBondContact NE1-CD2 3.2Å; W529-H533 PolarHBondContact O-N 3.38Å; H533-E535 PolarHBondContact O-N 3.33Å
534	E	94.1	Very high	94.7	Very high	18 Å²	18	42.7 Å²	42.7	8%	0.084	20%	0.2	C	C	.	.			trans	-63.7	137.5	-179.1	-84	-78.9	176.4	0	0	111.7	K506 W529 A530 V539 R540	K506-E534 WeakPolarHBondContact CD-OE1 3.45Å; K506-E534 IonicContact NZ-OE1 2.81Å; K506-E534 PolarHBondContact NZ-OE1 3.37Å; K506-E534 IonicContact NZ-OE2 3.61Å; W529-E534 HydrophobicContact CE3-CG 4.45Å; W529-E534 HydrophobicContact CZ3-CG 3.82Å; A530-E534 HydrophobicContact CB-CG 4.03Å; A530-E534 VanDerWaalsContact O-CB 3.25Å; A530-E534 WeakPolarHBondContact O-CB 3.32Å; A530-E534 PolarHBondContact O-N 2.71Å; E534-V539 HydrophobicContact CB-CB 4.2Å; E534-V539 HydrophobicContact CB-CG1 4.08Å; E534-V539 HydrophobicContact CG-CB 4.31Å; E534-V539 HydrophobicContact CG-CG1 3.68Å; E534-R540 HydrophobicContact CB-CG 4.22Å; E534-R540 PolarHBondContact O-NH1 2.99Å
535	E	91.8	Very high	94.8	Very high	163 Å²	163	44.2 Å²	44.2	76%	0.762	21%	0.207	S	C	*	.	S	Bend	trans	-72.2	-41.3	-176.9	-63.7	-176.9	173.3	0	0	111.9	H533 R540	H533-E535 PolarHBondContact O-N 3.33Å; E535-R540 PolarHBondContact O-NH1 3.39Å
536	K	95.7	Very high	94.9	Very high	96 Å²	96	40.3 Å²	40.3	42%	0.417	19%	0.187	S	C	.	.	S	Bend	trans	-80.2	124.7	-173.5	-61.6	-59.5	-177.5	-170	0	111	W503 Q538 V539 R540	W503-K536 HydrophobicContact CB-CB 4.12Å; W503-K536 HydrophobicContact CB-CG 3.77Å; W503-K536 HydrophobicContact CG-CB 4.4Å; W503-K536 HydrophobicContact CG-CG 3.98Å; K536-Q538 PolarHBondContact O-N 3.44Å; K536-V539 HydrophobicContact CB-CG2 3.99Å; K536-V539 PolarHBondContact O-N 3.28Å; K536-V539 VanDerWaalsContact O-N 3.11Å; K536-R540 PolarHBondContact O-N 2.9Å
537	P	95.6	Very high	95.2	Very high	22 Å²	22	37.7 Å²	37.7	14%	0.143	17%	0.174	C	C	.	.	H	α-helix	trans	-62.4	-30.6	-177	23.8	-32.4	0	0	0	112.9	V539 R540 I541 H570 V573	P537-V539 VanDerWaalsContact C-N 3.3Å; P537-V539 PolarHBondContact O-N 2.87Å; P537-R540 PolarHBondContact O-N 2.95Å; P537-I541 VanDerWaalsContact O-CG1 3.29Å; P537-I541 WeakPolarHBondContact O-CG1 3.46Å; P537-I541 PolarHBondContact O-N 3.37Å; P537-H570 HydrophobicContact CB-CB 4Å; P537-V573 HydrophobicContact CB-CG2 3.55Å
538	Q	96.6	Very high	95.1	Very high	78 Å²	78	42.4 Å²	42.4	36%	0.364	20%	0.195	S	C	.	.	H	α-helix	trans	-62.9	-37.2	177.9	-61.5	85.8	-14.2	0	0	112	W503 V507 K536 I541 A542	W503-Q538 HydrophobicContact CE3-CB 3.71Å; W503-Q538 HydrophobicContact CE3-CG 4.14Å; W503-Q538 HydrophobicContact CH2-CB 4.37Å; W503-Q538 HydrophobicContact CH2-CG 3.96Å; W503-Q538 HydrophobicContact CZ3-CB 3.45Å; W503-Q538 VanDerWaalsContact CZ3-CB 3.45Å; W503-Q538 HydrophobicContact CZ3-CG 3.52Å; V507-Q538 HydrophobicContact CG2-CB 3.92Å; K536-Q538 PolarHBondContact O-N 3.44Å; Q538-I541 PolarHBondContact O-N 3.36Å; Q538-A542 WeakPolarHBondContact O-CB 3.37Å; Q538-A542 PolarHBondContact O-N 3.3Å
539	V	96.7	Very high	95.1	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-68.8	-44.2	177.5	-174.4	0	0	0	0	110.2	W503 K506 V507 I510 E534 K536 P537 I541 A542 A543	W503-V539 HydrophobicContact CB-CG2 3.96Å; K506-V539 HydrophobicContact CB-CG1 4.24Å; K506-V539 HydrophobicContact CB-CG2 4.19Å; V507-V539 HydrophobicContact CG2-CB 4.44Å; V507-V539 HydrophobicContact CG2-CG2 3.92Å; I510-V539 HydrophobicContact CD1-CG1 3.71Å; E534-V539 HydrophobicContact CB-CB 4.2Å; E534-V539 HydrophobicContact CB-CG1 4.08Å; E534-V539 HydrophobicContact CG-CB 4.31Å; E534-V539 HydrophobicContact CG-CG1 3.68Å; K536-V539 HydrophobicContact CB-CG2 3.99Å; K536-V539 PolarHBondContact O-N 3.28Å; K536-V539 VanDerWaalsContact O-N 3.11Å; P537-V539 VanDerWaalsContact C-N 3.3Å; P537-V539 PolarHBondContact O-N 2.87Å; V539-I541 VanDerWaalsContact C-N 3.34Å; V539-I541 PolarHBondContact O-N 3Å; V539-A542 WeakPolarHBondContact O-CB 3.49Å; V539-A542 PolarHBondContact O-N 3.48Å; V539-A543 PolarHBondContact O-N 3.38Å
540	R	96.3	Very high	95.1	Very high	11 Å²	11	41.9 Å²	41.9	4%	0.042	20%	0.2	C	C	.	.	H	α-helix	trans	-59.9	-41.6	174.2	-62.4	-162.4	-65	-80.3	3.9	112.6	A530 L531 E534 E535 K536 P537 A543 C544 R564 E568 V573	A530-R540 WeakPolarHBondContact O-CG 3.28Å; L531-R540 HydrophobicContact CD1-CB 4.33Å; L531-R540 VanDerWaalsContact O-CD 3.27Å; L531-R540 WeakPolarHBondContact O-CD 3.13Å; E534-R540 HydrophobicContact CB-CG 4.22Å; E534-R540 PolarHBondContact O-NH1 2.99Å; E535-R540 PolarHBondContact O-NH1 3.39Å; K536-R540 PolarHBondContact O-N 2.9Å; P537-R540 PolarHBondContact O-N 2.95Å; R540-A543 PolarHBondContact O-N 3.35Å; R540-C544 WeakPolarHBondContact O-CB 3.28Å; R540-C544 PolarHBondContact O-N 3.29Å; R540-R564 VanDerWaalsContact CZ-NH2 3.33Å; R540-R564 VanDerWaalsContact NE-NH2 3.13Å; R540-E568 IonicContact CZ-OE1 2.83Å; R540-E568 IonicContact CZ-OE2 3.09Å; R540-E568 IonicContact NE-OE1 2.72Å; R540-E568 IonicContact NE-OE2 3.68Å; R540-E568 PolarHBondContact NE-OE2 3.49Å; R540-E568 IonicContact NH2-OE1 2.89Å; R540-E568 PolarHBondContact NH2-OE1 3.04Å; R540-E568 IonicContact NH2-OE2 2.83Å; R540-E568 PolarHBondContact NH2-OE2 2.85Å; R540-V573 HydrophobicContact CB-CG1 4.01Å; R540-V573 HydrophobicContact CB-CG2 4.38Å
541	I	96.2	Very high	95	Very high	19 Å²	19	49.3 Å²	49.3	10%	0.097	23%	0.231	C	C	.	.	H	α-helix	trans	-61.3	-47.2	175	-70.7	166.3	0	0	0	110.4	P537 Q538 V539 A543 C544 Q545 Q572 V573	P537-I541 VanDerWaalsContact O-CG1 3.29Å; P537-I541 WeakPolarHBondContact O-CG1 3.46Å; P537-I541 PolarHBondContact O-N 3.37Å; Q538-I541 PolarHBondContact O-N 3.36Å; V539-I541 VanDerWaalsContact C-N 3.34Å; V539-I541 PolarHBondContact O-N 3Å; I541-A543 VanDerWaalsContact C-N 3.33Å; I541-A543 PolarHBondContact O-N 3.48Å; I541-C544 PolarHBondContact O-N 2.97Å; I541-Q545 HydrophobicContact CG2-CG 4.39Å; I541-Q545 WeakPolarHBondContact O-CG 3.34Å; I541-Q545 PolarHBondContact O-N 3.43Å; I541-Q572 HydrophobicContact CD1-CB 3.88Å; I541-V573 HydrophobicContact CD1-CG2 4.05Å; I541-V573 HydrophobicContact CG1-CB 4.32Å; I541-V573 HydrophobicContact CG1-CG2 3.74Å
542	A	96.8	Very high	95	Very high	6 Å²	6	49.5 Å²	49.5	5%	0.05	23%	0.232	C	C	.	.	H	α-helix	trans	-60.4	-43.6	178.3	0	0	0	0	0	111.4	V507 I510 Q538 V539 Q545 A546	V507-A542 HydrophobicContact CB-CB 4.37Å; V507-A542 HydrophobicContact CG1-CB 4.06Å; V507-A542 HydrophobicContact CG2-CB 4.31Å; I510-A542 HydrophobicContact CB-CB 4.2Å; I510-A542 VanDerWaalsContact CG2-C 3.48Å; I510-A542 HydrophobicContact CG2-CB 3.94Å; I510-A542 WeakPolarHBondContact CG2-O 3.5Å; Q538-A542 WeakPolarHBondContact O-CB 3.37Å; Q538-A542 PolarHBondContact O-N 3.3Å; V539-A542 WeakPolarHBondContact O-CB 3.49Å; V539-A542 PolarHBondContact O-N 3.48Å; A542-Q545 PolarHBondContact O-N 3.17Å; A542-A546 WeakPolarHBondContact O-CB 3.3Å; A542-A546 PolarHBondContact O-N 3.29Å
543	A	96.8	Very high	94.9	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-60.8	-47.5	176.1	0	0	0	0	0	111.6	L527 A530 L531 V539 R540 I541 Q545 A546 L547	L527-A543 HydrophobicContact CD2-CB 4.39Å; A530-A543 HydrophobicContact CB-CB 4.01Å; L531-A543 HydrophobicContact CB-CB 4.26Å; V539-A543 PolarHBondContact O-N 3.38Å; R540-A543 PolarHBondContact O-N 3.35Å; I541-A543 VanDerWaalsContact C-N 3.33Å; I541-A543 PolarHBondContact O-N 3.48Å; A543-Q545 VanDerWaalsContact C-N 3.34Å; A543-Q545 PolarHBondContact O-N 3.25Å; A543-A546 PolarHBondContact O-N 3.05Å; A543-L547 WeakPolarHBondContact O-CB 3.2Å; A543-L547 VanDerWaalsContact O-CG 3.28Å; A543-L547 WeakPolarHBondContact O-CG 3.5Å; A543-L547 PolarHBondContact O-N 3.3Å
544	C	95.8	Very high	94.9	Very high	4 Å²	4	50.2 Å²	50.2	3%	0.027	24%	0.24	C	C	.	.	H	α-helix	trans	-58.6	-43.4	176.2	-173.9	0	0	0	0	112.3	L531 R540 I541 K548 H576	L531-C544 HydrophobicContact CD1-CB 4.11Å; R540-C544 WeakPolarHBondContact O-CB 3.28Å; R540-C544 PolarHBondContact O-N 3.29Å; I541-C544 PolarHBondContact O-N 2.97Å; C544-K548 PolarHBondContact O-N 3.01Å; C544-K548 VanDerWaalsContact O-N 3.1Å; C544-H576 HydrophobicContact CB-CB 4.44Å
545	Q	95.6	Very high	94.7	Very high	82 Å²	82	54 Å²	54	38%	0.383	27%	0.266	S	S	.	.	H	α-helix	trans	-66.3	-42.3	176.3	-70.8	176.3	2.9	0	0	112.1	I541 A542 A543 K548 I549 H576	I541-Q545 HydrophobicContact CG2-CG 4.39Å; I541-Q545 WeakPolarHBondContact O-CG 3.34Å; I541-Q545 PolarHBondContact O-N 3.43Å; A542-Q545 PolarHBondContact O-N 3.17Å; A543-Q545 VanDerWaalsContact C-N 3.34Å; A543-Q545 PolarHBondContact O-N 3.25Å; Q545-K548 WeakPolarHBondContact O-CB 3.42Å; Q545-K548 PolarHBondContact O-N 2.94Å; Q545-I549 VanDerWaalsContact O-CG1 3.31Å; Q545-I549 WeakPolarHBondContact O-CG1 3.39Å; Q545-I549 PolarHBondContact O-N 3.15Å; Q545-H576 PolarHBondContact NE2-CE1 3.15Å
546	A	95.9	Very high	94.6	Very high	3 Å²	3	51.5 Å²	51.5	3%	0.025	25%	0.254	C	S	.	.	H	α-helix	trans	-62.7	-44.8	176.7	0	0	0	0	0	111.5	I510 L527 A542 A543 K548 I549 L550	I510-A546 HydrophobicContact CG2-CB 3.63Å; L527-A546 HydrophobicContact CD1-CB 4.17Å; L527-A546 HydrophobicContact CD2-CB 3.94Å; A542-A546 WeakPolarHBondContact O-CB 3.3Å; A542-A546 PolarHBondContact O-N 3.29Å; A543-A546 PolarHBondContact O-N 3.05Å; A546-K548 VanDerWaalsContact C-N 3.25Å; A546-K548 PolarHBondContact O-N 2.91Å; A546-I549 PolarHBondContact O-N 3.39Å; A546-I549 VanDerWaalsContact O-N 3.16Å; A546-L550 VanDerWaalsContact O-CB 3.29Å; A546-L550 WeakPolarHBondContact O-CB 3.36Å; A546-L550 VanDerWaalsContact O-CG 3.27Å; A546-L550 WeakPolarHBondContact O-CG 3.46Å; A546-L550 PolarHBondContact O-N 2.69Å
547	L	96.1	Very high	94.5	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-57.5	-38.5	174.1	-71.2	165.9	0	0	0	112.1	L527 L528 L531 A543 K551 V552 L557 L580 Y584	L527-L547 HydrophobicContact CB-CD1 4.44Å; L527-L547 HydrophobicContact CB-CD2 3.72Å; L527-L547 HydrophobicContact CB-CG 3.96Å; L527-L547 HydrophobicContact CD1-CD2 4.06Å; L527-L547 HydrophobicContact CD1-CG 4.34Å; L528-L547 HydrophobicContact CD2-CD1 4.39Å; L528-L547 HydrophobicContact CD2-CD2 4.35Å; L531-L547 HydrophobicContact CD2-CD1 3.86Å; A543-L547 WeakPolarHBondContact O-CB 3.2Å; A543-L547 VanDerWaalsContact O-CG 3.28Å; A543-L547 WeakPolarHBondContact O-CG 3.5Å; A543-L547 PolarHBondContact O-N 3.3Å; L547-K551 PolarHBondContact O-N 3.44Å; L547-K551 VanDerWaalsContact O-N 3.16Å; L547-V552 HydrophobicContact CD2-CB 3.85Å; L547-V552 HydrophobicContact CD2-CG1 4.05Å; L547-V552 HydrophobicContact CD2-CG2 3.8Å; L547-V552 PolarHBondContact O-N 3.11Å; L547-L557 HydrophobicContact CD1-CD1 3.93Å; L547-L580 HydrophobicContact CB-CD2 4.39Å; L547-Y584 PolarHBondContact O-OH 3.1Å
548	K	94.8	Very high	94.3	Very high	103 Å²	103	48.8 Å²	48.8	45%	0.448	24%	0.242	S	C	.	.	H	α-helix	trans	-65.3	-48.9	173.9	-170.4	179.9	176.7	178.5	0	112.3	C544 Q545 A546 K551 L580	C544-K548 PolarHBondContact O-N 3.01Å; C544-K548 VanDerWaalsContact O-N 3.1Å; Q545-K548 WeakPolarHBondContact O-CB 3.42Å; Q545-K548 PolarHBondContact O-N 2.94Å; A546-K548 VanDerWaalsContact C-N 3.25Å; A546-K548 PolarHBondContact O-N 2.91Å; K548-K551 PolarHBondContact O-N 2.9Å; K548-L580 HydrophobicContact CB-CD1 3.71Å; K548-L580 HydrophobicContact CD-CD1 4.44Å; K548-L580 HydrophobicContact CG-CD1 3.89Å
549	I	94.9	Very high	94	Very high	99 Å²	99	49.7 Å²	49.7	51%	0.508	25%	0.249	S	C	.	.	H	α-helix	trans	-65.2	-42.9	-178	-68.3	165.8	0	0	0	110.8	G514 Q545 A546 K551	G514-I549 VanDerWaalsContact O-CG2 3.27Å; G514-I549 WeakPolarHBondContact O-CG2 3.25Å; Q545-I549 VanDerWaalsContact O-CG1 3.31Å; Q545-I549 WeakPolarHBondContact O-CG1 3.39Å; Q545-I549 PolarHBondContact O-N 3.15Å; A546-I549 PolarHBondContact O-N 3.39Å; A546-I549 VanDerWaalsContact O-N 3.16Å; I549-K551 PolarHBondContact O-N 3.43Å
550	L	94.1	Very high	93.8	Very high	21 Å²	21	50.9 Å²	50.9	11%	0.11	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-3.4	177.7	-64.1	171.5	0	0	0	113.1	L519 L523 L527 A546 V552	L519-L550 HydrophobicContact CD1-CB 4.38Å; L519-L550 HydrophobicContact CD1-CD1 4.04Å; L523-L550 HydrophobicContact CD2-CD1 3.96Å; L527-L550 HydrophobicContact CD1-CD1 3.65Å; A546-L550 VanDerWaalsContact O-CB 3.29Å; A546-L550 WeakPolarHBondContact O-CB 3.36Å; A546-L550 VanDerWaalsContact O-CG 3.27Å; A546-L550 WeakPolarHBondContact O-CG 3.46Å; A546-L550 PolarHBondContact O-N 2.69Å; L550-V552 VanDerWaalsContact C-N 3.26Å; L550-V552 HydrophobicContact CB-CG2 4.11Å; L550-V552 PolarHBondContact O-N 3.19Å
551	K	93.7	Very high	93.6	Very high	163 Å²	163	50.4 Å²	50.4	71%	0.709	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.2	35.5	177.5	-57	178.6	-178.8	176.5	0	113.6	L547 K548 I549 K553 Y584	L547-K551 PolarHBondContact O-N 3.44Å; L547-K551 VanDerWaalsContact O-N 3.16Å; K548-K551 PolarHBondContact O-N 2.9Å; I549-K551 PolarHBondContact O-N 3.43Å; K551-K553 PolarHBondContact O-N 2.87Å; K551-Y584 WeakPolarHBondContact CA-OH 3.44Å
552	V	93.4	Very high	93.3	Very high	4 Å²	4	51 Å²	51	2%	0.024	26%	0.256	C	S	.	.			trans	-65.5	131.9	176.3	-177.1	0	0	0	0	109.2	L519 Q524 L547 L550 L557 Y584	L519-V552 HydrophobicContact CD1-CG2 3.77Å; L519-V552 HydrophobicContact CD2-CG2 3.87Å; Q524-V552 HydrophobicContact CG-CG1 4.07Å; L547-V552 HydrophobicContact CD2-CB 3.85Å; L547-V552 HydrophobicContact CD2-CG1 4.05Å; L547-V552 HydrophobicContact CD2-CG2 3.8Å; L547-V552 PolarHBondContact O-N 3.11Å; L550-V552 VanDerWaalsContact C-N 3.26Å; L550-V552 HydrophobicContact CB-CG2 4.11Å; L550-V552 PolarHBondContact O-N 3.19Å; V552-L557 HydrophobicContact CB-CD2 4.3Å; V552-L557 HydrophobicContact CG1-CD2 4.16Å; V552-L557 WeakPolarHBondContact O-CD2 3.49Å; V552-Y584 WeakPolarHBondContact O-CE2 3.3Å; V552-Y584 PolarHBondContact O-OH 3.27Å
553	K	91.4	Very high	92.8	Very high	138 Å²	138	55.5 Å²	55.5	60%	0.6	28%	0.276	S	S	*	.			trans	-140.9	160.2	178.9	-65.7	-173.1	-178.7	-171.1	0	109.9	K551 Y584	K551-K553 PolarHBondContact O-N 2.87Å; K553-Y584 HydrophobicContact CD-CD1 4.33Å; K553-Y584 HydrophobicContact CD-CE1 4.41Å; K553-Y584 VanDerWaalsContact CE-CD1 3.49Å; K553-Y584 HydrophobicContact CG-CD1 4.25Å; K553-Y584 HydrophobicContact CG-CE1 4.11Å; K553-Y584 HydrophobicContact CG-CE2 4.37Å; K553-Y584 HydrophobicContact CG-CG 4.46Å
554	G	90.6	Very high	92.5	Very high	24 Å²	24	57.5 Å²	57.5	25%	0.247	28%	0.283	C	S	.	.	S	Bend	trans	142.7	167	176.8	0	0	0	0	0	112.6	E556 L557 Q558 Y586	G554-E556 VanDerWaalsContact C-N 3.27Å; G554-E556 PolarHBondContact O-N 3.42Å; G554-L557 PolarHBondContact O-N 2.87Å; G554-Q558 PolarHBondContact O-N 2.67Å; G554-Y586 PolarHBondContact N-OH 3.38Å
555	P	89.2	Confident	92.2	Very high	97 Å²	97	57.5 Å²	57.5	63%	0.63	28%	0.283	S	S	*	.	H	α-helix	trans	-63.3	-34.6	-179.3	26	-34	0	0	0	112.1	Q558 N559	P555-Q558 PolarHBondContact O-N 2.96Å; P555-N559 WeakPolarHBondContact O-CB 3.34Å; P555-N559 PolarHBondContact O-N 3.22Å; P555-N559 PolarHBondContact O-ND2 3.37Å; P555-N559 PolarHBondContact O-OD1 3.33Å
556	E	91.2	Very high	91.7	Very high	111 Å²	111	56.1 Å²	56.1	52%	0.519	28%	0.28	S	S	.	.	H	α-helix	trans	-60.3	-51.1	177.5	-176	-180	-161	0	0	112	L528 G554 Q558 N559 L560	L528-E556 HydrophobicContact CD1-CG 4.1Å; G554-E556 VanDerWaalsContact C-N 3.27Å; G554-E556 PolarHBondContact O-N 3.42Å; E556-Q558 VanDerWaalsContact C-N 3.33Å; E556-Q558 PolarHBondContact O-N 2.67Å; E556-N559 PolarHBondContact O-N 3.13Å; E556-L560 WeakPolarHBondContact O-CB 3.31Å; E556-L560 PolarHBondContact O-N 3.36Å
557	L	93.3	Very high	91.2	Very high	4 Å²	4	61 Å²	61	2%	0.021	31%	0.305	C	S	.	.	H	α-helix	trans	-63.2	-40.2	175.5	176.9	63.6	0	0	0	111.4	L528 L547 V552 G554 L561 Y584	L528-L557 HydrophobicContact CD2-CB 4.27Å; L528-L557 HydrophobicContact CD2-CD1 3.63Å; L547-L557 HydrophobicContact CD1-CD1 3.93Å; V552-L557 HydrophobicContact CB-CD2 4.3Å; V552-L557 HydrophobicContact CG1-CD2 4.16Å; V552-L557 WeakPolarHBondContact O-CD2 3.49Å; G554-L557 PolarHBondContact O-N 2.87Å; L557-L561 HydrophobicContact CD1-CD1 3.85Å; L557-L561 HydrophobicContact CD1-CD2 4.35Å; L557-L561 HydrophobicContact CD1-CG 3.83Å; L557-L561 HydrophobicContact CD2-CD1 4.37Å; L557-L561 HydrophobicContact CG-CD1 3.76Å; L557-L561 HydrophobicContact CG-CG 4.18Å; L557-L561 WeakPolarHBondContact O-CB 3.42Å; L557-L561 WeakPolarHBondContact O-CG 3.24Å; L557-L561 PolarHBondContact O-N 3.39Å; L557-Y584 HydrophobicContact CD2-CE2 4.21Å
558	Q	92	Very high	90.9	Very high	58 Å²	58	61.7 Å²	61.7	27%	0.271	31%	0.308	S	S	.	.	H	α-helix	trans	-59.4	-51.5	178.1	176.5	178.5	-11.2	0	0	111.3	G554 P555 E556 L560 L561 Q562 Y586	G554-Q558 PolarHBondContact O-N 2.67Å; P555-Q558 PolarHBondContact O-N 2.96Å; E556-Q558 VanDerWaalsContact C-N 3.33Å; E556-Q558 PolarHBondContact O-N 2.67Å; Q558-L560 PolarHBondContact O-N 3Å; Q558-L561 PolarHBondContact O-N 3.06Å; Q558-Q562 WeakPolarHBondContact O-CG 3.47Å; Q558-Q562 PolarHBondContact O-N 3.11Å; Q558-Y586 HydrophobicContact CB-CD1 4.17Å; Q558-Y586 HydrophobicContact CB-CD2 4.08Å; Q558-Y586 HydrophobicContact CB-CE1 4.13Å; Q558-Y586 HydrophobicContact CB-CE2 4.02Å; Q558-Y586 HydrophobicContact CB-CG 4.16Å; Q558-Y586 HydrophobicContact CG-CD1 3.89Å; Q558-Y586 HydrophobicContact CG-CD2 4.17Å; Q558-Y586 HydrophobicContact CG-CE1 4.34Å; Q558-Y586 HydrophobicContact CG-CG 3.81Å
559	N	89.5	Confident	90.6	Very high	96 Å²	96	62 Å²	62	51%	0.513	32%	0.321	S	S	.	.	H	α-helix	trans	-60.6	-47.5	-179.5	-68.2	-11.6	0	0	0	110.8	P555 E556 L561 Q562 E563	P555-N559 WeakPolarHBondContact O-CB 3.34Å; P555-N559 PolarHBondContact O-N 3.22Å; P555-N559 PolarHBondContact O-ND2 3.37Å; P555-N559 PolarHBondContact O-OD1 3.33Å; E556-N559 PolarHBondContact O-N 3.13Å; N559-L561 VanDerWaalsContact C-N 3.35Å; N559-L561 PolarHBondContact O-N 3.49Å; N559-Q562 PolarHBondContact O-N 3.01Å; N559-E563 WeakPolarHBondContact O-CB 3.33Å; N559-E563 PolarHBondContact O-N 3.43Å
560	L	91.7	Very high	90.5	Very high	26 Å²	26	59.9 Å²	59.9	14%	0.136	31%	0.309	C	S	.	.	H	α-helix	trans	-62	-40.5	179.3	-176.5	143.7	0	0	0	112.4	L528 L531 H532 E556 Q558 R564	L528-L560 HydrophobicContact CB-CD1 4.19Å; L528-L560 HydrophobicContact CD2-CD1 4.48Å; L531-L560 HydrophobicContact CB-CD2 4.25Å; L531-L560 HydrophobicContact CD2-CD2 3.58Å; L531-L560 HydrophobicContact CG-CD2 3.9Å; H532-L560 HydrophobicContact CB-CD1 3.94Å; H532-L560 HydrophobicContact CB-CG 4.32Å; E556-L560 WeakPolarHBondContact O-CB 3.31Å; E556-L560 PolarHBondContact O-N 3.36Å; Q558-L560 PolarHBondContact O-N 3Å; L560-R564 WeakPolarHBondContact O-CB 3.39Å; L560-R564 PolarHBondContact O-N 3.47Å
561	L	92.7	Very high	90.5	Very high	0 Å²	0	63 Å²	63	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-66.4	-42.8	175.6	-72.3	170.8	0	0	0	111.8	L531 L557 Q558 N559 F565 I577 L580 L581 Y586	L531-L561 HydrophobicContact CD2-CD2 3.69Å; L557-L561 HydrophobicContact CD1-CD1 3.85Å; L557-L561 HydrophobicContact CD1-CD2 4.35Å; L557-L561 HydrophobicContact CD1-CG 3.83Å; L557-L561 HydrophobicContact CD2-CD1 4.37Å; L557-L561 HydrophobicContact CG-CD1 3.76Å; L557-L561 HydrophobicContact CG-CG 4.18Å; L557-L561 WeakPolarHBondContact O-CB 3.42Å; L557-L561 WeakPolarHBondContact O-CG 3.24Å; L557-L561 PolarHBondContact O-N 3.39Å; Q558-L561 PolarHBondContact O-N 3.06Å; N559-L561 VanDerWaalsContact C-N 3.35Å; N559-L561 PolarHBondContact O-N 3.49Å; L561-F565 WeakPolarHBondContact O-CB 3.32Å; L561-F565 PolarHBondContact O-N 2.75Å; L561-I577 HydrophobicContact CB-CG2 4.27Å; L561-I577 HydrophobicContact CD2-CB 4.43Å; L561-I577 HydrophobicContact CD2-CG1 4.27Å; L561-I577 HydrophobicContact CD2-CG2 3.88Å; L561-L580 HydrophobicContact CD1-CB 4.42Å; L561-L580 HydrophobicContact CD1-CD2 3.85Å; L561-L580 HydrophobicContact CD1-CG 3.95Å; L561-L580 HydrophobicContact CD2-CD2 3.93Å; L561-L581 HydrophobicContact CB-CD2 3.61Å; L561-L581 HydrophobicContact CB-CG 4.04Å; L561-L581 HydrophobicContact CD1-CD2 4.17Å; L561-L581 HydrophobicContact CD1-CG 4.44Å; L561-Y586 HydrophobicContact CD1-CD2 4.36Å; L561-Y586 HydrophobicContact CD1-CE2 4.48Å
562	Q	89.9	Confident	90.5	Very high	32 Å²	32	59.8 Å²	59.8	15%	0.15	32%	0.318	C	S	.	.	H	α-helix	trans	-65.6	-46.1	179.6	-74	177.8	-26.7	0	0	111.7	Q558 N559 F565 V566 L581 S587	Q558-Q562 WeakPolarHBondContact O-CG 3.47Å; Q558-Q562 PolarHBondContact O-N 3.11Å; N559-Q562 PolarHBondContact O-N 3.01Å; Q562-F565 PolarHBondContact O-N 2.92Å; Q562-V566 PolarHBondContact O-N 2.85Å; Q562-L581 HydrophobicContact CG-CD2 4.07Å; Q562-S587 PolarHBondContact NE2-O 3.25Å
563	E	86.8	Confident	90.5	Very high	101 Å²	101	59.6 Å²	59.6	47%	0.472	32%	0.316	S	S	.	.	H	α-helix	trans	-60.5	-52.2	175.7	-174.7	-170.3	160.7	0	0	110.8	H532 N559 F565 V566 L567	H532-E563 IonicContact CE1-OE1 3.4Å; N559-E563 WeakPolarHBondContact O-CB 3.33Å; N559-E563 PolarHBondContact O-N 3.43Å; E563-F565 VanDerWaalsContact C-N 3.29Å; E563-F565 PolarHBondContact O-N 3.29Å; E563-V566 PolarHBondContact O-N 3.05Å; E563-L567 HydrophobicContact CG-CD1 4.31Å; E563-L567 PolarHBondContact O-N 3.3Å
564	R	89.9	Confident	90.6	Very high	41 Å²	41	55.7 Å²	55.7	16%	0.155	30%	0.3	C	S	.	.	H	α-helix	trans	-66.4	-32.1	-178.1	-170.8	59.6	-177	-162.1	8.3	112.2	H532 R540 L560 V566 L567 E568 I577	H532-R564 PolarHBondContact O-NH1 3.45Å; R540-R564 VanDerWaalsContact CZ-NH2 3.33Å; R540-R564 VanDerWaalsContact NE-NH2 3.13Å; L560-R564 WeakPolarHBondContact O-CB 3.39Å; L560-R564 PolarHBondContact O-N 3.47Å; R564-V566 VanDerWaalsContact C-N 3.25Å; R564-V566 PolarHBondContact O-N 2.76Å; R564-L567 PolarHBondContact O-N 2.84Å; R564-E568 HydrophobicContact CG-CB 4.47Å; R564-E568 IonicContact CZ-OE2 3.48Å; R564-E568 VanDerWaalsContact CZ-OE2 3.24Å; R564-E568 IonicContact NE-OE2 3.85Å; R564-E568 PolarHBondContact NE-OE2 3.24Å; R564-E568 IonicContact NH2-OE1 3.44Å; R564-E568 IonicContact NH2-OE2 3.38Å; R564-E568 PolarHBondContact NH2-OE2 3.07Å; R564-E568 WeakPolarHBondContact O-CB 3.41Å; R564-E568 PolarHBondContact O-N 3.45Å; R564-I577 HydrophobicContact CB-CD1 4.25Å; R564-I577 HydrophobicContact CG-CD1 3.75Å
565	F	89.8	Confident	90.8	Very high	4 Å²	4	61.9 Å²	61.9	2%	0.018	32%	0.316	C	S	.	.	H	α-helix	trans	-58.8	-37	177.5	-177.3	-110.1	0	0	0	112.6	L561 Q562 E563 H574 I577 Q578 L581 I588	L561-F565 WeakPolarHBondContact O-CB 3.32Å; L561-F565 PolarHBondContact O-N 2.75Å; Q562-F565 PolarHBondContact O-N 2.92Å; E563-F565 VanDerWaalsContact C-N 3.29Å; E563-F565 PolarHBondContact O-N 3.29Å; F565-H574 AromaticContact CD2-CE1 3.42Å; F565-H574 VanDerWaalsContact CD2-CE1 3.42Å; F565-H574 WeakPolarHBondContact CD2-CE1 3.49Å; F565-H574 AromaticContact CD2-ND1 3.6Å; F565-H574 AromaticContact CD2-NE2 3.88Å; F565-H574 AromaticContact CE1-CE1 3.83Å; F565-H574 AromaticContact CE2-CD2 3.59Å; F565-H574 AromaticContact CE2-CE1 3.06Å; F565-H574 WeakPolarHBondContact CE2-CE1 3.11Å; F565-H574 AromaticContact CE2-CG 3.89Å; F565-H574 AromaticContact CE2-ND1 3.58Å; F565-H574 AromaticContact CE2-NE2 3.05Å; F565-H574 WeakPolarHBondContact CE2-NE2 3.24Å; F565-H574 AromaticContact CG-CE1 3.93Å; F565-H574 AromaticContact CZ-CE1 3.29Å; F565-H574 WeakPolarHBondContact CZ-CE1 3.35Å; F565-H574 AromaticContact CZ-NE2 3.19Å; F565-H574 WeakPolarHBondContact CZ-NE2 3.45Å; F565-H574 PolarHBondContact O-CE1 3.28Å; F565-H574 PolarHBondContact O-ND1 3.45Å; F565-H574 VanDerWaalsContact O-ND1 3.08Å; F565-I577 HydrophobicContact CB-CG2 3.82Å; F565-I577 HydrophobicContact CD2-CB 4.38Å; F565-I577 HydrophobicContact CD2-CG2 3.86Å; F565-I577 HydrophobicContact CG-CG2 4.3Å; F565-Q578 HydrophobicContact CD2-CB 4.47Å; F565-Q578 HydrophobicContact CE2-CB 3.7Å; F565-Q578 HydrophobicContact CE2-CG 3.91Å; F565-Q578 HydrophobicContact CZ-CB 4.42Å; F565-Q578 HydrophobicContact CZ-CG 4.13Å; F565-L581 HydrophobicContact CB-CD1 4.22Å; F565-L581 HydrophobicContact CD2-CD1 4.27Å; F565-L581 HydrophobicContact CG-CD1 4.13Å; F565-I588 HydrophobicContact CD1-CG2 4.16Å; F565-I588 HydrophobicContact CE1-CG2 3.36Å; F565-I588 HydrophobicContact CZ-CG2 3.72Å
566	V	85.5	Confident	91	Very high	53 Å²	53	60.5 Å²	60.5	32%	0.321	30%	0.301	S	S	.	.	H	α-helix	trans	-75.5	-37	179	-178.3	0	0	0	0	111.7	Q562 E563 R564 R592 V595	Q562-V566 PolarHBondContact O-N 2.85Å; E563-V566 PolarHBondContact O-N 3.05Å; R564-V566 VanDerWaalsContact C-N 3.25Å; R564-V566 PolarHBondContact O-N 2.76Å; V566-R592 HydrophobicContact CG2-CG 4.46Å; V566-V595 HydrophobicContact CG1-CB 4.19Å; V566-V595 HydrophobicContact CG1-CG1 3.65Å; V566-V595 HydrophobicContact CG1-CG2 4.44Å
567	L	85.4	Confident	91.2	Very high	107 Å²	107	55.2 Å²	55.2	56%	0.56	28%	0.277	S	S	*	.	H	α-helix	trans	-92.1	-14.4	-173.9	-61.4	177.2	0	0	0	114.3	E563 R564 P569	E563-L567 HydrophobicContact CG-CD1 4.31Å; E563-L567 PolarHBondContact O-N 3.3Å; R564-L567 PolarHBondContact O-N 2.84Å; L567-P569 WeakPolarHBondContact O-CD 3.49Å
568	E	89.4	Confident	91.2	Very high	13 Å²	13	58 Å²	58	6%	0.061	29%	0.289	C	S	.	.			trans	-71.2	114.7	-171.8	179.1	58	-124.4	0	0	112.4	R540 R564 H570 V573 H574 I577	R540-E568 IonicContact CZ-OE1 2.83Å; R540-E568 IonicContact CZ-OE2 3.09Å; R540-E568 IonicContact NE-OE1 2.72Å; R540-E568 IonicContact NE-OE2 3.68Å; R540-E568 PolarHBondContact NE-OE2 3.49Å; R540-E568 IonicContact NH2-OE1 2.89Å; R540-E568 PolarHBondContact NH2-OE1 3.04Å; R540-E568 IonicContact NH2-OE2 2.83Å; R540-E568 PolarHBondContact NH2-OE2 2.85Å; R564-E568 HydrophobicContact CG-CB 4.47Å; R564-E568 IonicContact CZ-OE2 3.48Å; R564-E568 VanDerWaalsContact CZ-OE2 3.24Å; R564-E568 IonicContact NE-OE2 3.85Å; R564-E568 PolarHBondContact NE-OE2 3.24Å; R564-E568 IonicContact NH2-OE1 3.44Å; R564-E568 IonicContact NH2-OE2 3.38Å; R564-E568 PolarHBondContact NH2-OE2 3.07Å; R564-E568 WeakPolarHBondContact O-CB 3.41Å; R564-E568 PolarHBondContact O-N 3.45Å; E568-H570 VanDerWaalsContact OE1-CB 3.29Å; E568-H570 WeakPolarHBondContact OE1-CB 3.26Å; E568-H570 PolarHBondContact OE1-N 3.07Å; E568-H570 VanDerWaalsContact OE1-N 3.08Å; E568-V573 HydrophobicContact CG-CB 3.65Å; E568-V573 HydrophobicContact CG-CG1 3.68Å; E568-V573 WeakPolarHBondContact OE2-CG1 3.31Å; E568-H574 HydrophobicContact CG-CB 4.4Å; E568-I577 HydrophobicContact CB-CD1 4.47Å; E568-I577 HydrophobicContact CG-CD1 4.46Å
569	P	88.5	Confident	91.2	Very high	109 Å²	109	56.8 Å²	56.8	71%	0.708	29%	0.292	S	S	*	.			trans	-77	-25.2	-178.7	30.9	-36.4	0	0	0	113	L567	L567-P569 WeakPolarHBondContact O-CD 3.49Å
570	H	93.3	Very high	91.4	Very high	56 Å²	56	52.3 Å²	52.3	26%	0.259	27%	0.268	S	S	.	.			trans	-87.6	120.9	-171.7	-167.3	-93.6	0	0	0	111.9	P537 E568 Q572 V573 H574	P537-H570 HydrophobicContact CB-CB 4Å; E568-H570 VanDerWaalsContact OE1-CB 3.29Å; E568-H570 WeakPolarHBondContact OE1-CB 3.26Å; E568-H570 PolarHBondContact OE1-N 3.07Å; E568-H570 VanDerWaalsContact OE1-N 3.08Å; H570-Q572 VanDerWaalsContact C-N 3.29Å; H570-Q572 PolarHBondContact ND1-N 2.86Å; H570-Q572 PolarHBondContact O-N 3.13Å; H570-V573 HydrophobicContact CB-CB 4.29Å; H570-V573 HydrophobicContact CB-CG2 3.85Å; H570-V573 PolarHBondContact O-N 2.82Å; H570-V573 VanDerWaalsContact O-N 3.09Å; H570-H574 PolarHBondContact O-N 3.45Å
571	P	92.9	Very high	91.5	Very high	87 Å²	87	51 Å²	51	57%	0.565	26%	0.262	S	S	*	.	H	α-helix	trans	-65.2	-29.7	-170.4	24.8	-34.9	0	0	0	113.6	R575	P571-R575 WeakPolarHBondContact O-CG 3.42Å; P571-R575 PolarHBondContact O-N 3.24Å; P571-R575 VanDerWaalsContact O-N 3.11Å
572	Q	94	Very high	91.4	Very high	94 Å²	94	57.2 Å²	57.2	44%	0.439	29%	0.289	S	S	.	.	H	α-helix	trans	-72.6	-40.4	176.3	-58.1	-174.7	-28.5	0	0	111.9	I541 H570 H574 R575 H576	I541-Q572 HydrophobicContact CD1-CB 3.88Å; H570-Q572 VanDerWaalsContact C-N 3.29Å; H570-Q572 PolarHBondContact ND1-N 2.86Å; H570-Q572 PolarHBondContact O-N 3.13Å; Q572-H574 VanDerWaalsContact C-N 3.31Å; Q572-R575 PolarHBondContact O-N 3.45Å; Q572-H576 PolarHBondContact O-CD2 3.49Å; Q572-H576 PolarHBondContact O-N 2.8Å; Q572-H576 VanDerWaalsContact O-N 3.09Å
573	V	93.6	Very high	91.6	Very high	0 Å²	0	59.8 Å²	59.8	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-65.1	-44.2	178.5	-177.8	0	0	0	0	108.5	P537 R540 I541 E568 H570 R575 H576 I577	P537-V573 HydrophobicContact CB-CG2 3.55Å; R540-V573 HydrophobicContact CB-CG1 4.01Å; R540-V573 HydrophobicContact CB-CG2 4.38Å; I541-V573 HydrophobicContact CD1-CG2 4.05Å; I541-V573 HydrophobicContact CG1-CB 4.32Å; I541-V573 HydrophobicContact CG1-CG2 3.74Å; E568-V573 HydrophobicContact CG-CB 3.65Å; E568-V573 HydrophobicContact CG-CG1 3.68Å; E568-V573 WeakPolarHBondContact OE2-CG1 3.31Å; H570-V573 HydrophobicContact CB-CB 4.29Å; H570-V573 HydrophobicContact CB-CG2 3.85Å; H570-V573 PolarHBondContact O-N 2.82Å; H570-V573 VanDerWaalsContact O-N 3.09Å; V573-R575 VanDerWaalsContact C-N 3.34Å; V573-R575 PolarHBondContact O-N 3.21Å; V573-H576 PolarHBondContact O-N 2.91Å; V573-H576 VanDerWaalsContact O-N 3.07Å; V573-I577 HydrophobicContact CG1-CD1 3.85Å; V573-I577 HydrophobicContact CG1-CG1 4.33Å; V573-I577 WeakPolarHBondContact O-CG1 3.3Å; V573-I577 PolarHBondContact O-N 3.11Å
574	H	93.6	Very high	91.9	Very high	56 Å²	56	56.5 Å²	56.5	26%	0.259	29%	0.287	S	S	.	.	H	α-helix	trans	-55.1	-45.5	175.1	-170.9	89.1	0	0	0	112.5	F565 E568 H570 Q572 H576 I577 Q578	F565-H574 AromaticContact CD2-CE1 3.42Å; F565-H574 VanDerWaalsContact CD2-CE1 3.42Å; F565-H574 WeakPolarHBondContact CD2-CE1 3.49Å; F565-H574 AromaticContact CD2-ND1 3.6Å; F565-H574 AromaticContact CD2-NE2 3.88Å; F565-H574 AromaticContact CE1-CE1 3.83Å; F565-H574 AromaticContact CE2-CD2 3.59Å; F565-H574 AromaticContact CE2-CE1 3.06Å; F565-H574 WeakPolarHBondContact CE2-CE1 3.11Å; F565-H574 AromaticContact CE2-CG 3.89Å; F565-H574 AromaticContact CE2-ND1 3.58Å; F565-H574 AromaticContact CE2-NE2 3.05Å; F565-H574 WeakPolarHBondContact CE2-NE2 3.24Å; F565-H574 AromaticContact CG-CE1 3.93Å; F565-H574 AromaticContact CZ-CE1 3.29Å; F565-H574 WeakPolarHBondContact CZ-CE1 3.35Å; F565-H574 AromaticContact CZ-NE2 3.19Å; F565-H574 WeakPolarHBondContact CZ-NE2 3.45Å; F565-H574 PolarHBondContact O-CE1 3.28Å; F565-H574 PolarHBondContact O-ND1 3.45Å; F565-H574 VanDerWaalsContact O-ND1 3.08Å; E568-H574 HydrophobicContact CG-CB 4.4Å; H570-H574 PolarHBondContact O-N 3.45Å; Q572-H574 VanDerWaalsContact C-N 3.31Å; H574-H576 PolarHBondContact O-N 3.43Å; H574-I577 PolarHBondContact O-N 3.08Å; H574-Q578 WeakPolarHBondContact O-CB 3.38Å; H574-Q578 PolarHBondContact O-N 3.41Å
575	R	94.1	Very high	91.8	Very high	155 Å²	155	57.7 Å²	57.7	59%	0.585	31%	0.312	S	S	*	.	H	α-helix	trans	-60.9	-41.1	174.3	-79.8	-172.2	-75.5	143.3	-15.9	113.2	P571 Q572 V573 G579	P571-R575 WeakPolarHBondContact O-CG 3.42Å; P571-R575 PolarHBondContact O-N 3.24Å; P571-R575 VanDerWaalsContact O-N 3.11Å; Q572-R575 PolarHBondContact O-N 3.45Å; V573-R575 VanDerWaalsContact C-N 3.34Å; V573-R575 PolarHBondContact O-N 3.21Å; R575-G579 PolarHBondContact O-N 2.91Å
576	H	94.8	Very high	91.8	Very high	68 Å²	68	59.1 Å²	59.1	32%	0.315	32%	0.318	S	S	.	.	H	α-helix	trans	-66.2	-44.1	177.6	-80.7	-70.1	0	0	0	111.9	C544 Q545 Q572 V573 H574 G579 L580	C544-H576 HydrophobicContact CB-CB 4.44Å; Q545-H576 PolarHBondContact NE2-CE1 3.15Å; Q572-H576 PolarHBondContact O-CD2 3.49Å; Q572-H576 PolarHBondContact O-N 2.8Å; Q572-H576 VanDerWaalsContact O-N 3.09Å; V573-H576 PolarHBondContact O-N 2.91Å; V573-H576 VanDerWaalsContact O-N 3.07Å; H574-H576 PolarHBondContact O-N 3.43Å; H576-G579 PolarHBondContact O-N 3.45Å; H576-L580 PolarHBondContact O-N 2.85Å
577	I	94.5	Very high	91.8	Very high	0 Å²	0	59.8 Å²	59.8	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-60.8	-47.7	174.6	-67.2	171.7	0	0	0	110.5	L531 L561 R564 F565 E568 V573 H574 G579 L580 L581	L531-I577 HydrophobicContact CD1-CD1 4.36Å; L531-I577 HydrophobicContact CD1-CG1 4.35Å; L561-I577 HydrophobicContact CB-CG2 4.27Å; L561-I577 HydrophobicContact CD2-CB 4.43Å; L561-I577 HydrophobicContact CD2-CG1 4.27Å; L561-I577 HydrophobicContact CD2-CG2 3.88Å; R564-I577 HydrophobicContact CB-CD1 4.25Å; R564-I577 HydrophobicContact CG-CD1 3.75Å; F565-I577 HydrophobicContact CB-CG2 3.82Å; F565-I577 HydrophobicContact CD2-CB 4.38Å; F565-I577 HydrophobicContact CD2-CG2 3.86Å; F565-I577 HydrophobicContact CG-CG2 4.3Å; E568-I577 HydrophobicContact CB-CD1 4.47Å; E568-I577 HydrophobicContact CG-CD1 4.46Å; V573-I577 HydrophobicContact CG1-CD1 3.85Å; V573-I577 HydrophobicContact CG1-CG1 4.33Å; V573-I577 WeakPolarHBondContact O-CG1 3.3Å; V573-I577 PolarHBondContact O-N 3.11Å; H574-I577 PolarHBondContact O-N 3.08Å; I577-G579 VanDerWaalsContact C-N 3.3Å; I577-G579 PolarHBondContact O-N 2.92Å; I577-L580 PolarHBondContact O-N 3.22Å; I577-L581 HydrophobicContact CG2-CD1 4.03Å; I577-L581 HydrophobicContact CG2-CG 4.43Å; I577-L581 WeakPolarHBondContact O-CG 3.42Å; I577-L581 PolarHBondContact O-N 3.21Å
578	Q	92.8	Very high	91.3	Very high	61 Å²	61	56.8 Å²	56.8	29%	0.285	31%	0.309	S	S	.	.	H	α-helix	trans	-57.6	-44.6	176.7	-160.9	-174.4	23.2	0	0	111.9	F565 H574 L580 L581 K582 I588	F565-Q578 HydrophobicContact CD2-CB 4.47Å; F565-Q578 HydrophobicContact CE2-CB 3.7Å; F565-Q578 HydrophobicContact CE2-CG 3.91Å; F565-Q578 HydrophobicContact CZ-CB 4.42Å; F565-Q578 HydrophobicContact CZ-CG 4.13Å; H574-Q578 WeakPolarHBondContact O-CB 3.38Å; H574-Q578 PolarHBondContact O-N 3.41Å; Q578-L580 VanDerWaalsContact C-N 3.28Å; Q578-L580 PolarHBondContact O-N 3.4Å; Q578-L581 PolarHBondContact O-N 2.96Å; Q578-K582 WeakPolarHBondContact O-CB 3.44Å; Q578-K582 WeakPolarHBondContact O-CG 3.38Å; Q578-K582 PolarHBondContact O-N 3.24Å; Q578-I588 HydrophobicContact CG-CD1 4.42Å
579	G	92.9	Very high	90.2	Very high	33 Å²	33	61.1 Å²	61.1	34%	0.34	33%	0.332	S	S	.	.	H	α-helix	trans	-61.6	-37.8	176.8	0	0	0	0	0	112	R575 H576 I577 N583	R575-G579 PolarHBondContact O-N 2.91Å; H576-G579 PolarHBondContact O-N 3.45Å; I577-G579 VanDerWaalsContact C-N 3.3Å; I577-G579 PolarHBondContact O-N 2.92Å; G579-N583 WeakPolarHBondContact O-CB 3.39Å; G579-N583 PolarHBondContact O-N 2.88Å
580	L	93.8	Very high	88.9	Confident	2 Å²	2	57.6 Å²	57.6	1%	0.01	32%	0.316	C	S	.	.	H	α-helix	trans	-71.5	-44.1	177.9	-168.6	57	0	0	0	112.3	L547 K548 L561 H576 I577 Q578 K582 N583 Y584	L547-L580 HydrophobicContact CB-CD2 4.39Å; K548-L580 HydrophobicContact CB-CD1 3.71Å; K548-L580 HydrophobicContact CD-CD1 4.44Å; K548-L580 HydrophobicContact CG-CD1 3.89Å; L561-L580 HydrophobicContact CD1-CB 4.42Å; L561-L580 HydrophobicContact CD1-CD2 3.85Å; L561-L580 HydrophobicContact CD1-CG 3.95Å; L561-L580 HydrophobicContact CD2-CD2 3.93Å; H576-L580 PolarHBondContact O-N 2.85Å; I577-L580 PolarHBondContact O-N 3.22Å; Q578-L580 VanDerWaalsContact C-N 3.28Å; Q578-L580 PolarHBondContact O-N 3.4Å; L580-K582 PolarHBondContact O-N 3.34Å; L580-N583 PolarHBondContact O-N 3.12Å; L580-Y584 HydrophobicContact CD1-CD2 3.84Å; L580-Y584 HydrophobicContact CD1-CE2 3.32Å; L580-Y584 HydrophobicContact CG-CD2 4.13Å; L580-Y584 HydrophobicContact CG-CE2 3.94Å; L580-Y584 PolarHBondContact O-N 2.83Å
581	L	93	Very high	87.4	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-55.5	-50.8	173.5	-74.1	167.5	0	0	0	110.9	L561 Q562 F565 I577 Q578 N583 Y584 G585 Y586	L561-L581 HydrophobicContact CB-CD2 3.61Å; L561-L581 HydrophobicContact CB-CG 4.04Å; L561-L581 HydrophobicContact CD1-CD2 4.17Å; L561-L581 HydrophobicContact CD1-CG 4.44Å; Q562-L581 HydrophobicContact CG-CD2 4.07Å; F565-L581 HydrophobicContact CB-CD1 4.22Å; F565-L581 HydrophobicContact CD2-CD1 4.27Å; F565-L581 HydrophobicContact CG-CD1 4.13Å; I577-L581 HydrophobicContact CG2-CD1 4.03Å; I577-L581 HydrophobicContact CG2-CG 4.43Å; I577-L581 WeakPolarHBondContact O-CG 3.42Å; I577-L581 PolarHBondContact O-N 3.21Å; Q578-L581 PolarHBondContact O-N 2.96Å; L581-N583 PolarHBondContact O-N 3.35Å; L581-Y584 CarbonylContact O-C 3.6Å; L581-Y584 PolarHBondContact O-N 3.42Å; L581-G585 PolarHBondContact O-N 3.39Å; L581-Y586 HydrophobicContact CD2-CD2 4.06Å; L581-Y586 HydrophobicContact CD2-CG 4.34Å; L581-Y586 PolarHBondContact O-N 3.44Å
582	K	91.9	Very high	85.9	Confident	129 Å²	129	60.2 Å²	60.2	56%	0.561	32%	0.319	S	S	*	.	H	α-helix	trans	-61	-43.8	177.1	-73.6	180	178.2	-179	0	112.5	Q578 L580 Y584 G585 I588	Q578-K582 WeakPolarHBondContact O-CB 3.44Å; Q578-K582 WeakPolarHBondContact O-CG 3.38Å; Q578-K582 PolarHBondContact O-N 3.24Å; L580-K582 PolarHBondContact O-N 3.34Å; K582-Y584 PolarHBondContact O-N 2.93Å; K582-G585 PolarHBondContact O-N 3.47Å; K582-G585 VanDerWaalsContact O-N 3.11Å; K582-I588 HydrophobicContact CD-CD1 4.44Å; K582-I588 HydrophobicContact CG-CD1 3.97Å
583	N	92.9	Very high	84.4	Confident	86 Å²	86	57.9 Å²	57.9	46%	0.46	32%	0.32	S	S	.	.	H	α-helix	trans	-61.4	-27.4	-179	-173.8	63.3	0	0	0	113	G579 L580 L581	G579-N583 WeakPolarHBondContact O-CB 3.39Å; G579-N583 PolarHBondContact O-N 2.88Å; L580-N583 PolarHBondContact O-N 3.12Å; L581-N583 PolarHBondContact O-N 3.35Å
584	Y	92.4	Very high	83.1	Confident	33 Å²	33	62.7 Å²	62.7	13%	0.129	34%	0.344	C	S	.	.	H	α-helix	trans	-104.6	3.5	177	-62.2	-35.9	0	0	0	114.1	L547 K551 V552 K553 L557 L580 L581 K582 Y586	L547-Y584 PolarHBondContact O-OH 3.1Å; K551-Y584 WeakPolarHBondContact CA-OH 3.44Å; V552-Y584 WeakPolarHBondContact O-CE2 3.3Å; V552-Y584 PolarHBondContact O-OH 3.27Å; K553-Y584 HydrophobicContact CD-CD1 4.33Å; K553-Y584 HydrophobicContact CD-CE1 4.41Å; K553-Y584 VanDerWaalsContact CE-CD1 3.49Å; K553-Y584 HydrophobicContact CG-CD1 4.25Å; K553-Y584 HydrophobicContact CG-CE1 4.11Å; K553-Y584 HydrophobicContact CG-CE2 4.37Å; K553-Y584 HydrophobicContact CG-CG 4.46Å; L557-Y584 HydrophobicContact CD2-CE2 4.21Å; L580-Y584 HydrophobicContact CD1-CD2 3.84Å; L580-Y584 HydrophobicContact CD1-CE2 3.32Å; L580-Y584 HydrophobicContact CG-CD2 4.13Å; L580-Y584 HydrophobicContact CG-CE2 3.94Å; L580-Y584 PolarHBondContact O-N 2.83Å; L581-Y584 CarbonylContact O-C 3.6Å; L581-Y584 PolarHBondContact O-N 3.42Å; K582-Y584 PolarHBondContact O-N 2.93Å; Y584-Y586 VanDerWaalsContact C-N 3.26Å; Y584-Y586 HydrophobicContact CD2-CD2 4.44Å; Y584-Y586 AromaticContact CD2-CE2 3.78Å; Y584-Y586 HydrophobicContact CD2-CE2 3.78Å; Y584-Y586 HydrophobicContact CG-CE2 4.15Å; Y584-Y586 PolarHBondContact O-N 3.03Å
585	G	88	Confident	81.8	Confident	66 Å²	66	62.4 Å²	62.4	68%	0.68	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.6	21	179.7	0	0	0	0	0	114.1	L581 K582	L581-G585 PolarHBondContact O-N 3.39Å; K582-G585 PolarHBondContact O-N 3.47Å; K582-G585 VanDerWaalsContact O-N 3.11Å
586	Y	90.5	Very high	80.6	Confident	34 Å²	34	60.3 Å²	60.3	13%	0.133	34%	0.343	C	S	.	.			trans	-75.7	141.7	176.2	-59.9	-35.1	0	0	0	110.7	G554 Q558 L561 L581 Y584 I588	G554-Y586 PolarHBondContact N-OH 3.38Å; Q558-Y586 HydrophobicContact CB-CD1 4.17Å; Q558-Y586 HydrophobicContact CB-CD2 4.08Å; Q558-Y586 HydrophobicContact CB-CE1 4.13Å; Q558-Y586 HydrophobicContact CB-CE2 4.02Å; Q558-Y586 HydrophobicContact CB-CG 4.16Å; Q558-Y586 HydrophobicContact CG-CD1 3.89Å; Q558-Y586 HydrophobicContact CG-CD2 4.17Å; Q558-Y586 HydrophobicContact CG-CE1 4.34Å; Q558-Y586 HydrophobicContact CG-CG 3.81Å; L561-Y586 HydrophobicContact CD1-CD2 4.36Å; L561-Y586 HydrophobicContact CD1-CE2 4.48Å; L581-Y586 HydrophobicContact CD2-CD2 4.06Å; L581-Y586 HydrophobicContact CD2-CG 4.34Å; L581-Y586 PolarHBondContact O-N 3.44Å; Y584-Y586 VanDerWaalsContact C-N 3.26Å; Y584-Y586 HydrophobicContact CD2-CD2 4.44Å; Y584-Y586 AromaticContact CD2-CE2 3.78Å; Y584-Y586 HydrophobicContact CD2-CE2 3.78Å; Y584-Y586 HydrophobicContact CG-CE2 4.15Å; Y584-Y586 PolarHBondContact O-N 3.03Å; Y586-I588 PolarHBondContact O-N 3.43Å
587	S	84.6	Confident	79.5	Confident	66 Å²	66	64.6 Å²	64.6	46%	0.462	36%	0.36	S	S	.	.			trans	-61.9	132.9	176.9	179.5	0	0	0	0	110.8	Q562 D589	Q562-S587 PolarHBondContact NE2-O 3.25Å; S587-D589 PolarHBondContact OG-N 2.96Å
588	I	76.1	Confident	78.6	Confident	45 Å²	45	69 Å²	69	23%	0.231	38%	0.383	C	S	.	.	S	Bend	trans	-80.7	-24.9	177.3	-58.1	173.5	0	0	0	110.7	F565 Q578 K582 Y586 G590	F565-I588 HydrophobicContact CD1-CG2 4.16Å; F565-I588 HydrophobicContact CE1-CG2 3.36Å; F565-I588 HydrophobicContact CZ-CG2 3.72Å; Q578-I588 HydrophobicContact CG-CD1 4.42Å; K582-I588 HydrophobicContact CD-CD1 4.44Å; K582-I588 HydrophobicContact CG-CD1 3.97Å; Y586-I588 PolarHBondContact O-N 3.43Å; I588-G590 VanDerWaalsContact C-N 3.29Å; I588-G590 PolarHBondContact O-N 3.15Å
589	D	67	Low	77.8	Confident	104 Å²	104	72.8 Å²	72.8	56%	0.556	40%	0.399	S	S	*	.			trans	-75.4	-16.7	-170.7	-79.7	-35.5	0	0	0	113.9	S587 R592	S587-D589 PolarHBondContact OG-N 2.96Å; D589-R592 WeakPolarHBondContact O-CB 3.5Å; D589-R592 WeakPolarHBondContact O-CG 3.45Å; D589-R592 PolarHBondContact O-N 2.94Å; D589-R592 VanDerWaalsContact O-N 3.08Å
590	G	60.6	Low	77.2	Confident	35 Å²	35	76.2 Å²	76.2	36%	0.361	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	39.6	-143	176.9	0	0	0	0	0	112.4	I588	I588-G590 VanDerWaalsContact C-N 3.29Å; I588-G590 PolarHBondContact O-N 3.15Å
591	D	61.9	Low	76.6	Confident	90 Å²	90	80.6 Å²	80.6	48%	0.481	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.2	48.5	168	-151.5	-11.7	0	0	0	111.2	G593 M594 V595	D591-G593 PolarHBondContact O-N 3.24Å; D591-G593 VanDerWaalsContact O-N 3.11Å; D591-M594 HydrophobicContact CB-CB 4.2Å; D591-M594 PolarHBondContact O-N 2.91Å; D591-M594 VanDerWaalsContact O-N 3.07Å; D591-M594 WeakPolarHBondContact OD1-CB 3.4Å; D591-M594 PolarHBondContact OD1-N 3.45Å; D591-M594 WeakPolarHBondContact OD2-CB 3.29Å; D591-M594 WeakPolarHBondContact OD2-CE 3.44Å; D591-V595 PolarHBondContact O-N 3.44Å
592	R	61.2	Low	76.1	Confident	107 Å²	107	84.3 Å²	84.3	40%	0.404	45%	0.452	S	S	.	.	H	α-helix	trans	-51.1	-37	179.5	-94.2	-178.4	-177	-148.5	-3.5	112.1	V566 D589 H596	V566-R592 HydrophobicContact CG2-CG 4.46Å; D589-R592 WeakPolarHBondContact O-CB 3.5Å; D589-R592 WeakPolarHBondContact O-CG 3.45Å; D589-R592 PolarHBondContact O-N 2.94Å; D589-R592 VanDerWaalsContact O-N 3.08Å; R592-H596 PolarHBondContact O-N 3.32Å; R592-H596 PolarHBondContact O-ND1 3.21Å
593	G	63.3	Low	75.6	Confident	46 Å²	46	84.4 Å²	84.4	47%	0.474	45%	0.454	S	S	.	.	H	α-helix	trans	-62.9	-46.4	178.6	0	0	0	0	0	112.5	D591 K597	D591-G593 PolarHBondContact O-N 3.24Å; D591-G593 VanDerWaalsContact O-N 3.11Å; G593-K597 WeakPolarHBondContact O-CG 3.41Å; G593-K597 PolarHBondContact O-N 3.34Å; G593-K597 VanDerWaalsContact O-N 3.16Å
594	M	64.9	Low	75.2	Confident	101 Å²	101	88.4 Å²	88.4	50%	0.498	46%	0.463	S	S	.	.	H	α-helix	trans	-67.8	-40.7	177.5	-169.8	-178.8	-68.1	0	0	111.9	D591 H596 K597 I598	D591-M594 HydrophobicContact CB-CB 4.2Å; D591-M594 PolarHBondContact O-N 2.91Å; D591-M594 VanDerWaalsContact O-N 3.07Å; D591-M594 WeakPolarHBondContact OD1-CB 3.4Å; D591-M594 PolarHBondContact OD1-N 3.45Å; D591-M594 WeakPolarHBondContact OD2-CB 3.29Å; D591-M594 WeakPolarHBondContact OD2-CE 3.44Å; M594-H596 PolarHBondContact O-N 3.19Å; M594-K597 WeakPolarHBondContact O-CB 3.46Å; M594-K597 PolarHBondContact O-N 3.22Å; M594-I598 HydrophobicContact CG-CD1 3.94Å; M594-I598 HydrophobicContact CG-CG1 4.4Å; M594-I598 WeakPolarHBondContact O-CG1 3.46Å; M594-I598 PolarHBondContact O-N 3.46Å
595	V	66.9	Low	74.7	Confident	50 Å²	50	91 Å²	91	30%	0.303	48%	0.478	S	S	.	.	H	α-helix	trans	-65.6	-38.5	179.7	-179.2	0	0	0	0	112	V566 D591 I598 K599	V566-V595 HydrophobicContact CG1-CB 4.19Å; V566-V595 HydrophobicContact CG1-CG1 3.65Å; V566-V595 HydrophobicContact CG1-CG2 4.44Å; D591-V595 PolarHBondContact O-N 3.44Å; V595-I598 PolarHBondContact O-N 3.31Å; V595-K599 VanDerWaalsContact O-CB 3.32Å; V595-K599 WeakPolarHBondContact O-CB 3.39Å; V595-K599 PolarHBondContact O-N 2.79Å
596	H	67.8	Low	74.2	Confident	110 Å²	110	91.6 Å²	91.6	51%	0.509	47%	0.471	S	S	.	.	H	α-helix	trans	-63.4	-43.5	172.8	-77.6	79.9	0	0	0	111.4	R592 M594 I598 K599 D600	R592-H596 PolarHBondContact O-N 3.32Å; R592-H596 PolarHBondContact O-ND1 3.21Å; M594-H596 PolarHBondContact O-N 3.19Å; H596-I598 PolarHBondContact O-N 3.48Å; H596-K599 PolarHBondContact O-N 3.11Å; H596-D600 WeakPolarHBondContact O-CB 3.46Å; H596-D600 PolarHBondContact O-N 3.2Å
597	K	72.4	Confident	74.1	Confident	158 Å²	158	92.7 Å²	92.7	69%	0.687	48%	0.482	S	S	*	.	H	α-helix	trans	-60.8	-42.6	175.6	-71.1	176.2	-175.7	-178.2	0	112.5	G593 M594 Q601	G593-K597 WeakPolarHBondContact O-CG 3.41Å; G593-K597 PolarHBondContact O-N 3.34Å; G593-K597 VanDerWaalsContact O-N 3.16Å; M594-K597 WeakPolarHBondContact O-CB 3.46Å; M594-K597 PolarHBondContact O-N 3.22Å; K597-Q601 VanDerWaalsContact O-CB 3.32Å; K597-Q601 WeakPolarHBondContact O-CB 3.36Å; K597-Q601 PolarHBondContact O-N 3.2Å
598	I	76	Confident	74.2	Confident	93 Å²	93	98.2 Å²	98.2	48%	0.477	50%	0.497	S	S	.	.	H	α-helix	trans	-64	-44.8	176.2	-68.4	167.1	0	0	0	109.9	M594 V595 H596 D600 Q601 V602	M594-I598 HydrophobicContact CG-CD1 3.94Å; M594-I598 HydrophobicContact CG-CG1 4.4Å; M594-I598 WeakPolarHBondContact O-CG1 3.46Å; M594-I598 PolarHBondContact O-N 3.46Å; V595-I598 PolarHBondContact O-N 3.31Å; H596-I598 PolarHBondContact O-N 3.48Å; I598-D600 PolarHBondContact O-N 3.43Å; I598-Q601 PolarHBondContact O-N 3.37Å; I598-V602 HydrophobicContact CG2-CG2 4.17Å; I598-V602 WeakPolarHBondContact O-CB 3.48Å; I598-V602 VanDerWaalsContact O-CG2 3.25Å; I598-V602 WeakPolarHBondContact O-CG2 3.32Å; I598-V602 PolarHBondContact O-N 3.34Å
599	K	76.3	Confident	74.6	Confident	141 Å²	141	99.5 Å²	99.5	61%	0.613	51%	0.51	S	S	*	.	H	α-helix	trans	-62.1	-43.7	179.4	-168	176.2	-179	-179.1	0	111.9	V595 H596 V602 Q603	V595-K599 VanDerWaalsContact O-CB 3.32Å; V595-K599 WeakPolarHBondContact O-CB 3.39Å; V595-K599 PolarHBondContact O-N 2.79Å; H596-K599 PolarHBondContact O-N 3.11Å; K599-V602 PolarHBondContact O-N 3.14Å; K599-Q603 VanDerWaalsContact O-CB 3.28Å; K599-Q603 WeakPolarHBondContact O-CB 3.49Å; K599-Q603 PolarHBondContact O-N 3.19Å
600	D	78.9	Confident	75.4	Confident	104 Å²	104	96.8 Å²	96.8	56%	0.556	50%	0.496	S	S	*	.	H	α-helix	trans	-63.5	-42.3	175.3	-76.6	-3.6	0	0	0	111.4	H596 I598 Q603 R604	H596-D600 WeakPolarHBondContact O-CB 3.46Å; H596-D600 PolarHBondContact O-N 3.2Å; I598-D600 PolarHBondContact O-N 3.43Å; D600-Q603 PolarHBondContact O-N 3.1Å; D600-R604 WeakPolarHBondContact O-CB 3.47Å; D600-R604 PolarHBondContact O-N 2.9Å
601	Q	82.4	Confident	76.5	Confident	95 Å²	95	99.1 Å²	99.1	44%	0.444	50%	0.499	S	S	.	.	H	α-helix	trans	-68.4	-40.9	178.6	-165.5	70.1	-11.6	0	0	112.1	K597 I598 Q603 R604 L605	K597-Q601 VanDerWaalsContact O-CB 3.32Å; K597-Q601 WeakPolarHBondContact O-CB 3.36Å; K597-Q601 PolarHBondContact O-N 3.2Å; I598-Q601 PolarHBondContact O-N 3.37Å; Q601-Q603 VanDerWaalsContact C-N 3.34Å; Q601-R604 PolarHBondContact O-N 3Å; Q601-L605 HydrophobicContact CG-CD1 4.08Å; Q601-L605 WeakPolarHBondContact O-CB 3.45Å; Q601-L605 VanDerWaalsContact O-CG 3.23Å; Q601-L605 WeakPolarHBondContact O-CG 3.47Å; Q601-L605 PolarHBondContact O-N 3.35Å
602	V	81.8	Confident	77.5	Confident	77 Å²	77	98 Å²	98	47%	0.467	50%	0.495	S	S	.	.	H	α-helix	trans	-62	-44.5	172.7	169.7	0	0	0	0	110	I598 K599 R604 L605 C606	I598-V602 HydrophobicContact CG2-CG2 4.17Å; I598-V602 WeakPolarHBondContact O-CB 3.48Å; I598-V602 VanDerWaalsContact O-CG2 3.25Å; I598-V602 WeakPolarHBondContact O-CG2 3.32Å; I598-V602 PolarHBondContact O-N 3.34Å; K599-V602 PolarHBondContact O-N 3.14Å; V602-R604 VanDerWaalsContact C-N 3.31Å; V602-R604 PolarHBondContact O-N 3.48Å; V602-L605 PolarHBondContact O-N 3.12Å; V602-C606 VanDerWaalsContact O-CB 3.25Å; V602-C606 WeakPolarHBondContact O-CB 3.25Å; V602-C606 PolarHBondContact O-N 2.7Å; V602-C606 PolarHBondContact O-SG 3.26Å
603	Q	81.7	Confident	78.7	Confident	132 Å²	132	97.7 Å²	97.7	62%	0.617	50%	0.501	S	S	*	.	H	α-helix	trans	-63.5	-37.8	177.8	-169.7	167.9	-3.5	0	0	112.1	K599 D600 Q601	K599-Q603 VanDerWaalsContact O-CB 3.28Å; K599-Q603 WeakPolarHBondContact O-CB 3.49Å; K599-Q603 PolarHBondContact O-N 3.19Å; D600-Q603 PolarHBondContact O-N 3.1Å; Q601-Q603 VanDerWaalsContact C-N 3.34Å
604	R	85.4	Confident	79.7	Confident	170 Å²	170	100.1 Å²	100.1	64%	0.642	50%	0.499	S	S	*	.	H	α-helix	trans	-63	-51.3	172.3	-177.4	179.2	176.9	175.6	-2.3	111.4	D600 Q601 V602 C606 T607 I610	D600-R604 WeakPolarHBondContact O-CB 3.47Å; D600-R604 PolarHBondContact O-N 2.9Å; Q601-R604 PolarHBondContact O-N 3Å; V602-R604 VanDerWaalsContact C-N 3.31Å; V602-R604 PolarHBondContact O-N 3.48Å; R604-C606 VanDerWaalsContact C-N 3.34Å; R604-C606 PolarHBondContact O-N 2.92Å; R604-T607 WeakPolarHBondContact O-CG2 3.22Å; R604-T607 PolarHBondContact O-N 3.33Å; R604-T607 PolarHBondContact O-OG1 3.14Å; R604-I610 WeakPolarHBondContact O-CD1 3.36Å
605	L	81.1	Confident	80.6	Confident	86 Å²	86	98.9 Å²	98.9	45%	0.45	50%	0.497	S	S	.	.	H	α-helix	trans	-68.4	-30.1	-176.8	-69.9	170.8	0	0	0	113.3	Q601 V602 T607	Q601-L605 HydrophobicContact CG-CD1 4.08Å; Q601-L605 WeakPolarHBondContact O-CB 3.45Å; Q601-L605 VanDerWaalsContact O-CG 3.23Å; Q601-L605 WeakPolarHBondContact O-CG 3.47Å; Q601-L605 PolarHBondContact O-N 3.35Å; V602-L605 PolarHBondContact O-N 3.12Å; L605-T607 VanDerWaalsContact C-N 3.26Å; L605-T607 PolarHBondContact O-N 3.28Å
606	C	78.2	Confident	81.5	Confident	79 Å²	79	100.4 Å²	100.4	53%	0.534	50%	0.503	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87	16.2	178.2	-65.3	0	0	0	0	113.7	V602 R604 I611	V602-C606 VanDerWaalsContact O-CB 3.25Å; V602-C606 WeakPolarHBondContact O-CB 3.25Å; V602-C606 PolarHBondContact O-N 2.7Å; V602-C606 PolarHBondContact O-SG 3.26Å; R604-C606 VanDerWaalsContact C-N 3.34Å; R604-C606 PolarHBondContact O-N 2.92Å; C606-I611 HydrophobicContact CB-CD1 4.31Å; C606-I611 WeakPolarHBondContact O-CD1 3.43Å
607	T	88.1	Confident	82.4	Confident	57 Å²	57	99.6 Å²	99.6	35%	0.35	50%	0.502	S	S	.	.			trans	-67.3	142.1	172.3	46.6	0	0	0	0	110.8	R604 L605 S609 I610 I611	R604-T607 WeakPolarHBondContact O-CG2 3.22Å; R604-T607 PolarHBondContact O-N 3.33Å; R604-T607 PolarHBondContact O-OG1 3.14Å; L605-T607 VanDerWaalsContact C-N 3.26Å; L605-T607 PolarHBondContact O-N 3.28Å; T607-S609 PolarHBondContact O-N 3.06Å; T607-I610 PolarHBondContact O-N 2.52Å; T607-I610 VanDerWaalsContact O-N 3.11Å; T607-I610 VanDerWaalsContact OG1-CD1 3.26Å; T607-I610 WeakPolarHBondContact OG1-CD1 3.49Å; T607-I610 VanDerWaalsContact OG1-CG1 3.27Å; T607-I610 WeakPolarHBondContact OG1-CG1 3.35Å; T607-I611 WeakPolarHBondContact O-CG1 3.5Å; T607-I611 PolarHBondContact O-N 3.46Å
608	K	85.9	Confident	83	Confident	182 Å²	182	98.2 Å²	98.2	79%	0.791	50%	0.499	S	S	*	.	H	α-helix	trans	-52.3	-43.2	-175.4	-172	-178.1	177.9	-177.3	0	111.9	T612	K608-T612 WeakPolarHBondContact O-CB 3.27Å; K608-T612 PolarHBondContact O-N 2.88Å; K608-T612 PolarHBondContact O-OG1 3.24Å
609	S	85.5	Confident	83.4	Confident	72 Å²	72	98.8 Å²	98.8	50%	0.503	50%	0.5	S	S	.	.	H	α-helix	trans	-59	-52	178.2	49.5	0	0	0	0	112.3	T607 I611 T612 D613	T607-S609 PolarHBondContact O-N 3.06Å; S609-I611 PolarHBondContact O-N 3.21Å; S609-T612 PolarHBondContact O-N 3.38Å; S609-T612 VanDerWaalsContact O-N 3.14Å; S609-D613 WeakPolarHBondContact O-CB 3.36Å; S609-D613 VanDerWaalsContact O-CG 3.23Å; S609-D613 PolarHBondContact O-N 2.99Å
610	I	83.1	Confident	83.7	Confident	48 Å²	48	98.7 Å²	98.7	25%	0.246	50%	0.5	C	S	.	.	H	α-helix	trans	-63.4	-42.8	-178	-61.7	-177.5	0	0	0	111.1	R604 T607 T612 D613 K614	R604-I610 WeakPolarHBondContact O-CD1 3.36Å; T607-I610 PolarHBondContact O-N 2.52Å; T607-I610 VanDerWaalsContact O-N 3.11Å; T607-I610 VanDerWaalsContact OG1-CD1 3.26Å; T607-I610 WeakPolarHBondContact OG1-CD1 3.49Å; T607-I610 VanDerWaalsContact OG1-CG1 3.27Å; T607-I610 WeakPolarHBondContact OG1-CG1 3.35Å; I610-T612 VanDerWaalsContact C-N 3.33Å; I610-T612 PolarHBondContact O-N 3.27Å; I610-D613 PolarHBondContact O-N 3.09Å; I610-K614 HydrophobicContact CG2-CG 4.32Å; I610-K614 WeakPolarHBondContact O-CB 3.37Å; I610-K614 VanDerWaalsContact O-CG 3.27Å; I610-K614 WeakPolarHBondContact O-CG 3.31Å; I610-K614 PolarHBondContact O-N 2.88Å
611	I	84.6	Confident	83.9	Confident	84 Å²	84	96.7 Å²	96.7	43%	0.431	49%	0.489	S	S	.	.	H	α-helix	trans	-60.7	-46.2	175.5	-63.7	174.1	0	0	0	110	C606 T607 S609 D613 K614 V615	C606-I611 HydrophobicContact CB-CD1 4.31Å; C606-I611 WeakPolarHBondContact O-CD1 3.43Å; T607-I611 WeakPolarHBondContact O-CG1 3.5Å; T607-I611 PolarHBondContact O-N 3.46Å; S609-I611 PolarHBondContact O-N 3.21Å; I611-D613 PolarHBondContact O-N 2.88Å; I611-K614 PolarHBondContact O-N 3.35Å; I611-V615 HydrophobicContact CG2-CG2 4.33Å; I611-V615 WeakPolarHBondContact O-CB 3.42Å; I611-V615 VanDerWaalsContact O-CG2 3.23Å; I611-V615 WeakPolarHBondContact O-CG2 3.4Å; I611-V615 PolarHBondContact O-N 3.48Å
612	T	82.8	Confident	83.9	Confident	65 Å²	65	97.6 Å²	97.6	40%	0.399	49%	0.493	S	S	.	.	H	α-helix	trans	-63.5	-42.9	-179.2	-42.5	0	0	0	0	111	K608 S609 I610 V615 L616	K608-T612 WeakPolarHBondContact O-CB 3.27Å; K608-T612 PolarHBondContact O-N 2.88Å; K608-T612 PolarHBondContact O-OG1 3.24Å; S609-T612 PolarHBondContact O-N 3.38Å; S609-T612 VanDerWaalsContact O-N 3.14Å; I610-T612 VanDerWaalsContact C-N 3.33Å; I610-T612 PolarHBondContact O-N 3.27Å; T612-V615 PolarHBondContact O-N 3.37Å; T612-L616 HydrophobicContact CG2-CD1 4.21Å; T612-L616 WeakPolarHBondContact O-CB 3.46Å; T612-L616 VanDerWaalsContact O-CG 3.26Å; T612-L616 WeakPolarHBondContact O-CG 3.41Å; T612-L616 PolarHBondContact O-N 3.22Å
613	D	85.4	Confident	83.8	Confident	101 Å²	101	98.3 Å²	98.3	54%	0.54	49%	0.494	S	S	.	.	H	α-helix	trans	-65.2	-42.6	179.7	-69.1	-23.6	0	0	0	112.2	S609 I610 I611 L616 L617	S609-D613 WeakPolarHBondContact O-CB 3.36Å; S609-D613 VanDerWaalsContact O-CG 3.23Å; S609-D613 PolarHBondContact O-N 2.99Å; I610-D613 PolarHBondContact O-N 3.09Å; I611-D613 PolarHBondContact O-N 2.88Å; D613-L616 PolarHBondContact O-N 3.24Å; D613-L617 WeakPolarHBondContact O-CB 3.38Å; D613-L617 PolarHBondContact O-N 3.26Å
614	K	84.2	Confident	83.6	Confident	97 Å²	97	97 Å²	97	42%	0.422	49%	0.49	S	S	.	.	H	α-helix	trans	-69.9	-36.2	177.7	-64.4	-74.5	-176.9	-178.5	0	111.6	I610 I611 L617 M618 E654	I610-K614 HydrophobicContact CG2-CG 4.32Å; I610-K614 WeakPolarHBondContact O-CB 3.37Å; I610-K614 VanDerWaalsContact O-CG 3.27Å; I610-K614 WeakPolarHBondContact O-CG 3.31Å; I610-K614 PolarHBondContact O-N 2.88Å; I611-K614 PolarHBondContact O-N 3.35Å; K614-L617 PolarHBondContact O-N 3.36Å; K614-M618 VanDerWaalsContact O-CG 3.25Å; K614-M618 WeakPolarHBondContact O-CG 3.41Å; K614-M618 PolarHBondContact O-N 3.33Å; K614-E654 IonicContact NZ-OE2 3.93Å; K614-E654 PolarHBondContact NZ-OE2 2.68Å
615	V	85	Confident	83.1	Confident	75 Å²	75	96.2 Å²	96.2	46%	0.455	49%	0.488	S	S	.	.	H	α-helix	trans	-65.1	-46.1	173.8	170.5	0	0	0	0	111	I611 T612 L617 M618 E619	I611-V615 HydrophobicContact CG2-CG2 4.33Å; I611-V615 WeakPolarHBondContact O-CB 3.42Å; I611-V615 VanDerWaalsContact O-CG2 3.23Å; I611-V615 WeakPolarHBondContact O-CG2 3.4Å; I611-V615 PolarHBondContact O-N 3.48Å; T612-V615 PolarHBondContact O-N 3.37Å; V615-L617 VanDerWaalsContact C-N 3.28Å; V615-L617 PolarHBondContact O-N 3.44Å; V615-M618 WeakPolarHBondContact O-CB 3.43Å; V615-M618 PolarHBondContact O-N 2.99Å; V615-E619 PolarHBondContact O-N 2.96Å
616	L	85.4	Confident	82.8	Confident	82 Å²	82	97 Å²	97	43%	0.429	49%	0.489	S	S	.	.	H	α-helix	trans	-63	-35.1	175.8	-72.1	169.7	0	0	0	112.4	T612 D613 K620	T612-L616 HydrophobicContact CG2-CD1 4.21Å; T612-L616 WeakPolarHBondContact O-CB 3.46Å; T612-L616 VanDerWaalsContact O-CG 3.26Å; T612-L616 WeakPolarHBondContact O-CG 3.41Å; T612-L616 PolarHBondContact O-N 3.22Å; D613-L616 PolarHBondContact O-N 3.24Å; L616-K620 WeakPolarHBondContact O-CG 3.31Å; L616-K620 PolarHBondContact O-N 3.05Å
617	L	86.4	Confident	82.3	Confident	93 Å²	93	98.7 Å²	98.7	49%	0.487	49%	0.489	S	S	.	.	H	α-helix	trans	-66.5	-43.2	174.7	-172.8	72.4	0	0	0	111.4	D613 K614 V615 K620 L621	D613-L617 WeakPolarHBondContact O-CB 3.38Å; D613-L617 PolarHBondContact O-N 3.26Å; K614-L617 PolarHBondContact O-N 3.36Å; V615-L617 VanDerWaalsContact C-N 3.28Å; V615-L617 PolarHBondContact O-N 3.44Å; L617-K620 PolarHBondContact O-N 3.32Å; L617-L621 HydrophobicContact CG-CD1 4.32Å; L617-L621 WeakPolarHBondContact O-CG 3.21Å; L617-L621 PolarHBondContact O-N 3.14Å
618	M	83.8	Confident	81.2	Confident	129 Å²	129	100.5 Å²	100.5	64%	0.635	49%	0.493	S	S	*	.	H	α-helix	trans	-60.1	-45.4	174.6	-73.7	-86.3	-70.1	0	0	111.1	K614 V615 K620 L621 E622	K614-M618 VanDerWaalsContact O-CG 3.25Å; K614-M618 WeakPolarHBondContact O-CG 3.41Å; K614-M618 PolarHBondContact O-N 3.33Å; V615-M618 WeakPolarHBondContact O-CB 3.43Å; V615-M618 PolarHBondContact O-N 2.99Å; M618-K620 VanDerWaalsContact C-N 3.33Å; M618-K620 PolarHBondContact O-N 3.24Å; M618-L621 PolarHBondContact O-N 3.29Å; M618-E622 WeakPolarHBondContact O-CB 3.45Å; M618-E622 PolarHBondContact O-N 3.23Å
619	E	84.4	Confident	80	Confident	106 Å²	106	101.4 Å²	101.4	50%	0.495	49%	0.492	S	S	.	.	H	α-helix	trans	-61	-39.8	175.5	-73.3	179.4	167.8	0	0	112.5	V615 N623	V615-E619 PolarHBondContact O-N 2.96Å; E619-N623 WeakPolarHBondContact O-CB 3.46Å; E619-N623 VanDerWaalsContact O-CG 3.29Å; E619-N623 PolarHBondContact O-N 2.98Å; E619-N623 PolarHBondContact O-ND2 3.25Å
620	K	84.2	Confident	78.9	Confident	139 Å²	139	105.5 Å²	105.5	60%	0.604	50%	0.501	S	S	*	.	H	α-helix	trans	-64.9	-42.8	174.8	-78.5	177	-179.7	176.4	0	112.3	L616 L617 M618 N623 M624	L616-K620 WeakPolarHBondContact O-CG 3.31Å; L616-K620 PolarHBondContact O-N 3.05Å; L617-K620 PolarHBondContact O-N 3.32Å; M618-K620 VanDerWaalsContact C-N 3.33Å; M618-K620 PolarHBondContact O-N 3.24Å; K620-N623 PolarHBondContact O-N 3.36Å; K620-M624 WeakPolarHBondContact O-CG 3.36Å; K620-M624 PolarHBondContact O-N 3.16Å
621	L	82.1	Confident	77.6	Confident	62 Å²	62	111.8 Å²	111.8	33%	0.325	52%	0.522	S	S	.	.	H	α-helix	trans	-65.6	-41.3	177.7	-74.3	169.9	0	0	0	111.6	L617 M618 N623 M624 Y625	L617-L621 HydrophobicContact CG-CD1 4.32Å; L617-L621 WeakPolarHBondContact O-CG 3.21Å; L617-L621 PolarHBondContact O-N 3.14Å; M618-L621 PolarHBondContact O-N 3.29Å; L621-N623 VanDerWaalsContact C-N 3.33Å; L621-N623 PolarHBondContact O-N 3.19Å; L621-M624 PolarHBondContact O-N 2.86Å; L621-Y625 PolarHBondContact O-N 2.99Å
622	E	81.8	Confident	76.1	Confident	114 Å²	114	114.5 Å²	114.5	53%	0.533	54%	0.537	S	S	.	.	H	α-helix	trans	-59	-45.5	174.4	-165.1	77.5	-142.4	0	0	110.8	M618 M624 Y625 Q626	M618-E622 WeakPolarHBondContact O-CB 3.45Å; M618-E622 PolarHBondContact O-N 3.23Å; E622-M624 PolarHBondContact O-N 3.34Å; E622-Y625 PolarHBondContact O-N 3.37Å; E622-Q626 WeakPolarHBondContact O-CG 3.48Å; E622-Q626 PolarHBondContact O-N 3.02Å
623	N	79.9	Confident	74.7	Confident	91 Å²	91	117 Å²	117	49%	0.487	55%	0.552	S	S	.	*	H	α-helix	trans	-62.9	-41	176.4	-76.7	-39.2	0	0	0	112.7	E619 K620 L621 Q626 Q627	E619-N623 WeakPolarHBondContact O-CB 3.46Å; E619-N623 VanDerWaalsContact O-CG 3.29Å; E619-N623 PolarHBondContact O-N 2.98Å; E619-N623 PolarHBondContact O-ND2 3.25Å; K620-N623 PolarHBondContact O-N 3.36Å; L621-N623 VanDerWaalsContact C-N 3.33Å; L621-N623 PolarHBondContact O-N 3.19Å; N623-Q626 PolarHBondContact O-N 3.35Å; N623-Q627 WeakPolarHBondContact O-CG 3.49Å; N623-Q627 PolarHBondContact O-N 3.43Å
624	M	78.5	Confident	73.1	Confident	106 Å²	106	118.4 Å²	118.4	52%	0.522	56%	0.56	S	S	.	*	H	α-helix	trans	-64.7	-41.9	175	-74.4	177	57.5	0	0	112	K620 L621 E622 Q627 Q628	K620-M624 WeakPolarHBondContact O-CG 3.36Å; K620-M624 PolarHBondContact O-N 3.16Å; L621-M624 PolarHBondContact O-N 2.86Å; E622-M624 PolarHBondContact O-N 3.34Å; M624-Q627 PolarHBondContact O-N 2.92Å; M624-Q628 PolarHBondContact O-N 2.97Å
625	Y	75.6	Confident	71.2	Confident	153 Å²	153	122.7 Å²	122.7	60%	0.6	58%	0.581	S	S	*	*	H	α-helix	trans	-62.2	-41.9	174.5	-102.6	-79.9	0	0	0	111.9	L621 E622 Q628 R629	L621-Y625 PolarHBondContact O-N 2.99Å; E622-Y625 PolarHBondContact O-N 3.37Å; Y625-Q628 PolarHBondContact O-N 3.13Å; Y625-R629 WeakPolarHBondContact O-CB 3.11Å; Y625-R629 PolarHBondContact O-N 2.8Å
626	Q	72.9	Confident	69.3	Low	101 Å²	101	124.6 Å²	124.6	47%	0.472	60%	0.598	S	S	.	*	H	α-helix	trans	-65.9	-37	175.3	-72.9	-170.1	12.8	0	0	112.5	E622 N623 R629 K630	E622-Q626 WeakPolarHBondContact O-CG 3.48Å; E622-Q626 PolarHBondContact O-N 3.02Å; N623-Q626 PolarHBondContact O-N 3.35Å; Q626-R629 PolarHBondContact O-N 2.97Å; Q626-K630 WeakPolarHBondContact O-CG 3.13Å; Q626-K630 PolarHBondContact O-N 2.76Å; Q626-K630 VanDerWaalsContact O-N 3.15Å
627	Q	68.3	Low	67.5	Low	115 Å²	115	132 Å²	132	54%	0.537	62%	0.62	S	S	.	*	H	α-helix	trans	-65.5	-48.4	173.1	-77.6	175.9	-10.4	0	0	111.3	N623 M624 R629 K630 Y631	N623-Q627 WeakPolarHBondContact O-CG 3.49Å; N623-Q627 PolarHBondContact O-N 3.43Å; M624-Q627 PolarHBondContact O-N 2.92Å; Q627-R629 VanDerWaalsContact C-N 3.29Å; Q627-R629 PolarHBondContact O-N 3.19Å; Q627-K630 WeakPolarHBondContact O-CA 3.37Å; Q627-K630 WeakPolarHBondContact O-CB 3.39Å; Q627-K630 PolarHBondContact O-N 3.39Å; Q627-Y631 WeakPolarHBondContact O-CD2 3.33Å; Q627-Y631 PolarHBondContact O-N 3.24Å; Q627-Y631 VanDerWaalsContact O-N 3.1Å
628	Q	64.9	Low	65.8	Low	95 Å²	95	133 Å²	133	44%	0.444	63%	0.632	S	S	.	*	H	α-helix	trans	-58.6	-39.5	174.8	-95.9	-177.1	-18.2	0	0	112.5	M624 Y625 K630 Y631 L632	M624-Q628 PolarHBondContact O-N 2.97Å; Y625-Q628 PolarHBondContact O-N 3.13Å; Q628-K630 VanDerWaalsContact C-N 3.28Å; Q628-K630 PolarHBondContact O-N 2.95Å; Q628-Y631 PolarHBondContact O-N 3.36Å; Q628-L632 PolarHBondContact O-N 3.3Å
629	R	62.2	Low	64.1	Low	201 Å²	201	134.2 Å²	134.2	76%	0.758	64%	0.641	S	S	*	*	H	α-helix	trans	-60.5	-34.4	173	-104.1	-175.5	167.5	-168.9	-2.4	113.3	Y625 Q626 Q627	Y625-R629 WeakPolarHBondContact O-CB 3.11Å; Y625-R629 PolarHBondContact O-N 2.8Å; Q626-R629 PolarHBondContact O-N 2.97Å; Q627-R629 VanDerWaalsContact C-N 3.29Å; Q627-R629 PolarHBondContact O-N 3.19Å
630	K	61.3	Low	62.3	Low	159 Å²	159	135.5 Å²	135.5	69%	0.691	66%	0.656	S	S	*	*	H	α-helix	trans	-71.7	-33.3	174.9	-73.9	176.8	178.5	178.5	0	112.3	Q626 Q627 Q628	Q626-K630 WeakPolarHBondContact O-CG 3.13Å; Q626-K630 PolarHBondContact O-N 2.76Å; Q626-K630 VanDerWaalsContact O-N 3.15Å; Q627-K630 WeakPolarHBondContact O-CA 3.37Å; Q627-K630 WeakPolarHBondContact O-CB 3.39Å; Q627-K630 PolarHBondContact O-N 3.39Å; Q628-K630 VanDerWaalsContact C-N 3.28Å; Q628-K630 PolarHBondContact O-N 2.95Å
631	Y	57	Low	60.5	Low	180 Å²	180	135.4 Å²	135.4	71%	0.706	67%	0.668	S	S	*	*	H	α-helix	trans	-78.4	-32.1	176.5	-70.9	-72.5	0	0	0	113.3	Q627 Q628 V633 N634	Q627-Y631 WeakPolarHBondContact O-CD2 3.33Å; Q627-Y631 PolarHBondContact O-N 3.24Å; Q627-Y631 VanDerWaalsContact O-N 3.1Å; Q628-Y631 PolarHBondContact O-N 3.36Å; Y631-V633 PolarHBondContact O-N 3.11Å; Y631-N634 CarbonylContact O-C 3.48Å; Y631-N634 PolarHBondContact O-N 3.46Å
632	L	52.4	Low	59.2	Low	140 Å²	140	134.9 Å²	134.9	73%	0.733	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.5	-7.1	176.8	-98.8	137.2	0	0	0	115.1	Q628	Q628-L632 PolarHBondContact O-N 3.3Å
633	V	53.5	Low	57.7	Low	119 Å²	119	134 Å²	134	72%	0.721	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.7	-17.5	169.7	176.7	0	0	0	0	111.4	Y631	Y631-V633 PolarHBondContact O-N 3.11Å
634	N	51	Low	56.2	Low	130 Å²	130	132.8 Å²	132.8	70%	0.695	66%	0.664	S	S	*	*	S	Bend	trans	-121.9	101.3	177.1	-80.5	-6.4	0	0	0	110.7	Y631	Y631-N634 CarbonylContact O-C 3.48Å; Y631-N634 PolarHBondContact O-N 3.46Å
635	E	43.8	Very low	54.7	Low	187 Å²	187	134.1 Å²	134.1	87%	0.874	67%	0.67	S	S	*	*			trans	87.3	142	162.5	-58.3	-172	159	0	0	119.9
636	S	46.2	Very low	53.6	Low	115 Å²	115	131.8 Å²	131.8	80%	0.804	67%	0.667	S	S	*	*			trans	-61.6	151.6	-170.2	-6.3	0	0	0	0	115.2
637	R	46.9	Very low	52.5	Low	238 Å²	238	131.2 Å²	131.2	90%	0.898	67%	0.667	S	S	*	*			trans	-29.8	143.1	172.5	-79.4	-177.5	173.3	-179.3	-2.2	115
638	P	50.3	Low	51.4	Low	114 Å²	114	131.8 Å²	131.8	74%	0.74	67%	0.669	S	S	*	*				-136.4	171.6	98.7	29.3	-11.9	0	0	0	115.5
639	D	49.3	Very low	50.7	Low	154 Å²	154	134 Å²	134	82%	0.824	68%	0.679	S	S	*	*			trans	-39.8	122.1	-174.2	-60.9	-51.3	0	0	0	116.9
640	T	45.4	Very low	50.2	Low	132 Å²	132	133.9 Å²	133.9	81%	0.81	68%	0.679	S	S	*	*			trans	-148.7	97.6	152.5	31.9	0	0	0	0	110.1
641	T	46.5	Very low	49.5	Very low	138 Å²	138	135.5 Å²	135.5	85%	0.847	68%	0.682	S	S	*	*			trans	-69	148.1	153.2	11.4	0	0	0	0	109.1
642	P	54.8	Low	48.7	Very low	51 Å²	51	132.9 Å²	132.9	33%	0.331	68%	0.68	S	S	.	*				-129.3	156.2	-84.5	33	-17.8	0	0	0	112.4	S644 Q645	P642-S644 WeakPolarHBondContact CB-OG 3.25Å; P642-S644 WeakPolarHBondContact CG-OG 3.34Å; P642-S644 PolarHBondContact O-N 3.07Å; P642-Q645 PolarHBondContact O-N 3.43Å
643	I	51.9	Low	48.1	Very low	94 Å²	94	130.3 Å²	130.3	48%	0.482	67%	0.674	S	S	.	*	H	α-helix	trans	-50.6	-17.7	170.4	-68.7	165.8	0	0	0	112.5	Q645 L646 L647	I643-Q645 PolarHBondContact O-N 3.07Å; I643-L646 PolarHBondContact O-N 2.96Å; I643-L647 HydrophobicContact CG2-CD1 3.98Å; I643-L647 HydrophobicContact CG2-CG 4.15Å; I643-L647 WeakPolarHBondContact O-CB 3.49Å; I643-L647 WeakPolarHBondContact O-CG 3.36Å; I643-L647 PolarHBondContact O-N 2.88Å
644	S	48.7	Very low	47.4	Very low	66 Å²	66	135.3 Å²	135.3	46%	0.462	69%	0.69	S	S	.	*	H	α-helix	trans	-51.1	-38.5	167.2	-26.3	0	0	0	0	113.5	P642 L647 Q648	P642-S644 WeakPolarHBondContact CB-OG 3.25Å; P642-S644 WeakPolarHBondContact CG-OG 3.34Å; P642-S644 PolarHBondContact O-N 3.07Å; S644-L647 PolarHBondContact O-N 2.94Å; S644-Q648 WeakPolarHBondContact O-CB 3.37Å; S644-Q648 PolarHBondContact O-N 3.26Å
645	Q	46.8	Very low	47.2	Very low	135 Å²	135	135.6 Å²	135.6	63%	0.631	69%	0.69	S	S	*	*	H	α-helix	trans	-71.3	-38.6	178	-76.9	-177.7	-26.5	0	0	112.2	P642 I643 Q648 E649	P642-Q645 PolarHBondContact O-N 3.43Å; I643-Q645 PolarHBondContact O-N 3.07Å; Q645-Q648 PolarHBondContact O-N 3.04Å; Q645-E649 WeakPolarHBondContact O-CG 3.45Å; Q645-E649 PolarHBondContact O-N 3.04Å
646	L	50.8	Low	47.4	Very low	103 Å²	103	132.9 Å²	132.9	54%	0.539	68%	0.68	S	S	.	*	H	α-helix	trans	-69.7	-32.8	174.1	-84.1	162.2	0	0	0	112.8	I643 R650	I643-L646 PolarHBondContact O-N 2.96Å; L646-R650 PolarHBondContact O-N 3.08Å
647	L	50	Low	47.5	Very low	90 Å²	90	133.9 Å²	133.9	47%	0.471	67%	0.673	S	S	.	*	H	α-helix	trans	-68.8	-38.6	172.5	-76.6	166.4	0	0	0	111	I643 S644 Y651	I643-L647 HydrophobicContact CG2-CD1 3.98Å; I643-L647 HydrophobicContact CG2-CG 4.15Å; I643-L647 WeakPolarHBondContact O-CB 3.49Å; I643-L647 WeakPolarHBondContact O-CG 3.36Å; I643-L647 PolarHBondContact O-N 2.88Å; S644-L647 PolarHBondContact O-N 2.94Å; L647-Y651 WeakPolarHBondContact O-CB 3.29Å; L647-Y651 PolarHBondContact O-N 3.5Å
648	Q	47	Very low	47.5	Very low	127 Å²	127	127.8 Å²	127.8	59%	0.593	66%	0.66	S	S	*	*	H	α-helix	trans	-75.4	-37.6	-178.9	-149.5	132.6	10.3	0	0	112.7	S644 Q645 R650 N652	S644-Q648 WeakPolarHBondContact O-CB 3.37Å; S644-Q648 PolarHBondContact O-N 3.26Å; Q645-Q648 PolarHBondContact O-N 3.04Å; Q648-R650 VanDerWaalsContact C-N 3.34Å; Q648-R650 PolarHBondContact O-N 3.43Å; Q648-N652 WeakPolarHBondContact O-CB 3.49Å; Q648-N652 PolarHBondContact O-N 2.87Å; Q648-N652 PolarHBondContact O-ND2 3.24Å
649	E	48.3	Very low	47.3	Very low	140 Å²	140	128.6 Å²	128.6	65%	0.654	66%	0.655	S	S	*	*	H	α-helix	trans	-67.6	-31.4	174.9	-77.2	-179.3	168.1	0	0	112.9	Q645 S653	Q645-E649 WeakPolarHBondContact O-CG 3.45Å; Q645-E649 PolarHBondContact O-N 3.04Å; E649-S653 PolarHBondContact O-OG 3.23Å
650	R	52.6	Low	47.2	Very low	199 Å²	199	126.9 Å²	126.9	75%	0.751	64%	0.643	S	S	*	*	H	α-helix	trans	-89.4	-18.9	177.5	-71.5	-164.9	-167.3	-170.1	5.5	115.1	L646 Q648 S653	L646-R650 PolarHBondContact O-N 3.08Å; Q648-R650 VanDerWaalsContact C-N 3.34Å; Q648-R650 PolarHBondContact O-N 3.43Å; R650-S653 PolarHBondContact O-OG 2.91Å
651	Y	46.8	Very low	47.3	Very low	193 Å²	193	126.6 Å²	126.6	76%	0.757	63%	0.632	S	S	*	*	H	α-helix	trans	-81.3	-24.7	172.1	-134.3	-90.4	0	0	0	112.2	L647	L647-Y651 WeakPolarHBondContact O-CB 3.29Å; L647-Y651 PolarHBondContact O-N 3.5Å
652	N	40.5	Very low	47.4	Very low	125 Å²	125	125.7 Å²	125.7	67%	0.668	62%	0.615	S	S	*	*	S	Bend	trans	-90.2	1	-178	-71.7	-14.7	0	0	0	114.4	Q648	Q648-N652 WeakPolarHBondContact O-CB 3.49Å; Q648-N652 PolarHBondContact O-N 2.87Å; Q648-N652 PolarHBondContact O-ND2 3.24Å
653	S	40.1	Very low	46.8	Very low	87 Å²	87	131.9 Å²	131.9	61%	0.608	64%	0.639	S	S	*	*			trans	-103	34.9	-178.2	52.3	0	0	0	0	114.1	E649 R650	E649-S653 PolarHBondContact O-OG 3.23Å; R650-S653 PolarHBondContact O-OG 2.91Å
654	E	38	Very low	46.3	Very low	224 Å²	224	135.4 Å²	135.4	100%	1.047	65%	0.653	S	S	*	*			trans	-133.2	0	167.3	-75.4	-169.7	140.2	0	0	112.5	K614	K614-E654 IonicContact NZ-OE2 3.93Å; K614-E654 PolarHBondContact NZ-OE2 2.68Å

Retrieved 654 of 654 residues in 438.5 ms (Link to these results)

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