A0A077ZC74_TRITR Loading...

DNA primase large subunit

AlphaFold DB , UniProt , Accession A0A077ZC74, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 528 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36.9	Very low	33.2	Very low	230 Å²	230	139.1 Å²	139.1	100%	1.133	80%	0.799	S	S	*	*				0	103.5	0	-75.3	179.4	-179.9	0	0	105.2	I3	M1-I3 PolarHBondContact O-N 3.19Å; M1-I3 VanDerWaalsContact O-N 3.12Å
2	D	32.5	Very low	32.7	Very low	159 Å²	159	137.7 Å²	137.7	85%	0.85	79%	0.787	S	S	*	*			trans	-65.1	109.6	-179.4	-73.7	-42.6	0	0	0	109.2	T4	D2-T4 VanDerWaalsContact C-N 3.29Å; D2-T4 PolarHBondContact O-N 3.05Å
3	I	34.3	Very low	33	Very low	153 Å²	153	132.2 Å²	132.2	79%	0.785	77%	0.769	S	S	*	*			trans	-90.6	75.3	172.6	-54.1	174.7	0	0	0	106.2	M1	M1-I3 PolarHBondContact O-N 3.19Å; M1-I3 VanDerWaalsContact O-N 3.12Å
4	T	33.1	Very low	32.8	Very low	125 Å²	125	130.3 Å²	130.3	77%	0.767	77%	0.766	S	S	*	*			trans	-117	49.9	167	51.3	0	0	0	0	109.4	D2 G6	D2-T4 VanDerWaalsContact C-N 3.29Å; D2-T4 PolarHBondContact O-N 3.05Å; T4-G6 PolarHBondContact O-N 2.83Å
5	S	35.1	Very low	32.5	Very low	99 Å²	99	132.9 Å²	132.9	69%	0.692	77%	0.771	S	S	*	*			trans	-77	95.9	156.8	56.4	0	0	0	0	107	L7	S5-L7 PolarHBondContact O-N 3.44Å; S5-L7 VanDerWaalsContact O-N 3.12Å
6	G	32.5	Very low	32.9	Very low	72 Å²	72	127.4 Å²	127.4	74%	0.742	74%	0.74	S	S	*	*			trans	-52.5	115.7	176.4	0	0	0	0	0	110.8	T4	T4-G6 PolarHBondContact O-N 2.83Å
7	L	27.2	Very low	32.8	Very low	163 Å²	163	130.1 Å²	130.1	85%	0.853	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-64.4	126.3	160.1	-88.6	132.7	0	0	0	107.4	S5 S9	S5-L7 PolarHBondContact O-N 3.44Å; S5-L7 VanDerWaalsContact O-N 3.12Å; L7-S9 PolarHBondContact O-N 2.69Å; L7-S9 VanDerWaalsContact O-N 3.12Å
8	P	29	Very low	32.9	Very low	120 Å²	120	133.3 Å²	133.3	78%	0.779	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-64.4	117.8	174.5	-7.7	21	0	0	0	107.7	S10	P8-S10 PolarHBondContact O-N 3.28Å
9	S	30.6	Very low	33.3	Very low	91 Å²	91	131 Å²	131	64%	0.636	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-59.2	127.3	168.6	57.3	0	0	0	0	108.2	L7 R11	L7-S9 PolarHBondContact O-N 2.69Å; L7-S9 VanDerWaalsContact O-N 3.12Å; S9-R11 PolarHBondContact O-N 3.5Å
10	S	37.3	Very low	33.6	Very low	108 Å²	108	129.6 Å²	129.6	76%	0.755	74%	0.738	S	S	*	*	S	Bend	trans	-50	123.2	178.9	58.3	0	0	0	0	111	P8	P8-S10 PolarHBondContact O-N 3.28Å
11	R	36.5	Very low	34	Very low	210 Å²	210	130.6 Å²	130.6	79%	0.792	74%	0.737	S	S	*	*			trans	84	54.8	165.2	-51.7	177.6	173.8	-178.8	-0.7	117.2	S9 A13	S9-R11 PolarHBondContact O-N 3.5Å; R11-A13 PolarHBondContact O-N 3.37Å
12	D	27.6	Very low	34	Very low	122 Å²	122	126.6 Å²	126.6	65%	0.652	71%	0.709	S	S	*	*			trans	-75.1	112.2	152.9	-100.9	-32.7	0	0	0	110.2	S14	D12-S14 PolarHBondContact O-N 2.84Å
13	A	36	Very low	34.2	Very low	67 Å²	67	122.1 Å²	122.1	55%	0.554	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.2	6.5	-175	0	0	0	0	0	114.4	R11	R11-A13 PolarHBondContact O-N 3.37Å
14	S	31.3	Very low	34.7	Very low	105 Å²	105	117.8 Å²	117.8	73%	0.734	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.5	-16.4	-176.5	57.4	0	0	0	0	114.7	D12 V16	D12-S14 PolarHBondContact O-N 2.84Å; S14-V16 VanDerWaalsContact C-N 3.32Å; S14-V16 PolarHBondContact O-N 3.38Å
15	M	28.5	Very low	35.4	Very low	169 Å²	169	115.3 Å²	115.3	83%	0.833	66%	0.66	S	S	*	*	S	Bend	trans	-90.3	16.8	178.2	-72.6	-171.4	74.8	0	0	114.1
16	V	37.4	Very low	36.1	Very low	46 Å²	46	113.2 Å²	113.2	28%	0.279	64%	0.641	S	S	.	*			trans	-90.4	-7	-161.4	-177.3	0	0	0	0	114.7	S14 F40	S14-V16 VanDerWaalsContact C-N 3.32Å; S14-V16 PolarHBondContact O-N 3.38Å; V16-F40 HydrophobicContact CG1-CE1 4.11Å; V16-F40 HydrophobicContact CG1-CZ 4.38Å
17	L	32.6	Very low	36.9	Very low	172 Å²	172	115.1 Å²	115.1	90%	0.901	63%	0.63	S	S	*	*	S	Bend	trans	-107.8	3.8	-170.4	-69.4	175.8	0	0	0	117.1
18	E	34.2	Very low	38.7	Very low	188 Å²	188	110.6 Å²	110.6	88%	0.879	61%	0.61	S	S	*	*	S	Bend	trans	-114.4	6.2	-173.8	-67.3	-172	169.7	0	0	115.8	P20	E18-P20 WeakPolarHBondContact O-CD 3.35Å
19	D	40.6	Very low	40.5	Very low	90 Å²	90	107.1 Å²	107.1	48%	0.481	59%	0.591	S	S	.	*			trans	-109.9	103.9	-176.6	-159.3	-10.6	0	0	0	113.1	E21 R22 S23	D19-E21 VanDerWaalsContact C-N 3.3Å; D19-E21 PolarHBondContact O-N 3.36Å; D19-E21 PolarHBondContact OD1-N 2.91Å; D19-R22 HydrophobicContact CB-CB 4.1Å; D19-R22 WeakPolarHBondContact O-CB 3.46Å; D19-R22 PolarHBondContact O-N 2.91Å; D19-R22 VanDerWaalsContact O-N 3.09Å; D19-S23 PolarHBondContact O-N 3.1Å
20	P	39.7	Very low	42.3	Very low	102 Å²	102	104.2 Å²	104.2	66%	0.662	57%	0.566	S	S	*	*	H	α-helix	trans	-65.9	-27.9	-177.3	23.5	-30.9	0	0	0	113.5	E18 R22 S23 S24	E18-P20 WeakPolarHBondContact O-CD 3.35Å; P20-R22 PolarHBondContact O-N 3.48Å; P20-S23 PolarHBondContact O-N 2.92Å; P20-S24 PolarHBondContact O-N 3.47Å
21	E	40.6	Very low	44.2	Very low	152 Å²	152	102.8 Å²	102.8	71%	0.71	55%	0.548	S	S	*	.	H	α-helix	trans	-63.3	-36.7	173.2	-72.4	-172.6	173.1	0	0	110.5	D19 S24 C25	D19-E21 VanDerWaalsContact C-N 3.3Å; D19-E21 PolarHBondContact O-N 3.36Å; D19-E21 PolarHBondContact OD1-N 2.91Å; E21-S24 PolarHBondContact O-N 2.96Å; E21-S24 PolarHBondContact O-OG 2.94Å; E21-C25 PolarHBondContact O-N 3.44Å; E21-C25 PolarHBondContact O-SG 3.08Å
22	R	37.9	Very low	46.2	Very low	146 Å²	146	98 Å²	98	55%	0.551	54%	0.535	S	S	*	.	H	α-helix	trans	-73.6	-31.5	177.8	-136	175.7	-170.9	-176.3	4	112.9	D19 P20 S24 C25 I26	D19-R22 HydrophobicContact CB-CB 4.1Å; D19-R22 WeakPolarHBondContact O-CB 3.46Å; D19-R22 PolarHBondContact O-N 2.91Å; D19-R22 VanDerWaalsContact O-N 3.09Å; P20-R22 PolarHBondContact O-N 3.48Å; R22-S24 VanDerWaalsContact C-N 3.34Å; R22-C25 WeakPolarHBondContact O-CB 3.08Å; R22-C25 PolarHBondContact O-N 2.8Å; R22-I26 VanDerWaalsContact O-CG1 3.32Å; R22-I26 WeakPolarHBondContact O-CG1 3.29Å; R22-I26 PolarHBondContact O-N 2.76Å
23	S	37.2	Very low	49	Very low	64 Å²	64	92.6 Å²	92.6	45%	0.448	51%	0.506	S	S	.	.	H	α-helix	trans	-60.9	-43.2	172.7	-153	0	0	0	0	111.4	D19 P20 C25 I26 E27	D19-S23 PolarHBondContact O-N 3.1Å; P20-S23 PolarHBondContact O-N 2.92Å; S23-C25 VanDerWaalsContact C-N 3.31Å; S23-C25 PolarHBondContact O-N 3.08Å; S23-I26 PolarHBondContact O-N 3.28Å; S23-E27 PolarHBondContact O-N 3.17Å
24	S	44.2	Very low	51.4	Low	63 Å²	63	89.8 Å²	89.8	44%	0.441	48%	0.482	S	S	.	.	H	α-helix	trans	-66.3	-31.2	174.3	78.2	0	0	0	0	113.3	P20 E21 R22 T28	P20-S24 PolarHBondContact O-N 3.47Å; E21-S24 PolarHBondContact O-N 2.96Å; E21-S24 PolarHBondContact O-OG 2.94Å; R22-S24 VanDerWaalsContact C-N 3.34Å; S24-T28 PolarHBondContact O-N 2.93Å; S24-T28 PolarHBondContact O-OG1 3.3Å
25	C	47.8	Very low	54.2	Low	72 Å²	72	84.9 Å²	84.9	49%	0.486	45%	0.447	S	S	.	.	H	α-helix	trans	-70.6	-32	173.7	-65.1	0	0	0	0	112.6	E21 R22 S23 T28 A29	E21-C25 PolarHBondContact O-N 3.44Å; E21-C25 PolarHBondContact O-SG 3.08Å; R22-C25 WeakPolarHBondContact O-CB 3.08Å; R22-C25 PolarHBondContact O-N 2.8Å; S23-C25 VanDerWaalsContact C-N 3.31Å; S23-C25 PolarHBondContact O-N 3.08Å; C25-T28 PolarHBondContact O-OG1 3.03Å; C25-A29 WeakPolarHBondContact O-CB 2.88Å; C25-A29 PolarHBondContact O-N 3.48Å
26	I	48.6	Very low	57.2	Low	56 Å²	56	77.6 Å²	77.6	29%	0.287	41%	0.411	S	S	.	.	H	α-helix	trans	-70	-43.8	176.8	-67.8	163.2	0	0	0	110.4	R22 S23 T28 A29 F40	R22-I26 VanDerWaalsContact O-CG1 3.32Å; R22-I26 WeakPolarHBondContact O-CG1 3.29Å; R22-I26 PolarHBondContact O-N 2.76Å; S23-I26 PolarHBondContact O-N 3.28Å; I26-T28 PolarHBondContact O-N 3.03Å; I26-A29 PolarHBondContact O-N 2.83Å; I26-F40 HydrophobicContact CD1-CD2 4.34Å; I26-F40 HydrophobicContact CG1-CD2 4.18Å; I26-F40 HydrophobicContact CG2-CB 4.3Å
27	E	50	Low	59.9	Low	112 Å²	112	75.4 Å²	75.4	52%	0.523	40%	0.398	S	S	.	.	H	α-helix	trans	-60.2	-32.7	177.5	-79	-176.3	169.7	0	0	112.8	S23 W30 M31	S23-E27 PolarHBondContact O-N 3.17Å; E27-W30 VanDerWaalsContact O-CD1 3.32Å; E27-W30 PolarHBondContact O-NE1 3.33Å; E27-M31 WeakPolarHBondContact O-CG 3.48Å
28	T	64.9	Low	62.8	Low	68 Å²	68	67.5 Å²	67.5	42%	0.417	36%	0.356	S	S	.	.	H	α-helix	trans	-88.4	-28.5	-176.3	48.6	0	0	0	0	113.7	S24 C25 I26 W30 M31 Q32	S24-T28 PolarHBondContact O-N 2.93Å; S24-T28 PolarHBondContact O-OG1 3.3Å; C25-T28 PolarHBondContact O-OG1 3.03Å; I26-T28 PolarHBondContact O-N 3.03Å; T28-W30 PolarHBondContact O-N 3.46Å; T28-M31 PolarHBondContact O-N 2.86Å; T28-Q32 WeakPolarHBondContact O-CG 3.24Å
29	A	66.1	Low	65.5	Low	47 Å²	47	62.3 Å²	62.3	39%	0.388	33%	0.328	S	S	.	.	H	α-helix	trans	-65	-43.2	-172.9	0	0	0	0	0	113.6	C25 I26 M31 Q32	C25-A29 WeakPolarHBondContact O-CB 2.88Å; C25-A29 PolarHBondContact O-N 3.48Å; I26-A29 PolarHBondContact O-N 2.83Å; A29-M31 PolarHBondContact O-N 3.07Å; A29-Q32 PolarHBondContact O-N 3.47Å
30	W	70.3	Confident	67.8	Low	29 Å²	29	62.9 Å²	62.9	11%	0.11	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-23.3	-180	69.5	-92.2	0	0	0	112.8	E27 T28 Q32 Q36 L42 V110 R113 R114 V117	E27-W30 VanDerWaalsContact O-CD1 3.32Å; E27-W30 PolarHBondContact O-NE1 3.33Å; T28-W30 PolarHBondContact O-N 3.46Å; W30-Q32 VanDerWaalsContact C-N 3.32Å; W30-Q32 PolarHBondContact O-N 2.79Å; W30-Q36 PolarHBondContact O-NE2 3.48Å; W30-Q36 VanDerWaalsContact O-NE2 3.14Å; W30-L42 HydrophobicContact CB-CD2 4.38Å; W30-L42 HydrophobicContact CD2-CD2 3.84Å; W30-L42 HydrophobicContact CG-CD2 3.6Å; W30-L42 HydrophobicContact CZ2-CD1 4.38Å; W30-V110 HydrophobicContact CH2-CG1 4.03Å; W30-V110 HydrophobicContact CZ3-CG1 4.15Å; W30-R113 HydrophobicContact CE3-CB 4Å; W30-R113 HydrophobicContact CZ3-CB 4.05Å; W30-R114 HydrophobicContact CH2-CB 3.64Å; W30-R114 HydrophobicContact CH2-CG 4.01Å; W30-R114 VanDerWaalsContact CZ3-CA 3.48Å; W30-R114 HydrophobicContact CZ3-CB 3.57Å; W30-R114 HydrophobicContact CZ3-CG 4.36Å; W30-R114 VanDerWaalsContact CZ3-N 3.35Å; W30-V117 HydrophobicContact CB-CG2 4.02Å
31	M	75.3	Confident	70.2	Confident	78 Å²	78	61.7 Å²	61.7	38%	0.384	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-16.6	179.3	-63.9	-174.8	179.3	0	0	113.1	E27 T28 A29 R113	E27-M31 WeakPolarHBondContact O-CG 3.48Å; T28-M31 PolarHBondContact O-N 2.86Å; A29-M31 PolarHBondContact O-N 3.07Å; M31-R113 PolarHBondContact O-NH1 3.45Å
32	Q	78.8	Confident	72.4	Confident	109 Å²	109	55.9 Å²	55.9	51%	0.509	29%	0.292	S	S	.	.	S	Bend	trans	-82	-28.5	-169.8	-73.8	171.2	12.1	0	0	114.4	T28 A29 W30	T28-Q32 WeakPolarHBondContact O-CG 3.24Å; A29-Q32 PolarHBondContact O-N 3.47Å; W30-Q32 VanDerWaalsContact C-N 3.32Å; W30-Q32 PolarHBondContact O-N 2.79Å
33	H	86.8	Confident	74.6	Confident	9 Å²	9	56.5 Å²	56.5	4%	0.042	31%	0.307	C	S	.	.			trans	-147.3	149.5	-167.9	-161.8	-81.6	0	0	0	112.4	L35 Q36 T99 E152 S156 F160	H33-L35 WeakPolarHBondContact ND1-CB 3.19Å; H33-L35 PolarHBondContact ND1-N 2.77Å; H33-L35 PolarHBondContact ND1-O 3.23Å; H33-Q36 PolarHBondContact O-NE2 3.41Å; H33-T99 PolarHBondContact CE1-OG1 3.5Å; H33-T99 VanDerWaalsContact CE1-OG1 3.26Å; H33-T99 PolarHBondContact NE2-OG1 3.44Å; H33-E152 IonicContact CE1-OE2 3.33Å; H33-E152 PolarHBondContact CE1-OE2 2.88Å; H33-S156 PolarHBondContact CE1-OG 3.42Å; H33-S156 PolarHBondContact NE2-O 3.25Å; H33-S156 VanDerWaalsContact NE2-O 3.09Å; H33-S156 PolarHBondContact NE2-OG 3.27Å; H33-F160 AromaticContact ND1-CD2 3.81Å
34	N	87.4	Confident	76.5	Confident	9 Å²	9	57 Å²	57	5%	0.048	30%	0.304	C	S	.	.	S	Bend	trans	-68.8	-47.6	177.8	-68.2	-11.2	0	0	0	111.3	P95 F97 T99 R113 R148	N34-P95 HydrophobicContact CB-CB 4.35Å; N34-P95 HydrophobicContact CB-CG 3.56Å; N34-P95 WeakPolarHBondContact ND2-CB 3.46Å; N34-F97 PolarHBondContact ND2-O 2.82Å; N34-T99 WeakPolarHBondContact CB-OG1 3.4Å; N34-T99 VanDerWaalsContact CG-OG1 3.23Å; N34-T99 PolarHBondContact N-OG1 2.93Å; N34-T99 VanDerWaalsContact N-OG1 3.11Å; N34-T99 PolarHBondContact ND2-OG1 3.41Å; N34-R113 VanDerWaalsContact OD1-CZ 3.31Å; N34-R113 PolarHBondContact OD1-NE 2.83Å; N34-R113 PolarHBondContact OD1-NH2 2.93Å; N34-R148 PolarHBondContact O-NH2 3.31Å
35	L	90.1	Very high	78.5	Confident	2 Å²	2	62.6 Å²	62.6	1%	0.01	32%	0.324	C	S	.	.			trans	-64.4	137.8	167.9	-61.3	171.6	0	0	0	111.7	H33 R148 L149 E152 L157 F160	H33-L35 WeakPolarHBondContact ND1-CB 3.19Å; H33-L35 PolarHBondContact ND1-N 2.77Å; H33-L35 PolarHBondContact ND1-O 3.23Å; L35-R148 HydrophobicContact CD2-CB 3.47Å; L35-R148 VanDerWaalsContact CD2-CB 3.47Å; L35-L149 HydrophobicContact CD1-CD2 3.74Å; L35-E152 HydrophobicContact CD1-CB 4.11Å; L35-E152 HydrophobicContact CD1-CG 3.81Å; L35-E152 HydrophobicContact CG-CG 4.48Å; L35-L157 HydrophobicContact CD1-CD1 4.17Å; L35-F160 VanDerWaalsContact C-CE2 3.42Å; L35-F160 HydrophobicContact CB-CD1 4.12Å; L35-F160 HydrophobicContact CB-CD2 3.57Å; L35-F160 HydrophobicContact CB-CE1 4.14Å; L35-F160 HydrophobicContact CB-CE2 3.6Å; L35-F160 HydrophobicContact CB-CG 3.83Å; L35-F160 HydrophobicContact CB-CZ 3.88Å; L35-F160 HydrophobicContact CD1-CB 4.34Å; L35-F160 HydrophobicContact CD1-CD1 3.85Å; L35-F160 HydrophobicContact CD1-CE1 4.27Å; L35-F160 HydrophobicContact CD1-CG 4.01Å; L35-F160 VanDerWaalsContact O-CD2 3.29Å; L35-F160 WeakPolarHBondContact O-CD2 3.48Å; L35-F160 WeakPolarHBondContact O-CE2 3.33Å
36	Q	91.1	Very high	80.2	Confident	16 Å²	16	61.7 Å²	61.7	8%	0.075	31%	0.314	C	S	.	.			trans	-140.9	142.7	179.2	-68.1	-60.7	-32.5	0	0	110.2	W30 H33 Y38 V117 F145	W30-Q36 PolarHBondContact O-NE2 3.48Å; W30-Q36 VanDerWaalsContact O-NE2 3.14Å; H33-Q36 PolarHBondContact O-NE2 3.41Å; Q36-Y38 HydrophobicContact CB-CD1 3.9Å; Q36-Y38 HydrophobicContact CB-CE1 3.69Å; Q36-Y38 HydrophobicContact CB-CG 4.44Å; Q36-Y38 WeakPolarHBondContact O-CE2 3.41Å; Q36-V117 HydrophobicContact CG-CG2 4.28Å; Q36-F145 WeakPolarHBondContact O-CE2 3.46Å
37	F	93	Very high	81.9	Confident	0 Å²	0	60.9 Å²	60.9	0%	0	32%	0.319	C	S	.	.			trans	-87.5	-7.6	169.8	-77	-73.4	0	0	0	113.3	W39 F145 F160 N164 I166 V266 I269 F270 N273	F37-W39 HydrophobicContact CB-CD2 4.04Å; F37-W39 VanDerWaalsContact CB-CE2 3.46Å; F37-W39 HydrophobicContact CB-CG 4.37Å; F37-W39 HydrophobicContact CB-CH2 4.45Å; F37-W39 HydrophobicContact CB-CZ2 3.7Å; F37-W39 HydrophobicContact CD1-CZ2 4.31Å; F37-W39 HydrophobicContact CD2-CZ2 4.01Å; F37-W39 AromaticContact CD2-NE1 3.99Å; F37-W39 AromaticContact CG-CE2 3.99Å; F37-W39 AromaticContact CG-CZ2 3.77Å; F37-W39 HydrophobicContact CG-CZ2 3.77Å; F37-W39 PolarHBondContact O-N 3.46Å; F37-F145 HydrophobicContact CD1-CZ 4.07Å; F37-F145 HydrophobicContact CE1-CE1 4.16Å; F37-F145 AromaticContact CE1-CZ 3.78Å; F37-F145 HydrophobicContact CE1-CZ 3.78Å; F37-F145 HydrophobicContact CZ-CZ 4.32Å; F37-F160 HydrophobicContact CD1-CZ 4.48Å; F37-F160 HydrophobicContact CD2-CE1 4.1Å; F37-F160 AromaticContact CD2-CE2 3.89Å; F37-F160 HydrophobicContact CD2-CE2 3.89Å; F37-F160 AromaticContact CD2-CZ 3.33Å; F37-F160 HydrophobicContact CD2-CZ 3.33Å; F37-F160 HydrophobicContact CE1-CZ 4.34Å; F37-F160 HydrophobicContact CE2-CD1 4.45Å; F37-F160 AromaticContact CE2-CE1 3.45Å; F37-F160 HydrophobicContact CE2-CE1 3.45Å; F37-F160 VanDerWaalsContact CE2-CE1 3.45Å; F37-F160 HydrophobicContact CE2-CE2 4Å; F37-F160 AromaticContact CE2-CZ 3.17Å; F37-F160 HydrophobicContact CE2-CZ 3.17Å; F37-F160 HydrophobicContact CG-CZ 4.03Å; F37-F160 AromaticContact CZ-CE1 3.7Å; F37-F160 HydrophobicContact CZ-CE1 3.7Å; F37-F160 AromaticContact CZ-CZ 3.73Å; F37-F160 HydrophobicContact CZ-CZ 3.73Å; F37-N164 HydrophobicContact CD2-CB 4.03Å; F37-N164 VanDerWaalsContact CD2-CG 3.44Å; F37-N164 WeakPolarHBondContact CD2-OD1 3.46Å; F37-N164 HydrophobicContact CE2-CB 3.91Å; F37-I166 HydrophobicContact CE2-CD1 3.67Å; F37-I166 HydrophobicContact CZ-CD1 3.71Å; F37-V266 HydrophobicContact CE1-CG1 4.24Å; F37-V266 HydrophobicContact CZ-CG1 3.84Å; F37-I269 HydrophobicContact CD1-CG2 4.16Å; F37-I269 HydrophobicContact CE1-CB 4.02Å; F37-I269 HydrophobicContact CE1-CG2 3.75Å; F37-I269 HydrophobicContact CZ-CG2 4.18Å; F37-F270 HydrophobicContact CD1-CB 3.92Å; F37-F270 HydrophobicContact CD1-CD2 4.12Å; F37-F270 HydrophobicContact CE1-CB 4.05Å; F37-N273 PolarHBondContact O-ND2 3.44Å
38	Y	93.7	Very high	83.3	Confident	5 Å²	5	58.4 Å²	58.4	2%	0.02	31%	0.309	C	S	.	.			trans	51.9	53.5	-177	-43.8	-73.4	0	0	0	112.5	Q36 F40 R58 D116 V117 H120 F121 R148 F270 N273	Q36-Y38 HydrophobicContact CB-CD1 3.9Å; Q36-Y38 HydrophobicContact CB-CE1 3.69Å; Q36-Y38 HydrophobicContact CB-CG 4.44Å; Q36-Y38 WeakPolarHBondContact O-CE2 3.41Å; Y38-F40 VanDerWaalsContact C-N 3.28Å; Y38-F40 PolarHBondContact O-N 2.9Å; Y38-R58 PolarHBondContact OH-NH2 3.48Å; Y38-D116 PolarHBondContact OH-OD1 3.42Å; Y38-D116 VanDerWaalsContact OH-OD1 3.05Å; Y38-D116 PolarHBondContact OH-OD2 3.17Å; Y38-V117 HydrophobicContact CD1-CB 4.38Å; Y38-V117 HydrophobicContact CD1-CG1 4.3Å; Y38-V117 HydrophobicContact CD1-CG2 4.12Å; Y38-V117 HydrophobicContact CE1-CG2 4.13Å; Y38-H120 WeakPolarHBondContact CB-CD2 3.44Å; Y38-H120 HydrophobicContact CD1-CB 3.87Å; Y38-H120 AromaticContact CD1-CG 3.89Å; Y38-H120 HydrophobicContact CD2-CB 4.23Å; Y38-H120 AromaticContact CD2-CD2 3.7Å; Y38-H120 AromaticContact CD2-CE1 3.47Å; Y38-H120 VanDerWaalsContact CD2-CE1 3.47Å; Y38-H120 WeakPolarHBondContact CD2-CE1 3.48Å; Y38-H120 AromaticContact CD2-CG 3.52Å; Y38-H120 AromaticContact CD2-ND1 3.38Å; Y38-H120 WeakPolarHBondContact CD2-ND1 2.79Å; Y38-H120 AromaticContact CD2-NE2 3.69Å; Y38-H120 HydrophobicContact CE1-CB 3.87Å; Y38-H120 HydrophobicContact CE2-CB 4.28Å; Y38-H120 AromaticContact CE2-CG 3.9Å; Y38-H120 AromaticContact CE2-ND1 3.62Å; Y38-H120 HydrophobicContact CG-CB 4.06Å; Y38-H120 AromaticContact CG-CD2 3.44Å; Y38-H120 VanDerWaalsContact CG-CD2 3.44Å; Y38-H120 AromaticContact CG-CG 3.54Å; Y38-H120 AromaticContact CG-ND1 3.91Å; Y38-H120 AromaticContact CG-NE2 3.79Å; Y38-F121 HydrophobicContact CD1-CE2 4.49Å; Y38-F121 WeakPolarHBondContact O-CZ 3.45Å; Y38-R148 PolarHBondContact OH-NH1 2.63Å; Y38-F270 AromaticContact CD2-CE2 3.52Å; Y38-F270 HydrophobicContact CD2-CE2 3.52Å; Y38-F270 HydrophobicContact CD2-CZ 4.09Å; Y38-F270 AromaticContact CE2-CE2 3.62Å; Y38-F270 HydrophobicContact CE2-CE2 3.62Å; Y38-F270 HydrophobicContact CE2-CZ 4.01Å; Y38-N273 PolarHBondContact O-ND2 3.14Å
39	W	91.2	Very high	83.9	Confident	79 Å²	79	56.8 Å²	56.8	30%	0.299	30%	0.302	S	S	.	.			trans	-61.3	-38.2	178.9	-63.1	118.9	0	0	0	112.4	F37 N164 I269 N273	F37-W39 HydrophobicContact CB-CD2 4.04Å; F37-W39 VanDerWaalsContact CB-CE2 3.46Å; F37-W39 HydrophobicContact CB-CG 4.37Å; F37-W39 HydrophobicContact CB-CH2 4.45Å; F37-W39 HydrophobicContact CB-CZ2 3.7Å; F37-W39 HydrophobicContact CD1-CZ2 4.31Å; F37-W39 HydrophobicContact CD2-CZ2 4.01Å; F37-W39 AromaticContact CD2-NE1 3.99Å; F37-W39 AromaticContact CG-CE2 3.99Å; F37-W39 AromaticContact CG-CZ2 3.77Å; F37-W39 HydrophobicContact CG-CZ2 3.77Å; F37-W39 PolarHBondContact O-N 3.46Å; W39-N164 PolarHBondContact NE1-OD1 3Å; W39-I269 HydrophobicContact CH2-CG2 3.89Å; W39-I269 HydrophobicContact CZ2-CG2 4.29Å; W39-N273 HydrophobicContact CE3-CB 4.19Å; W39-N273 VanDerWaalsContact CE3-CG 3.43Å; W39-N273 HydrophobicContact CH2-CB 4.28Å; W39-N273 HydrophobicContact CZ3-CB 3.64Å; W39-N273 VanDerWaalsContact CZ3-CG 3.4Å; W39-N273 WeakPolarHBondContact CZ3-OD1 3.32Å
40	F	89.4	Confident	84.5	Confident	103 Å²	103	59.2 Å²	59.2	45%	0.452	31%	0.309	S	S	.	.	S	Bend	trans	-142.1	147.4	-176.5	-53.3	-74.4	0	0	0	110.8	V16 I26 Y38 F121	V16-F40 HydrophobicContact CG1-CE1 4.11Å; V16-F40 HydrophobicContact CG1-CZ 4.38Å; I26-F40 HydrophobicContact CD1-CD2 4.34Å; I26-F40 HydrophobicContact CG1-CD2 4.18Å; I26-F40 HydrophobicContact CG2-CB 4.3Å; Y38-F40 VanDerWaalsContact C-N 3.28Å; Y38-F40 PolarHBondContact O-N 2.9Å; F40-F121 VanDerWaalsContact O-CE2 3.22Å; F40-F121 WeakPolarHBondContact O-CE2 3.38Å; F40-F121 VanDerWaalsContact O-CZ 3.26Å; F40-F121 WeakPolarHBondContact O-CZ 3.26Å
41	P	89.1	Confident	85.1	Confident	76 Å²	76	58.8 Å²	58.8	49%	0.494	31%	0.308	S	S	.	.			trans	-66	160.1	170	30.4	-34.8	0	0	0	110.9	F121	P41-F121 HydrophobicContact CB-CD1 3.87Å; P41-F121 HydrophobicContact CB-CD2 4.14Å; P41-F121 HydrophobicContact CB-CE1 4.06Å; P41-F121 HydrophobicContact CB-CE2 4.3Å; P41-F121 HydrophobicContact CB-CG 3.96Å; P41-F121 HydrophobicContact CB-CZ 4.28Å; P41-F121 HydrophobicContact CG-CE1 4.47Å; P41-F121 VanDerWaalsContact N-CZ 3.27Å
42	L	87.4	Confident	85.4	Confident	30 Å²	30	55.3 Å²	55.3	16%	0.157	29%	0.291	C	S	.	.			trans	-74.1	141.4	171.6	-54.2	-174	0	0	0	110	W30 D44 R114 V117 Q118	W30-L42 HydrophobicContact CB-CD2 4.38Å; W30-L42 HydrophobicContact CD2-CD2 3.84Å; W30-L42 HydrophobicContact CG-CD2 3.6Å; W30-L42 HydrophobicContact CZ2-CD1 4.38Å; L42-D44 VanDerWaalsContact C-N 3.27Å; L42-D44 HydrophobicContact CB-CB 4.01Å; L42-D44 PolarHBondContact O-N 3.46Å; L42-R114 HydrophobicContact CD1-CG 3.83Å; L42-V117 HydrophobicContact CD1-CB 4.24Å; L42-V117 HydrophobicContact CD1-CG1 4.24Å; L42-V117 HydrophobicContact CD2-CB 4.33Å; L42-V117 HydrophobicContact CD2-CG1 3.73Å; L42-V117 HydrophobicContact CG-CB 4.22Å; L42-V117 HydrophobicContact CG-CG1 3.68Å; L42-Q118 HydrophobicContact CD1-CG 3.92Å
43	D	83.6	Confident	85.3	Confident	160 Å²	160	51.1 Å²	51.1	86%	0.856	27%	0.272	S	S	*	.	S	Bend	trans	-86.2	73.4	168	-166.4	23.2	0	0	0	109
44	D	78.9	Confident	85.2	Confident	74 Å²	74	51.2 Å²	51.2	40%	0.396	27%	0.273	S	S	.	.			trans	-145.6	150.2	-169.3	-164.9	-5	0	0	0	111.6	L42 R114	L42-D44 VanDerWaalsContact C-N 3.27Å; L42-D44 HydrophobicContact CB-CB 4.01Å; L42-D44 PolarHBondContact O-N 3.46Å; D44-R114 IonicContact OD1-NH2 3.68Å; D44-R114 PolarHBondContact OD1-NH2 2.98Å; D44-R114 IonicContact OD2-CZ 3.59Å; D44-R114 IonicContact OD2-NE 2.82Å; D44-R114 PolarHBondContact OD2-NE 2.66Å; D44-R114 IonicContact OD2-NH2 2.76Å; D44-R114 PolarHBondContact OD2-NH2 3.08Å
45	E	84.9	Confident	85	Confident	180 Å²	180	50.8 Å²	50.8	84%	0.841	27%	0.27	S	S	*	.			trans	-85.8	128.7	177.2	-65.4	-171.4	176.7	0	0	110.5	R114	E45-R114 PolarHBondContact O-NH2 3.06Å
46	I	84.7	Confident	84.4	Confident	54 Å²	54	52 Å²	52	28%	0.277	28%	0.275	S	S	.	.			trans	-123.7	128.5	174.2	-171.8	172.2	0	0	0	110.3	D50 M51 L54 Q118	I46-D50 HydrophobicContact CD1-CB 4.48Å; I46-D50 HydrophobicContact CG1-CB 4.12Å; I46-M51 HydrophobicContact CD1-CB 3.93Å; I46-M51 HydrophobicContact CG1-CB 4.17Å; I46-M51 HydrophobicContact CG2-CB 4.34Å; I46-L54 HydrophobicContact CD1-CD1 3.55Å; I46-Q118 HydrophobicContact CD1-CB 4.31Å
47	G	82.8	Confident	83.8	Confident	38 Å²	38	54.5 Å²	54.5	39%	0.392	28%	0.284	S	S	.	.			trans	-61.4	141	172.8	0	0	0	0	0	110.7	A49 D50 M51	G47-A49 VanDerWaalsContact C-N 3.27Å; G47-A49 PolarHBondContact O-N 3.39Å; G47-D50 PolarHBondContact O-N 3.11Å; G47-M51 PolarHBondContact O-N 3.25Å
48	L	80.6	Confident	83.5	Confident	60 Å²	60	54.6 Å²	54.6	31%	0.314	28%	0.284	S	S	.	.	H	α-helix	trans	-60.7	-38.1	-174.5	-160.1	72.7	0	0	0	112.3	M51 F52 R293 M430	L48-M51 HydrophobicContact CD1-CE 3.32Å; L48-M51 HydrophobicContact CD1-SD 4.14Å; L48-M51 HydrophobicContact CG-CE 4.11Å; L48-M51 WeakPolarHBondContact O-CB 3.47Å; L48-M51 PolarHBondContact O-N 2.47Å; L48-F52 HydrophobicContact CD1-CE2 4.21Å; L48-F52 HydrophobicContact CD2-CE2 3.98Å; L48-F52 HydrophobicContact CG-CD2 4.1Å; L48-F52 HydrophobicContact CG-CE2 3.67Å; L48-F52 WeakPolarHBondContact O-CD2 3.21Å; L48-F52 PolarHBondContact O-N 2.86Å; L48-F52 VanDerWaalsContact O-N 3.16Å; L48-R293 HydrophobicContact CD1-CB 3.64Å; L48-R293 HydrophobicContact CD1-CG 4.25Å; L48-R293 HydrophobicContact CD2-CB 3.76Å; L48-R293 HydrophobicContact CD2-CG 3.74Å; L48-R293 HydrophobicContact CG-CB 4.37Å; L48-M430 HydrophobicContact CB-CE 3.69Å; L48-M430 HydrophobicContact CD2-CE 3.42Å; L48-M430 VanDerWaalsContact CD2-CE 3.42Å; L48-M430 HydrophobicContact CD2-SD 4.45Å; L48-M430 HydrophobicContact CG-CE 3.48Å; L48-M430 VanDerWaalsContact CG-CE 3.48Å
49	A	76.1	Confident	83.2	Confident	34 Å²	34	54.5 Å²	54.5	28%	0.281	28%	0.284	S	S	.	.	H	α-helix	trans	-63.5	-40.3	175.9	0	0	0	0	0	112.5	G47 F52 D53 M430	G47-A49 VanDerWaalsContact C-N 3.27Å; G47-A49 PolarHBondContact O-N 3.39Å; A49-F52 PolarHBondContact O-N 3.45Å; A49-D53 PolarHBondContact O-N 3.39Å; A49-M430 HydrophobicContact CB-CB 4.48Å; A49-M430 HydrophobicContact CB-CE 4.47Å
50	D	80.5	Confident	82.6	Confident	99 Å²	99	52.9 Å²	52.9	53%	0.529	28%	0.278	S	S	.	.	H	α-helix	trans	-69.9	-40.9	179	-57.3	-43.9	0	0	0	111	I46 G47 F52 D53 L54	I46-D50 HydrophobicContact CD1-CB 4.48Å; I46-D50 HydrophobicContact CG1-CB 4.12Å; G47-D50 PolarHBondContact O-N 3.11Å; D50-F52 VanDerWaalsContact C-N 3.27Å; D50-F52 PolarHBondContact O-N 2.96Å; D50-D53 PolarHBondContact O-N 3.34Å; D50-D53 VanDerWaalsContact O-N 3.13Å; D50-L54 WeakPolarHBondContact O-CB 3.45Å; D50-L54 WeakPolarHBondContact O-CG 3.36Å; D50-L54 PolarHBondContact O-N 2.97Å
51	M	83.1	Confident	82.4	Confident	19 Å²	19	48 Å²	48	9%	0.094	26%	0.256	C	S	.	.	H	α-helix	trans	-53	-46.5	172.7	-175.3	-167.9	71	0	0	111.4	I46 G47 L48 A55 V122 L297	I46-M51 HydrophobicContact CD1-CB 3.93Å; I46-M51 HydrophobicContact CG1-CB 4.17Å; I46-M51 HydrophobicContact CG2-CB 4.34Å; G47-M51 PolarHBondContact O-N 3.25Å; L48-M51 HydrophobicContact CD1-CE 3.32Å; L48-M51 HydrophobicContact CD1-SD 4.14Å; L48-M51 HydrophobicContact CG-CE 4.11Å; L48-M51 WeakPolarHBondContact O-CB 3.47Å; L48-M51 PolarHBondContact O-N 2.47Å; M51-A55 WeakPolarHBondContact O-CB 3.26Å; M51-A55 PolarHBondContact O-N 3.45Å; M51-V122 HydrophobicContact CG-CB 4.27Å; M51-V122 HydrophobicContact CG-CG1 3.63Å; M51-V122 HydrophobicContact CG-CG2 3.52Å; M51-V122 HydrophobicContact SD-CG1 4.44Å; M51-V122 HydrophobicContact SD-CG2 4.47Å; M51-L297 HydrophobicContact CE-CD1 3.5Å; M51-L297 HydrophobicContact CE-CD2 3.96Å; M51-L297 HydrophobicContact CE-CG 3.71Å; M51-L297 HydrophobicContact SD-CD1 3.86Å
52	F	80.4	Confident	82.4	Confident	5 Å²	5	44.3 Å²	44.3	2%	0.022	23%	0.233	C	C	.	.	H	α-helix	trans	-70.2	-36.8	177.3	-78.3	-61.9	0	0	0	113.7	L48 A49 D50 A55 Y56 R293 A296 L297 M300 L426 M430	L48-F52 HydrophobicContact CD1-CE2 4.21Å; L48-F52 HydrophobicContact CD2-CE2 3.98Å; L48-F52 HydrophobicContact CG-CD2 4.1Å; L48-F52 HydrophobicContact CG-CE2 3.67Å; L48-F52 WeakPolarHBondContact O-CD2 3.21Å; L48-F52 PolarHBondContact O-N 2.86Å; L48-F52 VanDerWaalsContact O-N 3.16Å; A49-F52 PolarHBondContact O-N 3.45Å; D50-F52 VanDerWaalsContact C-N 3.27Å; D50-F52 PolarHBondContact O-N 2.96Å; F52-A55 PolarHBondContact O-N 3.4Å; F52-Y56 WeakPolarHBondContact O-CB 3.44Å; F52-Y56 PolarHBondContact O-N 2.75Å; F52-R293 WeakPolarHBondContact CZ-O 3.46Å; F52-A296 HydrophobicContact CE1-CB 4.17Å; F52-A296 HydrophobicContact CZ-CB 3.64Å; F52-L297 HydrophobicContact CD1-CD2 3.43Å; F52-L297 VanDerWaalsContact CD1-CD2 3.43Å; F52-L297 HydrophobicContact CD1-CG 4.09Å; F52-L297 HydrophobicContact CE1-CB 4.22Å; F52-L297 HydrophobicContact CE1-CD2 3.4Å; F52-L297 VanDerWaalsContact CE1-CD2 3.4Å; F52-L297 HydrophobicContact CE1-CG 3.53Å; F52-L297 HydrophobicContact CG-CD2 4.45Å; F52-L297 HydrophobicContact CZ-CD2 4.32Å; F52-L297 HydrophobicContact CZ-CG 4.08Å; F52-M300 HydrophobicContact CB-CE 4.4Å; F52-M300 HydrophobicContact CD1-CE 3.93Å; F52-M300 WeakPolarHBondContact O-CE 3.42Å; F52-L426 HydrophobicContact CB-CD2 3.53Å; F52-L426 HydrophobicContact CB-CG 3.77Å; F52-L426 HydrophobicContact CD1-CD1 4.22Å; F52-L426 HydrophobicContact CD1-CD2 3.28Å; F52-L426 HydrophobicContact CD1-CG 4.01Å; F52-L426 HydrophobicContact CD2-CD1 4.23Å; F52-L426 HydrophobicContact CD2-CD2 4.38Å; F52-L426 HydrophobicContact CD2-CG 4.26Å; F52-L426 HydrophobicContact CE1-CD1 4.34Å; F52-L426 HydrophobicContact CE1-CD2 3.98Å; F52-L426 HydrophobicContact CE2-CD1 4.45Å; F52-L426 HydrophobicContact CG-CD1 4.13Å; F52-L426 HydrophobicContact CG-CD2 3.49Å; F52-L426 VanDerWaalsContact CG-CD2 3.49Å; F52-L426 HydrophobicContact CG-CG 3.77Å; F52-L426 HydrophobicContact CZ-CD1 4.49Å; F52-M430 HydrophobicContact CD2-CE 3.33Å; F52-M430 HydrophobicContact CD2-SD 3.17Å; F52-M430 WeakPolarHBondContact CD2-SD 3.4Å; F52-M430 HydrophobicContact CE2-CE 3.48Å; F52-M430 VanDerWaalsContact CE2-CE 3.48Å; F52-M430 HydrophobicContact CE2-SD 3.18Å; F52-M430 WeakPolarHBondContact CE2-SD 3.2Å; F52-M430 HydrophobicContact CG-SD 4.19Å; F52-M430 HydrophobicContact CZ-SD 4.17Å
53	D	77.7	Confident	82.2	Confident	21 Å²	21	43.2 Å²	43.2	11%	0.112	23%	0.227	C	C	.	.	H	α-helix	trans	-64.3	-43.7	175.2	-166.1	68.6	0	0	0	111.1	A49 D50 Y56 R57	A49-D53 PolarHBondContact O-N 3.39Å; D50-D53 PolarHBondContact O-N 3.34Å; D50-D53 VanDerWaalsContact O-N 3.13Å; D53-Y56 PolarHBondContact O-N 2.9Å; D53-R57 WeakPolarHBondContact O-CB 3.43Å; D53-R57 VanDerWaalsContact O-CG 3.26Å; D53-R57 WeakPolarHBondContact O-CG 3.1Å; D53-R57 PolarHBondContact O-N 3.01Å; D53-R57 IonicContact OD2-CZ 2.78Å; D53-R57 IonicContact OD2-NE 3.96Å; D53-R57 PolarHBondContact OD2-NE 3.26Å; D53-R57 IonicContact OD2-NH2 2.8Å; D53-R57 PolarHBondContact OD2-NH2 3.33Å
54	L	83	Confident	82.1	Confident	11 Å²	11	35.6 Å²	35.6	6%	0.058	19%	0.186	C	C	.	.	H	α-helix	trans	-60.8	-47.4	174.2	-74.3	-173.1	0	0	0	112.3	I46 D50 Y56 R57 R58 T93 Q118	I46-L54 HydrophobicContact CD1-CD1 3.55Å; D50-L54 WeakPolarHBondContact O-CB 3.45Å; D50-L54 WeakPolarHBondContact O-CG 3.36Å; D50-L54 PolarHBondContact O-N 2.97Å; L54-Y56 VanDerWaalsContact C-N 3.34Å; L54-Y56 PolarHBondContact O-N 2.97Å; L54-R57 PolarHBondContact O-N 3Å; L54-R58 PolarHBondContact O-N 3.4Å; L54-T93 HydrophobicContact CD2-CG2 4.36Å; L54-Q118 HydrophobicContact CD1-CB 3.59Å
55	A	83.4	Confident	82.6	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-58.3	-46.9	176.7	0	0	0	0	0	111.3	M51 F52 R57 R58 Q59 V122 L123 L297 M300	M51-A55 WeakPolarHBondContact O-CB 3.26Å; M51-A55 PolarHBondContact O-N 3.45Å; F52-A55 PolarHBondContact O-N 3.4Å; A55-R57 PolarHBondContact O-N 3.1Å; A55-R58 PolarHBondContact O-N 2.98Å; A55-Q59 WeakPolarHBondContact O-CB 2.96Å; A55-Q59 PolarHBondContact O-N 3.43Å; A55-V122 HydrophobicContact CB-CG1 3.65Å; A55-L123 HydrophobicContact CB-CD2 3.93Å; A55-L123 WeakPolarHBondContact O-CD2 3.46Å; A55-L297 HydrophobicContact CB-CD2 4.12Å; A55-M300 HydrophobicContact CB-CE 3.55Å; A55-M300 HydrophobicContact CB-SD 3.44Å; A55-M300 WeakPolarHBondContact CB-SD 3.39Å
56	Y	77.6	Confident	82.5	Confident	28 Å²	28	24.9 Å²	24.9	11%	0.11	13%	0.134	C	C	.	.	H	α-helix	trans	-61.9	-45.9	178.4	-178.6	-107.3	0	0	0	111.9	F52 D53 L54 Q59 R60 H503	F52-Y56 WeakPolarHBondContact O-CB 3.44Å; F52-Y56 PolarHBondContact O-N 2.75Å; D53-Y56 PolarHBondContact O-N 2.9Å; L54-Y56 VanDerWaalsContact C-N 3.34Å; L54-Y56 PolarHBondContact O-N 2.97Å; Y56-Q59 PolarHBondContact O-N 2.97Å; Y56-R60 VanDerWaalsContact CE1-CD 3.47Å; Y56-R60 HydrophobicContact CE1-CG 4.25Å; Y56-R60 HydrophobicContact CE2-CG 4.41Å; Y56-R60 WeakPolarHBondContact O-CG 3.39Å; Y56-R60 PolarHBondContact O-N 3Å; Y56-H503 PolarHBondContact OH-CD2 3.35Å
57	R	78.3	Confident	82.3	Confident	68 Å²	68	23.1 Å²	23.1	26%	0.257	13%	0.126	S	C	.	.	H	α-helix	trans	-61.3	-48.7	178.5	-72.7	176.1	-167.7	-152.9	10.9	112	D53 L54 A55 R60 A61 L92 T93	D53-R57 WeakPolarHBondContact O-CB 3.43Å; D53-R57 VanDerWaalsContact O-CG 3.26Å; D53-R57 WeakPolarHBondContact O-CG 3.1Å; D53-R57 PolarHBondContact O-N 3.01Å; D53-R57 IonicContact OD2-CZ 2.78Å; D53-R57 IonicContact OD2-NE 3.96Å; D53-R57 PolarHBondContact OD2-NE 3.26Å; D53-R57 IonicContact OD2-NH2 2.8Å; D53-R57 PolarHBondContact OD2-NH2 3.33Å; L54-R57 PolarHBondContact O-N 3Å; A55-R57 PolarHBondContact O-N 3.1Å; R57-R60 PolarHBondContact O-N 3.23Å; R57-A61 PolarHBondContact O-N 2.94Å; R57-A61 VanDerWaalsContact O-N 3.17Å; R57-L92 HydrophobicContact CB-CD2 4.18Å; R57-L92 WeakPolarHBondContact O-CD2 3.39Å; R57-T93 WeakPolarHBondContact CD-OG1 3.09Å
58	R	88.5	Confident	82.2	Confident	2 Å²	2	21.3 Å²	21.3	1%	0.008	11%	0.107	C	C	.	.	H	α-helix	trans	-65	-40.8	177.5	-173.1	175.8	-154.2	101.1	5	111.3	Y38 L54 A55 R60 A61 L62 F94 D116 S119 L123 E141	Y38-R58 PolarHBondContact OH-NH2 3.48Å; L54-R58 PolarHBondContact O-N 3.4Å; A55-R58 PolarHBondContact O-N 2.98Å; R58-R60 VanDerWaalsContact C-N 3.29Å; R58-R60 PolarHBondContact O-N 3.45Å; R58-A61 WeakPolarHBondContact O-CB 3.36Å; R58-A61 PolarHBondContact O-N 2.9Å; R58-L62 HydrophobicContact CG-CG 4.44Å; R58-L62 WeakPolarHBondContact O-CG 3.2Å; R58-L62 PolarHBondContact O-N 3.31Å; R58-F94 HydrophobicContact CB-CZ 4.01Å; R58-F94 HydrophobicContact CG-CZ 3.86Å; R58-F94 VanDerWaalsContact NH1-CE1 3.28Å; R58-D116 IonicContact CZ-OD1 3.56Å; R58-D116 PolarHBondContact NH1-O 2.78Å; R58-D116 IonicContact NH1-OD1 3.69Å; R58-D116 PolarHBondContact NH1-OD1 3.18Å; R58-D116 IonicContact NH2-OD1 2.72Å; R58-S119 VanDerWaalsContact CD-C 3.49Å; R58-S119 WeakPolarHBondContact CD-O 3.23Å; R58-S119 PolarHBondContact NH1-OG 2.86Å; R58-L123 HydrophobicContact CB-CD1 3.71Å; R58-L123 HydrophobicContact CB-CG 4.22Å; R58-L123 HydrophobicContact CG-CD1 3.51Å; R58-L123 HydrophobicContact CG-CG 4.29Å; R58-E141 IonicContact CZ-OE1 3.76Å; R58-E141 IonicContact CZ-OE2 3.77Å; R58-E141 IonicContact NE-OE1 3.29Å; R58-E141 PolarHBondContact NE-OE1 3.44Å; R58-E141 VanDerWaalsContact NE-OE1 3.07Å; R58-E141 IonicContact NE-OE2 3.94Å; R58-E141 PolarHBondContact NE-OE2 3.42Å; R58-E141 IonicContact NH2-OE1 2.8Å; R58-E141 PolarHBondContact NH2-OE1 2.95Å; R58-E141 IonicContact NH2-OE2 3.87Å
59	Q	85.8	Confident	82.2	Confident	4 Å²	4	19.6 Å²	19.6	2%	0.019	10%	0.104	C	C	.	.	H	α-helix	trans	-57.9	-44.1	177.5	-175.4	-176.8	28.1	0	0	111	A55 Y56 A61 L62 L63 L123 Y127 M300	A55-Q59 WeakPolarHBondContact O-CB 2.96Å; A55-Q59 PolarHBondContact O-N 3.43Å; Y56-Q59 PolarHBondContact O-N 2.97Å; Q59-A61 VanDerWaalsContact C-N 3.31Å; Q59-A61 PolarHBondContact O-N 3.06Å; Q59-L62 PolarHBondContact O-N 3.38Å; Q59-L63 HydrophobicContact CG-CD1 3.92Å; Q59-L63 HydrophobicContact CG-CG 4.36Å; Q59-L63 WeakPolarHBondContact O-CB 3.32Å; Q59-L63 WeakPolarHBondContact O-CG 3Å; Q59-L63 PolarHBondContact O-N 2.96Å; Q59-L123 HydrophobicContact CB-CD1 4.38Å; Q59-L123 HydrophobicContact CB-CD2 4.37Å; Q59-Y127 WeakPolarHBondContact CG-OH 3.49Å; Q59-Y127 PolarHBondContact NE2-OH 3.36Å; Q59-M300 PolarHBondContact NE2-O 3.47Å
60	R	78.8	Confident	82.4	Confident	44 Å²	44	26.6 Å²	26.6	17%	0.166	12%	0.123	C	C	.	.	H	α-helix	trans	-60.9	-37.3	174.7	-74.1	-173.5	67	-164.9	1.5	113.1	Y56 R57 R58 A64 M90 V308 Y309	Y56-R60 VanDerWaalsContact CE1-CD 3.47Å; Y56-R60 HydrophobicContact CE1-CG 4.25Å; Y56-R60 HydrophobicContact CE2-CG 4.41Å; Y56-R60 WeakPolarHBondContact O-CG 3.39Å; Y56-R60 PolarHBondContact O-N 3Å; R57-R60 PolarHBondContact O-N 3.23Å; R58-R60 VanDerWaalsContact C-N 3.29Å; R58-R60 PolarHBondContact O-N 3.45Å; R60-A64 PolarHBondContact O-N 3.05Å; R60-A64 VanDerWaalsContact O-N 3.12Å; R60-M90 HydrophobicContact CB-SD 3.88Å; R60-V308 HydrophobicContact CG-CG1 4.31Å; R60-Y309 PolarHBondContact O-OH 3.43Å
61	A	85.1	Confident	82.2	Confident	0 Å²	0	28.2 Å²	28.2	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-66.5	-44.1	175.1	0	0	0	0	0	111.7	R57 R58 Q59 L63 A64 I65 F87 L92 F94	R57-A61 PolarHBondContact O-N 2.94Å; R57-A61 VanDerWaalsContact O-N 3.17Å; R58-A61 WeakPolarHBondContact O-CB 3.36Å; R58-A61 PolarHBondContact O-N 2.9Å; Q59-A61 VanDerWaalsContact C-N 3.31Å; Q59-A61 PolarHBondContact O-N 3.06Å; A61-L63 PolarHBondContact O-N 3.41Å; A61-A64 WeakPolarHBondContact O-CB 3.35Å; A61-A64 PolarHBondContact O-N 3.4Å; A61-I65 WeakPolarHBondContact O-CG1 3.29Å; A61-I65 PolarHBondContact O-N 2.88Å; A61-F87 HydrophobicContact CB-CE1 3.74Å; A61-F87 HydrophobicContact CB-CZ 3.97Å; A61-L92 HydrophobicContact CB-CD1 4.01Å; A61-L92 HydrophobicContact CB-CD2 4.28Å; A61-F94 HydrophobicContact CB-CD2 4.47Å; A61-F94 HydrophobicContact CB-CE2 3.62Å; A61-F94 HydrophobicContact CB-CZ 4.45Å
62	L	90.3	Very high	82.1	Confident	0 Å²	0	30.6 Å²	30.6	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-64.8	-39.7	178.1	-65.1	-171.5	0	0	0	113.3	R58 Q59 A64 I65 E66 L123 W136 F137 Q140 E141 L144	R58-L62 HydrophobicContact CG-CG 4.44Å; R58-L62 WeakPolarHBondContact O-CG 3.2Å; R58-L62 PolarHBondContact O-N 3.31Å; Q59-L62 PolarHBondContact O-N 3.38Å; L62-A64 PolarHBondContact O-N 3.44Å; L62-I65 WeakPolarHBondContact O-CB 3.37Å; L62-I65 PolarHBondContact O-N 3.1Å; L62-E66 PolarHBondContact O-N 3.35Å; L62-L123 HydrophobicContact CD1-CD1 3.71Å; L62-W136 HydrophobicContact CB-CH2 3.69Å; L62-W136 HydrophobicContact CB-CZ2 4.31Å; L62-W136 HydrophobicContact CB-CZ3 4.36Å; L62-W136 HydrophobicContact CD1-CH2 4.28Å; L62-W136 HydrophobicContact CD1-CZ3 4.14Å; L62-F137 HydrophobicContact CD1-CD2 3.61Å; L62-F137 HydrophobicContact CD1-CE2 3.76Å; L62-Q140 HydrophobicContact CB-CB 3.9Å; L62-Q140 HydrophobicContact CD2-CB 4.08Å; L62-Q140 HydrophobicContact CG-CB 4.4Å; L62-E141 HydrophobicContact CD2-CB 4.4Å; L62-E141 WeakPolarHBondContact CD2-OE2 2.88Å; L62-L144 HydrophobicContact CD2-CB 3.93Å; L62-L144 HydrophobicContact CD2-CD2 3.73Å; L62-L144 HydrophobicContact CD2-CG 4.46Å
63	L	82.1	Confident	82.4	Confident	6 Å²	6	35 Å²	35	3%	0.031	17%	0.165	C	C	.	.	H	α-helix	trans	-62.5	-32.4	173.8	-85.7	177.1	0	0	0	109.8	Q59 A61 E66 S67 W136 R304 V308 Y309	Q59-L63 HydrophobicContact CG-CD1 3.92Å; Q59-L63 HydrophobicContact CG-CG 4.36Å; Q59-L63 WeakPolarHBondContact O-CB 3.32Å; Q59-L63 WeakPolarHBondContact O-CG 3Å; Q59-L63 PolarHBondContact O-N 2.96Å; A61-L63 PolarHBondContact O-N 3.41Å; L63-E66 WeakPolarHBondContact O-CB 3.23Å; L63-E66 PolarHBondContact O-N 3.23Å; L63-S67 WeakPolarHBondContact O-CB 3.28Å; L63-S67 PolarHBondContact O-N 3.03Å; L63-W136 HydrophobicContact CD2-CH2 4.38Å; L63-W136 HydrophobicContact CD2-CZ2 3.79Å; L63-W136 HydrophobicContact CG-CH2 4.14Å; L63-W136 HydrophobicContact CG-CZ2 3.98Å; L63-R304 HydrophobicContact CD2-CG 3.9Å; L63-V308 HydrophobicContact CD1-CG2 4.33Å; L63-Y309 WeakPolarHBondContact CA-OH 3.44Å; L63-Y309 HydrophobicContact CB-CE2 3.48Å; L63-Y309 VanDerWaalsContact CB-CE2 3.48Å; L63-Y309 WeakPolarHBondContact CB-OH 3.38Å; L63-Y309 HydrophobicContact CD2-CE2 4.38Å; L63-Y309 HydrophobicContact CG-CE2 4.44Å; L63-Y309 WeakPolarHBondContact O-CE2 3.08Å; L63-Y309 PolarHBondContact O-OH 2.99Å
64	A	82.3	Confident	82.9	Confident	1 Å²	1	38.2 Å²	38.2	1%	0.008	18%	0.178	C	C	.	.	H	α-helix	trans	-75.6	-41.8	-178.3	0	0	0	0	0	110.6	R60 A61 L62 E66 S67 A68 E86 F87 M90 Y309	R60-A64 PolarHBondContact O-N 3.05Å; R60-A64 VanDerWaalsContact O-N 3.12Å; A61-A64 WeakPolarHBondContact O-CB 3.35Å; A61-A64 PolarHBondContact O-N 3.4Å; L62-A64 PolarHBondContact O-N 3.44Å; A64-E66 VanDerWaalsContact C-N 3.25Å; A64-E66 PolarHBondContact O-N 3.35Å; A64-S67 PolarHBondContact O-N 2.9Å; A64-A68 WeakPolarHBondContact O-CB 3.34Å; A64-A68 PolarHBondContact O-N 3.03Å; A64-E86 HydrophobicContact CB-CB 4.07Å; A64-E86 HydrophobicContact CB-CG 4.48Å; A64-F87 HydrophobicContact CB-CD1 4.38Å; A64-F87 HydrophobicContact CB-CE1 3.93Å; A64-M90 HydrophobicContact CB-CE 3.81Å; A64-Y309 VanDerWaalsContact CA-CE1 3.41Å; A64-Y309 VanDerWaalsContact CA-CZ 3.41Å; A64-Y309 WeakPolarHBondContact CA-OH 3.48Å; A64-Y309 HydrophobicContact CB-CE1 3.72Å; A64-Y309 PolarHBondContact N-OH 3.36Å
65	I	88.2	Confident	83.2	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-53.9	-43.7	167.8	-71.6	-69.4	0	0	0	111.1	A61 L62 G69 Y79 V83 F87 Q140 N143 L144 W147	A61-I65 WeakPolarHBondContact O-CG1 3.29Å; A61-I65 PolarHBondContact O-N 2.88Å; L62-I65 WeakPolarHBondContact O-CB 3.37Å; L62-I65 PolarHBondContact O-N 3.1Å; I65-G69 PolarHBondContact O-N 2.62Å; I65-G69 VanDerWaalsContact O-N 3.12Å; I65-Y79 WeakPolarHBondContact CD1-OH 3.44Å; I65-Y79 WeakPolarHBondContact CG2-OH 3.41Å; I65-Y79 PolarHBondContact O-OH 2.95Å; I65-V83 HydrophobicContact CD1-CG1 3.71Å; I65-V83 HydrophobicContact CD1-CG2 3.97Å; I65-F87 HydrophobicContact CD1-CZ 3.96Å; I65-F87 HydrophobicContact CG1-CE1 4.44Å; I65-F87 HydrophobicContact CG1-CZ 3.83Å; I65-Q140 HydrophobicContact CG2-CB 4.37Å; I65-N143 HydrophobicContact CG2-CB 3.38Å; I65-L144 HydrophobicContact CD1-CD1 4.39Å; I65-L144 HydrophobicContact CG1-CB 4.24Å; I65-L144 HydrophobicContact CG1-CD1 4.32Å; I65-W147 HydrophobicContact CD1-CB 4.23Å; I65-W147 HydrophobicContact CD1-CG 4.42Å
66	E	84.1	Confident	83.5	Confident	29 Å²	29	42 Å²	42	14%	0.136	20%	0.197	C	C	.	.	H	α-helix	trans	-65.8	-48.5	175.8	180	177.5	-154.8	0	0	111.9	L62 L63 A64 A68 G69 R70 W136 Q140	L62-E66 PolarHBondContact O-N 3.35Å; L63-E66 WeakPolarHBondContact O-CB 3.23Å; L63-E66 PolarHBondContact O-N 3.23Å; A64-E66 VanDerWaalsContact C-N 3.25Å; A64-E66 PolarHBondContact O-N 3.35Å; E66-A68 VanDerWaalsContact C-N 3.35Å; E66-A68 PolarHBondContact O-N 3.27Å; E66-G69 CarbonylContact O-C 3.54Å; E66-G69 PolarHBondContact O-N 2.58Å; E66-G69 VanDerWaalsContact O-N 3.1Å; E66-R70 WeakPolarHBondContact O-CG 3.48Å; E66-R70 PolarHBondContact O-N 3.37Å; E66-R70 IonicContact OE1-CZ 2.63Å; E66-R70 IonicContact OE1-NE 2.66Å; E66-R70 IonicContact OE1-NH2 3.67Å; E66-R70 PolarHBondContact OE1-NH2 3.27Å; E66-R70 IonicContact OE2-NH2 3.22Å; E66-W136 PolarHBondContact OE1-NE1 3.37Å; E66-W136 PolarHBondContact OE2-NE1 3.1Å; E66-Q140 HydrophobicContact CB-CG 4.21Å
67	S	78.9	Confident	84.1	Confident	16 Å²	16	47.1 Å²	47.1	11%	0.112	23%	0.227	C	C	.	.	H	α-helix	trans	-57.7	-46.6	-179.9	-176.1	0	0	0	0	111.6	L63 A64 G69 R70 K71	L63-S67 WeakPolarHBondContact O-CB 3.28Å; L63-S67 PolarHBondContact O-N 3.03Å; A64-S67 PolarHBondContact O-N 2.9Å; S67-G69 VanDerWaalsContact C-N 3.32Å; S67-G69 PolarHBondContact O-N 3.18Å; S67-R70 PolarHBondContact O-N 2.84Å; S67-K71 PolarHBondContact O-N 3.02Å
68	A	81.2	Confident	84.5	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-61.4	-41.3	175.1	0	0	0	0	0	111.9	A64 E66 R70 K71 F72 Y79 L82 V83	A64-A68 WeakPolarHBondContact O-CB 3.34Å; A64-A68 PolarHBondContact O-N 3.03Å; E66-A68 VanDerWaalsContact C-N 3.35Å; E66-A68 PolarHBondContact O-N 3.27Å; A68-R70 PolarHBondContact O-N 3.21Å; A68-K71 PolarHBondContact O-N 2.98Å; A68-K71 VanDerWaalsContact O-N 3.14Å; A68-F72 PolarHBondContact O-N 2.92Å; A68-Y79 HydrophobicContact CB-CD2 3.57Å; A68-Y79 HydrophobicContact CB-CE2 3.57Å; A68-Y79 HydrophobicContact CB-CG 4.39Å; A68-L82 HydrophobicContact CB-CB 4.41Å; A68-L82 HydrophobicContact CB-CD2 3.89Å; A68-L82 HydrophobicContact CB-CG 4.19Å; A68-V83 HydrophobicContact CB-CG2 3.56Å
69	G	81.8	Confident	84.4	Confident	24 Å²	24	48.4 Å²	48.4	25%	0.247	24%	0.239	C	C	.	.	H	α-helix	trans	-71	-13.1	178.7	0	0	0	0	0	114.8	I65 E66 S67	I65-G69 PolarHBondContact O-N 2.62Å; I65-G69 VanDerWaalsContact O-N 3.12Å; E66-G69 CarbonylContact O-C 3.54Å; E66-G69 PolarHBondContact O-N 2.58Å; E66-G69 VanDerWaalsContact O-N 3.1Å; S67-G69 VanDerWaalsContact C-N 3.32Å; S67-G69 PolarHBondContact O-N 3.18Å
70	R	79.4	Confident	84.6	Confident	181 Å²	181	49.3 Å²	49.3	68%	0.683	24%	0.243	S	C	*	.	H	α-helix	trans	-85.2	-32.5	169.6	-69.2	176.9	-172.1	170.9	2.4	112.1	E66 S67 A68	E66-R70 WeakPolarHBondContact O-CG 3.48Å; E66-R70 PolarHBondContact O-N 3.37Å; E66-R70 IonicContact OE1-CZ 2.63Å; E66-R70 IonicContact OE1-NE 2.66Å; E66-R70 IonicContact OE1-NH2 3.67Å; E66-R70 PolarHBondContact OE1-NH2 3.27Å; E66-R70 IonicContact OE2-NH2 3.22Å; S67-R70 PolarHBondContact O-N 2.84Å; A68-R70 PolarHBondContact O-N 3.21Å
71	K	75.7	Confident	85	Confident	134 Å²	134	50.9 Å²	50.9	58%	0.583	26%	0.261	S	S	*	.	H	α-helix	trans	-84.7	-37.8	-177.4	-68.8	-179	-179.3	-177.9	0	112.5	S67 A68 L82	S67-K71 PolarHBondContact O-N 3.02Å; A68-K71 PolarHBondContact O-N 2.98Å; A68-K71 VanDerWaalsContact O-N 3.14Å; K71-L82 HydrophobicContact CD-CD2 3.74Å
72	F	80.9	Confident	84.9	Confident	69 Å²	69	52.5 Å²	52.5	30%	0.303	27%	0.269	S	S	.	.	S	Bend	trans	-129.9	151.9	-174.4	-55.9	-68.9	0	0	0	110.9	A68 K74 D78 L82	A68-F72 PolarHBondContact O-N 2.92Å; F72-K74 PolarHBondContact O-N 2.96Å; F72-D78 HydrophobicContact CB-CB 4.36Å; F72-D78 HydrophobicContact CD1-CB 3.56Å; F72-D78 HydrophobicContact CD2-CB 4.12Å; F72-D78 HydrophobicContact CE1-CB 3.78Å; F72-D78 HydrophobicContact CE2-CB 4.29Å; F72-D78 HydrophobicContact CG-CB 3.75Å; F72-D78 HydrophobicContact CZ-CB 4.14Å; F72-L82 HydrophobicContact CD2-CD2 4.14Å; F72-L82 HydrophobicContact CE2-CB 4.21Å; F72-L82 HydrophobicContact CE2-CD2 3.78Å
73	P	87	Confident	84.7	Confident	96 Å²	96	52.5 Å²	52.5	62%	0.623	27%	0.269	S	S	*	.			trans	-53.3	135.8	165.2	-19.4	31.2	0	0	0	109.6	F75 T76	P73-F75 PolarHBondContact O-N 3.47Å; P73-T76 HydrophobicContact CB-CG2 3.82Å; P73-T76 HydrophobicContact CG-CG2 4.31Å; P73-T76 WeakPolarHBondContact O-CG2 3.34Å; P73-T76 PolarHBondContact O-N 3.43Å; P73-T76 PolarHBondContact O-OG1 3.33Å
74	K	89	Confident	84.8	Confident	90 Å²	90	54.3 Å²	54.3	39%	0.391	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	141.2	-174.3	-65.4	175.7	179.9	165.4	0	110.9	F72 T76 Y79	F72-K74 PolarHBondContact O-N 2.96Å; K74-T76 VanDerWaalsContact C-N 3.25Å; K74-T76 PolarHBondContact O-N 3.07Å; K74-Y79 HydrophobicContact CG-CE2 4.48Å
75	F	89.1	Confident	84.8	Confident	43 Å²	43	57 Å²	57	19%	0.189	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	64.1	24.1	176.2	-41.5	-68.7	0	0	0	114.5	P73 Y79 F80 N143 R146	P73-F75 PolarHBondContact O-N 3.47Å; F75-Y79 HydrophobicContact CD1-CD1 4.45Å; F75-Y79 HydrophobicContact CD1-CE1 4.04Å; F75-Y79 HydrophobicContact CE1-CE1 4.2Å; F75-Y79 VanDerWaalsContact N-CD1 3.32Å; F75-F80 VanDerWaalsContact CA-CE2 3.48Å; F75-F80 HydrophobicContact CB-CE2 3.8Å; F75-F80 HydrophobicContact CB-CZ 4.35Å; F75-F80 HydrophobicContact CD1-CE2 4.25Å; F75-F80 HydrophobicContact CD1-CZ 4.03Å; F75-N143 HydrophobicContact CZ-CB 4.21Å; F75-R146 HydrophobicContact CD1-CG 3.9Å; F75-R146 HydrophobicContact CE1-CB 3.69Å; F75-R146 HydrophobicContact CE1-CG 3.48Å; F75-R146 VanDerWaalsContact CE1-CG 3.48Å; F75-R146 VanDerWaalsContact CE2-CD 3.49Å; F75-R146 HydrophobicContact CE2-CG 4.29Å; F75-R146 HydrophobicContact CG-CG 4.48Å; F75-R146 HydrophobicContact CZ-CB 3.83Å; F75-R146 HydrophobicContact CZ-CG 3.72Å
76	T	89.8	Confident	84.1	Confident	46 Å²	46	57.5 Å²	57.5	28%	0.282	30%	0.299	S	S	.	.	S	Bend	trans	-83.6	163.3	162.1	60.7	0	0	0	0	110.9	P73 K74 D78 Y79 F80	P73-T76 HydrophobicContact CB-CG2 3.82Å; P73-T76 HydrophobicContact CG-CG2 4.31Å; P73-T76 WeakPolarHBondContact O-CG2 3.34Å; P73-T76 PolarHBondContact O-N 3.43Å; P73-T76 PolarHBondContact O-OG1 3.33Å; K74-T76 VanDerWaalsContact C-N 3.25Å; K74-T76 PolarHBondContact O-N 3.07Å; T76-D78 PolarHBondContact O-N 3.36Å; T76-Y79 WeakPolarHBondContact O-CA 3.21Å; T76-Y79 VanDerWaalsContact O-CB 3.31Å; T76-Y79 WeakPolarHBondContact O-CB 3.05Å; T76-Y79 PolarHBondContact O-N 3.28Å; T76-Y79 PolarHBondContact OG1-N 3.24Å; T76-F80 VanDerWaalsContact O-CD2 3.3Å; T76-F80 WeakPolarHBondContact O-CD2 3.36Å; T76-F80 PolarHBondContact O-N 3.42Å
77	D	89.3	Confident	84	Confident	136 Å²	136	56.2 Å²	56.2	73%	0.727	29%	0.293	S	S	*	.	H	α-helix	trans	-56.6	-37.1	177.2	-62.7	-30.4	0	0	0	112.4	F80 S81	D77-F80 PolarHBondContact O-N 3.24Å; D77-S81 VanDerWaalsContact O-CB 3.26Å; D77-S81 WeakPolarHBondContact O-CB 3.47Å; D77-S81 PolarHBondContact O-N 2.94Å; D77-S81 PolarHBondContact O-OG 3.35Å
78	D	87	Confident	83.8	Confident	97 Å²	97	64.5 Å²	64.5	52%	0.519	32%	0.322	S	S	.	.	H	α-helix	trans	-65.3	-39.9	174.8	-63.4	-37.4	0	0	0	112.4	F72 T76 L82	F72-D78 HydrophobicContact CB-CB 4.36Å; F72-D78 HydrophobicContact CD1-CB 3.56Å; F72-D78 HydrophobicContact CD2-CB 4.12Å; F72-D78 HydrophobicContact CE1-CB 3.78Å; F72-D78 HydrophobicContact CE2-CB 4.29Å; F72-D78 HydrophobicContact CG-CB 3.75Å; F72-D78 HydrophobicContact CZ-CB 4.14Å; T76-D78 PolarHBondContact O-N 3.36Å; D78-L82 WeakPolarHBondContact O-CB 3.35Å; D78-L82 PolarHBondContact O-N 3.2Å
79	Y	87.3	Confident	83.1	Confident	0 Å²	0	68.1 Å²	68.1	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-61.9	-50	174.7	171.3	-88	0	0	0	110.7	I65 A68 K74 F75 T76 L82 V83	I65-Y79 WeakPolarHBondContact CD1-OH 3.44Å; I65-Y79 WeakPolarHBondContact CG2-OH 3.41Å; I65-Y79 PolarHBondContact O-OH 2.95Å; A68-Y79 HydrophobicContact CB-CD2 3.57Å; A68-Y79 HydrophobicContact CB-CE2 3.57Å; A68-Y79 HydrophobicContact CB-CG 4.39Å; K74-Y79 HydrophobicContact CG-CE2 4.48Å; F75-Y79 HydrophobicContact CD1-CD1 4.45Å; F75-Y79 HydrophobicContact CD1-CE1 4.04Å; F75-Y79 HydrophobicContact CE1-CE1 4.2Å; F75-Y79 VanDerWaalsContact N-CD1 3.32Å; T76-Y79 WeakPolarHBondContact O-CA 3.21Å; T76-Y79 VanDerWaalsContact O-CB 3.31Å; T76-Y79 WeakPolarHBondContact O-CB 3.05Å; T76-Y79 PolarHBondContact O-N 3.28Å; T76-Y79 PolarHBondContact OG1-N 3.24Å; Y79-L82 PolarHBondContact O-N 2.87Å; Y79-V83 HydrophobicContact CD1-CG2 4.31Å; Y79-V83 HydrophobicContact CE1-CG2 3.91Å; Y79-V83 HydrophobicContact CE2-CG2 4.22Å; Y79-V83 VanDerWaalsContact O-CG2 3.31Å; Y79-V83 WeakPolarHBondContact O-CG2 3.49Å; Y79-V83 PolarHBondContact O-N 3.21Å
80	F	89.7	Confident	82.4	Confident	24 Å²	24	67.1 Å²	67.1	11%	0.105	33%	0.326	C	S	.	.	H	α-helix	trans	-60.4	-47.1	177.6	-84	-80.5	0	0	0	111.4	F75 T76 D77 L82 V83 D84 W147 E150 T151	F75-F80 VanDerWaalsContact CA-CE2 3.48Å; F75-F80 HydrophobicContact CB-CE2 3.8Å; F75-F80 HydrophobicContact CB-CZ 4.35Å; F75-F80 HydrophobicContact CD1-CE2 4.25Å; F75-F80 HydrophobicContact CD1-CZ 4.03Å; T76-F80 VanDerWaalsContact O-CD2 3.3Å; T76-F80 WeakPolarHBondContact O-CD2 3.36Å; T76-F80 PolarHBondContact O-N 3.42Å; D77-F80 PolarHBondContact O-N 3.24Å; F80-L82 VanDerWaalsContact C-N 3.3Å; F80-L82 PolarHBondContact O-N 3.37Å; F80-V83 PolarHBondContact O-N 2.86Å; F80-D84 WeakPolarHBondContact O-CB 3.43Å; F80-D84 VanDerWaalsContact O-CG 3.26Å; F80-D84 PolarHBondContact O-N 3.21Å; F80-W147 AromaticContact CD1-CD1 3.18Å; F80-W147 HydrophobicContact CD1-CG 4.19Å; F80-W147 AromaticContact CD1-NE1 3.46Å; F80-W147 HydrophobicContact CE1-CB 4.18Å; F80-W147 AromaticContact CE1-CD1 3.23Å; F80-W147 AromaticContact CE1-CG 3.85Å; F80-W147 HydrophobicContact CE1-CG 3.85Å; F80-W147 AromaticContact CE1-NE1 3.88Å; F80-E150 HydrophobicContact CE1-CB 4.06Å; F80-E150 VanDerWaalsContact CE2-OE2 3.27Å; F80-E150 WeakPolarHBondContact CE2-OE2 3.12Å; F80-E150 HydrophobicContact CZ-CB 3.64Å; F80-E150 HydrophobicContact CZ-CG 4.28Å; F80-E150 WeakPolarHBondContact CZ-OE2 3.38Å; F80-T151 HydrophobicContact CD1-CG2 4.07Å; F80-T151 HydrophobicContact CE1-CG2 4.02Å
81	S	88	Confident	81.2	Confident	76 Å²	76	61.3 Å²	61.3	53%	0.531	31%	0.314	S	S	.	.	H	α-helix	trans	-58	-42.3	179.8	-62.3	0	0	0	0	112.2	D77 C85	D77-S81 VanDerWaalsContact O-CB 3.26Å; D77-S81 WeakPolarHBondContact O-CB 3.47Å; D77-S81 PolarHBondContact O-N 2.94Å; D77-S81 PolarHBondContact O-OG 3.35Å; S81-C85 VanDerWaalsContact O-CB 3.24Å; S81-C85 WeakPolarHBondContact O-CB 3.47Å; S81-C85 PolarHBondContact O-N 3.01Å
82	L	81.7	Confident	80.2	Confident	35 Å²	35	55.7 Å²	55.7	18%	0.183	29%	0.29	C	S	.	.	H	α-helix	trans	-68.8	-45	176.4	179.3	59.1	0	0	0	111.9	A68 K71 F72 D78 Y79 F80 D84 C85 E86	A68-L82 HydrophobicContact CB-CB 4.41Å; A68-L82 HydrophobicContact CB-CD2 3.89Å; A68-L82 HydrophobicContact CB-CG 4.19Å; K71-L82 HydrophobicContact CD-CD2 3.74Å; F72-L82 HydrophobicContact CD2-CD2 4.14Å; F72-L82 HydrophobicContact CE2-CB 4.21Å; F72-L82 HydrophobicContact CE2-CD2 3.78Å; D78-L82 WeakPolarHBondContact O-CB 3.35Å; D78-L82 PolarHBondContact O-N 3.2Å; Y79-L82 PolarHBondContact O-N 2.87Å; F80-L82 VanDerWaalsContact C-N 3.3Å; F80-L82 PolarHBondContact O-N 3.37Å; L82-D84 VanDerWaalsContact C-N 3.35Å; L82-D84 PolarHBondContact O-N 3.17Å; L82-C85 PolarHBondContact O-N 3.46Å; L82-E86 HydrophobicContact CD1-CG 4.13Å; L82-E86 WeakPolarHBondContact O-CB 3.06Å; L82-E86 WeakPolarHBondContact O-CG 3.28Å; L82-E86 PolarHBondContact O-N 2.91Å
83	V	85.6	Confident	78.9	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-60.8	-45	177.7	173.1	0	0	0	0	111	I65 A68 Y79 F80 C85 E86 F87 W147	I65-V83 HydrophobicContact CD1-CG1 3.71Å; I65-V83 HydrophobicContact CD1-CG2 3.97Å; A68-V83 HydrophobicContact CB-CG2 3.56Å; Y79-V83 HydrophobicContact CD1-CG2 4.31Å; Y79-V83 HydrophobicContact CE1-CG2 3.91Å; Y79-V83 HydrophobicContact CE2-CG2 4.22Å; Y79-V83 VanDerWaalsContact O-CG2 3.31Å; Y79-V83 WeakPolarHBondContact O-CG2 3.49Å; Y79-V83 PolarHBondContact O-N 3.21Å; F80-V83 PolarHBondContact O-N 2.86Å; V83-C85 PolarHBondContact O-N 3.25Å; V83-E86 PolarHBondContact O-N 3.34Å; V83-F87 HydrophobicContact CG1-CD1 4.27Å; V83-F87 HydrophobicContact CG1-CD2 3.83Å; V83-F87 HydrophobicContact CG1-CE1 4.03Å; V83-F87 HydrophobicContact CG1-CE2 3.57Å; V83-F87 HydrophobicContact CG1-CG 4.18Å; V83-F87 HydrophobicContact CG1-CZ 3.68Å; V83-F87 WeakPolarHBondContact O-CB 3.41Å; V83-F87 WeakPolarHBondContact O-CG 3.27Å; V83-F87 PolarHBondContact O-N 3.11Å; V83-W147 HydrophobicContact CG1-CD2 4.08Å; V83-W147 HydrophobicContact CG1-CG 4.07Å; V83-W147 HydrophobicContact CG1-CZ2 4.39Å
84	D	85.8	Confident	77.7	Confident	44 Å²	44	48.8 Å²	48.8	24%	0.235	25%	0.251	C	S	.	.	H	α-helix	trans	-61.3	-44.8	177.8	-74.9	13.5	0	0	0	111.4	F80 L82 F87 R88 W147	F80-D84 WeakPolarHBondContact O-CB 3.43Å; F80-D84 VanDerWaalsContact O-CG 3.26Å; F80-D84 PolarHBondContact O-N 3.21Å; L82-D84 VanDerWaalsContact C-N 3.35Å; L82-D84 PolarHBondContact O-N 3.17Å; D84-F87 PolarHBondContact O-N 2.89Å; D84-R88 WeakPolarHBondContact O-CB 3.49Å; D84-R88 VanDerWaalsContact O-CG 3.27Å; D84-R88 WeakPolarHBondContact O-CG 3.19Å; D84-R88 PolarHBondContact O-N 3.28Å; D84-W147 VanDerWaalsContact OD1-CE2 3.32Å; D84-W147 WeakPolarHBondContact OD1-CZ2 3.45Å; D84-W147 PolarHBondContact OD1-NE1 2.71Å
85	C	81.5	Confident	76.2	Confident	56 Å²	56	45.3 Å²	45.3	38%	0.378	24%	0.238	S	C	.	.	H	α-helix	trans	-59.4	-48.2	175.9	-175.4	0	0	0	0	110.9	S81 L82 V83 R88 K89	S81-C85 VanDerWaalsContact O-CB 3.24Å; S81-C85 WeakPolarHBondContact O-CB 3.47Å; S81-C85 PolarHBondContact O-N 3.01Å; L82-C85 PolarHBondContact O-N 3.46Å; V83-C85 PolarHBondContact O-N 3.25Å; C85-R88 PolarHBondContact O-N 3.04Å; C85-K89 WeakPolarHBondContact O-CG 3.37Å; C85-K89 PolarHBondContact O-N 3.23Å; C85-K89 WeakPolarHBondContact SG-CE 3.36Å
86	E	74.3	Confident	74.6	Confident	11 Å²	11	47.2 Å²	47.2	5%	0.051	25%	0.246	C	C	.	.	H	α-helix	trans	-64	-44.8	178.9	-74.9	-53.1	116.7	0	0	112.3	A64 L82 V83 R88 K89 M90 A312	A64-E86 HydrophobicContact CB-CB 4.07Å; A64-E86 HydrophobicContact CB-CG 4.48Å; L82-E86 HydrophobicContact CD1-CG 4.13Å; L82-E86 WeakPolarHBondContact O-CB 3.06Å; L82-E86 WeakPolarHBondContact O-CG 3.28Å; L82-E86 PolarHBondContact O-N 2.91Å; V83-E86 PolarHBondContact O-N 3.34Å; E86-R88 PolarHBondContact O-N 3.39Å; E86-K89 WeakPolarHBondContact O-CB 3.19Å; E86-K89 PolarHBondContact O-N 2.99Å; E86-K89 IonicContact OE1-NZ 3.09Å; E86-K89 PolarHBondContact OE1-NZ 3.31Å; E86-M90 HydrophobicContact CB-CE 4.28Å; E86-M90 VanDerWaalsContact O-CG 3.31Å; E86-M90 WeakPolarHBondContact O-CG 3.2Å; E86-M90 PolarHBondContact O-N 3.04Å; E86-M90 VanDerWaalsContact O-N 3.11Å; E86-A312 WeakPolarHBondContact OE2-CB 3.46Å
87	F	81.1	Confident	73	Confident	3 Å²	3	52.9 Å²	52.9	1%	0.013	27%	0.267	C	S	.	.	H	α-helix	trans	-65.5	-41.9	178.9	-70.9	-1.2	0	0	0	110.2	A61 A64 I65 V83 D84 K89 M90 L92 F96 L144 W147	A61-F87 HydrophobicContact CB-CE1 3.74Å; A61-F87 HydrophobicContact CB-CZ 3.97Å; A64-F87 HydrophobicContact CB-CD1 4.38Å; A64-F87 HydrophobicContact CB-CE1 3.93Å; I65-F87 HydrophobicContact CD1-CZ 3.96Å; I65-F87 HydrophobicContact CG1-CE1 4.44Å; I65-F87 HydrophobicContact CG1-CZ 3.83Å; V83-F87 HydrophobicContact CG1-CD1 4.27Å; V83-F87 HydrophobicContact CG1-CD2 3.83Å; V83-F87 HydrophobicContact CG1-CE1 4.03Å; V83-F87 HydrophobicContact CG1-CE2 3.57Å; V83-F87 HydrophobicContact CG1-CG 4.18Å; V83-F87 HydrophobicContact CG1-CZ 3.68Å; V83-F87 WeakPolarHBondContact O-CB 3.41Å; V83-F87 WeakPolarHBondContact O-CG 3.27Å; V83-F87 PolarHBondContact O-N 3.11Å; D84-F87 PolarHBondContact O-N 2.89Å; F87-K89 PolarHBondContact O-N 3.48Å; F87-M90 CarbonylContact O-C 3.54Å; F87-M90 PolarHBondContact O-N 3.14Å; F87-M90 VanDerWaalsContact O-N 3.08Å; F87-L92 HydrophobicContact CB-CD1 4.03Å; F87-L92 HydrophobicContact CD1-CD1 3.71Å; F87-L92 HydrophobicContact CE1-CD1 4.28Å; F87-L92 HydrophobicContact CG-CD1 3.86Å; F87-F96 VanDerWaalsContact C-CE1 3.43Å; F87-F96 VanDerWaalsContact C-CZ 3.46Å; F87-F96 HydrophobicContact CB-CE1 3.4Å; F87-F96 VanDerWaalsContact CB-CE1 3.4Å; F87-F96 HydrophobicContact CB-CZ 3.81Å; F87-F96 WeakPolarHBondContact O-CZ 3.29Å; F87-L144 HydrophobicContact CE2-CD1 3.74Å; F87-L144 HydrophobicContact CZ-CD1 3.72Å; F87-W147 HydrophobicContact CD2-CE3 4.38Å; F87-W147 AromaticContact CD2-CH2 3.7Å; F87-W147 HydrophobicContact CD2-CH2 3.7Å; F87-W147 AromaticContact CD2-CZ2 3.91Å; F87-W147 HydrophobicContact CD2-CZ2 3.91Å; F87-W147 AromaticContact CD2-CZ3 3.93Å; F87-W147 HydrophobicContact CD2-CZ3 3.93Å; F87-W147 HydrophobicContact CE2-CD2 4.16Å; F87-W147 AromaticContact CE2-CE3 3.85Å; F87-W147 HydrophobicContact CE2-CE3 3.85Å; F87-W147 HydrophobicContact CE2-CH2 4.02Å; F87-W147 HydrophobicContact CE2-CZ2 4.26Å; F87-W147 AromaticContact CE2-CZ3 3.79Å; F87-W147 HydrophobicContact CE2-CZ3 3.79Å
88	R	75.7	Confident	71.7	Confident	189 Å²	189	49 Å²	49	71%	0.713	25%	0.254	S	S	*	.	H	α-helix	trans	-58.8	-32	176.3	-72.4	176.3	-155.6	175.1	10	113.6	D84 C85 E86	D84-R88 WeakPolarHBondContact O-CB 3.49Å; D84-R88 VanDerWaalsContact O-CG 3.27Å; D84-R88 WeakPolarHBondContact O-CG 3.19Å; D84-R88 PolarHBondContact O-N 3.28Å; C85-R88 PolarHBondContact O-N 3.04Å; E86-R88 PolarHBondContact O-N 3.39Å
89	K	66.6	Low	70.7	Confident	77 Å²	77	45 Å²	45	34%	0.335	23%	0.233	S	C	.	.	H	α-helix	trans	-72.2	-37.9	176.1	-65.4	169.4	-167.3	167.9	0	112.2	C85 E86 F87 S91 D313	C85-K89 WeakPolarHBondContact O-CG 3.37Å; C85-K89 PolarHBondContact O-N 3.23Å; C85-K89 WeakPolarHBondContact SG-CE 3.36Å; E86-K89 WeakPolarHBondContact O-CB 3.19Å; E86-K89 PolarHBondContact O-N 2.99Å; E86-K89 IonicContact OE1-NZ 3.09Å; E86-K89 PolarHBondContact OE1-NZ 3.31Å; F87-K89 PolarHBondContact O-N 3.48Å; K89-S91 PolarHBondContact O-N 2.93Å; K89-D313 IonicContact NZ-OD1 2.71Å; K89-D313 PolarHBondContact NZ-OD1 3.4Å
90	M	65.6	Low	69.8	Low	2 Å²	2	49.2 Å²	49.2	1%	0.01	26%	0.256	C	S	.	.	S	Bend	trans	-79.6	109.8	175.5	-58.4	-179.6	-162.7	0	0	106.9	R60 A64 E86 F87 L92 Y309	R60-M90 HydrophobicContact CB-SD 3.88Å; A64-M90 HydrophobicContact CB-CE 3.81Å; E86-M90 HydrophobicContact CB-CE 4.28Å; E86-M90 VanDerWaalsContact O-CG 3.31Å; E86-M90 WeakPolarHBondContact O-CG 3.2Å; E86-M90 PolarHBondContact O-N 3.04Å; E86-M90 VanDerWaalsContact O-N 3.11Å; F87-M90 CarbonylContact O-C 3.54Å; F87-M90 PolarHBondContact O-N 3.14Å; F87-M90 VanDerWaalsContact O-N 3.08Å; M90-L92 HydrophobicContact CB-CD1 3.77Å; M90-L92 HydrophobicContact CB-CD2 4.01Å; M90-L92 HydrophobicContact CB-CG 3.48Å; M90-L92 VanDerWaalsContact CB-CG 3.48Å; M90-L92 PolarHBondContact O-N 2.92Å; M90-L92 HydrophobicContact SD-CD1 4.22Å; M90-Y309 HydrophobicContact CE-CE1 4.23Å
91	S	54	Low	68.6	Low	60 Å²	60	51.3 Å²	51.3	42%	0.42	27%	0.272	S	S	.	.			trans	-66.2	72.7	172.2	-161.3	0	0	0	0	109.8	K89 N419	K89-S91 PolarHBondContact O-N 2.93Å; S91-N419 WeakPolarHBondContact CB-O 3.37Å
92	L	55.5	Low	67.6	Low	15 Å²	15	56.4 Å²	56.4	8%	0.079	29%	0.287	C	S	.	.			trans	-81	155.2	-169.5	-74.9	167.8	0	0	0	110.2	R57 A61 F87 M90 F94 F96	R57-L92 HydrophobicContact CB-CD2 4.18Å; R57-L92 WeakPolarHBondContact O-CD2 3.39Å; A61-L92 HydrophobicContact CB-CD1 4.01Å; A61-L92 HydrophobicContact CB-CD2 4.28Å; F87-L92 HydrophobicContact CB-CD1 4.03Å; F87-L92 HydrophobicContact CD1-CD1 3.71Å; F87-L92 HydrophobicContact CE1-CD1 4.28Å; F87-L92 HydrophobicContact CG-CD1 3.86Å; M90-L92 HydrophobicContact CB-CD1 3.77Å; M90-L92 HydrophobicContact CB-CD2 4.01Å; M90-L92 HydrophobicContact CB-CG 3.48Å; M90-L92 VanDerWaalsContact CB-CG 3.48Å; M90-L92 PolarHBondContact O-N 2.92Å; M90-L92 HydrophobicContact SD-CD1 4.22Å; L92-F94 VanDerWaalsContact C-N 3.32Å; L92-F94 HydrophobicContact CB-CD2 4.03Å; L92-F94 HydrophobicContact CB-CE2 4.49Å; L92-F94 HydrophobicContact CD1-CD2 4.11Å; L92-F94 HydrophobicContact CD1-CE2 4.3Å; L92-F94 HydrophobicContact CD2-CE2 4.17Å; L92-F94 HydrophobicContact CG-CD2 4.43Å; L92-F96 HydrophobicContact CB-CE2 4.01Å; L92-F96 HydrophobicContact CB-CZ 4.11Å; L92-F96 HydrophobicContact CD1-CZ 4.43Å
93	T	53.8	Low	67	Low	10 Å²	10	62.1 Å²	62.1	6%	0.061	31%	0.31	C	S	.	.	S	Bend	trans	-83.4	-4.2	179.3	3	0	0	0	0	113.3	L54 R57 L112 S115	L54-T93 HydrophobicContact CD2-CG2 4.36Å; R57-T93 WeakPolarHBondContact CD-OG1 3.09Å; T93-L112 HydrophobicContact CG2-CD2 3.99Å; T93-L112 VanDerWaalsContact O-CD2 3.27Å; T93-L112 WeakPolarHBondContact O-CD2 3.17Å; T93-S115 VanDerWaalsContact CG2-CB 3.41Å
94	F	62	Low	66.2	Low	11 Å²	11	70.8 Å²	70.8	5%	0.048	35%	0.351	C	S	.	.	S	Bend	trans	-76	134.6	172.9	-49.6	-58.1	0	0	0	109	R58 A61 L92 F96 D116	R58-F94 HydrophobicContact CB-CZ 4.01Å; R58-F94 HydrophobicContact CG-CZ 3.86Å; R58-F94 VanDerWaalsContact NH1-CE1 3.28Å; A61-F94 HydrophobicContact CB-CD2 4.47Å; A61-F94 HydrophobicContact CB-CE2 3.62Å; A61-F94 HydrophobicContact CB-CZ 4.45Å; L92-F94 VanDerWaalsContact C-N 3.32Å; L92-F94 HydrophobicContact CB-CD2 4.03Å; L92-F94 HydrophobicContact CB-CE2 4.49Å; L92-F94 HydrophobicContact CD1-CD2 4.11Å; L92-F94 HydrophobicContact CD1-CE2 4.3Å; L92-F94 HydrophobicContact CD2-CE2 4.17Å; L92-F94 HydrophobicContact CG-CD2 4.43Å; F94-F96 WeakPolarHBondContact O-CD2 3.48Å; F94-F96 PolarHBondContact O-N 2.65Å; F94-D116 HydrophobicContact CD1-CB 4.1Å; F94-D116 WeakPolarHBondContact CD1-OD1 3.4Å; F94-D116 HydrophobicContact CE1-CB 4.4Å; F94-D116 WeakPolarHBondContact CE1-OD1 3.1Å
95	P	56.4	Low	65.7	Low	17 Å²	17	71.5 Å²	71.5	11%	0.11	36%	0.357	C	S	.	.			trans	-61.6	106.7	168.9	24.8	-31.4	0	0	0	108.6	N34 F97	N34-P95 HydrophobicContact CB-CB 4.35Å; N34-P95 HydrophobicContact CB-CG 3.56Å; N34-P95 WeakPolarHBondContact ND2-CB 3.46Å; P95-F97 PolarHBondContact O-N 2.93Å
96	F	55	Low	65.6	Low	82 Å²	82	71.3 Å²	71.3	36%	0.36	36%	0.356	S	S	.	.			trans	-60.1	-20.7	171.1	-77.4	-92.1	0	0	0	112.6	F87 L92 F94	F87-F96 VanDerWaalsContact C-CE1 3.43Å; F87-F96 VanDerWaalsContact C-CZ 3.46Å; F87-F96 HydrophobicContact CB-CE1 3.4Å; F87-F96 VanDerWaalsContact CB-CE1 3.4Å; F87-F96 HydrophobicContact CB-CZ 3.81Å; F87-F96 WeakPolarHBondContact O-CZ 3.29Å; L92-F96 HydrophobicContact CB-CE2 4.01Å; L92-F96 HydrophobicContact CB-CZ 4.11Å; L92-F96 HydrophobicContact CD1-CZ 4.43Å; F94-F96 WeakPolarHBondContact O-CD2 3.48Å; F94-F96 PolarHBondContact O-N 2.65Å
97	F	57.5	Low	66	Low	165 Å²	165	79 Å²	79	72%	0.724	39%	0.392	S	S	*	.	S	Bend	trans	-89.9	136.7	-174.4	-52.1	-69.4	0	0	0	109.6	N34 P95	N34-F97 PolarHBondContact ND2-O 2.82Å; P95-F97 PolarHBondContact O-N 2.93Å
98	A	60.9	Low	65.9	Low	56 Å²	56	83.9 Å²	83.9	46%	0.463	42%	0.415	S	S	.	.	P	Polyproline II helix	trans	-46.7	142.4	163.9	0	0	0	0	0	109.8	N100 E152	A98-N100 PolarHBondContact O-N 3.01Å; A98-N100 VanDerWaalsContact O-N 3.07Å; A98-E152 WeakPolarHBondContact CA-OE1 3.29Å; A98-E152 WeakPolarHBondContact CB-OE1 3.38Å
99	T	66.9	Low	66.2	Low	11 Å²	11	76.6 Å²	76.6	7%	0.067	39%	0.392	C	S	.	.	P	Polyproline II helix	trans	-63.6	119.9	173.9	-48.8	0	0	0	0	107.1	H33 N34 P101 E152 S156	H33-T99 PolarHBondContact CE1-OG1 3.5Å; H33-T99 VanDerWaalsContact CE1-OG1 3.26Å; H33-T99 PolarHBondContact NE2-OG1 3.44Å; N34-T99 WeakPolarHBondContact CB-OG1 3.4Å; N34-T99 VanDerWaalsContact CG-OG1 3.23Å; N34-T99 PolarHBondContact N-OG1 2.93Å; N34-T99 VanDerWaalsContact N-OG1 3.11Å; N34-T99 PolarHBondContact ND2-OG1 3.41Å; T99-P101 WeakPolarHBondContact O-CD 3.38Å; T99-E152 PolarHBondContact N-OE1 3.3Å; T99-S156 WeakPolarHBondContact CB-OG 3.41Å; T99-S156 PolarHBondContact O-OG 2.89Å
100	N	68.3	Low	66.9	Low	90 Å²	90	74.8 Å²	74.8	48%	0.481	39%	0.387	S	S	.	.			trans	-91.1	103.9	171.1	-172.6	-12.7	0	0	0	108.5	A98 E102 K103	A98-N100 PolarHBondContact O-N 3.01Å; A98-N100 VanDerWaalsContact O-N 3.07Å; N100-E102 PolarHBondContact O-N 3.18Å; N100-E102 PolarHBondContact OD1-N 2.9Å; N100-K103 HydrophobicContact CB-CB 4.44Å; N100-K103 PolarHBondContact O-N 3.36Å
101	P	64.6	Low	67.8	Low	68 Å²	68	79 Å²	79	44%	0.442	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-14.6	-177.5	31.2	-36.9	0	0	0	113.9	T99 L159	T99-P101 WeakPolarHBondContact O-CD 3.38Å; P101-L159 HydrophobicContact CB-CD1 3.15Å; P101-L159 HydrophobicContact CG-CD1 3.56Å
102	E	66.5	Low	69.2	Low	182 Å²	182	78.6 Å²	78.6	85%	0.85	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.3	-9.9	-178.6	-60.8	178.6	-179.5	0	0	112.8	N100	N100-E102 PolarHBondContact O-N 3.18Å; N100-E102 PolarHBondContact OD1-N 2.9Å
103	K	69.4	Low	70.7	Confident	155 Å²	155	78.1 Å²	78.1	67%	0.674	40%	0.396	S	S	*	.	S	Bend	trans	-109.9	136	-176.8	-167.2	179.2	177.2	-178.3	0	110.6	N100 T105	N100-K103 HydrophobicContact CB-CB 4.44Å; N100-K103 PolarHBondContact O-N 3.36Å; K103-T105 PolarHBondContact O-N 3.17Å
104	E	68.3	Low	72.3	Confident	183 Å²	183	79.9 Å²	79.9	86%	0.855	40%	0.402	S	S	*	.	P	Polyproline II helix	trans	-54.6	130.2	169.3	-167.9	171.6	-164.4	0	0	109.7	S106	E104-S106 PolarHBondContact O-N 3.46Å
105	T	74.8	Confident	73.5	Confident	58 Å²	58	80 Å²	80	36%	0.356	40%	0.404	S	S	.	.	P	Polyproline II helix	trans	-70	118.6	-176.9	-61.3	0	0	0	0	108.2	K103 V109 V110 R113	K103-T105 PolarHBondContact O-N 3.17Å; T105-V109 HydrophobicContact CG2-CB 3.73Å; T105-V109 HydrophobicContact CG2-CG1 3.66Å; T105-V110 HydrophobicContact CG2-CG2 3.61Å; T105-R113 PolarHBondContact OG1-NH1 2.94Å
106	S	80.6	Confident	75.1	Confident	52 Å²	52	79.2 Å²	79.2	36%	0.364	40%	0.399	S	S	.	.	P	Polyproline II helix	trans	-66.6	151.8	175	62.7	0	0	0	0	110.9	E104 E108 V109 V110	E104-S106 PolarHBondContact O-N 3.46Å; S106-E108 PolarHBondContact O-N 3.45Å; S106-E108 VanDerWaalsContact O-N 3.12Å; S106-V109 PolarHBondContact O-N 3.43Å; S106-V109 WeakPolarHBondContact OG-CG2 3.4Å; S106-V109 PolarHBondContact OG-N 2.88Å; S106-V110 PolarHBondContact O-N 3.11Å; S106-V110 VanDerWaalsContact O-N 3.1Å
107	E	81.6	Confident	76.9	Confident	174 Å²	174	75.5 Å²	75.5	81%	0.813	38%	0.383	S	S	*	.	H	α-helix	trans	-51.4	-35.6	173.3	-171.4	176.7	-165.6	0	0	111.9	V109 V110 E111	E107-V109 PolarHBondContact O-N 3.02Å; E107-V110 PolarHBondContact O-N 2.87Å; E107-E111 PolarHBondContact O-N 3.22Å
108	E	79	Confident	78.5	Confident	104 Å²	104	68.4 Å²	68.4	49%	0.486	35%	0.352	S	S	.	.	H	α-helix	trans	-62.5	-40.4	175.2	-58.7	-172.6	145.6	0	0	113.1	S106 E111 L112 R416	S106-E108 PolarHBondContact O-N 3.45Å; S106-E108 VanDerWaalsContact O-N 3.12Å; E108-E111 PolarHBondContact O-N 3.28Å; E108-L112 VanDerWaalsContact O-CG 3.27Å; E108-L112 WeakPolarHBondContact O-CG 3.28Å; E108-L112 PolarHBondContact O-N 2.86Å; E108-L112 VanDerWaalsContact O-N 3.12Å; E108-R416 IonicContact OE1-CZ 3.73Å; E108-R416 IonicContact OE1-NH1 2.87Å; E108-R416 PolarHBondContact OE1-NH1 3.29Å
109	V	81.8	Confident	79.9	Confident	37 Å²	37	65.7 Å²	65.7	22%	0.224	33%	0.33	C	S	.	.	H	α-helix	trans	-71.4	-35.9	177.5	173.5	0	0	0	0	110.8	T105 S106 E107 L112 R113	T105-V109 HydrophobicContact CG2-CB 3.73Å; T105-V109 HydrophobicContact CG2-CG1 3.66Å; S106-V109 PolarHBondContact O-N 3.43Å; S106-V109 WeakPolarHBondContact OG-CG2 3.4Å; S106-V109 PolarHBondContact OG-N 2.88Å; E107-V109 PolarHBondContact O-N 3.02Å; V109-L112 PolarHBondContact O-N 3.25Å; V109-R113 WeakPolarHBondContact O-CG 3.18Å; V109-R113 PolarHBondContact O-N 3.34Å
110	V	83.2	Confident	81.2	Confident	39 Å²	39	65.3 Å²	65.3	24%	0.236	33%	0.327	C	S	.	.	H	α-helix	trans	-61	-46.6	173.8	179.3	0	0	0	0	110.5	W30 T105 S106 E107 L112 R113 R114	W30-V110 HydrophobicContact CH2-CG1 4.03Å; W30-V110 HydrophobicContact CZ3-CG1 4.15Å; T105-V110 HydrophobicContact CG2-CG2 3.61Å; S106-V110 PolarHBondContact O-N 3.11Å; S106-V110 VanDerWaalsContact O-N 3.1Å; E107-V110 PolarHBondContact O-N 2.87Å; V110-L112 VanDerWaalsContact C-N 3.3Å; V110-L112 PolarHBondContact O-N 2.84Å; V110-R113 WeakPolarHBondContact O-CB 3.37Å; V110-R113 PolarHBondContact O-N 2.78Å; V110-R113 VanDerWaalsContact O-N 3.15Å; V110-R114 WeakPolarHBondContact O-CB 3.35Å; V110-R114 PolarHBondContact O-N 3.32Å
111	E	83.8	Confident	82.4	Confident	89 Å²	89	62.2 Å²	62.2	42%	0.416	31%	0.309	S	S	.	.	H	α-helix	trans	-65.2	-33.3	179.2	-168.3	57.4	-145.9	0	0	112.6	E107 E108 R114 S115	E107-E111 PolarHBondContact O-N 3.22Å; E108-E111 PolarHBondContact O-N 3.28Å; E111-R114 WeakPolarHBondContact O-CB 3.39Å; E111-R114 PolarHBondContact O-N 3.28Å; E111-R114 IonicContact OE1-CZ 2.61Å; E111-R114 IonicContact OE1-NH1 3.79Å; E111-R114 PolarHBondContact OE1-NH1 3.47Å; E111-R114 WeakPolarHBondContact OE2-CD 3.4Å; E111-S115 WeakPolarHBondContact O-CB 3.26Å; E111-S115 PolarHBondContact O-N 3Å; E111-S115 PolarHBondContact O-OG 2.96Å
112	L	83.6	Confident	83.7	Confident	52 Å²	52	59.5 Å²	59.5	27%	0.272	29%	0.292	S	S	.	.	H	α-helix	trans	-65.8	-43.4	172.3	-69.8	170.6	0	0	0	111.8	T93 E108 V109 V110 R114 S115 D116	T93-L112 HydrophobicContact CG2-CD2 3.99Å; T93-L112 VanDerWaalsContact O-CD2 3.27Å; T93-L112 WeakPolarHBondContact O-CD2 3.17Å; E108-L112 VanDerWaalsContact O-CG 3.27Å; E108-L112 WeakPolarHBondContact O-CG 3.28Å; E108-L112 PolarHBondContact O-N 2.86Å; E108-L112 VanDerWaalsContact O-N 3.12Å; V109-L112 PolarHBondContact O-N 3.25Å; V110-L112 VanDerWaalsContact C-N 3.3Å; V110-L112 PolarHBondContact O-N 2.84Å; L112-R114 VanDerWaalsContact C-N 3.33Å; L112-R114 PolarHBondContact O-N 3.24Å; L112-S115 PolarHBondContact O-N 2.91Å; L112-D116 WeakPolarHBondContact O-CB 3.4Å; L112-D116 PolarHBondContact O-N 3.05Å
113	R	87.4	Confident	84.8	Confident	6 Å²	6	50.8 Å²	50.8	2%	0.023	25%	0.251	C	S	.	.	H	α-helix	trans	-61.9	-42.3	174.5	-70.8	173.5	-174.3	156.7	7.3	111.2	W30 M31 N34 T105 V109 V110 D116 V117	W30-R113 HydrophobicContact CE3-CB 4Å; W30-R113 HydrophobicContact CZ3-CB 4.05Å; M31-R113 PolarHBondContact O-NH1 3.45Å; N34-R113 VanDerWaalsContact OD1-CZ 3.31Å; N34-R113 PolarHBondContact OD1-NE 2.83Å; N34-R113 PolarHBondContact OD1-NH2 2.93Å; T105-R113 PolarHBondContact OG1-NH1 2.94Å; V109-R113 WeakPolarHBondContact O-CG 3.18Å; V109-R113 PolarHBondContact O-N 3.34Å; V110-R113 WeakPolarHBondContact O-CB 3.37Å; V110-R113 PolarHBondContact O-N 2.78Å; V110-R113 VanDerWaalsContact O-N 3.15Å; R113-D116 WeakPolarHBondContact O-CB 3.3Å; R113-D116 PolarHBondContact O-N 2.86Å; R113-V117 WeakPolarHBondContact O-CG2 3.28Å; R113-V117 PolarHBondContact O-N 2.85Å
114	R	87.2	Confident	86	Confident	47 Å²	47	43.9 Å²	43.9	18%	0.177	22%	0.221	C	C	.	.	H	α-helix	trans	-58.3	-52	176.2	-174.5	-177.2	172.4	-102.8	-3.9	111	W30 L42 D44 E45 V110 E111 L112 D116 V117 Q118	W30-R114 HydrophobicContact CH2-CB 3.64Å; W30-R114 HydrophobicContact CH2-CG 4.01Å; W30-R114 VanDerWaalsContact CZ3-CA 3.48Å; W30-R114 HydrophobicContact CZ3-CB 3.57Å; W30-R114 HydrophobicContact CZ3-CG 4.36Å; W30-R114 VanDerWaalsContact CZ3-N 3.35Å; L42-R114 HydrophobicContact CD1-CG 3.83Å; D44-R114 IonicContact OD1-NH2 3.68Å; D44-R114 PolarHBondContact OD1-NH2 2.98Å; D44-R114 IonicContact OD2-CZ 3.59Å; D44-R114 IonicContact OD2-NE 2.82Å; D44-R114 PolarHBondContact OD2-NE 2.66Å; D44-R114 IonicContact OD2-NH2 2.76Å; D44-R114 PolarHBondContact OD2-NH2 3.08Å; E45-R114 PolarHBondContact O-NH2 3.06Å; V110-R114 WeakPolarHBondContact O-CB 3.35Å; V110-R114 PolarHBondContact O-N 3.32Å; E111-R114 WeakPolarHBondContact O-CB 3.39Å; E111-R114 PolarHBondContact O-N 3.28Å; E111-R114 IonicContact OE1-CZ 2.61Å; E111-R114 IonicContact OE1-NH1 3.79Å; E111-R114 PolarHBondContact OE1-NH1 3.47Å; E111-R114 WeakPolarHBondContact OE2-CD 3.4Å; L112-R114 VanDerWaalsContact C-N 3.33Å; L112-R114 PolarHBondContact O-N 3.24Å; R114-D116 VanDerWaalsContact C-N 3.31Å; R114-D116 PolarHBondContact O-N 2.99Å; R114-V117 PolarHBondContact O-N 3.4Å; R114-Q118 VanDerWaalsContact NH2-NE2 3.18Å; R114-Q118 WeakPolarHBondContact O-CB 3.46Å; R114-Q118 WeakPolarHBondContact O-CG 3.05Å; R114-Q118 PolarHBondContact O-N 2.8Å
115	S	87.4	Confident	87	Confident	13 Å²	13	37.6 Å²	37.6	9%	0.091	19%	0.193	C	C	.	.	H	α-helix	trans	-59.9	-38.3	176.8	-69.4	0	0	0	0	112.8	T93 E111 L112 S119	T93-S115 VanDerWaalsContact CG2-CB 3.41Å; E111-S115 WeakPolarHBondContact O-CB 3.26Å; E111-S115 PolarHBondContact O-N 3Å; E111-S115 PolarHBondContact O-OG 2.96Å; L112-S115 PolarHBondContact O-N 2.91Å; S115-S119 WeakPolarHBondContact O-CB 3.39Å; S115-S119 PolarHBondContact O-N 2.87Å; S115-S119 PolarHBondContact O-OG 3.44Å; S115-S119 VanDerWaalsContact O-OG 3.04Å
116	D	90	Very high	87.6	Confident	1 Å²	1	34.9 Å²	34.9	1%	0.005	18%	0.176	C	C	.	.	H	α-helix	trans	-61.1	-52.9	175.2	-177.6	27.3	0	0	0	110.9	Y38 R58 F94 L112 R113 R114 Q118 S119 H120 R148	Y38-D116 PolarHBondContact OH-OD1 3.42Å; Y38-D116 VanDerWaalsContact OH-OD1 3.05Å; Y38-D116 PolarHBondContact OH-OD2 3.17Å; R58-D116 IonicContact CZ-OD1 3.56Å; R58-D116 PolarHBondContact NH1-O 2.78Å; R58-D116 IonicContact NH1-OD1 3.69Å; R58-D116 PolarHBondContact NH1-OD1 3.18Å; R58-D116 IonicContact NH2-OD1 2.72Å; F94-D116 HydrophobicContact CD1-CB 4.1Å; F94-D116 WeakPolarHBondContact CD1-OD1 3.4Å; F94-D116 HydrophobicContact CE1-CB 4.4Å; F94-D116 WeakPolarHBondContact CE1-OD1 3.1Å; L112-D116 WeakPolarHBondContact O-CB 3.4Å; L112-D116 PolarHBondContact O-N 3.05Å; R113-D116 WeakPolarHBondContact O-CB 3.3Å; R113-D116 PolarHBondContact O-N 2.86Å; R114-D116 VanDerWaalsContact C-N 3.31Å; R114-D116 PolarHBondContact O-N 2.99Å; D116-Q118 PolarHBondContact O-N 2.67Å; D116-S119 PolarHBondContact O-N 2.95Å; D116-S119 PolarHBondContact O-OG 2.86Å; D116-H120 PolarHBondContact O-N 3.26Å; D116-H120 VanDerWaalsContact O-N 3.13Å; D116-R148 IonicContact OD1-NH1 3.56Å; D116-R148 PolarHBondContact OD1-NH1 3.31Å; D116-R148 IonicContact OD2-CZ 2.98Å; D116-R148 VanDerWaalsContact OD2-CZ 3.26Å; D116-R148 IonicContact OD2-NH1 2.74Å; D116-R148 PolarHBondContact OD2-NH1 3.22Å; D116-R148 IonicContact OD2-NH2 3.7Å; D116-R148 PolarHBondContact OD2-NH2 3.13Å
117	V	91.5	Very high	88.1	Confident	3 Å²	3	32.4 Å²	32.4	2%	0.018	16%	0.159	C	C	.	.	H	α-helix	trans	-60.1	-50.2	178.2	179.6	0	0	0	0	111.3	W30 Q36 Y38 L42 R113 R114 S119 H120 F121	W30-V117 HydrophobicContact CB-CG2 4.02Å; Q36-V117 HydrophobicContact CG-CG2 4.28Å; Y38-V117 HydrophobicContact CD1-CB 4.38Å; Y38-V117 HydrophobicContact CD1-CG1 4.3Å; Y38-V117 HydrophobicContact CD1-CG2 4.12Å; Y38-V117 HydrophobicContact CE1-CG2 4.13Å; L42-V117 HydrophobicContact CD1-CB 4.24Å; L42-V117 HydrophobicContact CD1-CG1 4.24Å; L42-V117 HydrophobicContact CD2-CB 4.33Å; L42-V117 HydrophobicContact CD2-CG1 3.73Å; L42-V117 HydrophobicContact CG-CB 4.22Å; L42-V117 HydrophobicContact CG-CG1 3.68Å; R113-V117 WeakPolarHBondContact O-CG2 3.28Å; R113-V117 PolarHBondContact O-N 2.85Å; R114-V117 PolarHBondContact O-N 3.4Å; V117-S119 VanDerWaalsContact C-N 3.34Å; V117-S119 PolarHBondContact O-N 3.28Å; V117-H120 WeakPolarHBondContact O-CB 3.48Å; V117-H120 PolarHBondContact O-N 3.19Å; V117-F121 HydrophobicContact CG1-CD2 3.89Å; V117-F121 HydrophobicContact CG1-CE2 3.78Å; V117-F121 VanDerWaalsContact O-CD2 3.28Å; V117-F121 WeakPolarHBondContact O-CD2 3.49Å; V117-F121 PolarHBondContact O-N 3.02Å
118	Q	91.2	Very high	88.5	Confident	16 Å²	16	24.1 Å²	24.1	8%	0.075	12%	0.12	C	C	.	.	H	α-helix	trans	-57.4	-47	179.2	-73.3	177	-24.4	0	0	111.6	L42 I46 L54 R114 D116 H120 F121 V122	L42-Q118 HydrophobicContact CD1-CG 3.92Å; I46-Q118 HydrophobicContact CD1-CB 4.31Å; L54-Q118 HydrophobicContact CD1-CB 3.59Å; R114-Q118 VanDerWaalsContact NH2-NE2 3.18Å; R114-Q118 WeakPolarHBondContact O-CB 3.46Å; R114-Q118 WeakPolarHBondContact O-CG 3.05Å; R114-Q118 PolarHBondContact O-N 2.8Å; D116-Q118 PolarHBondContact O-N 2.67Å; Q118-H120 VanDerWaalsContact C-N 3.29Å; Q118-H120 PolarHBondContact O-N 3.1Å; Q118-F121 PolarHBondContact O-N 2.98Å; Q118-V122 WeakPolarHBondContact O-CB 3.19Å; Q118-V122 WeakPolarHBondContact O-CG2 3.38Å; Q118-V122 PolarHBondContact O-N 2.74Å
119	S	91.1	Very high	88.7	Confident	0 Å²	0	21.5 Å²	21.5	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-61.7	-34.3	-179.7	69	0	0	0	0	113.3	R58 S115 D116 V117 L123	R58-S119 VanDerWaalsContact CD-C 3.49Å; R58-S119 WeakPolarHBondContact CD-O 3.23Å; R58-S119 PolarHBondContact NH1-OG 2.86Å; S115-S119 WeakPolarHBondContact O-CB 3.39Å; S115-S119 PolarHBondContact O-N 2.87Å; S115-S119 PolarHBondContact O-OG 3.44Å; S115-S119 VanDerWaalsContact O-OG 3.04Å; D116-S119 PolarHBondContact O-N 2.95Å; D116-S119 PolarHBondContact O-OG 2.86Å; V117-S119 VanDerWaalsContact C-N 3.34Å; V117-S119 PolarHBondContact O-N 3.28Å; S119-L123 PolarHBondContact O-N 3.28Å
120	H	94	Very high	88.8	Confident	2 Å²	2	22.5 Å²	22.5	1%	0.009	12%	0.116	C	C	.	.	H	α-helix	trans	-60.8	-53.1	174.5	174.6	83.3	0	0	0	111.5	Y38 D116 V117 Q118 V122 L123 M124 E141	Y38-H120 WeakPolarHBondContact CB-CD2 3.44Å; Y38-H120 HydrophobicContact CD1-CB 3.87Å; Y38-H120 AromaticContact CD1-CG 3.89Å; Y38-H120 HydrophobicContact CD2-CB 4.23Å; Y38-H120 AromaticContact CD2-CD2 3.7Å; Y38-H120 AromaticContact CD2-CE1 3.47Å; Y38-H120 VanDerWaalsContact CD2-CE1 3.47Å; Y38-H120 WeakPolarHBondContact CD2-CE1 3.48Å; Y38-H120 AromaticContact CD2-CG 3.52Å; Y38-H120 AromaticContact CD2-ND1 3.38Å; Y38-H120 WeakPolarHBondContact CD2-ND1 2.79Å; Y38-H120 AromaticContact CD2-NE2 3.69Å; Y38-H120 HydrophobicContact CE1-CB 3.87Å; Y38-H120 HydrophobicContact CE2-CB 4.28Å; Y38-H120 AromaticContact CE2-CG 3.9Å; Y38-H120 AromaticContact CE2-ND1 3.62Å; Y38-H120 HydrophobicContact CG-CB 4.06Å; Y38-H120 AromaticContact CG-CD2 3.44Å; Y38-H120 VanDerWaalsContact CG-CD2 3.44Å; Y38-H120 AromaticContact CG-CG 3.54Å; Y38-H120 AromaticContact CG-ND1 3.91Å; Y38-H120 AromaticContact CG-NE2 3.79Å; D116-H120 PolarHBondContact O-N 3.26Å; D116-H120 VanDerWaalsContact O-N 3.13Å; V117-H120 WeakPolarHBondContact O-CB 3.48Å; V117-H120 PolarHBondContact O-N 3.19Å; Q118-H120 VanDerWaalsContact C-N 3.29Å; Q118-H120 PolarHBondContact O-N 3.1Å; H120-V122 PolarHBondContact O-N 3.05Å; H120-L123 PolarHBondContact O-N 2.96Å; H120-M124 PolarHBondContact O-N 3.44Å; H120-E141 IonicContact CE1-OE1 3.02Å; H120-E141 IonicContact CG-OE1 2.67Å; H120-E141 IonicContact ND1-OE1 2.75Å; H120-E141 PolarHBondContact ND1-OE1 3.35Å
121	F	93.4	Very high	88.9	Confident	25 Å²	25	23.8 Å²	23.8	11%	0.11	13%	0.131	C	C	.	.	H	α-helix	trans	-68.3	-35.8	-177.7	-75.3	-79.3	0	0	0	112.5	Y38 F40 P41 V117 Q118 M124 L125	Y38-F121 HydrophobicContact CD1-CE2 4.49Å; Y38-F121 WeakPolarHBondContact O-CZ 3.45Å; F40-F121 VanDerWaalsContact O-CE2 3.22Å; F40-F121 WeakPolarHBondContact O-CE2 3.38Å; F40-F121 VanDerWaalsContact O-CZ 3.26Å; F40-F121 WeakPolarHBondContact O-CZ 3.26Å; P41-F121 HydrophobicContact CB-CD1 3.87Å; P41-F121 HydrophobicContact CB-CD2 4.14Å; P41-F121 HydrophobicContact CB-CE1 4.06Å; P41-F121 HydrophobicContact CB-CE2 4.3Å; P41-F121 HydrophobicContact CB-CG 3.96Å; P41-F121 HydrophobicContact CB-CZ 4.28Å; P41-F121 HydrophobicContact CG-CE1 4.47Å; P41-F121 VanDerWaalsContact N-CZ 3.27Å; V117-F121 HydrophobicContact CG1-CD2 3.89Å; V117-F121 HydrophobicContact CG1-CE2 3.78Å; V117-F121 VanDerWaalsContact O-CD2 3.28Å; V117-F121 WeakPolarHBondContact O-CD2 3.49Å; V117-F121 PolarHBondContact O-N 3.02Å; Q118-F121 PolarHBondContact O-N 2.98Å; F121-M124 HydrophobicContact CD1-CE 3.39Å; F121-M124 HydrophobicContact CE1-CE 3.78Å; F121-M124 HydrophobicContact CG-CE 4.46Å; F121-M124 WeakPolarHBondContact O-CB 3.46Å; F121-M124 PolarHBondContact O-N 3.14Å; F121-L125 PolarHBondContact O-N 3.28Å; F121-L125 VanDerWaalsContact O-N 3.11Å
122	V	90.9	Very high	88.8	Confident	11 Å²	11	25.9 Å²	25.9	7%	0.067	14%	0.14	C	C	.	.	H	α-helix	trans	-64.4	-42.7	175	176.7	0	0	0	0	111.3	M51 A55 Q118 H120 M124 L125 A126 L297	M51-V122 HydrophobicContact CG-CB 4.27Å; M51-V122 HydrophobicContact CG-CG1 3.63Å; M51-V122 HydrophobicContact CG-CG2 3.52Å; M51-V122 HydrophobicContact SD-CG1 4.44Å; M51-V122 HydrophobicContact SD-CG2 4.47Å; A55-V122 HydrophobicContact CB-CG1 3.65Å; Q118-V122 WeakPolarHBondContact O-CB 3.19Å; Q118-V122 WeakPolarHBondContact O-CG2 3.38Å; Q118-V122 PolarHBondContact O-N 2.74Å; H120-V122 PolarHBondContact O-N 3.05Å; V122-M124 VanDerWaalsContact C-N 3.35Å; V122-L125 WeakPolarHBondContact O-CB 3.38Å; V122-L125 PolarHBondContact O-N 3.49Å; V122-A126 PolarHBondContact O-N 3.49Å; V122-L297 HydrophobicContact CG1-CD1 4.02Å; V122-L297 HydrophobicContact CG1-CD2 3.72Å
123	L	91.5	Very high	88.9	Confident	0 Å²	0	24.2 Å²	24.2	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-68.7	-33.6	175	-77.6	-161.2	0	0	0	113	A55 R58 Q59 L62 S119 H120 L125 A126 Y127 F137	A55-L123 HydrophobicContact CB-CD2 3.93Å; A55-L123 WeakPolarHBondContact O-CD2 3.46Å; R58-L123 HydrophobicContact CB-CD1 3.71Å; R58-L123 HydrophobicContact CB-CG 4.22Å; R58-L123 HydrophobicContact CG-CD1 3.51Å; R58-L123 HydrophobicContact CG-CG 4.29Å; Q59-L123 HydrophobicContact CB-CD1 4.38Å; Q59-L123 HydrophobicContact CB-CD2 4.37Å; L62-L123 HydrophobicContact CD1-CD1 3.71Å; S119-L123 PolarHBondContact O-N 3.28Å; H120-L123 PolarHBondContact O-N 2.96Å; L123-L125 VanDerWaalsContact C-N 3.26Å; L123-L125 PolarHBondContact O-N 2.83Å; L123-A126 HydrophobicContact CD2-CB 4.37Å; L123-A126 PolarHBondContact O-N 2.84Å; L123-Y127 HydrophobicContact CB-CD2 4.43Å; L123-Y127 HydrophobicContact CD2-CD2 4.22Å; L123-Y127 HydrophobicContact CD2-CE2 3.94Å; L123-Y127 WeakPolarHBondContact O-CB 3.18Å; L123-Y127 WeakPolarHBondContact O-CD2 3.28Å; L123-Y127 PolarHBondContact O-N 3.34Å; L123-F137 HydrophobicContact CB-CD2 4.21Å; L123-F137 HydrophobicContact CB-CE2 3.51Å; L123-F137 HydrophobicContact CB-CZ 3.88Å; L123-F137 HydrophobicContact CD1-CD2 4.45Å; L123-F137 HydrophobicContact CD1-CE2 4.01Å; L123-F137 HydrophobicContact CG-CE2 4.45Å
124	M	92.9	Very high	89.1	Confident	10 Å²	10	27.3 Å²	27.3	5%	0.049	14%	0.144	C	C	.	.	H	α-helix	trans	-58.3	-41.7	173.1	-172.4	173.4	55.7	0	0	111.1	H120 F121 V122 A128 F137 L274 L278 V281	H120-M124 PolarHBondContact O-N 3.44Å; F121-M124 HydrophobicContact CD1-CE 3.39Å; F121-M124 HydrophobicContact CE1-CE 3.78Å; F121-M124 HydrophobicContact CG-CE 4.46Å; F121-M124 WeakPolarHBondContact O-CB 3.46Å; F121-M124 PolarHBondContact O-N 3.14Å; V122-M124 VanDerWaalsContact C-N 3.35Å; M124-A128 VanDerWaalsContact O-CB 3.24Å; M124-A128 WeakPolarHBondContact O-CB 3.24Å; M124-A128 PolarHBondContact O-N 2.9Å; M124-F137 HydrophobicContact CB-CE1 3.94Å; M124-F137 HydrophobicContact CB-CZ 4.38Å; M124-F137 HydrophobicContact CG-CE1 4.35Å; M124-L274 HydrophobicContact SD-CD1 4.5Å; M124-L278 HydrophobicContact CG-CB 4.4Å; M124-L278 HydrophobicContact CG-CD1 3.59Å; M124-L278 HydrophobicContact SD-CB 4.49Å; M124-V281 HydrophobicContact CE-CG2 3.68Å; M124-V281 HydrophobicContact CG-CG2 4.07Å; M124-V281 HydrophobicContact SD-CG2 3.91Å
125	L	90.2	Very high	89.2	Confident	51 Å²	51	30.4 Å²	30.4	27%	0.267	16%	0.16	S	C	.	.	H	α-helix	trans	-62.7	-51.9	171.4	-68.7	170.8	0	0	0	111.2	F121 V122 L123 Y127 A128 V281 F298	F121-L125 PolarHBondContact O-N 3.28Å; F121-L125 VanDerWaalsContact O-N 3.11Å; V122-L125 WeakPolarHBondContact O-CB 3.38Å; V122-L125 PolarHBondContact O-N 3.49Å; L123-L125 VanDerWaalsContact C-N 3.26Å; L123-L125 PolarHBondContact O-N 2.83Å; L125-Y127 PolarHBondContact O-N 3.35Å; L125-A128 PolarHBondContact O-N 3.48Å; L125-V281 HydrophobicContact CD2-CG1 3.85Å; L125-F298 WeakPolarHBondContact O-CE1 3.36Å
126	A	87.5	Confident	89.2	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-58.5	-32.9	-176	0	0	0	0	0	113.9	V122 L123 L297	V122-A126 PolarHBondContact O-N 3.49Å; L123-A126 HydrophobicContact CD2-CB 4.37Å; L123-A126 PolarHBondContact O-N 2.84Å; A126-L297 HydrophobicContact CB-CB 4.15Å
127	Y	90.4	Very high	89.4	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-104.3	2.1	-175.2	-77.3	-92.1	0	0	0	114.7	Q59 L123 L125 N129 N133 R134 W136 F137 A301	Q59-Y127 WeakPolarHBondContact CG-OH 3.49Å; Q59-Y127 PolarHBondContact NE2-OH 3.36Å; L123-Y127 HydrophobicContact CB-CD2 4.43Å; L123-Y127 HydrophobicContact CD2-CD2 4.22Å; L123-Y127 HydrophobicContact CD2-CE2 3.94Å; L123-Y127 WeakPolarHBondContact O-CB 3.18Å; L123-Y127 WeakPolarHBondContact O-CD2 3.28Å; L123-Y127 PolarHBondContact O-N 3.34Å; L125-Y127 PolarHBondContact O-N 3.35Å; Y127-N129 PolarHBondContact O-N 3.41Å; Y127-N133 HydrophobicContact CD1-CB 3.85Å; Y127-N133 CarbonylContact O-C 3.59Å; Y127-N133 VanDerWaalsContact O-CB 3.27Å; Y127-N133 WeakPolarHBondContact O-CB 3.44Å; Y127-R134 WeakPolarHBondContact O-CG 3.37Å; Y127-R134 PolarHBondContact O-N 3.33Å; Y127-W136 AromaticContact CD1-CE3 3.89Å; Y127-W136 HydrophobicContact CD1-CE3 3.89Å; Y127-W136 HydrophobicContact CD1-CZ3 4.19Å; Y127-W136 HydrophobicContact CE1-CD2 4.46Å; Y127-W136 AromaticContact CE1-CE3 3.41Å; Y127-W136 HydrophobicContact CE1-CE3 3.41Å; Y127-W136 VanDerWaalsContact CE1-CE3 3.41Å; Y127-W136 AromaticContact CE1-CZ3 3.46Å; Y127-W136 HydrophobicContact CE1-CZ3 3.46Å; Y127-W136 VanDerWaalsContact CE1-CZ3 3.46Å; Y127-W136 HydrophobicContact CE2-CZ3 4.09Å; Y127-W136 AromaticContact CZ-CE3 3.88Å; Y127-W136 AromaticContact CZ-CZ3 3.38Å; Y127-W136 VanDerWaalsContact OH-CZ3 3.29Å; Y127-W136 WeakPolarHBondContact OH-CZ3 3.16Å; Y127-F137 HydrophobicContact CD1-CB 4.15Å; Y127-F137 HydrophobicContact CD2-CD2 4.41Å; Y127-F137 HydrophobicContact CG-CB 3.9Å; Y127-F137 HydrophobicContact CG-CG 4.31Å; Y127-A301 HydrophobicContact CD1-CB 3.93Å; Y127-A301 HydrophobicContact CE1-CB 3.83Å; Y127-A301 HydrophobicContact CG-CB 4.41Å
128	A	89.8	Confident	89.6	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.162	C	C	.	.			trans	-73.9	-22.7	-177.5	0	0	0	0	0	114.7	M124 L125 T130 R134 L278 V281 I285	M124-A128 VanDerWaalsContact O-CB 3.24Å; M124-A128 WeakPolarHBondContact O-CB 3.24Å; M124-A128 PolarHBondContact O-N 2.9Å; L125-A128 PolarHBondContact O-N 3.48Å; A128-T130 PolarHBondContact O-N 3.24Å; A128-R134 WeakPolarHBondContact O-CD 3.43Å; A128-R134 PolarHBondContact O-NH1 2.9Å; A128-L278 HydrophobicContact CB-CD1 4.29Å; A128-V281 HydrophobicContact CB-CB 4.18Å; A128-V281 HydrophobicContact CB-CG1 3.5Å; A128-I285 HydrophobicContact CB-CD1 3.87Å
129	N	83.3	Confident	89.8	Confident	50 Å²	50	32.7 Å²	32.7	27%	0.267	17%	0.168	S	C	.	.	S	Bend	trans	-62	-36	-167.6	62.4	-7	0	0	0	115.3	Y127 N133 F298	Y127-N129 PolarHBondContact O-N 3.41Å; N129-N133 PolarHBondContact OD1-ND2 2.75Å; N129-F298 HydrophobicContact CB-CD1 4.32Å
130	T	83.8	Confident	89.9	Confident	58 Å²	58	33.3 Å²	33.3	36%	0.356	17%	0.172	S	C	.	.	S	Bend	trans	-127.3	153.1	-179.4	76	0	0	0	0	111.8	A128 E132 N133 R134	A128-T130 PolarHBondContact O-N 3.24Å; T130-E132 PolarHBondContact O-N 3.15Å; T130-N133 PolarHBondContact O-N 3.04Å; T130-N133 VanDerWaalsContact OG1-CB 3.3Å; T130-N133 WeakPolarHBondContact OG1-CB 3.41Å; T130-N133 PolarHBondContact OG1-N 3.2Å; T130-N133 VanDerWaalsContact OG1-N 3.13Å; T130-N133 PolarHBondContact OG1-ND2 2.93Å; T130-R134 VanDerWaalsContact O-CG 3.32Å; T130-R134 WeakPolarHBondContact O-CG 3.29Å; T130-R134 PolarHBondContact O-N 3.5Å; T130-R134 PolarHBondContact O-NH1 3.33Å
131	A	86.6	Confident	90	Very high	66 Å²	66	33.3 Å²	33.3	55%	0.545	17%	0.171	S	C	.	.	H	α-helix	trans	-60.1	-36.4	177.6	0	0	0	0	0	112.6	R134 Q135	A131-R134 PolarHBondContact O-N 3.44Å; A131-Q135 WeakPolarHBondContact O-CB 3.37Å; A131-Q135 PolarHBondContact O-N 2.8Å
132	E	80.6	Confident	90.2	Very high	132 Å²	132	32.2 Å²	32.2	62%	0.617	17%	0.167	S	C	*	.	H	α-helix	trans	-67.4	-43.7	178.1	-166	-164.4	144	0	0	112.1	T130 R134 Q135 W136 R304	T130-E132 PolarHBondContact O-N 3.15Å; E132-R134 VanDerWaalsContact C-N 3.33Å; E132-R134 PolarHBondContact O-N 3.35Å; E132-Q135 PolarHBondContact O-N 3.24Å; E132-W136 PolarHBondContact O-N 3.24Å; E132-W136 VanDerWaalsContact O-N 3.07Å; E132-R304 IonicContact OE1-NH2 2.86Å; E132-R304 PolarHBondContact OE1-NH2 3.07Å
133	N	86	Confident	90.5	Very high	17 Å²	17	32 Å²	32	9%	0.091	17%	0.165	C	C	.	.	H	α-helix	trans	-62.4	-43.6	175.9	-74.9	-16.8	0	0	0	110.9	Y127 N129 T130 W136 F137 A301	Y127-N133 HydrophobicContact CD1-CB 3.85Å; Y127-N133 CarbonylContact O-C 3.59Å; Y127-N133 VanDerWaalsContact O-CB 3.27Å; Y127-N133 WeakPolarHBondContact O-CB 3.44Å; N129-N133 PolarHBondContact OD1-ND2 2.75Å; T130-N133 PolarHBondContact O-N 3.04Å; T130-N133 VanDerWaalsContact OG1-CB 3.3Å; T130-N133 WeakPolarHBondContact OG1-CB 3.41Å; T130-N133 PolarHBondContact OG1-N 3.2Å; T130-N133 VanDerWaalsContact OG1-N 3.13Å; T130-N133 PolarHBondContact OG1-ND2 2.93Å; N133-W136 PolarHBondContact O-N 2.97Å; N133-F137 WeakPolarHBondContact O-CB 3.26Å; N133-F137 PolarHBondContact O-N 3.12Å; N133-A301 WeakPolarHBondContact ND2-CB 3.35Å
134	R	91.8	Very high	90.6	Very high	72 Å²	72	32 Å²	32	27%	0.272	17%	0.166	S	C	.	.	H	α-helix	trans	-60.8	-47.3	176.4	-71.2	-169.4	-54.8	-94.5	7.5	112.7	Y127 A128 T130 A131 E132 W136 F137 L138 L278	Y127-R134 WeakPolarHBondContact O-CG 3.37Å; Y127-R134 PolarHBondContact O-N 3.33Å; A128-R134 WeakPolarHBondContact O-CD 3.43Å; A128-R134 PolarHBondContact O-NH1 2.9Å; T130-R134 VanDerWaalsContact O-CG 3.32Å; T130-R134 WeakPolarHBondContact O-CG 3.29Å; T130-R134 PolarHBondContact O-N 3.5Å; T130-R134 PolarHBondContact O-NH1 3.33Å; A131-R134 PolarHBondContact O-N 3.44Å; E132-R134 VanDerWaalsContact C-N 3.33Å; E132-R134 PolarHBondContact O-N 3.35Å; R134-W136 VanDerWaalsContact C-N 3.34Å; R134-W136 PolarHBondContact O-N 2.89Å; R134-F137 PolarHBondContact O-N 3.38Å; R134-L138 VanDerWaalsContact O-CB 3.24Å; R134-L138 WeakPolarHBondContact O-CB 3.29Å; R134-L138 PolarHBondContact O-N 3.21Å; R134-L278 HydrophobicContact CB-CD2 3.59Å; R134-L278 HydrophobicContact CB-CG 4.12Å; R134-L278 HydrophobicContact CG-CD1 4.05Å; R134-L278 HydrophobicContact CG-CD2 3.81Å; R134-L278 HydrophobicContact CG-CG 3.76Å; R134-L278 WeakPolarHBondContact O-CD2 3.37Å
135	Q	88.8	Confident	90.7	Very high	112 Å²	112	31.8 Å²	31.8	52%	0.523	16%	0.164	S	C	.	.	H	α-helix	trans	-62.2	-43.4	-178.6	-179.7	61	16.3	0	0	111.6	A131 E132 Q139	A131-Q135 WeakPolarHBondContact O-CB 3.37Å; A131-Q135 PolarHBondContact O-N 2.8Å; E132-Q135 PolarHBondContact O-N 3.24Å; Q135-Q139 VanDerWaalsContact O-CB 3.27Å; Q135-Q139 WeakPolarHBondContact O-CB 3.34Å; Q135-Q139 PolarHBondContact O-N 3.44Å
136	W	87.7	Confident	90.9	Very high	21 Å²	21	32.8 Å²	32.8	8%	0.08	16%	0.164	C	C	.	.	H	α-helix	trans	-65.4	-48.6	176.9	177.9	93.6	0	0	0	111.9	L62 L63 E66 Y127 E132 N133 R134 L138 Q139 Q140 R304	L62-W136 HydrophobicContact CB-CH2 3.69Å; L62-W136 HydrophobicContact CB-CZ2 4.31Å; L62-W136 HydrophobicContact CB-CZ3 4.36Å; L62-W136 HydrophobicContact CD1-CH2 4.28Å; L62-W136 HydrophobicContact CD1-CZ3 4.14Å; L63-W136 HydrophobicContact CD2-CH2 4.38Å; L63-W136 HydrophobicContact CD2-CZ2 3.79Å; L63-W136 HydrophobicContact CG-CH2 4.14Å; L63-W136 HydrophobicContact CG-CZ2 3.98Å; E66-W136 PolarHBondContact OE1-NE1 3.37Å; E66-W136 PolarHBondContact OE2-NE1 3.1Å; Y127-W136 AromaticContact CD1-CE3 3.89Å; Y127-W136 HydrophobicContact CD1-CE3 3.89Å; Y127-W136 HydrophobicContact CD1-CZ3 4.19Å; Y127-W136 HydrophobicContact CE1-CD2 4.46Å; Y127-W136 AromaticContact CE1-CE3 3.41Å; Y127-W136 HydrophobicContact CE1-CE3 3.41Å; Y127-W136 VanDerWaalsContact CE1-CE3 3.41Å; Y127-W136 AromaticContact CE1-CZ3 3.46Å; Y127-W136 HydrophobicContact CE1-CZ3 3.46Å; Y127-W136 VanDerWaalsContact CE1-CZ3 3.46Å; Y127-W136 HydrophobicContact CE2-CZ3 4.09Å; Y127-W136 AromaticContact CZ-CE3 3.88Å; Y127-W136 AromaticContact CZ-CZ3 3.38Å; Y127-W136 VanDerWaalsContact OH-CZ3 3.29Å; Y127-W136 WeakPolarHBondContact OH-CZ3 3.16Å; E132-W136 PolarHBondContact O-N 3.24Å; E132-W136 VanDerWaalsContact O-N 3.07Å; N133-W136 PolarHBondContact O-N 2.97Å; R134-W136 VanDerWaalsContact C-N 3.34Å; R134-W136 PolarHBondContact O-N 2.89Å; W136-L138 PolarHBondContact O-N 2.71Å; W136-Q139 PolarHBondContact O-N 3.35Å; W136-Q139 VanDerWaalsContact O-N 3.12Å; W136-Q140 HydrophobicContact CD2-CG 3.94Å; W136-Q140 VanDerWaalsContact CE2-CG 3.49Å; W136-Q140 HydrophobicContact CG-CG 4.34Å; W136-Q140 HydrophobicContact CH2-CG 4.37Å; W136-Q140 HydrophobicContact CZ2-CB 4.5Å; W136-Q140 HydrophobicContact CZ2-CG 3.74Å; W136-Q140 WeakPolarHBondContact O-CG 3.4Å; W136-Q140 PolarHBondContact O-N 3Å; W136-R304 HydrophobicContact CD2-CG 4.31Å; W136-R304 HydrophobicContact CH2-CG 4.23Å; W136-R304 HydrophobicContact CZ2-CG 3.89Å
137	F	94.7	Very high	91.1	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-59.1	-50.6	-179.7	174.7	-116.7	0	0	0	110.2	L62 L123 M124 Y127 N133 R134 Q139 Q140 E141 L274 L278	L62-F137 HydrophobicContact CD1-CD2 3.61Å; L62-F137 HydrophobicContact CD1-CE2 3.76Å; L123-F137 HydrophobicContact CB-CD2 4.21Å; L123-F137 HydrophobicContact CB-CE2 3.51Å; L123-F137 HydrophobicContact CB-CZ 3.88Å; L123-F137 HydrophobicContact CD1-CD2 4.45Å; L123-F137 HydrophobicContact CD1-CE2 4.01Å; L123-F137 HydrophobicContact CG-CE2 4.45Å; M124-F137 HydrophobicContact CB-CE1 3.94Å; M124-F137 HydrophobicContact CB-CZ 4.38Å; M124-F137 HydrophobicContact CG-CE1 4.35Å; Y127-F137 HydrophobicContact CD1-CB 4.15Å; Y127-F137 HydrophobicContact CD2-CD2 4.41Å; Y127-F137 HydrophobicContact CG-CB 3.9Å; Y127-F137 HydrophobicContact CG-CG 4.31Å; N133-F137 WeakPolarHBondContact O-CB 3.26Å; N133-F137 PolarHBondContact O-N 3.12Å; R134-F137 PolarHBondContact O-N 3.38Å; F137-Q139 VanDerWaalsContact C-N 3.28Å; F137-Q139 PolarHBondContact O-N 3.24Å; F137-Q140 PolarHBondContact O-N 3.25Å; F137-E141 HydrophobicContact CD2-CB 4.32Å; F137-E141 HydrophobicContact CE2-CB 4.08Å; F137-E141 HydrophobicContact CE2-CG 4.1Å; F137-E141 HydrophobicContact CZ-CB 4.36Å; F137-E141 HydrophobicContact CZ-CG 4.02Å; F137-E141 WeakPolarHBondContact O-CB 3.49Å; F137-E141 PolarHBondContact O-N 2.8Å; F137-L274 HydrophobicContact CE1-CD1 3.86Å; F137-L278 HydrophobicContact CD1-CD1 4.03Å; F137-L278 HydrophobicContact CD1-CD2 4.16Å; F137-L278 HydrophobicContact CE1-CD1 4.41Å
138	L	96.4	Very high	91.2	Very high	15 Å²	15	34.7 Å²	34.7	8%	0.079	17%	0.171	C	C	.	.	H	α-helix	trans	-52.4	-46.7	174.1	177.2	63	0	0	0	111.6	R134 W136 V142 R271 L274 L278	R134-L138 VanDerWaalsContact O-CB 3.24Å; R134-L138 WeakPolarHBondContact O-CB 3.29Å; R134-L138 PolarHBondContact O-N 3.21Å; W136-L138 PolarHBondContact O-N 2.71Å; L138-V142 HydrophobicContact CD1-CG2 3.94Å; L138-V142 WeakPolarHBondContact O-CB 3.39Å; L138-V142 WeakPolarHBondContact O-CG2 3.3Å; L138-V142 PolarHBondContact O-N 2.89Å; L138-V142 VanDerWaalsContact O-N 3.08Å; L138-R271 HydrophobicContact CD1-CG 4.24Å; L138-L274 HydrophobicContact CD1-CB 4.03Å; L138-L274 HydrophobicContact CD1-CD2 3.82Å; L138-L274 HydrophobicContact CD1-CG 3.78Å; L138-L278 HydrophobicContact CB-CD2 4.41Å
139	Q	94.8	Very high	91.2	Very high	44 Å²	44	34.8 Å²	34.8	21%	0.206	17%	0.172	C	C	.	.	H	α-helix	trans	-65.5	-46.9	-177.6	-179.8	57.5	70.9	0	0	112.8	Q135 W136 F137 N143	Q135-Q139 VanDerWaalsContact O-CB 3.27Å; Q135-Q139 WeakPolarHBondContact O-CB 3.34Å; Q135-Q139 PolarHBondContact O-N 3.44Å; W136-Q139 PolarHBondContact O-N 3.35Å; W136-Q139 VanDerWaalsContact O-N 3.12Å; F137-Q139 VanDerWaalsContact C-N 3.28Å; F137-Q139 PolarHBondContact O-N 3.24Å; Q139-N143 PolarHBondContact NE2-ND2 3.16Å; Q139-N143 PolarHBondContact NE2-OD1 3.19Å; Q139-N143 PolarHBondContact O-N 2.86Å; Q139-N143 PolarHBondContact O-ND2 3.48Å; Q139-N143 VanDerWaalsContact O-ND2 3.14Å; Q139-N143 PolarHBondContact O-OD1 3.09Å
140	Q	93.8	Very high	91.4	Very high	14 Å²	14	35.7 Å²	35.7	7%	0.065	18%	0.175	C	C	.	.	H	α-helix	trans	-76.5	-37.7	-177.1	-52.8	-41.3	-25.3	0	0	112.1	L62 I65 E66 W136 F137 V142 N143 L144	L62-Q140 HydrophobicContact CB-CB 3.9Å; L62-Q140 HydrophobicContact CD2-CB 4.08Å; L62-Q140 HydrophobicContact CG-CB 4.4Å; I65-Q140 HydrophobicContact CG2-CB 4.37Å; E66-Q140 HydrophobicContact CB-CG 4.21Å; W136-Q140 HydrophobicContact CD2-CG 3.94Å; W136-Q140 VanDerWaalsContact CE2-CG 3.49Å; W136-Q140 HydrophobicContact CG-CG 4.34Å; W136-Q140 HydrophobicContact CH2-CG 4.37Å; W136-Q140 HydrophobicContact CZ2-CB 4.5Å; W136-Q140 HydrophobicContact CZ2-CG 3.74Å; W136-Q140 WeakPolarHBondContact O-CG 3.4Å; W136-Q140 PolarHBondContact O-N 3Å; F137-Q140 PolarHBondContact O-N 3.25Å; Q140-V142 VanDerWaalsContact C-N 3.32Å; Q140-V142 PolarHBondContact O-N 3.38Å; Q140-N143 PolarHBondContact O-N 3.14Å; Q140-N143 VanDerWaalsContact O-N 3.15Å; Q140-N143 PolarHBondContact OE1-ND2 3.49Å; Q140-N143 VanDerWaalsContact OE1-ND2 3.15Å; Q140-L144 WeakPolarHBondContact O-CB 3.27Å; Q140-L144 PolarHBondContact O-N 3.22Å
141	E	95.9	Very high	91.5	Very high	1 Å²	1	36.1 Å²	36.1	1%	0.005	18%	0.177	C	C	.	.	H	α-helix	trans	-64.3	-38.5	177.6	-172.6	69.7	-165	0	0	111.1	R58 L62 H120 F137 L144 F145 F270 L274	R58-E141 IonicContact CZ-OE1 3.76Å; R58-E141 IonicContact CZ-OE2 3.77Å; R58-E141 IonicContact NE-OE1 3.29Å; R58-E141 PolarHBondContact NE-OE1 3.44Å; R58-E141 VanDerWaalsContact NE-OE1 3.07Å; R58-E141 IonicContact NE-OE2 3.94Å; R58-E141 PolarHBondContact NE-OE2 3.42Å; R58-E141 IonicContact NH2-OE1 2.8Å; R58-E141 PolarHBondContact NH2-OE1 2.95Å; R58-E141 IonicContact NH2-OE2 3.87Å; L62-E141 HydrophobicContact CD2-CB 4.4Å; L62-E141 WeakPolarHBondContact CD2-OE2 2.88Å; H120-E141 IonicContact CE1-OE1 3.02Å; H120-E141 IonicContact CG-OE1 2.67Å; H120-E141 IonicContact ND1-OE1 2.75Å; H120-E141 PolarHBondContact ND1-OE1 3.35Å; F137-E141 HydrophobicContact CD2-CB 4.32Å; F137-E141 HydrophobicContact CE2-CB 4.08Å; F137-E141 HydrophobicContact CE2-CG 4.1Å; F137-E141 HydrophobicContact CZ-CB 4.36Å; F137-E141 HydrophobicContact CZ-CG 4.02Å; F137-E141 WeakPolarHBondContact O-CB 3.49Å; F137-E141 PolarHBondContact O-N 2.8Å; E141-L144 PolarHBondContact O-N 3.47Å; E141-F145 WeakPolarHBondContact O-CB 3.31Å; E141-F145 PolarHBondContact O-N 2.95Å; E141-F270 HydrophobicContact CG-CE1 4.11Å; E141-F270 HydrophobicContact CG-CZ 3.96Å; E141-L274 HydrophobicContact CB-CD2 3.69Å; E141-L274 HydrophobicContact CG-CD2 3.44Å; E141-L274 VanDerWaalsContact CG-CD2 3.44Å
142	V	97.5	Very high	91.4	Very high	3 Å²	3	34 Å²	34	2%	0.018	16%	0.156	C	C	.	.	H	α-helix	trans	-66.1	-39.6	171.8	170.4	0	0	0	0	111.8	L138 Q140 F145 R146 V267 F270 R271 L274	L138-V142 HydrophobicContact CD1-CG2 3.94Å; L138-V142 WeakPolarHBondContact O-CB 3.39Å; L138-V142 WeakPolarHBondContact O-CG2 3.3Å; L138-V142 PolarHBondContact O-N 2.89Å; L138-V142 VanDerWaalsContact O-N 3.08Å; Q140-V142 VanDerWaalsContact C-N 3.32Å; Q140-V142 PolarHBondContact O-N 3.38Å; V142-F145 PolarHBondContact O-N 2.91Å; V142-R146 WeakPolarHBondContact O-CB 3.48Å; V142-R146 PolarHBondContact O-N 2.88Å; V142-V267 HydrophobicContact CG1-CG1 3.56Å; V142-F270 HydrophobicContact CG2-CD1 3.93Å; V142-F270 HydrophobicContact CG2-CE1 4.09Å; V142-R271 HydrophobicContact CG1-CB 4.45Å; V142-R271 HydrophobicContact CG2-CB 3.8Å; V142-R271 HydrophobicContact CG2-CG 4.12Å; V142-L274 HydrophobicContact CG2-CD2 4.49Å
143	N	95.7	Very high	91.5	Very high	6 Å²	6	29.3 Å²	29.3	3%	0.032	14%	0.143	C	C	.	.	H	α-helix	trans	-67.2	-40.3	176.6	-66.6	-21.5	0	0	0	111.4	I65 F75 Q139 Q140 R146 W147	I65-N143 HydrophobicContact CG2-CB 3.38Å; F75-N143 HydrophobicContact CZ-CB 4.21Å; Q139-N143 PolarHBondContact NE2-ND2 3.16Å; Q139-N143 PolarHBondContact NE2-OD1 3.19Å; Q139-N143 PolarHBondContact O-N 2.86Å; Q139-N143 PolarHBondContact O-ND2 3.48Å; Q139-N143 VanDerWaalsContact O-ND2 3.14Å; Q139-N143 PolarHBondContact O-OD1 3.09Å; Q140-N143 PolarHBondContact O-N 3.14Å; Q140-N143 VanDerWaalsContact O-N 3.15Å; Q140-N143 PolarHBondContact OE1-ND2 3.49Å; Q140-N143 VanDerWaalsContact OE1-ND2 3.15Å; N143-R146 PolarHBondContact O-N 3.38Å; N143-W147 PolarHBondContact O-N 3.43Å
144	L	94.3	Very high	91.1	Very high	1 Å²	1	31.6 Å²	31.6	1%	0.005	16%	0.155	C	C	.	.	H	α-helix	trans	-58.7	-49.6	173.1	174.4	61.3	0	0	0	110.2	L62 I65 F87 Q140 E141 R146 W147 R148	L62-L144 HydrophobicContact CD2-CB 3.93Å; L62-L144 HydrophobicContact CD2-CD2 3.73Å; L62-L144 HydrophobicContact CD2-CG 4.46Å; I65-L144 HydrophobicContact CD1-CD1 4.39Å; I65-L144 HydrophobicContact CG1-CB 4.24Å; I65-L144 HydrophobicContact CG1-CD1 4.32Å; F87-L144 HydrophobicContact CE2-CD1 3.74Å; F87-L144 HydrophobicContact CZ-CD1 3.72Å; Q140-L144 WeakPolarHBondContact O-CB 3.27Å; Q140-L144 PolarHBondContact O-N 3.22Å; E141-L144 PolarHBondContact O-N 3.47Å; L144-R146 VanDerWaalsContact C-N 3.3Å; L144-R146 PolarHBondContact O-N 3.4Å; L144-W147 HydrophobicContact CD1-CE3 4.3Å; L144-W147 PolarHBondContact O-N 2.88Å; L144-R148 HydrophobicContact CD1-CG 4.44Å; L144-R148 VanDerWaalsContact O-CG 3.32Å; L144-R148 WeakPolarHBondContact O-CG 3.33Å; L144-R148 PolarHBondContact O-N 3.2Å
145	F	95.3	Very high	90.6	Very high	4 Å²	4	33.6 Å²	33.6	2%	0.018	17%	0.171	C	C	.	.	H	α-helix	trans	-59.1	-41.8	177.4	-177.2	-107	0	0	0	112.2	Q36 F37 E141 V142 R148 L149 F160 V266 V267 F270	Q36-F145 WeakPolarHBondContact O-CE2 3.46Å; F37-F145 HydrophobicContact CD1-CZ 4.07Å; F37-F145 HydrophobicContact CE1-CE1 4.16Å; F37-F145 AromaticContact CE1-CZ 3.78Å; F37-F145 HydrophobicContact CE1-CZ 3.78Å; F37-F145 HydrophobicContact CZ-CZ 4.32Å; E141-F145 WeakPolarHBondContact O-CB 3.31Å; E141-F145 PolarHBondContact O-N 2.95Å; V142-F145 PolarHBondContact O-N 2.91Å; F145-R148 WeakPolarHBondContact O-CB 3.09Å; F145-R148 PolarHBondContact O-N 3.11Å; F145-L149 HydrophobicContact CD1-CD1 3.75Å; F145-L149 HydrophobicContact CD1-CG 4.31Å; F145-L149 HydrophobicContact CE1-CD1 3.36Å; F145-L149 HydrophobicContact CE1-CD2 4.43Å; F145-L149 HydrophobicContact CE1-CG 3.98Å; F145-L149 HydrophobicContact CZ-CD1 3.96Å; F145-L149 HydrophobicContact CZ-CD2 4.21Å; F145-L149 HydrophobicContact CZ-CG 4.14Å; F145-L149 WeakPolarHBondContact O-CG 3.28Å; F145-L149 PolarHBondContact O-N 3.48Å; F145-F160 HydrophobicContact CE2-CZ 4.2Å; F145-F160 HydrophobicContact CZ-CE1 4.1Å; F145-F160 HydrophobicContact CZ-CZ 4.06Å; F145-V266 HydrophobicContact CE1-CG1 4.25Å; F145-V266 HydrophobicContact CZ-CG1 4.38Å; F145-V267 HydrophobicContact CD1-CG2 4.35Å; F145-F270 HydrophobicContact CB-CD1 3.76Å; F145-F270 HydrophobicContact CB-CD2 4.4Å; F145-F270 HydrophobicContact CB-CE1 3.69Å; F145-F270 HydrophobicContact CB-CE2 4.3Å; F145-F270 HydrophobicContact CB-CG 4.14Å; F145-F270 HydrophobicContact CB-CZ 3.98Å; F145-F270 HydrophobicContact CD1-CB 3.5Å; F145-F270 VanDerWaalsContact CD1-CB 3.5Å; F145-F270 AromaticContact CD1-CD1 3.79Å; F145-F270 HydrophobicContact CD1-CD1 3.79Å; F145-F270 AromaticContact CD1-CD2 3.98Å; F145-F270 HydrophobicContact CD1-CD2 3.98Å; F145-F270 AromaticContact CD1-CG 3.48Å; F145-F270 HydrophobicContact CD1-CG 3.48Å; F145-F270 VanDerWaalsContact CD1-CG 3.48Å; F145-F270 AromaticContact CD2-CD2 3.76Å; F145-F270 HydrophobicContact CD2-CD2 3.76Å; F145-F270 AromaticContact CD2-CE2 3.89Å; F145-F270 HydrophobicContact CD2-CE2 3.89Å; F145-F270 HydrophobicContact CD2-CG 4.11Å; F145-F270 HydrophobicContact CD2-CZ 4.39Å; F145-F270 HydrophobicContact CE1-CB 3.4Å; F145-F270 VanDerWaalsContact CE1-CB 3.4Å; F145-F270 HydrophobicContact CE1-CD2 4.12Å; F145-F270 AromaticContact CE1-CG 3.79Å; F145-F270 HydrophobicContact CE1-CG 3.79Å; F145-F270 AromaticContact CE2-CD2 3.94Å; F145-F270 HydrophobicContact CE2-CD2 3.94Å; F145-F270 HydrophobicContact CE2-CE2 4.38Å; F145-F270 HydrophobicContact CE2-CG 4.4Å; F145-F270 HydrophobicContact CG-CB 4.18Å; F145-F270 AromaticContact CG-CD1 3.79Å; F145-F270 HydrophobicContact CG-CD1 3.79Å; F145-F270 AromaticContact CG-CD2 3.78Å; F145-F270 HydrophobicContact CG-CD2 3.78Å; F145-F270 HydrophobicContact CG-CE1 4.1Å; F145-F270 HydrophobicContact CG-CE2 4.05Å; F145-F270 AromaticContact CG-CG 3.64Å; F145-F270 HydrophobicContact CG-CG 3.64Å; F145-F270 HydrophobicContact CG-CZ 4.22Å; F145-F270 HydrophobicContact CZ-CB 4.04Å; F145-F270 HydrophobicContact CZ-CD2 4.11Å; F145-F270 HydrophobicContact CZ-CG 4.25Å
146	R	94.4	Very high	90.4	Very high	73 Å²	73	28.4 Å²	28.4	28%	0.275	15%	0.148	S	C	.	.	H	α-helix	trans	-64.1	-44.6	175.7	-178.4	162.8	173.7	153.3	9.6	112.9	F75 V142 N143 L144 R148 L149 E150 I263 V267	F75-R146 HydrophobicContact CD1-CG 3.9Å; F75-R146 HydrophobicContact CE1-CB 3.69Å; F75-R146 HydrophobicContact CE1-CG 3.48Å; F75-R146 VanDerWaalsContact CE1-CG 3.48Å; F75-R146 VanDerWaalsContact CE2-CD 3.49Å; F75-R146 HydrophobicContact CE2-CG 4.29Å; F75-R146 HydrophobicContact CG-CG 4.48Å; F75-R146 HydrophobicContact CZ-CB 3.83Å; F75-R146 HydrophobicContact CZ-CG 3.72Å; V142-R146 WeakPolarHBondContact O-CB 3.48Å; V142-R146 PolarHBondContact O-N 2.88Å; N143-R146 PolarHBondContact O-N 3.38Å; L144-R146 VanDerWaalsContact C-N 3.3Å; L144-R146 PolarHBondContact O-N 3.4Å; R146-R148 PolarHBondContact O-N 3.45Å; R146-L149 PolarHBondContact O-N 2.99Å; R146-L149 VanDerWaalsContact O-N 3.12Å; R146-E150 HydrophobicContact CG-CG 4.49Å; R146-E150 IonicContact CZ-OE1 3.01Å; R146-E150 IonicContact NE-OE1 3.45Å; R146-E150 PolarHBondContact NE-OE1 3.39Å; R146-E150 IonicContact NH2-OE1 2.76Å; R146-E150 PolarHBondContact NH2-OE1 3.16Å; R146-E150 PolarHBondContact O-N 3.32Å; R146-I263 HydrophobicContact CG-CG2 4.15Å; R146-V267 HydrophobicContact CB-CG1 4.47Å; R146-V267 HydrophobicContact CB-CG2 3.7Å; R146-V267 HydrophobicContact CG-CG2 3.89Å
147	W	92.1	Very high	90.3	Very high	23 Å²	23	27.9 Å²	27.9	9%	0.087	15%	0.146	C	C	.	.	H	α-helix	trans	-56.8	-41.7	173.8	171.6	94.1	0	0	0	110.9	I65 F80 V83 D84 F87 N143 L144 L149 E150 T151	I65-W147 HydrophobicContact CD1-CB 4.23Å; I65-W147 HydrophobicContact CD1-CG 4.42Å; F80-W147 AromaticContact CD1-CD1 3.18Å; F80-W147 HydrophobicContact CD1-CG 4.19Å; F80-W147 AromaticContact CD1-NE1 3.46Å; F80-W147 HydrophobicContact CE1-CB 4.18Å; F80-W147 AromaticContact CE1-CD1 3.23Å; F80-W147 AromaticContact CE1-CG 3.85Å; F80-W147 HydrophobicContact CE1-CG 3.85Å; F80-W147 AromaticContact CE1-NE1 3.88Å; V83-W147 HydrophobicContact CG1-CD2 4.08Å; V83-W147 HydrophobicContact CG1-CG 4.07Å; V83-W147 HydrophobicContact CG1-CZ2 4.39Å; D84-W147 VanDerWaalsContact OD1-CE2 3.32Å; D84-W147 WeakPolarHBondContact OD1-CZ2 3.45Å; D84-W147 PolarHBondContact OD1-NE1 2.71Å; F87-W147 HydrophobicContact CD2-CE3 4.38Å; F87-W147 AromaticContact CD2-CH2 3.7Å; F87-W147 HydrophobicContact CD2-CH2 3.7Å; F87-W147 AromaticContact CD2-CZ2 3.91Å; F87-W147 HydrophobicContact CD2-CZ2 3.91Å; F87-W147 AromaticContact CD2-CZ3 3.93Å; F87-W147 HydrophobicContact CD2-CZ3 3.93Å; F87-W147 HydrophobicContact CE2-CD2 4.16Å; F87-W147 AromaticContact CE2-CE3 3.85Å; F87-W147 HydrophobicContact CE2-CE3 3.85Å; F87-W147 HydrophobicContact CE2-CH2 4.02Å; F87-W147 HydrophobicContact CE2-CZ2 4.26Å; F87-W147 AromaticContact CE2-CZ3 3.79Å; F87-W147 HydrophobicContact CE2-CZ3 3.79Å; N143-W147 PolarHBondContact O-N 3.43Å; L144-W147 HydrophobicContact CD1-CE3 4.3Å; L144-W147 PolarHBondContact O-N 2.88Å; W147-L149 PolarHBondContact O-N 3.42Å; W147-E150 PolarHBondContact O-N 3.21Å; W147-T151 HydrophobicContact CD2-CG2 4.43Å; W147-T151 HydrophobicContact CZ2-CG2 4.16Å; W147-T151 WeakPolarHBondContact O-CG2 3.21Å; W147-T151 PolarHBondContact O-N 3.47Å; W147-T151 VanDerWaalsContact O-N 3.12Å; W147-T151 PolarHBondContact O-OG1 2.84Å
148	R	91	Very high	89.8	Confident	16 Å²	16	33.8 Å²	33.8	6%	0.06	17%	0.168	C	C	.	.	H	α-helix	trans	-64.6	-38	176.1	-64.2	173.1	73.3	169.6	3.5	112.6	N34 L35 Y38 D116 L144 F145 R146 T151 E152	N34-R148 PolarHBondContact O-NH2 3.31Å; L35-R148 HydrophobicContact CD2-CB 3.47Å; L35-R148 VanDerWaalsContact CD2-CB 3.47Å; Y38-R148 PolarHBondContact OH-NH1 2.63Å; D116-R148 IonicContact OD1-NH1 3.56Å; D116-R148 PolarHBondContact OD1-NH1 3.31Å; D116-R148 IonicContact OD2-CZ 2.98Å; D116-R148 VanDerWaalsContact OD2-CZ 3.26Å; D116-R148 IonicContact OD2-NH1 2.74Å; D116-R148 PolarHBondContact OD2-NH1 3.22Å; D116-R148 IonicContact OD2-NH2 3.7Å; D116-R148 PolarHBondContact OD2-NH2 3.13Å; L144-R148 HydrophobicContact CD1-CG 4.44Å; L144-R148 VanDerWaalsContact O-CG 3.32Å; L144-R148 WeakPolarHBondContact O-CG 3.33Å; L144-R148 PolarHBondContact O-N 3.2Å; F145-R148 WeakPolarHBondContact O-CB 3.09Å; F145-R148 PolarHBondContact O-N 3.11Å; R146-R148 PolarHBondContact O-N 3.45Å; R148-T151 WeakPolarHBondContact CA-OG1 3.48Å; R148-T151 PolarHBondContact O-OG1 2.99Å; R148-E152 WeakPolarHBondContact O-CB 3.25Å; R148-E152 PolarHBondContact O-N 2.71Å
149	L	90.2	Very high	89.3	Confident	2 Å²	2	35.9 Å²	35.9	1%	0.01	18%	0.179	C	C	.	.	H	α-helix	trans	-67.5	-41.7	177.7	-75.8	171.7	0	0	0	112.7	L35 F145 R146 W147 T151 E152 L157 F160 I263 V266 V267	L35-L149 HydrophobicContact CD1-CD2 3.74Å; F145-L149 HydrophobicContact CD1-CD1 3.75Å; F145-L149 HydrophobicContact CD1-CG 4.31Å; F145-L149 HydrophobicContact CE1-CD1 3.36Å; F145-L149 HydrophobicContact CE1-CD2 4.43Å; F145-L149 HydrophobicContact CE1-CG 3.98Å; F145-L149 HydrophobicContact CZ-CD1 3.96Å; F145-L149 HydrophobicContact CZ-CD2 4.21Å; F145-L149 HydrophobicContact CZ-CG 4.14Å; F145-L149 WeakPolarHBondContact O-CG 3.28Å; F145-L149 PolarHBondContact O-N 3.48Å; R146-L149 PolarHBondContact O-N 2.99Å; R146-L149 VanDerWaalsContact O-N 3.12Å; W147-L149 PolarHBondContact O-N 3.42Å; L149-T151 VanDerWaalsContact C-N 3.31Å; L149-E152 PolarHBondContact O-N 3.42Å; L149-L157 HydrophobicContact CD2-CD1 3.49Å; L149-L157 VanDerWaalsContact CD2-CD1 3.49Å; L149-F160 HydrophobicContact CD2-CE1 4.35Å; L149-I263 HydrophobicContact CB-CD1 4.29Å; L149-V266 HydrophobicContact CD1-CB 4.12Å; L149-V266 HydrophobicContact CD1-CG1 3.8Å; L149-V266 HydrophobicContact CD2-CG1 4Å; L149-V267 HydrophobicContact CD1-CG2 3.56Å
150	E	88.6	Confident	89	Confident	70 Å²	70	33.8 Å²	33.8	33%	0.327	17%	0.17	S	C	.	.	H	α-helix	trans	-75.5	-21.4	-177.9	-68.3	-173.4	-158.9	0	0	112.7	F80 R146 W147 I263	F80-E150 HydrophobicContact CE1-CB 4.06Å; F80-E150 VanDerWaalsContact CE2-OE2 3.27Å; F80-E150 WeakPolarHBondContact CE2-OE2 3.12Å; F80-E150 HydrophobicContact CZ-CB 3.64Å; F80-E150 HydrophobicContact CZ-CG 4.28Å; F80-E150 WeakPolarHBondContact CZ-OE2 3.38Å; R146-E150 HydrophobicContact CG-CG 4.49Å; R146-E150 IonicContact CZ-OE1 3.01Å; R146-E150 IonicContact NE-OE1 3.45Å; R146-E150 PolarHBondContact NE-OE1 3.39Å; R146-E150 IonicContact NH2-OE1 2.76Å; R146-E150 PolarHBondContact NH2-OE1 3.16Å; R146-E150 PolarHBondContact O-N 3.32Å; W147-E150 PolarHBondContact O-N 3.21Å; E150-I263 HydrophobicContact CG-CG1 4.48Å; E150-I263 HydrophobicContact CG-CG2 3.99Å
151	T	85.8	Confident	88.8	Confident	66 Å²	66	33.9 Å²	33.9	41%	0.405	17%	0.17	S	C	.	.	H	α-helix	trans	-90.6	-10.1	173.6	50.8	0	0	0	0	113.6	F80 W147 R148 L149	F80-T151 HydrophobicContact CD1-CG2 4.07Å; F80-T151 HydrophobicContact CE1-CG2 4.02Å; W147-T151 HydrophobicContact CD2-CG2 4.43Å; W147-T151 HydrophobicContact CZ2-CG2 4.16Å; W147-T151 WeakPolarHBondContact O-CG2 3.21Å; W147-T151 PolarHBondContact O-N 3.47Å; W147-T151 VanDerWaalsContact O-N 3.12Å; W147-T151 PolarHBondContact O-OG1 2.84Å; R148-T151 WeakPolarHBondContact CA-OG1 3.48Å; R148-T151 PolarHBondContact O-OG1 2.99Å; L149-T151 VanDerWaalsContact C-N 3.31Å
152	E	84.6	Confident	88.3	Confident	22 Å²	22	38 Å²	38	10%	0.103	19%	0.19	C	C	.	.	S	Bend	trans	-81.9	143.3	-179.1	-171	65.7	-85.1	0	0	111.8	H33 L35 A98 T99 R148 L149 S156 L157	H33-E152 IonicContact CE1-OE2 3.33Å; H33-E152 PolarHBondContact CE1-OE2 2.88Å; L35-E152 HydrophobicContact CD1-CB 4.11Å; L35-E152 HydrophobicContact CD1-CG 3.81Å; L35-E152 HydrophobicContact CG-CG 4.48Å; A98-E152 WeakPolarHBondContact CA-OE1 3.29Å; A98-E152 WeakPolarHBondContact CB-OE1 3.38Å; T99-E152 PolarHBondContact N-OE1 3.3Å; R148-E152 WeakPolarHBondContact O-CB 3.25Å; R148-E152 PolarHBondContact O-N 2.71Å; L149-E152 PolarHBondContact O-N 3.42Å; E152-S156 WeakPolarHBondContact OE1-CB 3.48Å; E152-S156 PolarHBondContact OE1-OG 3.3Å; E152-S156 VanDerWaalsContact OE1-OG 3.13Å; E152-S156 PolarHBondContact OE2-OG 3.41Å; E152-L157 HydrophobicContact CG-CB 4.46Å
153	G	81.4	Confident	87.7	Confident	34 Å²	34	40 Å²	40	35%	0.351	21%	0.206	S	C	.	.			trans	-70.3	145.9	177.7	0	0	0	0	0	112.6	N155 S156 L157	G153-N155 VanDerWaalsContact C-N 3.29Å; G153-N155 PolarHBondContact O-N 3.43Å; G153-S156 WeakPolarHBondContact O-CB 3.31Å; G153-S156 PolarHBondContact O-N 3.44Å; G153-L157 PolarHBondContact O-N 3.17Å
154	L	79.1	Confident	87.4	Confident	65 Å²	65	41.2 Å²	41.2	34%	0.34	21%	0.213	S	C	.	.	H	α-helix	trans	-53.2	-41.6	-178	-68.4	178.8	0	0	0	114	L157 R158 F224 F228	L154-L157 PolarHBondContact O-N 3.47Å; L154-R158 WeakPolarHBondContact O-CB 3.49Å; L154-R158 PolarHBondContact O-N 3.29Å; L154-F224 HydrophobicContact CD1-CE1 3.64Å; L154-F224 HydrophobicContact CD1-CE2 4.46Å; L154-F224 HydrophobicContact CD1-CZ 3.48Å; L154-F224 VanDerWaalsContact CD1-CZ 3.48Å; L154-F224 HydrophobicContact CG-CE1 4.29Å; L154-F224 HydrophobicContact CG-CZ 4.12Å; L154-F228 HydrophobicContact CD1-CE2 4.35Å; L154-F228 HydrophobicContact CD2-CE2 4.28Å
155	N	81.5	Confident	87.1	Confident	113 Å²	113	48 Å²	48	60%	0.604	25%	0.249	S	C	*	.	H	α-helix	trans	-66.2	-41.4	178.4	-74.3	-26.4	0	0	0	112	G153 R158 L159	G153-N155 VanDerWaalsContact C-N 3.29Å; G153-N155 PolarHBondContact O-N 3.43Å; N155-R158 PolarHBondContact O-N 3.46Å; N155-L159 WeakPolarHBondContact O-CG 3.45Å; N155-L159 PolarHBondContact O-N 2.66Å
156	S	84.5	Confident	86.8	Confident	4 Å²	4	48.6 Å²	48.6	3%	0.028	25%	0.252	C	S	.	.	H	α-helix	trans	-64.9	-45.6	176	-173.4	0	0	0	0	110.6	H33 T99 E152 G153 R158 L159 F160	H33-S156 PolarHBondContact CE1-OG 3.42Å; H33-S156 PolarHBondContact NE2-O 3.25Å; H33-S156 VanDerWaalsContact NE2-O 3.09Å; H33-S156 PolarHBondContact NE2-OG 3.27Å; T99-S156 WeakPolarHBondContact CB-OG 3.41Å; T99-S156 PolarHBondContact O-OG 2.89Å; E152-S156 WeakPolarHBondContact OE1-CB 3.48Å; E152-S156 PolarHBondContact OE1-OG 3.3Å; E152-S156 VanDerWaalsContact OE1-OG 3.13Å; E152-S156 PolarHBondContact OE2-OG 3.41Å; G153-S156 WeakPolarHBondContact O-CB 3.31Å; G153-S156 PolarHBondContact O-N 3.44Å; S156-R158 VanDerWaalsContact C-N 3.31Å; S156-R158 PolarHBondContact O-N 2.81Å; S156-L159 WeakPolarHBondContact O-CB 3.49Å; S156-L159 PolarHBondContact O-N 3.19Å; S156-L159 VanDerWaalsContact O-N 3.09Å; S156-F160 PolarHBondContact O-N 2.88Å
157	L	85.6	Confident	86.3	Confident	9 Å²	9	50.6 Å²	50.6	5%	0.047	27%	0.269	C	S	.	.	H	α-helix	trans	-59.5	-41.9	176.7	-174.5	54.4	0	0	0	111.9	L35 L149 E152 G153 L154 L159 F160 L161 F262 I263	L35-L157 HydrophobicContact CD1-CD1 4.17Å; L149-L157 HydrophobicContact CD2-CD1 3.49Å; L149-L157 VanDerWaalsContact CD2-CD1 3.49Å; E152-L157 HydrophobicContact CG-CB 4.46Å; G153-L157 PolarHBondContact O-N 3.17Å; L154-L157 PolarHBondContact O-N 3.47Å; L157-L159 VanDerWaalsContact C-N 3.32Å; L157-L159 PolarHBondContact O-N 2.79Å; L157-F160 HydrophobicContact CD1-CD1 4.12Å; L157-F160 WeakPolarHBondContact O-CB 3Å; L157-F160 PolarHBondContact O-N 3.04Å; L157-L161 VanDerWaalsContact O-CG 3.27Å; L157-L161 WeakPolarHBondContact O-CG 3.47Å; L157-L161 PolarHBondContact O-N 3.24Å; L157-F262 HydrophobicContact CD2-CE1 3.66Å; L157-F262 HydrophobicContact CD2-CZ 4.32Å; L157-F262 HydrophobicContact CG-CE1 4.28Å; L157-F262 HydrophobicContact CG-CZ 4.47Å; L157-I263 HydrophobicContact CD2-CD1 4.3Å
158	R	84	Confident	86	Confident	124 Å²	124	51.1 Å²	51.1	47%	0.468	27%	0.271	S	S	.	.	H	α-helix	trans	-58	-44.3	173.9	-175.8	177.8	68.4	87.6	-3	112	L154 N155 S156 L161 Q162	L154-R158 WeakPolarHBondContact O-CB 3.49Å; L154-R158 PolarHBondContact O-N 3.29Å; N155-R158 PolarHBondContact O-N 3.46Å; S156-R158 VanDerWaalsContact C-N 3.31Å; S156-R158 PolarHBondContact O-N 2.81Å; R158-L161 PolarHBondContact O-N 3.37Å; R158-Q162 VanDerWaalsContact O-CG 3.31Å; R158-Q162 WeakPolarHBondContact O-CG 3.36Å; R158-Q162 PolarHBondContact O-N 3.49Å
159	L	85.2	Confident	85.7	Confident	59 Å²	59	52.7 Å²	52.7	31%	0.309	28%	0.284	S	S	.	.	H	α-helix	trans	-67.7	-39.8	178.5	-67.9	169.9	0	0	0	112.1	P101 N155 S156 L157 L161 Q162 A163	P101-L159 HydrophobicContact CB-CD1 3.15Å; P101-L159 HydrophobicContact CG-CD1 3.56Å; N155-L159 WeakPolarHBondContact O-CG 3.45Å; N155-L159 PolarHBondContact O-N 2.66Å; S156-L159 WeakPolarHBondContact O-CB 3.49Å; S156-L159 PolarHBondContact O-N 3.19Å; S156-L159 VanDerWaalsContact O-N 3.09Å; L157-L159 VanDerWaalsContact C-N 3.32Å; L157-L159 PolarHBondContact O-N 2.79Å; L159-L161 VanDerWaalsContact C-N 3.33Å; L159-L161 PolarHBondContact O-N 3.08Å; L159-Q162 PolarHBondContact O-N 3.46Å; L159-A163 WeakPolarHBondContact O-CB 3.44Å; L159-A163 PolarHBondContact O-N 3.03Å
160	F	88.3	Confident	85.5	Confident	1 Å²	1	55.7 Å²	55.7	0%	0.004	30%	0.304	C	S	.	.	H	α-helix	trans	-57.4	-45.5	173.7	171.5	-116.2	0	0	0	112.3	H33 L35 F37 F145 L149 S156 L157 A163 N164 V266	H33-F160 AromaticContact ND1-CD2 3.81Å; L35-F160 VanDerWaalsContact C-CE2 3.42Å; L35-F160 HydrophobicContact CB-CD1 4.12Å; L35-F160 HydrophobicContact CB-CD2 3.57Å; L35-F160 HydrophobicContact CB-CE1 4.14Å; L35-F160 HydrophobicContact CB-CE2 3.6Å; L35-F160 HydrophobicContact CB-CG 3.83Å; L35-F160 HydrophobicContact CB-CZ 3.88Å; L35-F160 HydrophobicContact CD1-CB 4.34Å; L35-F160 HydrophobicContact CD1-CD1 3.85Å; L35-F160 HydrophobicContact CD1-CE1 4.27Å; L35-F160 HydrophobicContact CD1-CG 4.01Å; L35-F160 VanDerWaalsContact O-CD2 3.29Å; L35-F160 WeakPolarHBondContact O-CD2 3.48Å; L35-F160 WeakPolarHBondContact O-CE2 3.33Å; F37-F160 HydrophobicContact CD1-CZ 4.48Å; F37-F160 HydrophobicContact CD2-CE1 4.1Å; F37-F160 AromaticContact CD2-CE2 3.89Å; F37-F160 HydrophobicContact CD2-CE2 3.89Å; F37-F160 AromaticContact CD2-CZ 3.33Å; F37-F160 HydrophobicContact CD2-CZ 3.33Å; F37-F160 HydrophobicContact CE1-CZ 4.34Å; F37-F160 HydrophobicContact CE2-CD1 4.45Å; F37-F160 AromaticContact CE2-CE1 3.45Å; F37-F160 HydrophobicContact CE2-CE1 3.45Å; F37-F160 VanDerWaalsContact CE2-CE1 3.45Å; F37-F160 HydrophobicContact CE2-CE2 4Å; F37-F160 AromaticContact CE2-CZ 3.17Å; F37-F160 HydrophobicContact CE2-CZ 3.17Å; F37-F160 HydrophobicContact CG-CZ 4.03Å; F37-F160 AromaticContact CZ-CE1 3.7Å; F37-F160 HydrophobicContact CZ-CE1 3.7Å; F37-F160 AromaticContact CZ-CZ 3.73Å; F37-F160 HydrophobicContact CZ-CZ 3.73Å; F145-F160 HydrophobicContact CE2-CZ 4.2Å; F145-F160 HydrophobicContact CZ-CE1 4.1Å; F145-F160 HydrophobicContact CZ-CZ 4.06Å; L149-F160 HydrophobicContact CD2-CE1 4.35Å; S156-F160 PolarHBondContact O-N 2.88Å; L157-F160 HydrophobicContact CD1-CD1 4.12Å; L157-F160 WeakPolarHBondContact O-CB 3Å; L157-F160 PolarHBondContact O-N 3.04Å; F160-A163 PolarHBondContact O-N 3.43Å; F160-N164 VanDerWaalsContact CE2-ND2 3.34Å; F160-N164 WeakPolarHBondContact CE2-ND2 3.31Å; F160-N164 PolarHBondContact O-N 3.34Å; F160-N164 PolarHBondContact O-ND2 2.64Å; F160-V266 HydrophobicContact CE1-CG1 4.41Å
161	L	88.9	Confident	85.4	Confident	15 Å²	15	52.4 Å²	52.4	8%	0.079	29%	0.289	C	S	.	.	H	α-helix	trans	-65.1	-46	177.5	-64.3	171.7	0	0	0	111.5	L157 R158 L159 A163 N164 N165 I166 F262 V266	L157-L161 VanDerWaalsContact O-CG 3.27Å; L157-L161 WeakPolarHBondContact O-CG 3.47Å; L157-L161 PolarHBondContact O-N 3.24Å; R158-L161 PolarHBondContact O-N 3.37Å; L159-L161 VanDerWaalsContact C-N 3.33Å; L159-L161 PolarHBondContact O-N 3.08Å; L161-A163 VanDerWaalsContact C-N 3.34Å; L161-A163 PolarHBondContact O-N 3.4Å; L161-N164 CarbonylContact O-C 3.4Å; L161-N164 WeakPolarHBondContact O-CA 3.35Å; L161-N164 PolarHBondContact O-N 3.06Å; L161-N165 PolarHBondContact O-N 3.15Å; L161-I166 CarbonylContact C-O 3.54Å; L161-I166 HydrophobicContact CB-CB 4.05Å; L161-I166 HydrophobicContact CB-CG2 4.39Å; L161-I166 WeakPolarHBondContact CB-O 3.38Å; L161-I166 HydrophobicContact CD2-CB 4.1Å; L161-I166 HydrophobicContact CD2-CD1 4.12Å; L161-I166 HydrophobicContact CD2-CG2 3.92Å; L161-I166 PolarHBondContact O-N 2.66Å; L161-F262 HydrophobicContact CD1-CE2 3.88Å; L161-F262 HydrophobicContact CD1-CZ 3.46Å; L161-F262 VanDerWaalsContact CD1-CZ 3.46Å; L161-F262 HydrophobicContact CD2-CZ 4.48Å; L161-F262 HydrophobicContact CG-CZ 4.49Å; L161-V266 HydrophobicContact CD2-CG1 4.28Å; L161-V266 HydrophobicContact CD2-CG2 3.98Å
162	Q	86.1	Confident	85.4	Confident	88 Å²	88	51.3 Å²	51.3	41%	0.411	28%	0.283	S	S	.	.	H	α-helix	trans	-58.8	-44.1	177.2	-74.7	-179.7	-22.5	0	0	111.8	R158 L159 N164 N165	R158-Q162 VanDerWaalsContact O-CG 3.31Å; R158-Q162 WeakPolarHBondContact O-CG 3.36Å; R158-Q162 PolarHBondContact O-N 3.49Å; L159-Q162 PolarHBondContact O-N 3.46Å; Q162-N164 PolarHBondContact O-N 3.1Å; Q162-N165 PolarHBondContact O-N 3.37Å
163	A	86	Confident	85.2	Confident	44 Å²	44	53.9 Å²	53.9	36%	0.364	30%	0.296	S	S	.	.	H	α-helix	trans	-61.7	-24.2	176.3	0	0	0	0	0	113.1	L159 F160 L161	L159-A163 WeakPolarHBondContact O-CB 3.44Å; L159-A163 PolarHBondContact O-N 3.03Å; F160-A163 PolarHBondContact O-N 3.43Å; L161-A163 VanDerWaalsContact C-N 3.34Å; L161-A163 PolarHBondContact O-N 3.4Å
164	N	89.1	Confident	85.3	Confident	32 Å²	32	58.3 Å²	58.3	17%	0.171	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.1	13.3	177.1	-74.2	-84.2	0	0	0	113.5	F37 W39 F160 L161 Q162 I166	F37-N164 HydrophobicContact CD2-CB 4.03Å; F37-N164 VanDerWaalsContact CD2-CG 3.44Å; F37-N164 WeakPolarHBondContact CD2-OD1 3.46Å; F37-N164 HydrophobicContact CE2-CB 3.91Å; W39-N164 PolarHBondContact NE1-OD1 3Å; F160-N164 VanDerWaalsContact CE2-ND2 3.34Å; F160-N164 WeakPolarHBondContact CE2-ND2 3.31Å; F160-N164 PolarHBondContact O-N 3.34Å; F160-N164 PolarHBondContact O-ND2 2.64Å; L161-N164 CarbonylContact O-C 3.4Å; L161-N164 WeakPolarHBondContact O-CA 3.35Å; L161-N164 PolarHBondContact O-N 3.06Å; Q162-N164 PolarHBondContact O-N 3.1Å; N164-I166 HydrophobicContact CB-CD1 4.17Å; N164-I166 HydrophobicContact CB-CG1 4.23Å; N164-I166 PolarHBondContact O-N 3.13Å
165	N	88.2	Confident	85.7	Confident	144 Å²	144	58.1 Å²	58.1	77%	0.77	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.7	29.9	-176.4	-57.3	-63.4	0	0	0	113.7	L161 Q162	L161-N165 PolarHBondContact O-N 3.15Å; Q162-N165 PolarHBondContact O-N 3.37Å
166	I	88.6	Confident	85.7	Confident	16 Å²	16	54.6 Å²	54.6	8%	0.082	29%	0.289	C	S	.	.			trans	-98	97.3	175.6	-58.7	174.6	0	0	0	108.1	F37 L161 N164 Y168 I269	F37-I166 HydrophobicContact CE2-CD1 3.67Å; F37-I166 HydrophobicContact CZ-CD1 3.71Å; L161-I166 CarbonylContact C-O 3.54Å; L161-I166 HydrophobicContact CB-CB 4.05Å; L161-I166 HydrophobicContact CB-CG2 4.39Å; L161-I166 WeakPolarHBondContact CB-O 3.38Å; L161-I166 HydrophobicContact CD2-CB 4.1Å; L161-I166 HydrophobicContact CD2-CD1 4.12Å; L161-I166 HydrophobicContact CD2-CG2 3.92Å; L161-I166 PolarHBondContact O-N 2.66Å; N164-I166 HydrophobicContact CB-CD1 4.17Å; N164-I166 HydrophobicContact CB-CG1 4.23Å; N164-I166 PolarHBondContact O-N 3.13Å; I166-Y168 HydrophobicContact CG2-CD1 3.87Å; I166-Y168 HydrophobicContact CG2-CD2 3.71Å; I166-Y168 HydrophobicContact CG2-CE1 3.51Å; I166-Y168 HydrophobicContact CG2-CE2 3.34Å; I166-Y168 HydrophobicContact CG2-CG 3.95Å; I166-I269 HydrophobicContact CD1-CD1 3.89Å
167	N	82.7	Confident	85.6	Confident	116 Å²	116	61.6 Å²	61.6	62%	0.62	32%	0.321	S	S	*	.			trans	-105.7	74.1	-175.9	-68.7	-32.7	0	0	0	111.1
168	Y	87.3	Confident	85.7	Confident	33 Å²	33	64.9 Å²	64.9	13%	0.129	35%	0.349	C	S	.	.			trans	-86.4	128	173.7	-56.5	-21.2	0	0	0	110	I166 V234 D238 F262 I265 I269	I166-Y168 HydrophobicContact CG2-CD1 3.87Å; I166-Y168 HydrophobicContact CG2-CD2 3.71Å; I166-Y168 HydrophobicContact CG2-CE1 3.51Å; I166-Y168 HydrophobicContact CG2-CE2 3.34Å; I166-Y168 HydrophobicContact CG2-CG 3.95Å; Y168-V234 HydrophobicContact CD1-CB 4.31Å; Y168-V234 HydrophobicContact CD1-CG1 4.11Å; Y168-V234 HydrophobicContact CD1-CG2 4.02Å; Y168-V234 HydrophobicContact CD2-CG2 3.99Å; Y168-V234 HydrophobicContact CE1-CB 4.35Å; Y168-V234 HydrophobicContact CE1-CG1 3.66Å; Y168-V234 HydrophobicContact CE1-CG2 4.32Å; Y168-V234 HydrophobicContact CE2-CG1 4.34Å; Y168-V234 HydrophobicContact CE2-CG2 4.29Å; Y168-V234 HydrophobicContact CG-CG2 3.87Å; Y168-D238 WeakPolarHBondContact CE1-OD2 3.29Å; Y168-D238 PolarHBondContact OH-OD2 3Å; Y168-F262 HydrophobicContact CD2-CD2 4.27Å; Y168-F262 AromaticContact CD2-CE2 3.89Å; Y168-F262 HydrophobicContact CD2-CE2 3.89Å; Y168-I265 HydrophobicContact CE2-CG2 3.97Å; Y168-I269 WeakPolarHBondContact OH-CD1 3.41Å
169	S	85	Confident	85.8	Confident	49 Å²	49	59.7 Å²	59.7	34%	0.343	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	144.2	-177.8	47.1	0	0	0	0	111.2	I232 Q233	S169-I232 CarbonylContact O-C 3.46Å; S169-I232 WeakPolarHBondContact O-CA 3.09Å; S169-Q233 PolarHBondContact N-O 3.22Å; S169-Q233 PolarHBondContact O-N 3.2Å; S169-Q233 PolarHBondContact OG-OE1 3.46Å
170	P	84.8	Confident	85.6	Confident	66 Å²	66	60.7 Å²	60.7	43%	0.429	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	143	167.3	26.9	-32.3	0	0	0	110.3	S172 F228	P170-S172 PolarHBondContact O-N 2.66Å; P170-F228 HydrophobicContact CB-CD1 4.14Å
171	L	86	Confident	85.3	Confident	1 Å²	1	68.5 Å²	68.5	1%	0.005	36%	0.36	C	S	.	.	P	Polyproline II helix	trans	-65.3	132.2	171.9	-172.3	67.4	0	0	0	110.1	E175 K176 I183 Y231 Q233 I256	L171-E175 HydrophobicContact CD1-CB 3.68Å; L171-E175 HydrophobicContact CD1-CG 4.49Å; L171-E175 HydrophobicContact CG-CB 4.18Å; L171-K176 HydrophobicContact CD2-CB 3.85Å; L171-K176 HydrophobicContact CD2-CG 4.28Å; L171-K176 HydrophobicContact CG-CB 4.27Å; L171-I183 HydrophobicContact CD2-CD1 3.62Å; L171-Y231 PolarHBondContact N-O 2.81Å; L171-Q233 HydrophobicContact CD1-CG 3.95Å; L171-I256 HydrophobicContact CD1-CD1 4.19Å; L171-I256 HydrophobicContact CD1-CG1 4.46Å; L171-I256 HydrophobicContact CD2-CG2 4Å
172	S	86.1	Confident	85.1	Confident	42 Å²	42	73 Å²	73	29%	0.294	38%	0.381	S	S	.	.	P	Polyproline II helix	trans	-67.1	161.2	178	71.2	0	0	0	0	111.8	P170 D174 E175 K176	P170-S172 PolarHBondContact O-N 2.66Å; S172-D174 VanDerWaalsContact C-N 3.32Å; S172-E175 VanDerWaalsContact CB-OE2 3.28Å; S172-E175 WeakPolarHBondContact CB-OE2 3.45Å; S172-E175 PolarHBondContact N-OE2 3.15Å; S172-E175 VanDerWaalsContact N-OE2 3.13Å; S172-E175 VanDerWaalsContact OG-CB 3.31Å; S172-E175 WeakPolarHBondContact OG-CB 3.33Å; S172-E175 VanDerWaalsContact OG-CD 3.25Å; S172-E175 WeakPolarHBondContact OG-CG 3.34Å; S172-E175 PolarHBondContact OG-N 3.28Å; S172-E175 PolarHBondContact OG-OE2 3.22Å; S172-K176 VanDerWaalsContact O-CB 3.23Å; S172-K176 WeakPolarHBondContact O-CB 3.48Å; S172-K176 PolarHBondContact O-N 3.36Å
173	M	80.5	Confident	85.1	Confident	76 Å²	76	69 Å²	69	37%	0.374	36%	0.362	S	S	.	.	H	α-helix	trans	-63	-43	176.6	-108.5	-5.2	-136.3	0	0	111	K176 E177 F216 K229	M173-K176 WeakPolarHBondContact O-CB 3.32Å; M173-K176 PolarHBondContact O-N 2.97Å; M173-K176 HydrophobicContact SD-CD 4.48Å; M173-E177 PolarHBondContact O-N 3.07Å; M173-F216 HydrophobicContact CE-CZ 4.36Å; M173-K229 HydrophobicContact CG-CD 4.04Å; M173-K229 VanDerWaalsContact CG-CE 3.48Å; M173-K229 HydrophobicContact SD-CD 3.4Å; M173-K229 WeakPolarHBondContact SD-CD 3.23Å; M173-K229 WeakPolarHBondContact SD-CE 3.36Å; M173-K229 HydrophobicContact SD-CG 3.94Å
174	D	84.8	Confident	84.7	Confident	127 Å²	127	73.3 Å²	73.3	68%	0.679	37%	0.37	S	S	*	.	H	α-helix	trans	-67.4	-42.9	-175	-53.2	-27.5	0	0	0	111	S172 E177 A178	S172-D174 VanDerWaalsContact C-N 3.32Å; D174-E177 PolarHBondContact O-N 2.63Å; D174-A178 WeakPolarHBondContact O-CB 3.42Å; D174-A178 PolarHBondContact O-N 3.16Å
175	E	85.9	Confident	84.3	Confident	62 Å²	62	75.5 Å²	75.5	29%	0.29	39%	0.392	S	S	.	.	H	α-helix	trans	-65.2	-40.3	173.4	-69.4	167.1	123	0	0	111.5	L171 S172 E177 A178 L179 Q233	L171-E175 HydrophobicContact CD1-CB 3.68Å; L171-E175 HydrophobicContact CD1-CG 4.49Å; L171-E175 HydrophobicContact CG-CB 4.18Å; S172-E175 VanDerWaalsContact CB-OE2 3.28Å; S172-E175 WeakPolarHBondContact CB-OE2 3.45Å; S172-E175 PolarHBondContact N-OE2 3.15Å; S172-E175 VanDerWaalsContact N-OE2 3.13Å; S172-E175 VanDerWaalsContact OG-CB 3.31Å; S172-E175 WeakPolarHBondContact OG-CB 3.33Å; S172-E175 VanDerWaalsContact OG-CD 3.25Å; S172-E175 WeakPolarHBondContact OG-CG 3.34Å; S172-E175 PolarHBondContact OG-N 3.28Å; S172-E175 PolarHBondContact OG-OE2 3.22Å; E175-E177 VanDerWaalsContact C-N 3.34Å; E175-E177 PolarHBondContact O-N 2.9Å; E175-A178 PolarHBondContact O-N 3.49Å; E175-L179 VanDerWaalsContact O-CB 3.26Å; E175-L179 WeakPolarHBondContact O-CB 3.4Å; E175-L179 VanDerWaalsContact O-CG 3.28Å; E175-L179 WeakPolarHBondContact O-CG 3.47Å; E175-L179 PolarHBondContact O-N 3.26Å; E175-Q233 PolarHBondContact OE1-NE2 3.12Å; E175-Q233 PolarHBondContact OE2-NE2 2.93Å
176	K	82.6	Confident	83.9	Confident	39 Å²	39	69.8 Å²	69.8	17%	0.17	37%	0.365	C	S	.	.	H	α-helix	trans	-61	-44.4	177.2	-174.9	-179	177.9	-177.7	0	110.9	L171 S172 M173 L179 W180 N230	L171-K176 HydrophobicContact CD2-CB 3.85Å; L171-K176 HydrophobicContact CD2-CG 4.28Å; L171-K176 HydrophobicContact CG-CB 4.27Å; S172-K176 VanDerWaalsContact O-CB 3.23Å; S172-K176 WeakPolarHBondContact O-CB 3.48Å; S172-K176 PolarHBondContact O-N 3.36Å; M173-K176 WeakPolarHBondContact O-CB 3.32Å; M173-K176 PolarHBondContact O-N 2.97Å; M173-K176 HydrophobicContact SD-CD 4.48Å; K176-L179 PolarHBondContact O-N 3.32Å; K176-W180 WeakPolarHBondContact O-CA 3.06Å; K176-W180 VanDerWaalsContact O-CB 3.3Å; K176-W180 WeakPolarHBondContact O-CB 3.38Å; K176-W180 PolarHBondContact O-N 2.71Å; K176-N230 PolarHBondContact NZ-ND2 3.18Å
177	E	82.3	Confident	83.2	Confident	150 Å²	150	69.4 Å²	69.4	70%	0.701	36%	0.364	S	S	*	.	H	α-helix	trans	-67.8	-39.7	177.3	-173.2	171.6	-174.8	0	0	112.1	M173 D174 E175 L179 W180	M173-E177 PolarHBondContact O-N 3.07Å; D174-E177 PolarHBondContact O-N 2.63Å; E175-E177 VanDerWaalsContact C-N 3.34Å; E175-E177 PolarHBondContact O-N 2.9Å; E177-L179 VanDerWaalsContact C-N 3.33Å; E177-L179 PolarHBondContact O-N 3.46Å; E177-W180 VanDerWaalsContact O-CD1 3.29Å
178	A	86.9	Confident	82.2	Confident	78 Å²	78	65.3 Å²	65.3	65%	0.645	35%	0.349	S	S	*	.	H	α-helix	trans	-66.3	-34.8	176.7	0	0	0	0	0	112.9	D174 E175	D174-A178 WeakPolarHBondContact O-CB 3.42Å; D174-A178 PolarHBondContact O-N 3.16Å; E175-A178 PolarHBondContact O-N 3.49Å
179	L	86.1	Confident	80.3	Confident	15 Å²	15	69 Å²	69	8%	0.079	38%	0.378	C	S	.	.	H	α-helix	trans	-107.9	-0.6	-168.8	-57.9	176.3	0	0	0	114.4	E175 K176 E177 R181 Q182 I183 M249 H251 I256	E175-L179 VanDerWaalsContact O-CB 3.26Å; E175-L179 WeakPolarHBondContact O-CB 3.4Å; E175-L179 VanDerWaalsContact O-CG 3.28Å; E175-L179 WeakPolarHBondContact O-CG 3.47Å; E175-L179 PolarHBondContact O-N 3.26Å; K176-L179 PolarHBondContact O-N 3.32Å; E177-L179 VanDerWaalsContact C-N 3.33Å; E177-L179 PolarHBondContact O-N 3.46Å; L179-R181 VanDerWaalsContact C-N 3.28Å; L179-R181 PolarHBondContact O-N 3.03Å; L179-R181 VanDerWaalsContact O-N 3.07Å; L179-Q182 PolarHBondContact O-N 3.24Å; L179-I183 HydrophobicContact CB-CD1 3.91Å; L179-I183 HydrophobicContact CB-CG1 4.11Å; L179-I183 WeakPolarHBondContact O-CG1 3.37Å; L179-I183 PolarHBondContact O-N 3.01Å; L179-M249 HydrophobicContact CB-CE 4.07Å; L179-M249 HydrophobicContact CB-SD 4.47Å; L179-M249 HydrophobicContact CD1-CE 4.13Å; L179-M249 HydrophobicContact CD2-CE 3.97Å; L179-M249 HydrophobicContact CG-CE 4.28Å; L179-H251 HydrophobicContact CD1-CB 4.37Å; L179-I256 HydrophobicContact CD1-CD1 3.84Å
180	W	82.1	Confident	78.4	Confident	80 Å²	80	71.8 Å²	71.8	30%	0.303	38%	0.382	S	S	.	.	H	α-helix	trans	-53.6	-39.4	-168.1	80.2	-95.2	0	0	0	114	K176 E177 Q182 I183 Y184 V210	K176-W180 WeakPolarHBondContact O-CA 3.06Å; K176-W180 VanDerWaalsContact O-CB 3.3Å; K176-W180 WeakPolarHBondContact O-CB 3.38Å; K176-W180 PolarHBondContact O-N 2.71Å; E177-W180 VanDerWaalsContact O-CD1 3.29Å; W180-Q182 VanDerWaalsContact C-N 3.34Å; W180-Q182 PolarHBondContact O-N 3.34Å; W180-I183 PolarHBondContact O-N 3.09Å; W180-Y184 VanDerWaalsContact O-CB 3.28Å; W180-Y184 WeakPolarHBondContact O-CB 3.45Å; W180-Y184 PolarHBondContact O-N 2.91Å; W180-V210 HydrophobicContact CH2-CB 4.31Å; W180-V210 HydrophobicContact CH2-CG1 3.13Å; W180-V210 HydrophobicContact CH2-CG2 4.29Å; W180-V210 HydrophobicContact CZ2-CG1 3.43Å; W180-V210 VanDerWaalsContact CZ2-CG1 3.43Å; W180-V210 HydrophobicContact CZ3-CG1 3.77Å
181	R	81.8	Confident	76.2	Confident	165 Å²	165	76.3 Å²	76.3	62%	0.623	40%	0.395	S	S	*	.	H	α-helix	trans	-61.5	-42.8	178.5	-68	-172.9	-177.8	98.6	-3.2	111.8	L179 A185	L179-R181 VanDerWaalsContact C-N 3.28Å; L179-R181 PolarHBondContact O-N 3.03Å; L179-R181 VanDerWaalsContact O-N 3.07Å; R181-A185 WeakPolarHBondContact O-CB 3.4Å; R181-A185 PolarHBondContact O-N 3.19Å
182	Q	84.8	Confident	73.7	Confident	110 Å²	110	83 Å²	83	51%	0.514	44%	0.435	S	S	.	.	H	α-helix	trans	-73.8	-40.7	-178.6	-62.2	175	43.1	0	0	110.5	L179 W180 Y184 A185 A186 M249	L179-Q182 PolarHBondContact O-N 3.24Å; W180-Q182 VanDerWaalsContact C-N 3.34Å; W180-Q182 PolarHBondContact O-N 3.34Å; Q182-Y184 VanDerWaalsContact C-N 3.35Å; Q182-Y184 PolarHBondContact O-N 3.48Å; Q182-A185 PolarHBondContact O-N 3.1Å; Q182-A186 VanDerWaalsContact O-CB 3.31Å; Q182-A186 WeakPolarHBondContact O-CB 3.39Å; Q182-A186 PolarHBondContact O-N 3.32Å; Q182-M249 VanDerWaalsContact C-SD 3.59Å; Q182-M249 HydrophobicContact CB-CE 3.45Å; Q182-M249 VanDerWaalsContact CB-CE 3.45Å; Q182-M249 HydrophobicContact CB-SD 3.49Å; Q182-M249 WeakPolarHBondContact CB-SD 3.29Å; Q182-M249 HydrophobicContact CG-CE 4.24Å
183	I	84.8	Confident	71.4	Confident	3 Å²	3	86.6 Å²	86.6	2%	0.015	46%	0.461	C	S	.	.	H	α-helix	trans	-60	-47.8	174.2	-64.5	171.4	0	0	0	109.7	L171 L179 W180 A186 T187 Y231 M249 I256	L171-I183 HydrophobicContact CD2-CD1 3.62Å; L179-I183 HydrophobicContact CB-CD1 3.91Å; L179-I183 HydrophobicContact CB-CG1 4.11Å; L179-I183 WeakPolarHBondContact O-CG1 3.37Å; L179-I183 PolarHBondContact O-N 3.01Å; W180-I183 PolarHBondContact O-N 3.09Å; I183-A186 PolarHBondContact O-N 3.47Å; I183-T187 HydrophobicContact CG2-CG2 4.38Å; I183-T187 WeakPolarHBondContact O-CB 3.38Å; I183-T187 WeakPolarHBondContact O-CG2 3.4Å; I183-T187 PolarHBondContact O-N 3.12Å; I183-T187 PolarHBondContact O-OG1 2.98Å; I183-Y231 HydrophobicContact CG2-CD1 3.84Å; I183-Y231 HydrophobicContact CG2-CD2 4.37Å; I183-Y231 HydrophobicContact CG2-CE1 3.25Å; I183-Y231 HydrophobicContact CG2-CE2 3.86Å; I183-Y231 HydrophobicContact CG2-CG 4.37Å; I183-Y231 WeakPolarHBondContact CG2-OH 3.49Å; I183-M249 HydrophobicContact CB-SD 4.26Å; I183-M249 HydrophobicContact CG1-SD 3.46Å; I183-M249 WeakPolarHBondContact CG1-SD 3.22Å; I183-M249 PolarHBondContact N-SD 2.83Å; I183-M249 VanDerWaalsContact N-SD 3.4Å; I183-I256 HydrophobicContact CD1-CD1 4.21Å; I183-I256 HydrophobicContact CD1-CG2 4.09Å; I183-I256 HydrophobicContact CG1-CD1 4.21Å; I183-I256 HydrophobicContact CG1-CG2 4.2Å
184	Y	78.7	Confident	69.1	Low	136 Å²	136	89.3 Å²	89.3	53%	0.533	48%	0.476	S	S	.	.	H	α-helix	trans	-62.4	-43.5	178.2	-176.4	-97.4	0	0	0	111.9	W180 Q182 A186 G188	W180-Y184 VanDerWaalsContact O-CB 3.28Å; W180-Y184 WeakPolarHBondContact O-CB 3.45Å; W180-Y184 PolarHBondContact O-N 2.91Å; Q182-Y184 VanDerWaalsContact C-N 3.35Å; Q182-Y184 PolarHBondContact O-N 3.48Å; Y184-A186 VanDerWaalsContact C-N 3.35Å; Y184-A186 PolarHBondContact O-N 3.12Å; Y184-G188 WeakPolarHBondContact O-CA 3.29Å; Y184-G188 PolarHBondContact O-N 3.29Å
185	A	79.6	Confident	66.5	Low	77 Å²	77	93.5 Å²	93.5	64%	0.636	49%	0.488	S	S	*	.	H	α-helix	trans	-62.9	-39.1	176.5	0	0	0	0	0	112.8	R181 Q182	R181-A185 WeakPolarHBondContact O-CB 3.4Å; R181-A185 PolarHBondContact O-N 3.19Å; Q182-A185 PolarHBondContact O-N 3.1Å
186	A	80.2	Confident	63.7	Low	24 Å²	24	97.8 Å²	97.8	20%	0.198	51%	0.508	C	S	.	.	H	α-helix	trans	-80.7	-32.4	-177.6	0	0	0	0	0	113.9	Q182 I183 Y184 M249	Q182-A186 VanDerWaalsContact O-CB 3.31Å; Q182-A186 WeakPolarHBondContact O-CB 3.39Å; Q182-A186 PolarHBondContact O-N 3.32Å; I183-A186 PolarHBondContact O-N 3.47Å; Y184-A186 VanDerWaalsContact C-N 3.35Å; Y184-A186 PolarHBondContact O-N 3.12Å; A186-M249 HydrophobicContact CB-CB 3.76Å
187	T	74.9	Confident	61	Low	9 Å²	9	105.9 Å²	105.9	6%	0.055	54%	0.543	C	S	.	.	H	α-helix	trans	-105.2	-16.5	-175.6	64.1	0	0	0	0	113.3	I183 C189 Y190 Y231 P258	I183-T187 HydrophobicContact CG2-CG2 4.38Å; I183-T187 WeakPolarHBondContact O-CB 3.38Å; I183-T187 WeakPolarHBondContact O-CG2 3.4Å; I183-T187 PolarHBondContact O-N 3.12Å; I183-T187 PolarHBondContact O-OG1 2.98Å; T187-C189 PolarHBondContact O-N 2.68Å; T187-C189 VanDerWaalsContact O-N 3.1Å; T187-Y190 PolarHBondContact O-N 3.19Å; T187-Y190 VanDerWaalsContact O-N 3.14Å; T187-Y231 HydrophobicContact CG2-CE1 4.18Å; T187-Y231 PolarHBondContact OG1-OH 2.87Å; T187-P258 HydrophobicContact CG2-CG 4.09Å
188	G	60.7	Low	58.5	Low	30 Å²	30	106.8 Å²	106.8	31%	0.309	55%	0.545	S	S	.	.	G	3₁₀ helix	trans	-65.2	-13.3	-174.7	0	0	0	0	0	115.3	Y184 Y190 K191	Y184-G188 WeakPolarHBondContact O-CA 3.29Å; Y184-G188 PolarHBondContact O-N 3.29Å; G188-Y190 PolarHBondContact O-N 3.07Å; G188-K191 PolarHBondContact O-N 3.1Å
189	C	48.6	Very low	55.5	Low	109 Å²	109	111.8 Å²	111.8	74%	0.736	56%	0.555	S	S	*	*	G	3₁₀ helix	trans	-64.7	0.5	168.3	-72.8	0	0	0	0	114.1	T187 K191	T187-C189 PolarHBondContact O-N 2.68Å; T187-C189 VanDerWaalsContact O-N 3.1Å; C189-K191 VanDerWaalsContact C-N 3.31Å; C189-K191 PolarHBondContact O-N 3.05Å
190	Y	43.4	Very low	52.9	Low	109 Å²	109	115.6 Å²	115.6	43%	0.427	59%	0.589	S	S	.	*	G	3₁₀ helix	trans	-74.3	-7.6	171.9	-101.6	-91.1	0	0	0	115.4	T187 G188 D261	T187-Y190 PolarHBondContact O-N 3.19Å; T187-Y190 VanDerWaalsContact O-N 3.14Å; G188-Y190 PolarHBondContact O-N 3.07Å; Y190-D261 VanDerWaalsContact OH-CG 3.29Å; Y190-D261 PolarHBondContact OH-OD1 3.3Å; Y190-D261 PolarHBondContact OH-OD2 3.2Å
191	K	40.1	Very low	50.5	Low	161 Å²	161	115.3 Å²	115.3	70%	0.7	60%	0.598	S	S	*	*	G	3₁₀ helix	trans	-108.8	6.2	-172.1	-77.7	-165.6	177.7	-174.4	0	118.4	G188 C189 S193	G188-K191 PolarHBondContact O-N 3.1Å; C189-K191 VanDerWaalsContact C-N 3.31Å; C189-K191 PolarHBondContact O-N 3.05Å; K191-S193 PolarHBondContact O-N 3.33Å; K191-S193 VanDerWaalsContact O-N 3.15Å
192	T	33.3	Very low	48.2	Very low	140 Å²	140	111.8 Å²	111.8	86%	0.859	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.1	5.7	176.2	-6.1	0	0	0	0	115.2
193	S	37.7	Very low	46.2	Very low	118 Å²	118	114.2 Å²	114.2	83%	0.825	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.3	-3	173.9	-124.6	0	0	0	0	115.6	K191	K191-S193 PolarHBondContact O-N 3.33Å; K191-S193 VanDerWaalsContact O-N 3.15Å
194	L	32.7	Very low	44	Very low	133 Å²	133	123.6 Å²	123.6	70%	0.696	65%	0.653	S	S	*	*	S	Bend	trans	-96.3	115.7	165.9	-78.5	161.5	0	0	0	107.5	E196	L194-E196 PolarHBondContact O-N 3.39Å
195	K	28.3	Very low	42.1	Very low	216 Å²	216	118.5 Å²	118.5	94%	0.939	64%	0.639	S	S	*	*			trans	-67.4	50.1	-176.7	-75.3	-178	171	177.1	0	113.6
196	E	29.1	Very low	40.4	Very low	151 Å²	151	119.7 Å²	119.7	71%	0.706	63%	0.632	S	S	*	*			trans	-112.3	105.2	165.5	-72	-174.4	169.8	0	0	108	L194 F198	L194-E196 PolarHBondContact O-N 3.39Å; E196-F198 VanDerWaalsContact C-N 3.33Å; E196-F198 HydrophobicContact CB-CD2 4.19Å; E196-F198 HydrophobicContact CB-CE2 4.38Å; E196-F198 PolarHBondContact O-N 3.11Å
197	K	25.1	Very low	38.5	Very low	209 Å²	209	124.6 Å²	124.6	91%	0.909	65%	0.65	S	S	*	*			trans	-59.9	95.6	170	-67.6	177.2	176.2	-178.5	0	108
198	F	28.9	Very low	36.6	Very low	170 Å²	170	130.4 Å²	130.4	75%	0.746	68%	0.677	S	S	*	*			trans	-100.2	109.2	161.9	-92.2	-90.6	0	0	0	108	E196	E196-F198 VanDerWaalsContact C-N 3.33Å; E196-F198 HydrophobicContact CB-CD2 4.19Å; E196-F198 HydrophobicContact CB-CE2 4.38Å; E196-F198 PolarHBondContact O-N 3.11Å
199	E	25.1	Very low	35.3	Very low	182 Å²	182	132.7 Å²	132.7	85%	0.85	68%	0.682	S	S	*	*	P	Polyproline II helix	trans	-63.4	137.9	168.7	-77.3	173.7	161	0	0	109.4	P201	E199-P201 WeakPolarHBondContact O-CD 3.46Å
200	A	30.7	Very low	34.9	Very low	96 Å²	96	129.4 Å²	129.4	79%	0.793	66%	0.658	S	S	*	*	P	Polyproline II helix	trans	-64.2	123.8	178.1	0	0	0	0	0	109.8
201	P	32.7	Very low	34.4	Very low	74 Å²	74	130.9 Å²	130.9	48%	0.481	67%	0.667	S	S	.	*	P	Polyproline II helix	trans	-67.4	138.5	-179.8	-17.9	30.2	0	0	0	111.9	E199	E199-P201 WeakPolarHBondContact O-CD 3.46Å
202	S	32.9	Very low	34	Very low	90 Å²	90	129.2 Å²	129.2	63%	0.629	66%	0.66	S	S	*	*	P	Polyproline II helix	trans	-65.2	155	176.1	50.9	0	0	0	0	112.7	E204 A205	S202-E204 PolarHBondContact O-N 3.39Å; S202-A205 PolarHBondContact O-N 3.24Å; S202-A205 VanDerWaalsContact O-N 3.09Å
203	E	42.5	Very low	34.1	Very low	162 Å²	162	126.8 Å²	126.8	76%	0.757	64%	0.641	S	S	*	*	G	3₁₀ helix	trans	-53.7	-26.5	-165.3	-69	-178.4	156.6	0	0	115.7	Q206	E203-Q206 WeakPolarHBondContact O-CB 3.39Å; E203-Q206 VanDerWaalsContact O-CG 3.3Å; E203-Q206 WeakPolarHBondContact O-CG 3.37Å
204	E	38.2	Very low	33.7	Very low	199 Å²	199	125.8 Å²	125.8	93%	0.93	63%	0.627	S	S	*	*	G	3₁₀ helix	trans	-89.9	-15.7	-174.5	-64.5	170.7	171.4	0	0	113.3	S202 Q206	S202-E204 PolarHBondContact O-N 3.39Å; E204-Q206 VanDerWaalsContact C-N 3.34Å
205	A	40.3	Very low	33.9	Very low	29 Å²	29	124.9 Å²	124.9	24%	0.24	62%	0.617	C	S	.	*	G	3₁₀ helix	trans	-88.8	0.2	172.7	0	0	0	0	0	113	S202 E207 D209	S202-A205 PolarHBondContact O-N 3.24Å; S202-A205 VanDerWaalsContact O-N 3.09Å; A205-E207 VanDerWaalsContact C-N 3.3Å; A205-E207 PolarHBondContact O-N 3.47Å; A205-E207 VanDerWaalsContact O-N 3.13Å; A205-D209 WeakPolarHBondContact O-CB 3.37Å; A205-D209 PolarHBondContact O-N 3.1Å
206	Q	43.1	Very low	33.9	Very low	103 Å²	103	122.5 Å²	122.5	48%	0.481	61%	0.607	S	S	.	*	T	Hydrogen-bonded Turn	trans	-69.1	-10.5	-165.6	-76	-175.3	-11	0	0	116.8	E203 E204 V210	E203-Q206 WeakPolarHBondContact O-CB 3.39Å; E203-Q206 VanDerWaalsContact O-CG 3.3Å; E203-Q206 WeakPolarHBondContact O-CG 3.37Å; E204-Q206 VanDerWaalsContact C-N 3.34Å; Q206-V210 WeakPolarHBondContact O-CB 3.48Å; Q206-V210 WeakPolarHBondContact O-CG2 3.3Å
207	E	41	Very low	33.7	Very low	126 Å²	126	122.1 Å²	122.1	59%	0.589	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.6	-39.7	-176.9	-162.5	169.8	175	0	0	114.2	A205 K211	A205-E207 VanDerWaalsContact C-N 3.3Å; A205-E207 PolarHBondContact O-N 3.47Å; A205-E207 VanDerWaalsContact O-N 3.13Å; E207-K211 WeakPolarHBondContact O-CB 3.4Å; E207-K211 VanDerWaalsContact O-CD 3.29Å; E207-K211 WeakPolarHBondContact O-CD 3.43Å; E207-K211 WeakPolarHBondContact O-CG 3.48Å; E207-K211 PolarHBondContact O-N 3.15Å; E207-K211 IonicContact OE1-NZ 2.77Å; E207-K211 PolarHBondContact OE1-NZ 2.89Å
208	E	34.7	Very low	33.8	Very low	131 Å²	131	118.1 Å²	118.1	61%	0.612	60%	0.596	S	S	*	*	H	α-helix	trans	-84.6	-41.8	175.4	-90.4	-159.6	-176.9	0	0	112.9	V210 K211 K212	E208-V210 VanDerWaalsContact C-N 3.32Å; E208-V210 PolarHBondContact O-N 3.48Å; E208-K211 CarbonylContact O-C 3.54Å; E208-K211 PolarHBondContact O-N 2.96Å; E208-K212 WeakPolarHBondContact O-CB 3.29Å; E208-K212 WeakPolarHBondContact O-CG 3.3Å; E208-K212 PolarHBondContact O-N 3.36Å; E208-K212 IonicContact OE2-NZ 2.87Å; E208-K212 PolarHBondContact OE2-NZ 2.75Å
209	D	33.9	Very low	33.8	Very low	79 Å²	79	115.1 Å²	115.1	42%	0.422	59%	0.591	S	S	.	*	H	α-helix	trans	-76.2	-23.1	-178.7	-73.5	-24.9	0	0	0	112.2	A205 K212 L213	A205-D209 WeakPolarHBondContact O-CB 3.37Å; A205-D209 PolarHBondContact O-N 3.1Å; D209-K212 CarbonylContact O-C 3.42Å; D209-K212 PolarHBondContact O-N 3Å; D209-L213 WeakPolarHBondContact O-CA 3.28Å; D209-L213 VanDerWaalsContact O-CB 3.24Å; D209-L213 WeakPolarHBondContact O-CB 3.27Å; D209-L213 WeakPolarHBondContact O-CD1 3.5Å; D209-L213 PolarHBondContact O-N 3.35Å
210	V	39.3	Very low	33.8	Very low	39 Å²	39	115.1 Å²	115.1	24%	0.236	59%	0.591	C	S	.	*	H	α-helix	trans	-72.5	-33.5	168.2	169.1	0	0	0	0	111.7	W180 Q206 E208	W180-V210 HydrophobicContact CH2-CB 4.31Å; W180-V210 HydrophobicContact CH2-CG1 3.13Å; W180-V210 HydrophobicContact CH2-CG2 4.29Å; W180-V210 HydrophobicContact CZ2-CG1 3.43Å; W180-V210 VanDerWaalsContact CZ2-CG1 3.43Å; W180-V210 HydrophobicContact CZ3-CG1 3.77Å; Q206-V210 WeakPolarHBondContact O-CB 3.48Å; Q206-V210 WeakPolarHBondContact O-CG2 3.3Å; E208-V210 VanDerWaalsContact C-N 3.32Å; E208-V210 PolarHBondContact O-N 3.48Å
211	K	33.6	Very low	33.9	Very low	140 Å²	140	114.3 Å²	114.3	61%	0.609	59%	0.592	S	S	*	*	H	α-helix	trans	-74	-29.9	171.4	-73.1	173.3	-168.5	166.9	0	111.8	E207 E208	E207-K211 WeakPolarHBondContact O-CB 3.4Å; E207-K211 VanDerWaalsContact O-CD 3.29Å; E207-K211 WeakPolarHBondContact O-CD 3.43Å; E207-K211 WeakPolarHBondContact O-CG 3.48Å; E207-K211 PolarHBondContact O-N 3.15Å; E207-K211 IonicContact OE1-NZ 2.77Å; E207-K211 PolarHBondContact OE1-NZ 2.89Å; E208-K211 CarbonylContact O-C 3.54Å; E208-K211 PolarHBondContact O-N 2.96Å
212	K	30.8	Very low	33.8	Very low	127 Å²	127	115.9 Å²	115.9	55%	0.552	60%	0.6	S	S	*	*	H	α-helix	trans	-91.8	-5	175.7	-70.5	172.4	-177.1	154.7	0	114.3	E208 D209 D214	E208-K212 WeakPolarHBondContact O-CB 3.29Å; E208-K212 WeakPolarHBondContact O-CG 3.3Å; E208-K212 PolarHBondContact O-N 3.36Å; E208-K212 IonicContact OE2-NZ 2.87Å; E208-K212 PolarHBondContact OE2-NZ 2.75Å; D209-K212 CarbonylContact O-C 3.42Å; D209-K212 PolarHBondContact O-N 3Å; K212-D214 PolarHBondContact O-N 2.93Å
213	L	35.5	Very low	33.6	Very low	89 Å²	89	116.2 Å²	116.2	47%	0.466	60%	0.603	S	S	.	*	S	Bend	trans	-70.8	63.4	169.2	-122.7	94	0	0	0	108.2	D209 F215	D209-L213 WeakPolarHBondContact O-CA 3.28Å; D209-L213 VanDerWaalsContact O-CB 3.24Å; D209-L213 WeakPolarHBondContact O-CB 3.27Å; D209-L213 WeakPolarHBondContact O-CD1 3.5Å; D209-L213 PolarHBondContact O-N 3.35Å; L213-F215 WeakPolarHBondContact O-CD2 3.24Å; L213-F215 PolarHBondContact O-N 3.45Å
214	D	29.9	Very low	33.2	Very low	96 Å²	96	115.6 Å²	115.6	51%	0.513	60%	0.598	S	S	.	*	S	Bend	trans	17	48.2	169.3	-77.3	-29.1	0	0	0	116.8	K212 K217	K212-D214 PolarHBondContact O-N 2.93Å; D214-K217 HydrophobicContact CB-CB 4.46Å; D214-K217 WeakPolarHBondContact OD1-CD 3.48Å; D214-K217 VanDerWaalsContact OD1-CE 3.3Å; D214-K217 WeakPolarHBondContact OD1-CE 3.43Å; D214-K217 VanDerWaalsContact OD1-CG 3.31Å; D214-K217 WeakPolarHBondContact OD1-CG 3.42Å; D214-K217 IonicContact OD1-NZ 2.68Å; D214-K217 PolarHBondContact OD1-NZ 2.77Å; D214-K217 WeakPolarHBondContact OD2-CD 3.37Å; D214-K217 WeakPolarHBondContact OD2-CE 3.39Å; D214-K217 IonicContact OD2-NZ 3.07Å; D214-K217 PolarHBondContact OD2-NZ 2.94Å
215	F	35.7	Very low	33.1	Very low	115 Å²	115	111.4 Å²	111.4	50%	0.504	59%	0.586	S	S	.	*	S	Bend	trans	-75.8	-12.4	162.7	-80.8	-78.3	0	0	0	110.9	L213	L213-F215 WeakPolarHBondContact O-CD2 3.24Å; L213-F215 PolarHBondContact O-N 3.45Å
216	F	28.8	Very low	32.8	Very low	165 Å²	165	115.3 Å²	115.3	72%	0.724	61%	0.611	S	S	*	*	S	Bend	trans	-132.6	20.6	-174.2	-75.9	-78.9	0	0	0	115.3	M173 V218	M173-F216 HydrophobicContact CE-CZ 4.36Å; F216-V218 VanDerWaalsContact C-N 3.27Å; F216-V218 PolarHBondContact O-N 3.37Å
217	K	24.5	Very low	32.7	Very low	144 Å²	144	116.3 Å²	116.3	63%	0.626	62%	0.618	S	S	*	*			trans	-73.8	93	159	-95.4	-177.8	-166	146.7	0	108.6	D214 V219	D214-K217 HydrophobicContact CB-CB 4.46Å; D214-K217 WeakPolarHBondContact OD1-CD 3.48Å; D214-K217 VanDerWaalsContact OD1-CE 3.3Å; D214-K217 WeakPolarHBondContact OD1-CE 3.43Å; D214-K217 VanDerWaalsContact OD1-CG 3.31Å; D214-K217 WeakPolarHBondContact OD1-CG 3.42Å; D214-K217 IonicContact OD1-NZ 2.68Å; D214-K217 PolarHBondContact OD1-NZ 2.77Å; D214-K217 WeakPolarHBondContact OD2-CD 3.37Å; D214-K217 WeakPolarHBondContact OD2-CE 3.39Å; D214-K217 IonicContact OD2-NZ 3.07Å; D214-K217 PolarHBondContact OD2-NZ 2.94Å; K217-V219 PolarHBondContact O-N 3.46Å
218	V	28	Very low	32.7	Very low	125 Å²	125	113.3 Å²	113.3	76%	0.758	60%	0.604	S	S	*	*			trans	-55.1	95.7	152.7	178.8	0	0	0	0	105.5	F216 E220	F216-V218 VanDerWaalsContact C-N 3.27Å; F216-V218 PolarHBondContact O-N 3.37Å; V218-E220 VanDerWaalsContact C-N 3.31Å; V218-E220 PolarHBondContact O-N 3Å
219	V	28.2	Very low	33.5	Very low	106 Å²	106	111.2 Å²	111.2	64%	0.642	59%	0.592	S	S	*	*			trans	-67.2	104.9	161	-179.6	0	0	0	0	104.1	K217 G221 V222	K217-V219 PolarHBondContact O-N 3.46Å; V219-G221 PolarHBondContact O-N 2.83Å; V219-V222 HydrophobicContact CG1-CG2 4.29Å
220	E	25.4	Very low	35.4	Very low	183 Å²	183	111 Å²	111	86%	0.855	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-48	116.6	171.6	-71.2	-179.1	153.3	0	0	108.3	V218	V218-E220 VanDerWaalsContact C-N 3.31Å; V218-E220 PolarHBondContact O-N 3Å
221	G	33	Very low	37.6	Very low	79 Å²	79	111 Å²	111	81%	0.814	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	103.5	30.5	169.8	0	0	0	0	0	118.3	V219	V219-G221 PolarHBondContact O-N 2.83Å
222	V	30.5	Very low	40.2	Very low	106 Å²	106	104.6 Å²	104.6	64%	0.642	56%	0.56	S	S	*	*			trans	-129.5	93.4	167.9	-153.5	0	0	0	0	114	V219	V219-V222 HydrophobicContact CG1-CG2 4.29Å
223	S	29.6	Very low	43	Very low	98 Å²	98	99.6 Å²	99.6	69%	0.685	54%	0.538	S	S	*	.			trans	13.8	131.3	133.5	-168	0	0	0	0	120	V225	S223-V225 VanDerWaalsContact C-N 3.32Å; S223-V225 PolarHBondContact O-N 2.89Å
224	F	32.7	Very low	45.7	Very low	149 Å²	149	95.4 Å²	95.4	65%	0.654	52%	0.516	S	S	*	.	S	Bend	trans	61.5	-18.2	151.9	-156	-108.5	0	0	0	121.2	L154 S226	L154-F224 HydrophobicContact CD1-CE1 3.64Å; L154-F224 HydrophobicContact CD1-CE2 4.46Å; L154-F224 HydrophobicContact CD1-CZ 3.48Å; L154-F224 VanDerWaalsContact CD1-CZ 3.48Å; L154-F224 HydrophobicContact CG-CE1 4.29Å; L154-F224 HydrophobicContact CG-CZ 4.12Å; F224-S226 VanDerWaalsContact C-N 3.28Å; F224-S226 PolarHBondContact O-N 3.37Å
225	V	36.5	Very low	48.7	Very low	111 Å²	111	92.8 Å²	92.8	67%	0.673	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.8	5.1	-174.5	-174.6	0	0	0	0	114.6	S223	S223-V225 VanDerWaalsContact C-N 3.32Å; S223-V225 PolarHBondContact O-N 2.89Å
226	S	33.9	Very low	51.5	Low	111 Å²	111	91.1 Å²	91.1	78%	0.776	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.2	0.2	-169.5	-56.1	0	0	0	0	117.6	F224	F224-S226 VanDerWaalsContact C-N 3.28Å; F224-S226 PolarHBondContact O-N 3.37Å
227	I	41.4	Very low	54.5	Low	123 Å²	123	88.8 Å²	88.8	63%	0.631	49%	0.489	S	S	*	.	S	Bend	trans	-84.8	-23.4	-173.1	-62	176.8	0	0	0	113.5
228	F	40	Very low	57.5	Low	64 Å²	64	85.1 Å²	85.1	28%	0.281	48%	0.476	S	S	.	.	S	Bend	trans	-114.2	121.7	171.7	-67.9	-83.3	0	0	0	109.3	L154 P170 N230 Q259	L154-F228 HydrophobicContact CD1-CE2 4.35Å; L154-F228 HydrophobicContact CD2-CE2 4.28Å; P170-F228 HydrophobicContact CB-CD1 4.14Å; F228-N230 PolarHBondContact O-N 3.36Å; F228-Q259 VanDerWaalsContact CB-CD 3.43Å; F228-Q259 HydrophobicContact CB-CG 4.34Å; F228-Q259 VanDerWaalsContact CB-OE1 3.26Å
229	K	52.5	Low	60.5	Low	86 Å²	86	79.5 Å²	79.5	37%	0.374	44%	0.441	S	S	.	.			trans	-71.8	67.9	179.3	-72.9	165.8	171	176.5	0	111.3	M173 Y231	M173-K229 HydrophobicContact CG-CD 4.04Å; M173-K229 VanDerWaalsContact CG-CE 3.48Å; M173-K229 HydrophobicContact SD-CD 3.4Å; M173-K229 WeakPolarHBondContact SD-CD 3.23Å; M173-K229 WeakPolarHBondContact SD-CE 3.36Å; M173-K229 HydrophobicContact SD-CG 3.94Å; K229-Y231 PolarHBondContact O-N 3.3Å
230	N	74.1	Confident	63.5	Low	76 Å²	76	78 Å²	78	41%	0.406	43%	0.434	S	S	.	.	S	Bend	trans	53.8	-20.5	174.1	-60.7	-5.1	0	0	0	118.4	K176 F228 Q259	K176-N230 PolarHBondContact NZ-ND2 3.18Å; F228-N230 PolarHBondContact O-N 3.36Å; N230-Q259 PolarHBondContact O-N 3.5Å
231	Y	85.1	Confident	66.4	Low	39 Å²	39	73.5 Å²	73.5	15%	0.153	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	145.3	-171.6	-65.9	-85.3	0	0	0	111.1	L171 I183 T187 K229 I256 V257 P258	L171-Y231 PolarHBondContact N-O 2.81Å; I183-Y231 HydrophobicContact CG2-CD1 3.84Å; I183-Y231 HydrophobicContact CG2-CD2 4.37Å; I183-Y231 HydrophobicContact CG2-CE1 3.25Å; I183-Y231 HydrophobicContact CG2-CE2 3.86Å; I183-Y231 HydrophobicContact CG2-CG 4.37Å; I183-Y231 WeakPolarHBondContact CG2-OH 3.49Å; T187-Y231 HydrophobicContact CG2-CE1 4.18Å; T187-Y231 PolarHBondContact OG1-OH 2.87Å; K229-Y231 PolarHBondContact O-N 3.3Å; Y231-I256 HydrophobicContact CD1-CG2 3.88Å; Y231-I256 HydrophobicContact CG-CG2 4.11Å; Y231-V257 CarbonylContact C-O 3.53Å; Y231-V257 VanDerWaalsContact CA-O 3.24Å; Y231-V257 WeakPolarHBondContact CA-O 3.21Å; Y231-P258 HydrophobicContact CD1-CG 4.41Å; Y231-P258 HydrophobicContact CE1-CB 4.41Å; Y231-P258 HydrophobicContact CE1-CG 4Å
232	I	88.2	Confident	69	Low	5 Å²	5	71.5 Å²	71.5	3%	0.026	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	150	176	59	171.5	0	0	0	109.8	S169 V234 I256 V257 F262 I265	S169-I232 CarbonylContact O-C 3.46Å; S169-I232 WeakPolarHBondContact O-CA 3.09Å; I232-V234 HydrophobicContact CD1-CG2 3.69Å; I232-V234 HydrophobicContact CG1-CG2 4Å; I232-I256 WeakPolarHBondContact O-CA 3.49Å; I232-V257 HydrophobicContact CD1-CB 4.42Å; I232-V257 HydrophobicContact CG1-CB 3.95Å; I232-V257 WeakPolarHBondContact CG1-O 3.36Å; I232-V257 PolarHBondContact N-O 3.47Å; I232-V257 PolarHBondContact O-N 3.2Å; I232-F262 HydrophobicContact CD1-CB 3.85Å; I232-F262 HydrophobicContact CD1-CD2 3.59Å; I232-F262 HydrophobicContact CD1-CG 4.16Å; I232-I265 HydrophobicContact CD1-CD1 4.29Å
233	Q	90.7	Very high	71.9	Confident	22 Å²	22	68.4 Å²	68.4	10%	0.103	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	127.4	169.1	-66.5	-178.8	-18.2	0	0	108.9	S169 L171 E175 N254	S169-Q233 PolarHBondContact N-O 3.22Å; S169-Q233 PolarHBondContact O-N 3.2Å; S169-Q233 PolarHBondContact OG-OE1 3.46Å; L171-Q233 HydrophobicContact CD1-CG 3.95Å; E175-Q233 PolarHBondContact OE1-NE2 3.12Å; E175-Q233 PolarHBondContact OE2-NE2 2.93Å; Q233-N254 HydrophobicContact CB-CB 4.29Å
234	V	92.1	Very high	74.8	Confident	0 Å²	0	72.3 Å²	72.3	0%	0	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	132.5	-178.9	176.5	0	0	0	0	107.4	Y168 I232 F236 D238 I239 N254 A255 V257 I265	Y168-V234 HydrophobicContact CD1-CB 4.31Å; Y168-V234 HydrophobicContact CD1-CG1 4.11Å; Y168-V234 HydrophobicContact CD1-CG2 4.02Å; Y168-V234 HydrophobicContact CD2-CG2 3.99Å; Y168-V234 HydrophobicContact CE1-CB 4.35Å; Y168-V234 HydrophobicContact CE1-CG1 3.66Å; Y168-V234 HydrophobicContact CE1-CG2 4.32Å; Y168-V234 HydrophobicContact CE2-CG1 4.34Å; Y168-V234 HydrophobicContact CE2-CG2 4.29Å; Y168-V234 HydrophobicContact CG-CG2 3.87Å; I232-V234 HydrophobicContact CD1-CG2 3.69Å; I232-V234 HydrophobicContact CG1-CG2 4Å; V234-F236 PolarHBondContact O-N 2.93Å; V234-D238 HydrophobicContact CG1-CB 4.03Å; V234-I239 HydrophobicContact CB-CD1 4.34Å; V234-I239 HydrophobicContact CG1-CD1 4.24Å; V234-I239 HydrophobicContact CG1-CG1 4.2Å; V234-I239 HydrophobicContact CG1-CG2 3.97Å; V234-N254 CarbonylContact O-C 3.39Å; V234-N254 WeakPolarHBondContact O-CA 3.33Å; V234-A255 PolarHBondContact N-O 3.49Å; V234-A255 PolarHBondContact O-N 3.29Å; V234-V257 HydrophobicContact CG2-CG2 4.39Å; V234-I265 HydrophobicContact CG2-CD1 4.27Å
235	P	93	Very high	77.4	Confident	42 Å²	42	67.9 Å²	67.9	27%	0.273	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-50.4	130.3	171.9	-27.1	36	0	0	0	110.5	E237 D238	P235-E237 PolarHBondContact O-N 3.39Å; P235-E237 VanDerWaalsContact O-N 3.15Å; P235-D238 WeakPolarHBondContact O-CB 3.47Å; P235-D238 PolarHBondContact O-N 3.35Å
236	F	93.4	Very high	79.9	Confident	80 Å²	80	73 Å²	73	35%	0.351	37%	0.37	S	S	.	.	G	3₁₀ helix	trans	-66.3	-23.6	-170.8	77	-92.5	0	0	0	112.2	V234 D238 I239 V243 L250 G253 A255	V234-F236 PolarHBondContact O-N 2.93Å; F236-D238 PolarHBondContact O-N 3.37Å; F236-I239 PolarHBondContact O-N 3.04Å; F236-V243 HydrophobicContact CB-CG2 4.22Å; F236-L250 HydrophobicContact CB-CD2 3.54Å; F236-L250 HydrophobicContact CG-CD2 4.27Å; F236-G253 WeakPolarHBondContact CD1-O 3.48Å; F236-A255 HydrophobicContact CB-CB 4.19Å
237	E	91.3	Very high	82.3	Confident	115 Å²	115	72.4 Å²	72.4	54%	0.537	35%	0.354	S	S	.	.	G	3₁₀ helix	trans	-64	-26	175.8	-59.7	88.4	163.5	0	0	112.8	P235 I239	P235-E237 PolarHBondContact O-N 3.39Å; P235-E237 VanDerWaalsContact O-N 3.15Å; E237-I239 VanDerWaalsContact C-N 3.34Å
238	D	88.5	Confident	84.5	Confident	68 Å²	68	67.2 Å²	67.2	36%	0.364	33%	0.327	S	S	.	.	G	3₁₀ helix	trans	-76.4	-23.3	178.2	-76.8	-0.1	0	0	0	112.3	Y168 V234 P235 F236 P240	Y168-D238 WeakPolarHBondContact CE1-OD2 3.29Å; Y168-D238 PolarHBondContact OH-OD2 3Å; V234-D238 HydrophobicContact CG1-CB 4.03Å; P235-D238 WeakPolarHBondContact O-CB 3.47Å; P235-D238 PolarHBondContact O-N 3.35Å; F236-D238 PolarHBondContact O-N 3.37Å; D238-P240 WeakPolarHBondContact O-CD 3.46Å
239	I	90.3	Very high	86.9	Confident	6 Å²	6	64.6 Å²	64.6	3%	0.031	32%	0.316	C	S	.	.			trans	-128.1	50.7	-171.7	56.7	165.2	0	0	0	114	V234 F236 E237 D241 L242 V243 V248 A255 V257 I265	V234-I239 HydrophobicContact CB-CD1 4.34Å; V234-I239 HydrophobicContact CG1-CD1 4.24Å; V234-I239 HydrophobicContact CG1-CG1 4.2Å; V234-I239 HydrophobicContact CG1-CG2 3.97Å; F236-I239 PolarHBondContact O-N 3.04Å; E237-I239 VanDerWaalsContact C-N 3.34Å; I239-D241 PolarHBondContact O-N 2.99Å; I239-D241 VanDerWaalsContact O-N 3.1Å; I239-L242 HydrophobicContact CB-CB 4.44Å; I239-L242 HydrophobicContact CB-CD1 4.4Å; I239-L242 HydrophobicContact CD1-CB 4.44Å; I239-L242 HydrophobicContact CD1-CD1 4.3Å; I239-L242 PolarHBondContact O-N 3.49Å; I239-L242 VanDerWaalsContact O-N 3.11Å; I239-V243 HydrophobicContact CG1-CG2 4.43Å; I239-V243 WeakPolarHBondContact O-CG2 3.26Å; I239-V243 PolarHBondContact O-N 2.97Å; I239-V248 HydrophobicContact CD1-CG1 4.27Å; I239-A255 HydrophobicContact CD1-CB 3.39Å; I239-A255 HydrophobicContact CG1-CB 4.1Å; I239-V257 HydrophobicContact CD1-CG2 3.51Å; I239-I265 HydrophobicContact CG2-CB 4.32Å; I239-I265 HydrophobicContact CG2-CD1 4Å; I239-I265 HydrophobicContact CG2-CG1 3.8Å; I239-I265 HydrophobicContact CG2-CG2 3.61Å
240	P	90.6	Very high	88.9	Confident	75 Å²	75	64.9 Å²	64.9	49%	0.487	32%	0.321	S	S	.	.	H	α-helix	trans	-60	-29.4	-175.7	26.4	-35.6	0	0	0	113	D238 V243 K244	D238-P240 WeakPolarHBondContact O-CD 3.46Å; P240-V243 PolarHBondContact O-N 3.46Å; P240-K244 VanDerWaalsContact O-CB 3.22Å; P240-K244 WeakPolarHBondContact O-CB 3.49Å; P240-K244 PolarHBondContact O-N 2.96Å
241	D	87.5	Confident	89.8	Confident	88 Å²	88	65 Å²	65	47%	0.471	32%	0.319	S	S	.	.	H	α-helix	trans	-65.2	-42	178.8	-64.7	-38.1	0	0	0	112.4	I239 A245 N268	I239-D241 PolarHBondContact O-N 2.99Å; I239-D241 VanDerWaalsContact O-N 3.1Å; D241-A245 WeakPolarHBondContact O-CB 3.47Å; D241-A245 PolarHBondContact O-N 3.14Å; D241-N268 PolarHBondContact OD2-ND2 3.2Å
242	L	88.1	Confident	90	Very high	37 Å²	37	66.6 Å²	66.6	19%	0.194	35%	0.348	C	S	.	.	H	α-helix	trans	-73.4	-35.7	178.9	-64.5	-176.8	0	0	0	111.4	I239 A245 R246 K247 V248 V257 I265	I239-L242 HydrophobicContact CB-CB 4.44Å; I239-L242 HydrophobicContact CB-CD1 4.4Å; I239-L242 HydrophobicContact CD1-CB 4.44Å; I239-L242 HydrophobicContact CD1-CD1 4.3Å; I239-L242 PolarHBondContact O-N 3.49Å; I239-L242 VanDerWaalsContact O-N 3.11Å; L242-A245 PolarHBondContact O-N 2.97Å; L242-R246 PolarHBondContact O-N 3.16Å; L242-K247 HydrophobicContact CD2-CD 4.49Å; L242-K247 PolarHBondContact O-N 3.27Å; L242-V248 HydrophobicContact CB-CG1 3.75Å; L242-V248 HydrophobicContact CB-CG2 4.34Å; L242-V248 HydrophobicContact CD1-CG1 4.18Å; L242-V257 HydrophobicContact CD1-CG1 4.35Å; L242-I265 HydrophobicContact CD1-CD1 4.25Å; L242-I265 HydrophobicContact CD1-CG1 4.04Å
243	V	91.5	Very high	90.2	Very high	41 Å²	41	68.5 Å²	68.5	25%	0.248	37%	0.369	C	S	.	.	H	α-helix	trans	-63.7	-48.6	173	178.4	0	0	0	0	110.4	F236 I239 P240 A245 R246 V248 L250	F236-V243 HydrophobicContact CB-CG2 4.22Å; I239-V243 HydrophobicContact CG1-CG2 4.43Å; I239-V243 WeakPolarHBondContact O-CG2 3.26Å; I239-V243 PolarHBondContact O-N 2.97Å; P240-V243 PolarHBondContact O-N 3.46Å; V243-A245 VanDerWaalsContact C-N 3.28Å; V243-A245 PolarHBondContact O-N 2.94Å; V243-R246 PolarHBondContact O-N 2.9Å; V243-V248 HydrophobicContact CB-CG2 4.45Å; V243-V248 HydrophobicContact CG2-CG2 3.84Å; V243-L250 HydrophobicContact CG1-CD1 4.23Å; V243-L250 HydrophobicContact CG2-CD2 4.06Å
244	K	89.9	Confident	90.4	Very high	181 Å²	181	69.6 Å²	69.6	79%	0.787	38%	0.375	S	S	*	.	H	α-helix	trans	-58.2	-40.4	176.1	179.9	-177.7	177.4	-177.6	0	111.9	P240 R246	P240-K244 VanDerWaalsContact O-CB 3.22Å; P240-K244 WeakPolarHBondContact O-CB 3.49Å; P240-K244 PolarHBondContact O-N 2.96Å; K244-R246 PolarHBondContact O-N 2.62Å
245	A	87.5	Confident	90.4	Very high	55 Å²	55	69.6 Å²	69.6	46%	0.455	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-3.4	177.9	0	0	0	0	0	113.9	D241 L242 V243 K247	D241-A245 WeakPolarHBondContact O-CB 3.47Å; D241-A245 PolarHBondContact O-N 3.14Å; L242-A245 PolarHBondContact O-N 2.97Å; V243-A245 VanDerWaalsContact C-N 3.28Å; V243-A245 PolarHBondContact O-N 2.94Å; A245-K247 HydrophobicContact CB-CD 4.09Å; A245-K247 HydrophobicContact CB-CG 3.9Å; A245-K247 PolarHBondContact O-N 3.47Å
246	R	87.2	Confident	90.4	Very high	219 Å²	219	67.6 Å²	67.6	83%	0.826	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	53	37.4	-174.6	-57.8	-178.1	178.7	137.9	-1.4	112.9	L242 V243 K244	L242-R246 PolarHBondContact O-N 3.16Å; V243-R246 PolarHBondContact O-N 2.9Å; K244-R246 PolarHBondContact O-N 2.62Å
247	K	84.3	Confident	90.2	Very high	99 Å²	99	63.8 Å²	63.8	43%	0.43	35%	0.346	S	S	.	.			trans	-94.8	1.4	179.9	-70.8	-173.9	173.5	-171.2	0	113.6	L242 A245	L242-K247 HydrophobicContact CD2-CD 4.49Å; L242-K247 PolarHBondContact O-N 3.27Å; A245-K247 HydrophobicContact CB-CD 4.09Å; A245-K247 HydrophobicContact CB-CG 3.9Å; A245-K247 PolarHBondContact O-N 3.47Å
248	V	89.6	Confident	89.9	Confident	13 Å²	13	59.1 Å²	59.1	8%	0.079	33%	0.325	C	S	.	.	S	Bend	trans	-136.8	152.9	-173.3	-63.1	0	0	0	0	110.1	I239 L242 V243 A255 V257	I239-V248 HydrophobicContact CD1-CG1 4.27Å; L242-V248 HydrophobicContact CB-CG1 3.75Å; L242-V248 HydrophobicContact CB-CG2 4.34Å; L242-V248 HydrophobicContact CD1-CG1 4.18Å; V243-V248 HydrophobicContact CB-CG2 4.45Å; V243-V248 HydrophobicContact CG2-CG2 3.84Å; V248-A255 HydrophobicContact CB-CB 4.28Å; V248-A255 HydrophobicContact CG2-CB 4.1Å; V248-V257 HydrophobicContact CB-CG2 4.46Å; V248-V257 HydrophobicContact CG1-CB 4.4Å; V248-V257 HydrophobicContact CG1-CG1 4.22Å; V248-V257 HydrophobicContact CG1-CG2 3.77Å
249	M	90.3	Very high	89.4	Confident	10 Å²	10	59 Å²	59	5%	0.049	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	131.6	173.7	175.6	-179.8	170.6	0	0	109.8	L179 Q182 I183 A186 H251 A255 I256	L179-M249 HydrophobicContact CB-CE 4.07Å; L179-M249 HydrophobicContact CB-SD 4.47Å; L179-M249 HydrophobicContact CD1-CE 4.13Å; L179-M249 HydrophobicContact CD2-CE 3.97Å; L179-M249 HydrophobicContact CG-CE 4.28Å; Q182-M249 VanDerWaalsContact C-SD 3.59Å; Q182-M249 HydrophobicContact CB-CE 3.45Å; Q182-M249 VanDerWaalsContact CB-CE 3.45Å; Q182-M249 HydrophobicContact CB-SD 3.49Å; Q182-M249 WeakPolarHBondContact CB-SD 3.29Å; Q182-M249 HydrophobicContact CG-CE 4.24Å; I183-M249 HydrophobicContact CB-SD 4.26Å; I183-M249 HydrophobicContact CG1-SD 3.46Å; I183-M249 WeakPolarHBondContact CG1-SD 3.22Å; I183-M249 PolarHBondContact N-SD 2.83Å; I183-M249 VanDerWaalsContact N-SD 3.4Å; A186-M249 HydrophobicContact CB-CB 3.76Å; M249-H251 HydrophobicContact CE-CB 4.35Å; M249-A255 CarbonylContact O-C 3.5Å; M249-A255 VanDerWaalsContact O-CA 3.3Å; M249-A255 WeakPolarHBondContact O-CA 3.5Å; M249-I256 HydrophobicContact CB-CB 4.31Å; M249-I256 HydrophobicContact CE-CD1 4.48Å; M249-I256 HydrophobicContact CG-CD1 4.48Å; M249-I256 PolarHBondContact N-O 2.95Å; M249-I256 PolarHBondContact O-N 3.28Å; M249-I256 HydrophobicContact SD-CD1 4.09Å
250	L	93	Very high	88.9	Confident	92 Å²	92	65.3 Å²	65.3	48%	0.482	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	131.8	173	-60.6	-178.9	0	0	0	110.7	F236 V243 N254 A255	F236-L250 HydrophobicContact CB-CD2 3.54Å; F236-L250 HydrophobicContact CG-CD2 4.27Å; V243-L250 HydrophobicContact CG1-CD1 4.23Å; V243-L250 HydrophobicContact CG2-CD2 4.06Å; L250-N254 CarbonylContact C-O 3.44Å; L250-N254 WeakPolarHBondContact CA-O 3.38Å; L250-A255 HydrophobicContact CD2-CB 3.92Å
251	H	92.7	Very high	88.6	Confident	77 Å²	77	63 Å²	63	36%	0.356	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	124.4	177.2	-171.2	73.2	0	0	0	110.9	L179 M249 G253 N254 I256	L179-H251 HydrophobicContact CD1-CB 4.37Å; M249-H251 HydrophobicContact CE-CB 4.35Å; H251-G253 VanDerWaalsContact C-N 3.33Å; H251-G253 PolarHBondContact O-N 3.23Å; H251-N254 PolarHBondContact N-O 3.4Å; H251-N254 PolarHBondContact O-N 3.18Å; H251-N254 VanDerWaalsContact O-O 3.12Å; H251-I256 HydrophobicContact CB-CD1 3.99Å; H251-I256 HydrophobicContact CB-CG1 4.49Å
252	G	91	Very high	88.6	Confident	73 Å²	73	60.4 Å²	60.4	75%	0.753	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.5	32.5	171.2	0	0	0	0	0	115.9	N254	G252-N254 VanDerWaalsContact C-N 3.27Å; G252-N254 PolarHBondContact O-N 3.03Å
253	G	92.3	Very high	88.6	Confident	45 Å²	45	60 Å²	60	46%	0.464	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.1	1.6	-175	0	0	0	0	0	114.3	F236 H251	F236-G253 WeakPolarHBondContact CD1-O 3.48Å; H251-G253 VanDerWaalsContact C-N 3.33Å; H251-G253 PolarHBondContact O-N 3.23Å
254	N	93.5	Very high	88.5	Confident	45 Å²	45	59.6 Å²	59.6	24%	0.241	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	157.2	175.3	-65.8	-45.7	0	0	0	111.1	Q233 V234 L250 H251 G252	Q233-N254 HydrophobicContact CB-CB 4.29Å; V234-N254 CarbonylContact O-C 3.39Å; V234-N254 WeakPolarHBondContact O-CA 3.33Å; L250-N254 CarbonylContact C-O 3.44Å; L250-N254 WeakPolarHBondContact CA-O 3.38Å; H251-N254 PolarHBondContact N-O 3.4Å; H251-N254 PolarHBondContact O-N 3.18Å; H251-N254 VanDerWaalsContact O-O 3.12Å; G252-N254 VanDerWaalsContact C-N 3.27Å; G252-N254 PolarHBondContact O-N 3.03Å
255	A	93.3	Very high	88.6	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	129.7	162.9	0	0	0	0	0	109.6	V234 F236 I239 V248 M249 L250 V257	V234-A255 PolarHBondContact N-O 3.49Å; V234-A255 PolarHBondContact O-N 3.29Å; F236-A255 HydrophobicContact CB-CB 4.19Å; I239-A255 HydrophobicContact CD1-CB 3.39Å; I239-A255 HydrophobicContact CG1-CB 4.1Å; V248-A255 HydrophobicContact CB-CB 4.28Å; V248-A255 HydrophobicContact CG2-CB 4.1Å; M249-A255 CarbonylContact O-C 3.5Å; M249-A255 VanDerWaalsContact O-CA 3.3Å; M249-A255 WeakPolarHBondContact O-CA 3.5Å; L250-A255 HydrophobicContact CD2-CB 3.92Å; A255-V257 HydrophobicContact CB-CG2 4.31Å
256	I	91.9	Very high	88.8	Confident	1 Å²	1	48.6 Å²	48.6	1%	0.005	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	116.9	172.6	-57.4	173.4	0	0	0	107.4	L171 L179 I183 Y231 I232 M249 H251	L171-I256 HydrophobicContact CD1-CD1 4.19Å; L171-I256 HydrophobicContact CD1-CG1 4.46Å; L171-I256 HydrophobicContact CD2-CG2 4Å; L179-I256 HydrophobicContact CD1-CD1 3.84Å; I183-I256 HydrophobicContact CD1-CD1 4.21Å; I183-I256 HydrophobicContact CD1-CG2 4.09Å; I183-I256 HydrophobicContact CG1-CD1 4.21Å; I183-I256 HydrophobicContact CG1-CG2 4.2Å; Y231-I256 HydrophobicContact CD1-CG2 3.88Å; Y231-I256 HydrophobicContact CG-CG2 4.11Å; I232-I256 WeakPolarHBondContact O-CA 3.49Å; M249-I256 HydrophobicContact CB-CB 4.31Å; M249-I256 HydrophobicContact CE-CD1 4.48Å; M249-I256 HydrophobicContact CG-CD1 4.48Å; M249-I256 PolarHBondContact N-O 2.95Å; M249-I256 PolarHBondContact O-N 3.28Å; M249-I256 HydrophobicContact SD-CD1 4.09Å; H251-I256 HydrophobicContact CB-CD1 3.99Å; H251-I256 HydrophobicContact CB-CG1 4.49Å
257	V	89.4	Confident	89.2	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	139.9	-173.5	-167.7	0	0	0	0	110.2	Y231 I232 V234 I239 L242 V248 A255 D261 I265	Y231-V257 CarbonylContact C-O 3.53Å; Y231-V257 VanDerWaalsContact CA-O 3.24Å; Y231-V257 WeakPolarHBondContact CA-O 3.21Å; I232-V257 HydrophobicContact CD1-CB 4.42Å; I232-V257 HydrophobicContact CG1-CB 3.95Å; I232-V257 WeakPolarHBondContact CG1-O 3.36Å; I232-V257 PolarHBondContact N-O 3.47Å; I232-V257 PolarHBondContact O-N 3.2Å; V234-V257 HydrophobicContact CG2-CG2 4.39Å; I239-V257 HydrophobicContact CD1-CG2 3.51Å; L242-V257 HydrophobicContact CD1-CG1 4.35Å; V248-V257 HydrophobicContact CB-CG2 4.46Å; V248-V257 HydrophobicContact CG1-CB 4.4Å; V248-V257 HydrophobicContact CG1-CG1 4.22Å; V248-V257 HydrophobicContact CG1-CG2 3.77Å; A255-V257 HydrophobicContact CB-CG2 4.31Å; V257-D261 HydrophobicContact CG1-CB 3.77Å; V257-I265 HydrophobicContact CB-CD1 4.25Å; V257-I265 HydrophobicContact CG1-CD1 3.87Å; V257-I265 HydrophobicContact CG2-CD1 4.13Å
258	P	84.7	Confident	89.6	Confident	17 Å²	17	36.1 Å²	36.1	11%	0.11	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.2	140.9	168.7	-24.4	35	0	0	0	112	T187 Y231 I260 D261	T187-P258 HydrophobicContact CG2-CG 4.09Å; Y231-P258 HydrophobicContact CD1-CG 4.41Å; Y231-P258 HydrophobicContact CE1-CB 4.41Å; Y231-P258 HydrophobicContact CE1-CG 4Å; P258-I260 HydrophobicContact CB-CG2 3.88Å; P258-I260 PolarHBondContact O-N 3.29Å; P258-D261 PolarHBondContact O-N 2.94Å
259	Q	79.3	Confident	89.8	Confident	64 Å²	64	36.8 Å²	36.8	30%	0.299	22%	0.224	S	C	.	.	G	3₁₀ helix	trans	-59.3	-30.9	178.3	-174.5	-172.6	-6.4	0	0	112.7	F228 N230 D261 F262	F228-Q259 VanDerWaalsContact CB-CD 3.43Å; F228-Q259 HydrophobicContact CB-CG 4.34Å; F228-Q259 VanDerWaalsContact CB-OE1 3.26Å; N230-Q259 PolarHBondContact O-N 3.5Å; Q259-D261 PolarHBondContact O-N 3.26Å; Q259-D261 VanDerWaalsContact O-N 3.17Å; Q259-F262 WeakPolarHBondContact O-CB 3.44Å; Q259-F262 PolarHBondContact O-N 2.89Å
260	I	79.3	Confident	90	Very high	140 Å²	140	36.3 Å²	36.3	72%	0.718	22%	0.222	S	C	*	.	G	3₁₀ helix	trans	-59.9	-25.9	177.8	-168.5	165.9	0	0	0	112.9	P258	P258-I260 HydrophobicContact CB-CG2 3.88Å; P258-I260 PolarHBondContact O-N 3.29Å
261	D	84.1	Confident	90.2	Very high	27 Å²	27	35.2 Å²	35.2	14%	0.144	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	-89	-7.6	178.8	-64.1	-48.2	0	0	0	113	Y190 V257 P258 Q259 I263 G264 I265	Y190-D261 VanDerWaalsContact OH-CG 3.29Å; Y190-D261 PolarHBondContact OH-OD1 3.3Å; Y190-D261 PolarHBondContact OH-OD2 3.2Å; V257-D261 HydrophobicContact CG1-CB 3.77Å; P258-D261 PolarHBondContact O-N 2.94Å; Q259-D261 PolarHBondContact O-N 3.26Å; Q259-D261 VanDerWaalsContact O-N 3.17Å; D261-I263 PolarHBondContact O-N 3.19Å; D261-G264 WeakPolarHBondContact O-CA 3.35Å; D261-G264 PolarHBondContact O-N 3.26Å; D261-I265 PolarHBondContact O-N 3Å
262	F	86.8	Confident	90.3	Very high	32 Å²	32	35.3 Å²	35.3	14%	0.14	21%	0.214	C	C	.	.	H	α-helix	trans	-55.3	-49.6	-177.1	169.5	-102.8	0	0	0	112.5	L157 L161 Y168 I232 Q259 G264 I265 V266	L157-F262 HydrophobicContact CD2-CE1 3.66Å; L157-F262 HydrophobicContact CD2-CZ 4.32Å; L157-F262 HydrophobicContact CG-CE1 4.28Å; L157-F262 HydrophobicContact CG-CZ 4.47Å; L161-F262 HydrophobicContact CD1-CE2 3.88Å; L161-F262 HydrophobicContact CD1-CZ 3.46Å; L161-F262 VanDerWaalsContact CD1-CZ 3.46Å; L161-F262 HydrophobicContact CD2-CZ 4.48Å; L161-F262 HydrophobicContact CG-CZ 4.49Å; Y168-F262 HydrophobicContact CD2-CD2 4.27Å; Y168-F262 AromaticContact CD2-CE2 3.89Å; Y168-F262 HydrophobicContact CD2-CE2 3.89Å; I232-F262 HydrophobicContact CD1-CB 3.85Å; I232-F262 HydrophobicContact CD1-CD2 3.59Å; I232-F262 HydrophobicContact CD1-CG 4.16Å; Q259-F262 WeakPolarHBondContact O-CB 3.44Å; Q259-F262 PolarHBondContact O-N 2.89Å; F262-G264 PolarHBondContact O-N 3.26Å; F262-I265 WeakPolarHBondContact O-CB 3.19Å; F262-I265 PolarHBondContact O-N 3.1Å; F262-I265 VanDerWaalsContact O-N 3.1Å; F262-V266 HydrophobicContact CD2-CG2 4.43Å; F262-V266 HydrophobicContact CE1-CG2 4.23Å; F262-V266 HydrophobicContact CE2-CG2 3.93Å; F262-V266 HydrophobicContact CZ-CG2 3.79Å; F262-V266 PolarHBondContact O-N 3.18Å; F262-V266 VanDerWaalsContact O-N 3.14Å
263	I	89.3	Confident	90.5	Very high	30 Å²	30	32.9 Å²	32.9	15%	0.154	18%	0.184	C	C	.	.	H	α-helix	trans	-58.8	-40.9	176.9	-62.1	-64.2	0	0	0	110	R146 L149 E150 L157 D261 I265 V266 V267	R146-I263 HydrophobicContact CG-CG2 4.15Å; L149-I263 HydrophobicContact CB-CD1 4.29Å; E150-I263 HydrophobicContact CG-CG1 4.48Å; E150-I263 HydrophobicContact CG-CG2 3.99Å; L157-I263 HydrophobicContact CD2-CD1 4.3Å; D261-I263 PolarHBondContact O-N 3.19Å; I263-I265 VanDerWaalsContact C-N 3.32Å; I263-I265 PolarHBondContact O-N 3.45Å; I263-V266 PolarHBondContact O-N 3.21Å; I263-V267 HydrophobicContact CG2-CG2 4.07Å; I263-V267 VanDerWaalsContact O-CB 3.31Å; I263-V267 WeakPolarHBondContact O-CB 3.43Å; I263-V267 WeakPolarHBondContact O-CG2 3.14Å; I263-V267 PolarHBondContact O-N 3.43Å
264	G	90	Very high	90.7	Very high	31 Å²	31	30.8 Å²	30.8	32%	0.32	16%	0.163	S	C	.	.	H	α-helix	trans	-58.8	-40.5	176.3	0	0	0	0	0	113.2	D261 F262 N268	D261-G264 WeakPolarHBondContact O-CA 3.35Å; D261-G264 PolarHBondContact O-N 3.26Å; F262-G264 PolarHBondContact O-N 3.26Å; G264-N268 WeakPolarHBondContact O-CB 3.11Å; G264-N268 PolarHBondContact O-N 3.45Å
265	I	91.1	Very high	90.8	Very high	6 Å²	6	31.2 Å²	31.2	3%	0.031	17%	0.169	C	C	.	.	H	α-helix	trans	-63.4	-52.2	177	-67.3	166.3	0	0	0	110.7	Y168 I232 V234 I239 L242 V257 D261 F262 I263 V267 N268 I269	Y168-I265 HydrophobicContact CE2-CG2 3.97Å; I232-I265 HydrophobicContact CD1-CD1 4.29Å; V234-I265 HydrophobicContact CG2-CD1 4.27Å; I239-I265 HydrophobicContact CG2-CB 4.32Å; I239-I265 HydrophobicContact CG2-CD1 4Å; I239-I265 HydrophobicContact CG2-CG1 3.8Å; I239-I265 HydrophobicContact CG2-CG2 3.61Å; L242-I265 HydrophobicContact CD1-CD1 4.25Å; L242-I265 HydrophobicContact CD1-CG1 4.04Å; V257-I265 HydrophobicContact CB-CD1 4.25Å; V257-I265 HydrophobicContact CG1-CD1 3.87Å; V257-I265 HydrophobicContact CG2-CD1 4.13Å; D261-I265 PolarHBondContact O-N 3Å; F262-I265 WeakPolarHBondContact O-CB 3.19Å; F262-I265 PolarHBondContact O-N 3.1Å; F262-I265 VanDerWaalsContact O-N 3.1Å; I263-I265 VanDerWaalsContact C-N 3.32Å; I263-I265 PolarHBondContact O-N 3.45Å; I265-V267 VanDerWaalsContact C-N 3.3Å; I265-V267 PolarHBondContact O-N 2.74Å; I265-N268 WeakPolarHBondContact O-CB 3.35Å; I265-N268 PolarHBondContact O-N 3.21Å; I265-I269 PolarHBondContact O-N 3.3Å; I265-I269 VanDerWaalsContact O-N 3.1Å
266	V	92.1	Very high	90.9	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-61.9	-41.2	-178.8	-177.2	0	0	0	0	110.8	F37 F145 L149 F160 L161 F262 I263 N268 I269 F270	F37-V266 HydrophobicContact CE1-CG1 4.24Å; F37-V266 HydrophobicContact CZ-CG1 3.84Å; F145-V266 HydrophobicContact CE1-CG1 4.25Å; F145-V266 HydrophobicContact CZ-CG1 4.38Å; L149-V266 HydrophobicContact CD1-CB 4.12Å; L149-V266 HydrophobicContact CD1-CG1 3.8Å; L149-V266 HydrophobicContact CD2-CG1 4Å; F160-V266 HydrophobicContact CE1-CG1 4.41Å; L161-V266 HydrophobicContact CD2-CG1 4.28Å; L161-V266 HydrophobicContact CD2-CG2 3.98Å; F262-V266 HydrophobicContact CD2-CG2 4.43Å; F262-V266 HydrophobicContact CE1-CG2 4.23Å; F262-V266 HydrophobicContact CE2-CG2 3.93Å; F262-V266 HydrophobicContact CZ-CG2 3.79Å; F262-V266 PolarHBondContact O-N 3.18Å; F262-V266 VanDerWaalsContact O-N 3.14Å; I263-V266 PolarHBondContact O-N 3.21Å; V266-N268 VanDerWaalsContact C-N 3.28Å; V266-N268 PolarHBondContact O-N 2.98Å; V266-I269 WeakPolarHBondContact O-CB 3.48Å; V266-I269 PolarHBondContact O-N 3.11Å; V266-F270 PolarHBondContact O-N 3.31Å
267	V	94.6	Very high	91.1	Very high	12 Å²	12	35.5 Å²	35.5	7%	0.073	20%	0.196	C	C	.	.	H	α-helix	trans	-62.1	-35.6	174.3	171.4	0	0	0	0	111.7	V142 F145 R146 L149 I263 I265 F270 R271	V142-V267 HydrophobicContact CG1-CG1 3.56Å; F145-V267 HydrophobicContact CD1-CG2 4.35Å; R146-V267 HydrophobicContact CB-CG1 4.47Å; R146-V267 HydrophobicContact CB-CG2 3.7Å; R146-V267 HydrophobicContact CG-CG2 3.89Å; L149-V267 HydrophobicContact CD1-CG2 3.56Å; I263-V267 HydrophobicContact CG2-CG2 4.07Å; I263-V267 VanDerWaalsContact O-CB 3.31Å; I263-V267 WeakPolarHBondContact O-CB 3.43Å; I263-V267 WeakPolarHBondContact O-CG2 3.14Å; I263-V267 PolarHBondContact O-N 3.43Å; I265-V267 VanDerWaalsContact C-N 3.3Å; I265-V267 PolarHBondContact O-N 2.74Å; V267-F270 PolarHBondContact O-N 3.38Å; V267-R271 WeakPolarHBondContact O-CB 3.12Å; V267-R271 PolarHBondContact O-N 3.47Å
268	N	92.9	Very high	91.3	Very high	44 Å²	44	35.7 Å²	35.7	24%	0.235	20%	0.197	C	C	.	.	H	α-helix	trans	-69.4	-38	178.1	-158.6	46.6	0	0	0	112.2	D241 G264 I265 V266 F270 R271 N272	D241-N268 PolarHBondContact OD2-ND2 3.2Å; G264-N268 WeakPolarHBondContact O-CB 3.11Å; G264-N268 PolarHBondContact O-N 3.45Å; I265-N268 WeakPolarHBondContact O-CB 3.35Å; I265-N268 PolarHBondContact O-N 3.21Å; V266-N268 VanDerWaalsContact C-N 3.28Å; V266-N268 PolarHBondContact O-N 2.98Å; N268-F270 VanDerWaalsContact C-N 3.31Å; N268-F270 PolarHBondContact O-N 3.46Å; N268-R271 PolarHBondContact O-N 3.21Å; N268-N272 PolarHBondContact ND2-ND2 3.37Å; N268-N272 WeakPolarHBondContact O-CB 3.19Å; N268-N272 PolarHBondContact O-N 3.09Å; N268-N272 PolarHBondContact O-ND2 3.17Å
269	I	93.3	Very high	91.8	Very high	27 Å²	27	37.5 Å²	37.5	14%	0.138	21%	0.214	C	C	.	.	H	α-helix	trans	-56.7	-48.9	173.3	-63.1	170	0	0	0	109.8	F37 W39 I166 Y168 I265 V266 N272 N273	F37-I269 HydrophobicContact CD1-CG2 4.16Å; F37-I269 HydrophobicContact CE1-CB 4.02Å; F37-I269 HydrophobicContact CE1-CG2 3.75Å; F37-I269 HydrophobicContact CZ-CG2 4.18Å; W39-I269 HydrophobicContact CH2-CG2 3.89Å; W39-I269 HydrophobicContact CZ2-CG2 4.29Å; I166-I269 HydrophobicContact CD1-CD1 3.89Å; Y168-I269 WeakPolarHBondContact OH-CD1 3.41Å; I265-I269 PolarHBondContact O-N 3.3Å; I265-I269 VanDerWaalsContact O-N 3.1Å; V266-I269 WeakPolarHBondContact O-CB 3.48Å; V266-I269 PolarHBondContact O-N 3.11Å; I269-N272 PolarHBondContact O-N 3.18Å; I269-N273 PolarHBondContact O-N 3.18Å
270	F	96.3	Very high	92.5	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-60.7	-49.4	176.6	179.1	-96.4	0	0	0	112.6	F37 Y38 E141 V142 F145 V266 V267 N268 N272 N273 L274	F37-F270 HydrophobicContact CD1-CB 3.92Å; F37-F270 HydrophobicContact CD1-CD2 4.12Å; F37-F270 HydrophobicContact CE1-CB 4.05Å; Y38-F270 AromaticContact CD2-CE2 3.52Å; Y38-F270 HydrophobicContact CD2-CE2 3.52Å; Y38-F270 HydrophobicContact CD2-CZ 4.09Å; Y38-F270 AromaticContact CE2-CE2 3.62Å; Y38-F270 HydrophobicContact CE2-CE2 3.62Å; Y38-F270 HydrophobicContact CE2-CZ 4.01Å; E141-F270 HydrophobicContact CG-CE1 4.11Å; E141-F270 HydrophobicContact CG-CZ 3.96Å; V142-F270 HydrophobicContact CG2-CD1 3.93Å; V142-F270 HydrophobicContact CG2-CE1 4.09Å; F145-F270 HydrophobicContact CB-CD1 3.76Å; F145-F270 HydrophobicContact CB-CD2 4.4Å; F145-F270 HydrophobicContact CB-CE1 3.69Å; F145-F270 HydrophobicContact CB-CE2 4.3Å; F145-F270 HydrophobicContact CB-CG 4.14Å; F145-F270 HydrophobicContact CB-CZ 3.98Å; F145-F270 HydrophobicContact CD1-CB 3.5Å; F145-F270 VanDerWaalsContact CD1-CB 3.5Å; F145-F270 AromaticContact CD1-CD1 3.79Å; F145-F270 HydrophobicContact CD1-CD1 3.79Å; F145-F270 AromaticContact CD1-CD2 3.98Å; F145-F270 HydrophobicContact CD1-CD2 3.98Å; F145-F270 AromaticContact CD1-CG 3.48Å; F145-F270 HydrophobicContact CD1-CG 3.48Å; F145-F270 VanDerWaalsContact CD1-CG 3.48Å; F145-F270 AromaticContact CD2-CD2 3.76Å; F145-F270 HydrophobicContact CD2-CD2 3.76Å; F145-F270 AromaticContact CD2-CE2 3.89Å; F145-F270 HydrophobicContact CD2-CE2 3.89Å; F145-F270 HydrophobicContact CD2-CG 4.11Å; F145-F270 HydrophobicContact CD2-CZ 4.39Å; F145-F270 HydrophobicContact CE1-CB 3.4Å; F145-F270 VanDerWaalsContact CE1-CB 3.4Å; F145-F270 HydrophobicContact CE1-CD2 4.12Å; F145-F270 AromaticContact CE1-CG 3.79Å; F145-F270 HydrophobicContact CE1-CG 3.79Å; F145-F270 AromaticContact CE2-CD2 3.94Å; F145-F270 HydrophobicContact CE2-CD2 3.94Å; F145-F270 HydrophobicContact CE2-CE2 4.38Å; F145-F270 HydrophobicContact CE2-CG 4.4Å; F145-F270 HydrophobicContact CG-CB 4.18Å; F145-F270 AromaticContact CG-CD1 3.79Å; F145-F270 HydrophobicContact CG-CD1 3.79Å; F145-F270 AromaticContact CG-CD2 3.78Å; F145-F270 HydrophobicContact CG-CD2 3.78Å; F145-F270 HydrophobicContact CG-CE1 4.1Å; F145-F270 HydrophobicContact CG-CE2 4.05Å; F145-F270 AromaticContact CG-CG 3.64Å; F145-F270 HydrophobicContact CG-CG 3.64Å; F145-F270 HydrophobicContact CG-CZ 4.22Å; F145-F270 HydrophobicContact CZ-CB 4.04Å; F145-F270 HydrophobicContact CZ-CD2 4.11Å; F145-F270 HydrophobicContact CZ-CG 4.25Å; V266-F270 PolarHBondContact O-N 3.31Å; V267-F270 PolarHBondContact O-N 3.38Å; N268-F270 VanDerWaalsContact C-N 3.31Å; N268-F270 PolarHBondContact O-N 3.46Å; F270-N272 VanDerWaalsContact C-N 3.28Å; F270-N272 PolarHBondContact O-N 2.83Å; F270-N273 PolarHBondContact O-N 2.94Å; F270-L274 HydrophobicContact CE1-CD2 3.87Å; F270-L274 HydrophobicContact CZ-CD2 4.23Å; F270-L274 WeakPolarHBondContact O-CB 3.2Å; F270-L274 PolarHBondContact O-N 3.34Å
271	R	96.5	Very high	93.2	Very high	69 Å²	69	34.4 Å²	34.4	26%	0.26	20%	0.196	S	C	.	.	H	α-helix	trans	-55.6	-44.1	178.3	174.6	-178	-76.6	-86.9	2	111.6	L138 V142 V267 N268 S275	L138-R271 HydrophobicContact CD1-CG 4.24Å; V142-R271 HydrophobicContact CG1-CB 4.45Å; V142-R271 HydrophobicContact CG2-CB 3.8Å; V142-R271 HydrophobicContact CG2-CG 4.12Å; V267-R271 WeakPolarHBondContact O-CB 3.12Å; V267-R271 PolarHBondContact O-N 3.47Å; N268-R271 PolarHBondContact O-N 3.21Å; R271-S275 WeakPolarHBondContact O-CB 3.34Å; R271-S275 PolarHBondContact O-N 2.85Å
272	N	94.3	Very high	93.5	Very high	78 Å²	78	34 Å²	34	42%	0.417	20%	0.197	S	C	.	.	H	α-helix	trans	-69.2	-41.2	-178.6	-70.5	-20.8	0	0	0	111.8	N268 I269 F270 T276	N268-N272 PolarHBondContact ND2-ND2 3.37Å; N268-N272 WeakPolarHBondContact O-CB 3.19Å; N268-N272 PolarHBondContact O-N 3.09Å; N268-N272 PolarHBondContact O-ND2 3.17Å; I269-N272 PolarHBondContact O-N 3.18Å; F270-N272 VanDerWaalsContact C-N 3.28Å; F270-N272 PolarHBondContact O-N 2.83Å; N272-T276 WeakPolarHBondContact O-CB 3.47Å; N272-T276 PolarHBondContact O-N 3.41Å; N272-T276 PolarHBondContact O-OG1 3.02Å
273	N	94.9	Very high	93.8	Very high	23 Å²	23	40.8 Å²	40.8	12%	0.123	23%	0.226	C	C	.	.	H	α-helix	trans	-59	-53.2	172.8	-175.3	45.5	0	0	0	111	F37 Y38 W39 I269 F270 S275 T276 S277	F37-N273 PolarHBondContact O-ND2 3.44Å; Y38-N273 PolarHBondContact O-ND2 3.14Å; W39-N273 HydrophobicContact CE3-CB 4.19Å; W39-N273 VanDerWaalsContact CE3-CG 3.43Å; W39-N273 HydrophobicContact CH2-CB 4.28Å; W39-N273 HydrophobicContact CZ3-CB 3.64Å; W39-N273 VanDerWaalsContact CZ3-CG 3.4Å; W39-N273 WeakPolarHBondContact CZ3-OD1 3.32Å; I269-N273 PolarHBondContact O-N 3.18Å; F270-N273 PolarHBondContact O-N 2.94Å; N273-S275 PolarHBondContact O-N 3.36Å; N273-T276 PolarHBondContact O-N 3.31Å; N273-S277 PolarHBondContact O-N 3.44Å; N273-S277 PolarHBondContact O-OG 2.55Å
274	L	96.9	Very high	93.9	Very high	1 Å²	1	43.1 Å²	43.1	1%	0.005	24%	0.239	C	C	.	.	H	α-helix	trans	-60.9	-44.9	-178.8	-179.8	53.3	0	0	0	112.2	M124 F137 L138 E141 V142 F270 T276 S277 L278	M124-L274 HydrophobicContact SD-CD1 4.5Å; F137-L274 HydrophobicContact CE1-CD1 3.86Å; L138-L274 HydrophobicContact CD1-CB 4.03Å; L138-L274 HydrophobicContact CD1-CD2 3.82Å; L138-L274 HydrophobicContact CD1-CG 3.78Å; E141-L274 HydrophobicContact CB-CD2 3.69Å; E141-L274 HydrophobicContact CG-CD2 3.44Å; E141-L274 VanDerWaalsContact CG-CD2 3.44Å; V142-L274 HydrophobicContact CG2-CD2 4.49Å; F270-L274 HydrophobicContact CE1-CD2 3.87Å; F270-L274 HydrophobicContact CZ-CD2 4.23Å; F270-L274 WeakPolarHBondContact O-CB 3.2Å; F270-L274 PolarHBondContact O-N 3.34Å; L274-T276 VanDerWaalsContact C-N 3.31Å; L274-T276 PolarHBondContact O-N 3.38Å; L274-S277 PolarHBondContact O-N 3.47Å; L274-L278 WeakPolarHBondContact O-CB 3.48Å; L274-L278 PolarHBondContact O-N 2.89Å
275	S	96.3	Very high	93.8	Very high	54 Å²	54	42.5 Å²	42.5	38%	0.378	23%	0.228	S	C	.	.	H	α-helix	trans	-57.9	-44.6	176.8	-176.4	0	0	0	0	111.6	R271 N273 A279	R271-S275 WeakPolarHBondContact O-CB 3.34Å; R271-S275 PolarHBondContact O-N 2.85Å; N273-S275 PolarHBondContact O-N 3.36Å; S275-A279 WeakPolarHBondContact O-CB 3.36Å; S275-A279 PolarHBondContact O-N 3.23Å
276	T	95.8	Very high	93.5	Very high	73 Å²	73	46.1 Å²	46.1	45%	0.448	25%	0.253	S	S	.	.	H	α-helix	trans	-65	-48.4	178.8	-57.3	0	0	0	0	111.6	N272 N273 L274 A279 K280	N272-T276 WeakPolarHBondContact O-CB 3.47Å; N272-T276 PolarHBondContact O-N 3.41Å; N272-T276 PolarHBondContact O-OG1 3.02Å; N273-T276 PolarHBondContact O-N 3.31Å; L274-T276 VanDerWaalsContact C-N 3.31Å; L274-T276 PolarHBondContact O-N 3.38Å; T276-A279 PolarHBondContact O-N 3.46Å; T276-K280 WeakPolarHBondContact O-CG 3.32Å; T276-K280 PolarHBondContact O-N 3.3Å
277	S	95.3	Very high	93.2	Very high	18 Å²	18	52 Å²	52	13%	0.126	28%	0.284	C	S	.	.	H	α-helix	trans	-64.1	-43.2	179.9	-65.6	0	0	0	0	111.8	N273 L274 A279 K280 V281	N273-S277 PolarHBondContact O-N 3.44Å; N273-S277 PolarHBondContact O-OG 2.55Å; L274-S277 PolarHBondContact O-N 3.47Å; S277-A279 VanDerWaalsContact C-N 3.34Å; S277-A279 PolarHBondContact O-N 3.23Å; S277-K280 WeakPolarHBondContact O-CB 3.39Å; S277-K280 PolarHBondContact O-N 3.31Å; S277-V281 VanDerWaalsContact O-CG2 3.24Å; S277-V281 WeakPolarHBondContact O-CG2 3.42Å; S277-V281 PolarHBondContact O-N 2.6Å
278	L	94.4	Very high	92.6	Very high	4 Å²	4	53.3 Å²	53.3	2%	0.021	29%	0.292	C	S	.	.	H	α-helix	trans	-65.1	-36.5	177.5	-171	66.1	0	0	0	111.9	M124 A128 R134 F137 L138 L274 V281 A282	M124-L278 HydrophobicContact CG-CB 4.4Å; M124-L278 HydrophobicContact CG-CD1 3.59Å; M124-L278 HydrophobicContact SD-CB 4.49Å; A128-L278 HydrophobicContact CB-CD1 4.29Å; R134-L278 HydrophobicContact CB-CD2 3.59Å; R134-L278 HydrophobicContact CB-CG 4.12Å; R134-L278 HydrophobicContact CG-CD1 4.05Å; R134-L278 HydrophobicContact CG-CD2 3.81Å; R134-L278 HydrophobicContact CG-CG 3.76Å; R134-L278 WeakPolarHBondContact O-CD2 3.37Å; F137-L278 HydrophobicContact CD1-CD1 4.03Å; F137-L278 HydrophobicContact CD1-CD2 4.16Å; F137-L278 HydrophobicContact CE1-CD1 4.41Å; L138-L278 HydrophobicContact CB-CD2 4.41Å; L274-L278 WeakPolarHBondContact O-CB 3.48Å; L274-L278 PolarHBondContact O-N 2.89Å; L278-V281 PolarHBondContact O-N 2.87Å; L278-A282 VanDerWaalsContact O-CB 3.28Å; L278-A282 WeakPolarHBondContact O-CB 3.32Å; L278-A282 PolarHBondContact O-N 2.85Å
279	A	94.4	Very high	91.8	Very high	55 Å²	55	55.7 Å²	55.7	46%	0.455	30%	0.301	S	S	.	.	H	α-helix	trans	-66.6	-40	173.2	0	0	0	0	0	112.5	S275 T276 S277 A282 K283	S275-A279 WeakPolarHBondContact O-CB 3.36Å; S275-A279 PolarHBondContact O-N 3.23Å; T276-A279 PolarHBondContact O-N 3.46Å; S277-A279 VanDerWaalsContact C-N 3.34Å; S277-A279 PolarHBondContact O-N 3.23Å; A279-A282 PolarHBondContact O-N 3.43Å; A279-K283 WeakPolarHBondContact O-CB 3.45Å; A279-K283 PolarHBondContact O-N 3.26Å
280	K	94.4	Very high	91	Very high	112 Å²	112	59.6 Å²	59.6	49%	0.487	33%	0.331	S	S	.	.	H	α-helix	trans	-62	-44.7	174.3	-72	173.4	-179.8	177.5	0	111.5	T276 S277 K283 N284	T276-K280 WeakPolarHBondContact O-CG 3.32Å; T276-K280 PolarHBondContact O-N 3.3Å; S277-K280 WeakPolarHBondContact O-CB 3.39Å; S277-K280 PolarHBondContact O-N 3.31Å; K280-K283 PolarHBondContact O-N 2.96Å; K280-N284 PolarHBondContact O-N 2.97Å; K280-N284 PolarHBondContact O-ND2 2.98Å
281	V	92.7	Very high	90.3	Very high	27 Å²	27	61.5 Å²	61.5	16%	0.164	34%	0.341	C	S	.	.	H	α-helix	trans	-64	-47.3	177.8	177	0	0	0	0	110.2	M124 L125 A128 S277 L278 K283 N284 I285	M124-V281 HydrophobicContact CE-CG2 3.68Å; M124-V281 HydrophobicContact CG-CG2 4.07Å; M124-V281 HydrophobicContact SD-CG2 3.91Å; L125-V281 HydrophobicContact CD2-CG1 3.85Å; A128-V281 HydrophobicContact CB-CB 4.18Å; A128-V281 HydrophobicContact CB-CG1 3.5Å; S277-V281 VanDerWaalsContact O-CG2 3.24Å; S277-V281 WeakPolarHBondContact O-CG2 3.42Å; S277-V281 PolarHBondContact O-N 2.6Å; L278-V281 PolarHBondContact O-N 2.87Å; V281-K283 VanDerWaalsContact C-N 3.29Å; V281-K283 PolarHBondContact O-N 3.3Å; V281-N284 CarbonylContact O-C 3.42Å; V281-N284 PolarHBondContact O-N 3.5Å; V281-I285 HydrophobicContact CG1-CD1 4.27Å; V281-I285 PolarHBondContact O-N 3.23Å
282	A	91.8	Very high	89.2	Confident	19 Å²	19	62 Å²	62	16%	0.157	36%	0.36	C	S	.	.	H	α-helix	trans	-58.9	-39	179.1	0	0	0	0	0	113.1	L278 A279 N284 I285	L278-A282 VanDerWaalsContact O-CB 3.28Å; L278-A282 WeakPolarHBondContact O-CB 3.32Å; L278-A282 PolarHBondContact O-N 2.85Å; A279-A282 PolarHBondContact O-N 3.43Å; A282-N284 PolarHBondContact O-N 3.48Å; A282-I285 VanDerWaalsContact O-CG2 3.31Å; A282-I285 WeakPolarHBondContact O-CG2 3.31Å; A282-I285 PolarHBondContact O-N 2.66Å
283	K	93	Very high	88.2	Confident	173 Å²	173	65.2 Å²	65.2	75%	0.752	37%	0.366	S	S	*	.	H	α-helix	trans	-63.7	-30.6	176.5	-175.6	179.4	176.5	-176.1	0	112.7	A279 K280 V281	A279-K283 WeakPolarHBondContact O-CB 3.45Å; A279-K283 PolarHBondContact O-N 3.26Å; K280-K283 PolarHBondContact O-N 2.96Å; V281-K283 VanDerWaalsContact C-N 3.29Å; V281-K283 PolarHBondContact O-N 3.3Å
284	N	91.7	Very high	87.3	Confident	80 Å²	80	65.6 Å²	65.6	43%	0.428	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.9	10.5	-175.6	-65.1	-74.1	0	0	0	113	K280 V281 A282 C286 L287	K280-N284 PolarHBondContact O-N 2.97Å; K280-N284 PolarHBondContact O-ND2 2.98Å; V281-N284 CarbonylContact O-C 3.42Å; V281-N284 PolarHBondContact O-N 3.5Å; A282-N284 PolarHBondContact O-N 3.48Å; N284-C286 PolarHBondContact O-N 3.36Å; N284-L287 HydrophobicContact CB-CD1 4.08Å; N284-L287 WeakPolarHBondContact O-CB 3.24Å; N284-L287 WeakPolarHBondContact O-CG 3.42Å; N284-L287 PolarHBondContact O-N 2.81Å
285	I	87.6	Confident	86.2	Confident	17 Å²	17	67.4 Å²	67.4	9%	0.087	38%	0.381	C	S	.	.	G	3₁₀ helix	trans	-61.9	-32.4	-172	-161.1	64.7	0	0	0	112.5	A128 V281 A282 L287 V288 E289 F298	A128-I285 HydrophobicContact CB-CD1 3.87Å; V281-I285 HydrophobicContact CG1-CD1 4.27Å; V281-I285 PolarHBondContact O-N 3.23Å; A282-I285 VanDerWaalsContact O-CG2 3.31Å; A282-I285 WeakPolarHBondContact O-CG2 3.31Å; A282-I285 PolarHBondContact O-N 2.66Å; I285-L287 PolarHBondContact O-N 2.99Å; I285-L287 VanDerWaalsContact O-N 3.15Å; I285-V288 HydrophobicContact CD1-CG2 3.87Å; I285-V288 HydrophobicContact CG1-CG2 4.49Å; I285-V288 WeakPolarHBondContact O-CG2 3.48Å; I285-V288 PolarHBondContact O-N 2.89Å; I285-E289 HydrophobicContact CG1-CG 4.45Å; I285-E289 WeakPolarHBondContact O-CG 3.37Å; I285-E289 PolarHBondContact O-N 3.5Å; I285-E289 VanDerWaalsContact O-N 3.08Å; I285-F298 HydrophobicContact CD1-CE1 3.76Å; I285-F298 HydrophobicContact CD1-CZ 3.72Å; I285-F298 HydrophobicContact CG1-CE1 4.25Å; I285-F298 HydrophobicContact CG1-CZ 3.95Å
286	C	85.1	Confident	85.1	Confident	82 Å²	82	66.4 Å²	66.4	55%	0.554	38%	0.376	S	S	*	.	G	3₁₀ helix	trans	-61.4	-22.6	177.2	58.7	0	0	0	0	113.7	N284 V288	N284-C286 PolarHBondContact O-N 3.36Å; C286-V288 VanDerWaalsContact C-N 3.26Å; C286-V288 PolarHBondContact O-N 3.4Å
287	L	85.2	Confident	84.2	Confident	124 Å²	124	62.9 Å²	62.9	65%	0.649	35%	0.354	S	S	*	.	G	3₁₀ helix	trans	-71.6	-23.8	176.9	-58.4	-179.2	0	0	0	112.4	N284 I285	N284-L287 HydrophobicContact CB-CD1 4.08Å; N284-L287 WeakPolarHBondContact O-CB 3.24Å; N284-L287 WeakPolarHBondContact O-CG 3.42Å; N284-L287 PolarHBondContact O-N 2.81Å; I285-L287 PolarHBondContact O-N 2.99Å; I285-L287 VanDerWaalsContact O-N 3.15Å
288	V	82.2	Confident	83.2	Confident	40 Å²	40	63 Å²	63	24%	0.242	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.6	-13.7	-176.5	-65	0	0	0	0	113.2	I285 C286 S290 D291 I294	I285-V288 HydrophobicContact CD1-CG2 3.87Å; I285-V288 HydrophobicContact CG1-CG2 4.49Å; I285-V288 WeakPolarHBondContact O-CG2 3.48Å; I285-V288 PolarHBondContact O-N 2.89Å; C286-V288 VanDerWaalsContact C-N 3.26Å; C286-V288 PolarHBondContact O-N 3.4Å; V288-S290 VanDerWaalsContact C-N 3.26Å; V288-S290 PolarHBondContact O-N 3.17Å; V288-D291 PolarHBondContact O-N 3.34Å; V288-D291 VanDerWaalsContact O-N 3.14Å; V288-I294 HydrophobicContact CB-CD1 3.67Å; V288-I294 HydrophobicContact CB-CG2 4.13Å; V288-I294 HydrophobicContact CG1-CD1 3.94Å; V288-I294 HydrophobicContact CG2-CG2 4.12Å
289	E	75.5	Confident	81.9	Confident	94 Å²	94	66.9 Å²	66.9	44%	0.439	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-31	-179.6	-86.8	175.6	-179.4	0	0	114.2	I285 D291 S295 F298	I285-E289 HydrophobicContact CG1-CG 4.45Å; I285-E289 WeakPolarHBondContact O-CG 3.37Å; I285-E289 PolarHBondContact O-N 3.5Å; I285-E289 VanDerWaalsContact O-N 3.08Å; E289-D291 VanDerWaalsContact C-N 3.26Å; E289-D291 PolarHBondContact O-N 3.49Å; E289-S295 PolarHBondContact O-OG 2.74Å; E289-F298 HydrophobicContact CG-CE2 3.79Å; E289-F298 HydrophobicContact CG-CZ 4.24Å
290	S	76.7	Confident	80.6	Confident	108 Å²	108	64.5 Å²	64.5	76%	0.755	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.2	-20.4	178.9	58.1	0	0	0	0	113.3	V288 A292	V288-S290 VanDerWaalsContact C-N 3.26Å; V288-S290 PolarHBondContact O-N 3.17Å; S290-A292 PolarHBondContact O-N 3.49Å
291	D	80.8	Confident	79	Confident	41 Å²	41	59.4 Å²	59.4	22%	0.219	33%	0.331	C	S	.	.			trans	-80	107.5	178.1	-168.3	-43.2	0	0	0	109.9	V288 E289 R293 I294 S295	V288-D291 PolarHBondContact O-N 3.34Å; V288-D291 VanDerWaalsContact O-N 3.14Å; E289-D291 VanDerWaalsContact C-N 3.26Å; E289-D291 PolarHBondContact O-N 3.49Å; D291-R293 PolarHBondContact O-N 3.26Å; D291-R293 WeakPolarHBondContact OD1-CA 3.27Å; D291-R293 WeakPolarHBondContact OD1-CB 3.03Å; D291-R293 WeakPolarHBondContact OD1-CG 3.36Å; D291-R293 IonicContact OD1-CZ 3.17Å; D291-R293 PolarHBondContact OD1-N 3.35Å; D291-R293 IonicContact OD1-NE 2.93Å; D291-R293 PolarHBondContact OD1-NE 3.48Å; D291-R293 IonicContact OD2-CZ 3.4Å; D291-R293 VanDerWaalsContact OD2-CZ 3.29Å; D291-R293 IonicContact OD2-NE 2.65Å; D291-R293 PolarHBondContact OD2-NE 3.14Å; D291-R293 VanDerWaalsContact OD2-NE 3.1Å; D291-R293 IonicContact OD2-NH2 2.71Å; D291-R293 PolarHBondContact OD2-NH2 3.01Å; D291-I294 HydrophobicContact CB-CB 4.36Å; D291-I294 HydrophobicContact CB-CD1 4.21Å; D291-I294 HydrophobicContact CB-CG1 4.25Å; D291-I294 WeakPolarHBondContact O-CA 3.48Å; D291-I294 PolarHBondContact O-N 3.34Å; D291-S295 PolarHBondContact O-N 2.7Å; D291-S295 PolarHBondContact O-OG 2.61Å
292	A	73.4	Confident	77.4	Confident	79 Å²	79	62.3 Å²	62.3	65%	0.653	35%	0.353	S	S	*	.	H	α-helix	trans	-53.1	-25.5	-179.6	0	0	0	0	0	113.9	S290 A296	S290-A292 PolarHBondContact O-N 3.49Å; A292-A296 PolarHBondContact O-N 3.35Å
293	R	74.3	Confident	75.6	Confident	145 Å²	145	63.2 Å²	63.2	55%	0.547	35%	0.354	S	S	.	.	H	α-helix	trans	-70.4	-38.9	176.7	-54.1	175.8	-67.8	174	-0.1	111.4	L48 F52 D291	L48-R293 HydrophobicContact CD1-CB 3.64Å; L48-R293 HydrophobicContact CD1-CG 4.25Å; L48-R293 HydrophobicContact CD2-CB 3.76Å; L48-R293 HydrophobicContact CD2-CG 3.74Å; L48-R293 HydrophobicContact CG-CB 4.37Å; F52-R293 WeakPolarHBondContact CZ-O 3.46Å; D291-R293 PolarHBondContact O-N 3.26Å; D291-R293 WeakPolarHBondContact OD1-CA 3.27Å; D291-R293 WeakPolarHBondContact OD1-CB 3.03Å; D291-R293 WeakPolarHBondContact OD1-CG 3.36Å; D291-R293 IonicContact OD1-CZ 3.17Å; D291-R293 PolarHBondContact OD1-N 3.35Å; D291-R293 IonicContact OD1-NE 2.93Å; D291-R293 PolarHBondContact OD1-NE 3.48Å; D291-R293 IonicContact OD2-CZ 3.4Å; D291-R293 VanDerWaalsContact OD2-CZ 3.29Å; D291-R293 IonicContact OD2-NE 2.65Å; D291-R293 PolarHBondContact OD2-NE 3.14Å; D291-R293 VanDerWaalsContact OD2-NE 3.1Å; D291-R293 IonicContact OD2-NH2 2.71Å; D291-R293 PolarHBondContact OD2-NH2 3.01Å
294	I	76.2	Confident	74	Confident	31 Å²	31	57 Å²	57	16%	0.159	33%	0.326	C	S	.	.	H	α-helix	trans	-82.9	-36.7	177.9	-59.1	176.1	0	0	0	110.2	V288 D291 A296 L297 F298	V288-I294 HydrophobicContact CB-CD1 3.67Å; V288-I294 HydrophobicContact CB-CG2 4.13Å; V288-I294 HydrophobicContact CG1-CD1 3.94Å; V288-I294 HydrophobicContact CG2-CG2 4.12Å; D291-I294 HydrophobicContact CB-CB 4.36Å; D291-I294 HydrophobicContact CB-CD1 4.21Å; D291-I294 HydrophobicContact CB-CG1 4.25Å; D291-I294 WeakPolarHBondContact O-CA 3.48Å; D291-I294 PolarHBondContact O-N 3.34Å; I294-A296 PolarHBondContact O-N 3.26Å; I294-A296 VanDerWaalsContact O-N 3.17Å; I294-L297 WeakPolarHBondContact O-CA 3.33Å; I294-L297 VanDerWaalsContact O-CB 3.29Å; I294-L297 WeakPolarHBondContact O-CB 3.46Å; I294-L297 PolarHBondContact O-N 2.79Å; I294-F298 HydrophobicContact CG2-CE1 4.31Å; I294-F298 HydrophobicContact CG2-CE2 4.3Å; I294-F298 HydrophobicContact CG2-CZ 3.82Å; I294-F298 PolarHBondContact O-N 3.28Å
295	S	73.9	Confident	71.7	Confident	40 Å²	40	56.4 Å²	56.4	28%	0.28	34%	0.339	S	S	.	.	H	α-helix	trans	-56.9	-35.1	174.7	-33.9	0	0	0	0	111.7	E289 D291 L297 F298	E289-S295 PolarHBondContact O-OG 2.74Å; D291-S295 PolarHBondContact O-N 2.7Å; D291-S295 PolarHBondContact O-OG 2.61Å; S295-L297 VanDerWaalsContact C-N 3.3Å; S295-L297 PolarHBondContact O-N 2.85Å; S295-F298 PolarHBondContact O-N 3.05Å
296	A	73.7	Confident	69.6	Low	32 Å²	32	55.9 Å²	55.9	26%	0.264	34%	0.337	S	S	.	.	H	α-helix	trans	-66.7	-25.6	175	0	0	0	0	0	113.7	F52 A292 I294	F52-A296 HydrophobicContact CE1-CB 4.17Å; F52-A296 HydrophobicContact CZ-CB 3.64Å; A292-A296 PolarHBondContact O-N 3.35Å; I294-A296 PolarHBondContact O-N 3.26Å; I294-A296 VanDerWaalsContact O-N 3.17Å
297	L	75.8	Confident	67.2	Low	0 Å²	0	54.3 Å²	54.3	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-68.9	-34.3	171.9	-77.3	169.2	0	0	0	112.2	M51 F52 A55 V122 A126 I294 S295 N299 M300	M51-L297 HydrophobicContact CE-CD1 3.5Å; M51-L297 HydrophobicContact CE-CD2 3.96Å; M51-L297 HydrophobicContact CE-CG 3.71Å; M51-L297 HydrophobicContact SD-CD1 3.86Å; F52-L297 HydrophobicContact CD1-CD2 3.43Å; F52-L297 VanDerWaalsContact CD1-CD2 3.43Å; F52-L297 HydrophobicContact CD1-CG 4.09Å; F52-L297 HydrophobicContact CE1-CB 4.22Å; F52-L297 HydrophobicContact CE1-CD2 3.4Å; F52-L297 VanDerWaalsContact CE1-CD2 3.4Å; F52-L297 HydrophobicContact CE1-CG 3.53Å; F52-L297 HydrophobicContact CG-CD2 4.45Å; F52-L297 HydrophobicContact CZ-CD2 4.32Å; F52-L297 HydrophobicContact CZ-CG 4.08Å; A55-L297 HydrophobicContact CB-CD2 4.12Å; V122-L297 HydrophobicContact CG1-CD1 4.02Å; V122-L297 HydrophobicContact CG1-CD2 3.72Å; A126-L297 HydrophobicContact CB-CB 4.15Å; I294-L297 WeakPolarHBondContact O-CA 3.33Å; I294-L297 VanDerWaalsContact O-CB 3.29Å; I294-L297 WeakPolarHBondContact O-CB 3.46Å; I294-L297 PolarHBondContact O-N 2.79Å; S295-L297 VanDerWaalsContact C-N 3.3Å; S295-L297 PolarHBondContact O-N 2.85Å; L297-N299 PolarHBondContact O-N 2.91Å; L297-M300 WeakPolarHBondContact O-CB 3.4Å; L297-M300 PolarHBondContact O-N 3.13Å
298	F	73.9	Confident	64.9	Low	21 Å²	21	49 Å²	49	9%	0.092	30%	0.299	C	S	.	.	H	α-helix	trans	-62.6	-26.9	179.4	-57.8	-40.9	0	0	0	112.8	L125 N129 I285 E289 I294 S295 M300 A301	L125-F298 WeakPolarHBondContact O-CE1 3.36Å; N129-F298 HydrophobicContact CB-CD1 4.32Å; I285-F298 HydrophobicContact CD1-CE1 3.76Å; I285-F298 HydrophobicContact CD1-CZ 3.72Å; I285-F298 HydrophobicContact CG1-CE1 4.25Å; I285-F298 HydrophobicContact CG1-CZ 3.95Å; E289-F298 HydrophobicContact CG-CE2 3.79Å; E289-F298 HydrophobicContact CG-CZ 4.24Å; I294-F298 HydrophobicContact CG2-CE1 4.31Å; I294-F298 HydrophobicContact CG2-CE2 4.3Å; I294-F298 HydrophobicContact CG2-CZ 3.82Å; I294-F298 PolarHBondContact O-N 3.28Å; S295-F298 PolarHBondContact O-N 3.05Å; F298-M300 PolarHBondContact O-N 3.37Å; F298-A301 PolarHBondContact O-N 2.99Å
299	N	67.4	Low	62.9	Low	85 Å²	85	48.6 Å²	48.6	46%	0.455	29%	0.294	S	S	.	.	H	α-helix	trans	-63.2	-23.2	172.7	-65.6	-28.8	0	0	0	112.3	L297 A301 S302 I303	L297-N299 PolarHBondContact O-N 2.91Å; N299-A301 VanDerWaalsContact C-N 3.32Å; N299-A301 PolarHBondContact O-N 3.07Å; N299-S302 WeakPolarHBondContact O-CB 3.38Å; N299-S302 PolarHBondContact O-N 2.99Å; N299-I303 WeakPolarHBondContact O-CG1 3.39Å; N299-I303 PolarHBondContact O-N 2.86Å; N299-I303 VanDerWaalsContact O-N 3.1Å
300	M	66.7	Low	61.1	Low	5 Å²	5	48.7 Å²	48.7	3%	0.025	30%	0.298	C	S	.	.	H	α-helix	trans	-61	-41.4	173.5	-71	-145.3	171.5	0	0	112.2	F52 A55 Q59 L297 F298 S302 I303 R304 L426	F52-M300 HydrophobicContact CB-CE 4.4Å; F52-M300 HydrophobicContact CD1-CE 3.93Å; F52-M300 WeakPolarHBondContact O-CE 3.42Å; A55-M300 HydrophobicContact CB-CE 3.55Å; A55-M300 HydrophobicContact CB-SD 3.44Å; A55-M300 WeakPolarHBondContact CB-SD 3.39Å; Q59-M300 PolarHBondContact NE2-O 3.47Å; L297-M300 WeakPolarHBondContact O-CB 3.4Å; L297-M300 PolarHBondContact O-N 3.13Å; F298-M300 PolarHBondContact O-N 3.37Å; M300-S302 PolarHBondContact O-N 3.35Å; M300-I303 WeakPolarHBondContact O-CA 3.33Å; M300-I303 WeakPolarHBondContact O-CB 3.43Å; M300-I303 PolarHBondContact O-N 2.89Å; M300-R304 PolarHBondContact O-N 3.3Å; M300-L426 HydrophobicContact CE-CD2 3.64Å
301	A	61.8	Low	59.3	Low	4 Å²	4	44.4 Å²	44.4	3%	0.033	27%	0.265	C	S	.	.	H	α-helix	trans	-63.6	-34.8	177.9	0	0	0	0	0	111.3	Y127 N133 F298 N299 I303 R304	Y127-A301 HydrophobicContact CD1-CB 3.93Å; Y127-A301 HydrophobicContact CE1-CB 3.83Å; Y127-A301 HydrophobicContact CG-CB 4.41Å; N133-A301 WeakPolarHBondContact ND2-CB 3.35Å; F298-A301 PolarHBondContact O-N 2.99Å; N299-A301 VanDerWaalsContact C-N 3.32Å; N299-A301 PolarHBondContact O-N 3.07Å; A301-I303 VanDerWaalsContact C-N 3.28Å; A301-I303 PolarHBondContact O-N 3.16Å; A301-R304 WeakPolarHBondContact O-CB 3.38Å; A301-R304 PolarHBondContact O-N 3.19Å
302	S	58	Low	57.3	Low	88 Å²	88	43.3 Å²	43.3	62%	0.615	26%	0.261	S	S	*	.	H	α-helix	trans	-64.3	-31.6	171.8	-55.1	0	0	0	0	112.7	N299 M300 R304	N299-S302 WeakPolarHBondContact O-CB 3.38Å; N299-S302 PolarHBondContact O-N 2.99Å; M300-S302 PolarHBondContact O-N 3.35Å; S302-R304 VanDerWaalsContact C-N 3.29Å; S302-R304 PolarHBondContact O-N 2.97Å
303	I	55.2	Low	55.4	Low	38 Å²	38	43.2 Å²	43.2	20%	0.195	25%	0.25	C	C	.	.	H	α-helix	trans	-75	-14.3	176.7	-63.5	160.1	0	0	0	112.2	N299 M300 A301 G305 C306 Y502	N299-I303 WeakPolarHBondContact O-CG1 3.39Å; N299-I303 PolarHBondContact O-N 2.86Å; N299-I303 VanDerWaalsContact O-N 3.1Å; M300-I303 WeakPolarHBondContact O-CA 3.33Å; M300-I303 WeakPolarHBondContact O-CB 3.43Å; M300-I303 PolarHBondContact O-N 2.89Å; A301-I303 VanDerWaalsContact C-N 3.28Å; A301-I303 PolarHBondContact O-N 3.16Å; I303-G305 PolarHBondContact O-N 3.21Å; I303-G305 VanDerWaalsContact O-N 3.16Å; I303-C306 HydrophobicContact CG2-CB 4.2Å; I303-C306 WeakPolarHBondContact O-CA 3.48Å; I303-C306 WeakPolarHBondContact O-CB 3.34Å; I303-C306 PolarHBondContact O-N 3.49Å; I303-C306 PolarHBondContact O-SG 3.18Å; I303-Y502 HydrophobicContact CB-CG 4.49Å; I303-Y502 HydrophobicContact CD1-CG 4.22Å; I303-Y502 HydrophobicContact CG1-CD1 4.41Å; I303-Y502 HydrophobicContact CG1-CG 4.15Å; I303-Y502 HydrophobicContact CG2-CD1 3.71Å; I303-Y502 HydrophobicContact CG2-CD2 3.52Å; I303-Y502 HydrophobicContact CG2-CE1 3.97Å; I303-Y502 HydrophobicContact CG2-CE2 3.75Å; I303-Y502 HydrophobicContact CG2-CG 3.49Å; I303-Y502 VanDerWaalsContact CG2-CG 3.49Å
304	R	57.9	Low	53.6	Low	43 Å²	43	40.9 Å²	40.9	16%	0.162	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-35.7	177.3	-174.9	-167.4	62.4	-174.3	6.4	113.1	L63 E132 W136 M300 A301 S302 C306	L63-R304 HydrophobicContact CD2-CG 3.9Å; E132-R304 IonicContact OE1-NH2 2.86Å; E132-R304 PolarHBondContact OE1-NH2 3.07Å; W136-R304 HydrophobicContact CD2-CG 4.31Å; W136-R304 HydrophobicContact CH2-CG 4.23Å; W136-R304 HydrophobicContact CZ2-CG 3.89Å; M300-R304 PolarHBondContact O-N 3.3Å; A301-R304 WeakPolarHBondContact O-CB 3.38Å; A301-R304 PolarHBondContact O-N 3.19Å; S302-R304 VanDerWaalsContact C-N 3.29Å; S302-R304 PolarHBondContact O-N 2.97Å; R304-C306 PolarHBondContact O-N 3.34Å
305	G	43.5	Very low	51.7	Low	67 Å²	67	42.1 Å²	42.1	69%	0.691	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	-12.4	177.7	0	0	0	0	0	113.4	I303 S307	I303-G305 PolarHBondContact O-N 3.21Å; I303-G305 VanDerWaalsContact O-N 3.16Å; G305-S307 PolarHBondContact O-N 2.8Å
306	C	44.2	Very low	50	Low	6 Å²	6	50.3 Å²	50.3	4%	0.041	29%	0.293	C	S	.	.	S	Bend	trans	-84.4	104.9	176.2	-46.9	0	0	0	0	109.4	I303 R304 V308 Q499 Y502	I303-C306 HydrophobicContact CG2-CB 4.2Å; I303-C306 WeakPolarHBondContact O-CA 3.48Å; I303-C306 WeakPolarHBondContact O-CB 3.34Å; I303-C306 PolarHBondContact O-N 3.49Å; I303-C306 PolarHBondContact O-SG 3.18Å; R304-C306 PolarHBondContact O-N 3.34Å; C306-V308 PolarHBondContact O-N 3.2Å; C306-Q499 VanDerWaalsContact CB-CD 3.43Å; C306-Q499 HydrophobicContact CB-CG 4.12Å; C306-Q499 VanDerWaalsContact CB-NE2 3.29Å; C306-Q499 WeakPolarHBondContact SG-CG 3.41Å; C306-Q499 PolarHBondContact SG-NE2 3.45Å; C306-Y502 HydrophobicContact CB-CD1 4.1Å; C306-Y502 HydrophobicContact CB-CE1 3.17Å; C306-Y502 VanDerWaalsContact CB-CZ 3.47Å; C306-Y502 WeakPolarHBondContact CB-OH 3.26Å; C306-Y502 WeakPolarHBondContact SG-CE1 3.44Å
307	S	33.9	Very low	48.5	Very low	49 Å²	49	52.1 Å²	52.1	34%	0.343	32%	0.315	S	S	.	.			trans	-58.4	98.3	174.1	-176.4	0	0	0	0	109.9	G305 Y309 Y311	G305-S307 PolarHBondContact O-N 2.8Å; S307-Y309 PolarHBondContact O-N 3.27Å; S307-Y309 PolarHBondContact OG-N 3.45Å; S307-Y311 WeakPolarHBondContact O-CD2 3.2Å; S307-Y311 WeakPolarHBondContact O-CE2 3.47Å
308	V	37.8	Very low	47.6	Very low	13 Å²	13	57.3 Å²	57.3	8%	0.079	34%	0.337	C	S	.	.	G	3₁₀ helix	trans	-68.1	-14	165.9	-176.7	0	0	0	0	109.9	R60 L63 C306 Y311 A312 Y502	R60-V308 HydrophobicContact CG-CG1 4.31Å; L63-V308 HydrophobicContact CD1-CG2 4.33Å; C306-V308 PolarHBondContact O-N 3.2Å; V308-Y311 PolarHBondContact O-N 3.18Å; V308-A312 PolarHBondContact O-N 3.07Å; V308-Y502 HydrophobicContact CG2-CE2 4.17Å
309	Y	41.3	Very low	47.2	Very low	31 Å²	31	63.6 Å²	63.6	12%	0.122	37%	0.367	C	S	.	.	G	3₁₀ helix	trans	-75.5	-22.2	-174.8	-68.6	-64.4	0	0	0	115.9	R60 L63 A64 M90 S307 Y311	R60-Y309 PolarHBondContact O-OH 3.43Å; L63-Y309 WeakPolarHBondContact CA-OH 3.44Å; L63-Y309 HydrophobicContact CB-CE2 3.48Å; L63-Y309 VanDerWaalsContact CB-CE2 3.48Å; L63-Y309 WeakPolarHBondContact CB-OH 3.38Å; L63-Y309 HydrophobicContact CD2-CE2 4.38Å; L63-Y309 HydrophobicContact CG-CE2 4.44Å; L63-Y309 WeakPolarHBondContact O-CE2 3.08Å; L63-Y309 PolarHBondContact O-OH 2.99Å; A64-Y309 VanDerWaalsContact CA-CE1 3.41Å; A64-Y309 VanDerWaalsContact CA-CZ 3.41Å; A64-Y309 WeakPolarHBondContact CA-OH 3.48Å; A64-Y309 HydrophobicContact CB-CE1 3.72Å; A64-Y309 PolarHBondContact N-OH 3.36Å; M90-Y309 HydrophobicContact CE-CE1 4.23Å; S307-Y309 PolarHBondContact O-N 3.27Å; S307-Y309 PolarHBondContact OG-N 3.45Å; Y309-Y311 PolarHBondContact O-N 2.79Å; Y309-Y311 VanDerWaalsContact O-N 3.13Å
310	D	35.8	Very low	47.9	Very low	97 Å²	97	60.4 Å²	60.4	52%	0.519	35%	0.351	S	S	.	.	G	3₁₀ helix	trans	-72	-4.6	173.5	-75.2	9.8	0	0	0	111.8	K513	D310-K513 VanDerWaalsContact CB-NZ 3.33Å; D310-K513 IonicContact OD2-NZ 3.1Å; D310-K513 PolarHBondContact OD2-NZ 2.71Å
311	Y	40	Very low	48.9	Very low	18 Å²	18	62.5 Å²	62.5	7%	0.071	36%	0.364	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119	-29.1	-168.4	-52.6	-52.1	0	0	0	112.9	S307 V308 Y309 D313 R364 Q506 D509 D510 K513	S307-Y311 WeakPolarHBondContact O-CD2 3.2Å; S307-Y311 WeakPolarHBondContact O-CE2 3.47Å; V308-Y311 PolarHBondContact O-N 3.18Å; Y309-Y311 PolarHBondContact O-N 2.79Å; Y309-Y311 VanDerWaalsContact O-N 3.13Å; Y311-D313 CarbonylContact O-C 3.57Å; Y311-D313 PolarHBondContact O-N 3.22Å; Y311-D313 VanDerWaalsContact O-N 3.11Å; Y311-R364 PolarHBondContact O-NH1 2.83Å; Y311-R364 PolarHBondContact O-NH2 2.89Å; Y311-Q506 HydrophobicContact CE2-CG 4.35Å; Y311-D509 HydrophobicContact CD1-CB 3.5Å; Y311-D509 VanDerWaalsContact CD1-CG 3.46Å; Y311-D509 WeakPolarHBondContact CD1-OD2 3.44Å; Y311-D509 HydrophobicContact CE1-CB 3.12Å; Y311-D509 HydrophobicContact CG-CB 4.46Å; Y311-D510 PolarHBondContact OH-OD1 2.87Å; Y311-K513 HydrophobicContact CE1-CD 4.48Å; Y311-K513 WeakPolarHBondContact OH-CE 3.46Å; Y311-K513 PolarHBondContact OH-NZ 2.71Å
312	A	39.1	Very low	50.2	Low	17 Å²	17	64.4 Å²	64.4	14%	0.14	38%	0.375	C	S	.	.	S	Bend	trans	-57.9	-29.2	-177.6	0	0	0	0	0	113.9	E86 V308 L314	E86-A312 WeakPolarHBondContact OE2-CB 3.46Å; V308-A312 PolarHBondContact O-N 3.07Å; A312-L314 PolarHBondContact O-N 3.41Å
313	D	32.7	Very low	51.6	Low	78 Å²	78	67.3 Å²	67.3	42%	0.417	38%	0.379	S	S	.	.	S	Bend	trans	-76.8	114.3	166.7	-68.3	-34.5	0	0	0	109.6	K89 Y311 S315	K89-D313 IonicContact NZ-OD1 2.71Å; K89-D313 PolarHBondContact NZ-OD1 3.4Å; Y311-D313 CarbonylContact O-C 3.57Å; Y311-D313 PolarHBondContact O-N 3.22Å; Y311-D313 VanDerWaalsContact O-N 3.11Å; D313-S315 PolarHBondContact O-N 3.25Å
314	L	37	Very low	53.3	Low	95 Å²	95	69 Å²	69	50%	0.497	39%	0.386	S	S	.	.			trans	-55	95.6	133.3	-69.7	166.4	0	0	0	103.6	A312 E316	A312-L314 PolarHBondContact O-N 3.41Å; L314-E316 PolarHBondContact O-N 3.5Å
315	S	36.7	Very low	54.9	Low	58 Å²	58	67 Å²	67	41%	0.406	38%	0.379	S	S	.	.			trans	-49.3	122.1	158.2	55	0	0	0	0	104	D313 G317 K318	D313-S315 PolarHBondContact O-N 3.25Å; S315-G317 PolarHBondContact O-N 3.19Å; S315-K318 PolarHBondContact O-N 2.93Å; S315-K318 WeakPolarHBondContact OG-CD 3.06Å; S315-K318 VanDerWaalsContact OG-CG 3.31Å; S315-K318 WeakPolarHBondContact OG-CG 3.42Å
316	E	37.6	Very low	57.2	Low	211 Å²	211	67.3 Å²	67.3	99%	0.986	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	12.5	-170	-71.8	174.7	144.3	0	0	115	L314	L314-E316 PolarHBondContact O-N 3.5Å
317	G	42.4	Very low	59.5	Low	70 Å²	70	72.6 Å²	72.6	72%	0.722	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125.3	10.5	171.6	0	0	0	0	0	116.6	S315 E319	S315-G317 PolarHBondContact O-N 3.19Å; G317-E319 PolarHBondContact O-N 3.2Å
318	K	56.3	Low	62.3	Low	109 Å²	109	70.8 Å²	70.8	47%	0.474	37%	0.374	S	S	.	.			trans	-94.2	63.5	175	-76.7	-179.1	-173.8	-178.7	0	112.1	S315 V320	S315-K318 PolarHBondContact O-N 2.93Å; S315-K318 WeakPolarHBondContact OG-CD 3.06Å; S315-K318 VanDerWaalsContact OG-CG 3.31Å; S315-K318 WeakPolarHBondContact OG-CG 3.42Å; K318-V320 PolarHBondContact O-N 2.78Å
319	E	66.8	Low	65.1	Low	153 Å²	153	70.5 Å²	70.5	72%	0.715	37%	0.373	S	S	*	.			trans	-81.5	110.2	168.1	-70.3	-169	161.8	0	0	109.6	G317	G317-E319 PolarHBondContact O-N 3.2Å
320	V	82	Confident	67.6	Low	19 Å²	19	73.1 Å²	73.1	12%	0.115	39%	0.392	C	S	.	.			trans	-83.8	117.4	166.8	171.4	0	0	0	0	108.2	K318 M324 L325 L328 L365 L367	K318-V320 PolarHBondContact O-N 2.78Å; V320-M324 HydrophobicContact CG1-CB 4.42Å; V320-L325 HydrophobicContact CG1-CD2 3.51Å; V320-L325 HydrophobicContact CG1-CG 4.46Å; V320-L328 HydrophobicContact CB-CD1 4.49Å; V320-L328 HydrophobicContact CG1-CD1 3.56Å; V320-L328 HydrophobicContact CG2-CD1 4.05Å; V320-L365 HydrophobicContact CB-CB 4.34Å; V320-L365 HydrophobicContact CG2-CB 4.15Å; V320-L365 VanDerWaalsContact CG2-O 3.24Å; V320-L365 WeakPolarHBondContact CG2-O 3.34Å; V320-L367 WeakPolarHBondContact O-CD1 3.38Å
321	T	86.9	Confident	70.3	Confident	48 Å²	48	71.1 Å²	71.1	29%	0.294	38%	0.383	S	S	.	.			trans	-85.8	165.1	175.5	78.9	0	0	0	0	111.3	E323 M324	T321-E323 VanDerWaalsContact C-N 3.25Å; T321-E323 WeakPolarHBondContact CB-OE2 3.45Å; T321-E323 PolarHBondContact O-N 3.2Å; T321-E323 PolarHBondContact OG1-OE2 2.94Å; T321-M324 HydrophobicContact CG2-CE 4.28Å; T321-M324 PolarHBondContact O-N 3.23Å
322	V	88.8	Confident	72.8	Confident	44 Å²	44	70.3 Å²	70.3	27%	0.267	38%	0.38	S	S	.	.	G	3₁₀ helix	trans	-63	-36.1	-178.5	177.7	0	0	0	0	111.2	M324 L325 L367 F375	V322-M324 VanDerWaalsContact C-N 3.26Å; V322-M324 PolarHBondContact O-N 3.43Å; V322-L325 WeakPolarHBondContact O-CB 3.2Å; V322-L325 WeakPolarHBondContact O-CG 3.28Å; V322-L325 PolarHBondContact O-N 2.96Å; V322-L367 HydrophobicContact CG2-CD1 3.88Å; V322-F375 HydrophobicContact CG1-CB 4.43Å; V322-F375 HydrophobicContact CG1-CD2 3.9Å; V322-F375 HydrophobicContact CG2-CB 4.04Å
323	E	88.6	Confident	75.6	Confident	149 Å²	149	69.7 Å²	69.7	70%	0.696	37%	0.374	S	S	*	.	G	3₁₀ helix	trans	-67.9	-27.5	-177.8	-54	73.1	-154.1	0	0	112	T321 L325	T321-E323 VanDerWaalsContact C-N 3.25Å; T321-E323 WeakPolarHBondContact CB-OE2 3.45Å; T321-E323 PolarHBondContact O-N 3.2Å; T321-E323 PolarHBondContact OG1-OE2 2.94Å; E323-L325 VanDerWaalsContact C-N 3.33Å
324	M	89.3	Confident	78.6	Confident	73 Å²	73	66 Å²	66	36%	0.36	35%	0.354	S	S	.	.	G	3₁₀ helix	trans	-75.4	-23.2	177.7	-64.5	177	-179.4	0	0	112.7	V320 T321 V322 D326 K327 L328	V320-M324 HydrophobicContact CG1-CB 4.42Å; T321-M324 HydrophobicContact CG2-CE 4.28Å; T321-M324 PolarHBondContact O-N 3.23Å; V322-M324 VanDerWaalsContact C-N 3.26Å; V322-M324 PolarHBondContact O-N 3.43Å; M324-D326 VanDerWaalsContact C-N 3.29Å; M324-D326 PolarHBondContact O-N 3.48Å; M324-K327 PolarHBondContact O-N 2.88Å; M324-L328 HydrophobicContact CB-CD1 3.94Å; M324-L328 HydrophobicContact CB-CG 4.41Å; M324-L328 WeakPolarHBondContact O-CB 3.29Å; M324-L328 VanDerWaalsContact O-CG 3.29Å; M324-L328 WeakPolarHBondContact O-CG 3.42Å; M324-L328 PolarHBondContact O-N 3.44Å
325	L	92.4	Very high	81.5	Confident	1 Å²	1	61.5 Å²	61.5	1%	0.005	33%	0.331	C	S	.	.	H	α-helix	trans	-60.5	-36.4	-168.8	-64.6	-179.7	0	0	0	113	V320 V322 E323 L328 S329 F333 F341 L362 F375	V320-L325 HydrophobicContact CG1-CD2 3.51Å; V320-L325 HydrophobicContact CG1-CG 4.46Å; V322-L325 WeakPolarHBondContact O-CB 3.2Å; V322-L325 WeakPolarHBondContact O-CG 3.28Å; V322-L325 PolarHBondContact O-N 2.96Å; E323-L325 VanDerWaalsContact C-N 3.33Å; L325-L328 PolarHBondContact O-N 3.49Å; L325-S329 VanDerWaalsContact O-CB 3.29Å; L325-S329 WeakPolarHBondContact O-CB 3.44Å; L325-S329 PolarHBondContact O-N 3.35Å; L325-F333 HydrophobicContact CD2-CZ 4.32Å; L325-F341 HydrophobicContact CB-CE2 3.92Å; L325-F341 HydrophobicContact CB-CZ 3.76Å; L325-F341 HydrophobicContact CD1-CE2 4.33Å; L325-L362 HydrophobicContact CD1-CD2 4.36Å; L325-L362 HydrophobicContact CD2-CD2 3.73Å; L325-F375 HydrophobicContact CD1-CD2 3.94Å; L325-F375 HydrophobicContact CD1-CE2 3.79Å; L325-F375 HydrophobicContact CD1-CZ 4.31Å
326	D	92.4	Very high	84.4	Confident	75 Å²	75	59.4 Å²	59.4	40%	0.401	32%	0.316	S	S	.	.	H	α-helix	trans	-62.7	-48.7	179.5	-81.8	-29.3	0	0	0	112.2	M324 S329 F341 K345	M324-D326 VanDerWaalsContact C-N 3.29Å; M324-D326 PolarHBondContact O-N 3.48Å; D326-S329 PolarHBondContact O-N 3.02Å; D326-S329 PolarHBondContact O-OG 3.35Å; D326-F341 VanDerWaalsContact OD1-CE1 3.29Å; D326-F341 WeakPolarHBondContact OD1-CE1 3.41Å; D326-F341 WeakPolarHBondContact OD1-CZ 3.39Å; D326-K345 WeakPolarHBondContact OD1-CD 3.41Å; D326-K345 WeakPolarHBondContact OD1-CE 3.47Å; D326-K345 IonicContact OD1-NZ 2.79Å; D326-K345 PolarHBondContact OD1-NZ 3.26Å; D326-K345 IonicContact OD2-NZ 3.67Å; D326-K345 PolarHBondContact OD2-NZ 2.79Å
327	K	91.9	Very high	87.3	Confident	117 Å²	117	49.3 Å²	49.3	51%	0.509	27%	0.269	S	S	.	.	H	α-helix	trans	-62.7	-46.9	176.1	-174.9	-175.8	176.9	-166.7	0	110.6	M324 S329 V330 T331 E522	M324-K327 PolarHBondContact O-N 2.88Å; K327-S329 VanDerWaalsContact C-N 3.27Å; K327-S329 PolarHBondContact O-N 3.46Å; K327-V330 PolarHBondContact O-N 3.21Å; K327-T331 PolarHBondContact O-N 3.13Å; K327-T331 VanDerWaalsContact O-N 3.12Å; K327-T331 PolarHBondContact O-OG1 3.24Å; K327-T331 VanDerWaalsContact O-OG1 3.1Å; K327-E522 IonicContact NZ-OE1 3.39Å; K327-E522 PolarHBondContact NZ-OE1 3.01Å
328	L	93.1	Very high	90	Very high	10 Å²	10	47.4 Å²	47.4	5%	0.052	24%	0.24	C	C	.	.	H	α-helix	trans	-62.7	-32.6	-179.8	-71.2	176.2	0	0	0	113.1	V320 M324 L325 V330 T331 S332 F333 F508 R512	V320-L328 HydrophobicContact CB-CD1 4.49Å; V320-L328 HydrophobicContact CG1-CD1 3.56Å; V320-L328 HydrophobicContact CG2-CD1 4.05Å; M324-L328 HydrophobicContact CB-CD1 3.94Å; M324-L328 HydrophobicContact CB-CG 4.41Å; M324-L328 WeakPolarHBondContact O-CB 3.29Å; M324-L328 VanDerWaalsContact O-CG 3.29Å; M324-L328 WeakPolarHBondContact O-CG 3.42Å; M324-L328 PolarHBondContact O-N 3.44Å; L325-L328 PolarHBondContact O-N 3.49Å; L328-V330 PolarHBondContact O-N 3.03Å; L328-T331 PolarHBondContact O-N 2.96Å; L328-S332 CarbonylContact O-C 3.57Å; L328-S332 PolarHBondContact O-N 3.02Å; L328-F333 HydrophobicContact CB-CD1 4.34Å; L328-F333 HydrophobicContact CB-CE1 3.86Å; L328-F333 VanDerWaalsContact O-CD1 3.3Å; L328-F333 WeakPolarHBondContact O-CD1 3.22Å; L328-F333 PolarHBondContact O-N 2.87Å; L328-F508 HydrophobicContact CB-CE2 4.16Å; L328-F508 HydrophobicContact CD1-CE2 4.32Å; L328-F508 HydrophobicContact CD1-CZ 4.06Å; L328-F508 HydrophobicContact CD2-CE2 3.98Å; L328-F508 HydrophobicContact CD2-CZ 3.83Å; L328-F508 HydrophobicContact CG-CE2 4.38Å; L328-F508 HydrophobicContact CG-CZ 4.4Å; L328-R512 VanDerWaalsContact CD2-NH1 3.28Å
329	S	95	Very high	91.9	Very high	8 Å²	8	44.4 Å²	44.4	6%	0.056	23%	0.225	C	C	.	.	H	α-helix	trans	-63.4	-32.1	178.9	77.4	0	0	0	0	113	L325 D326 K327 R338	L325-S329 VanDerWaalsContact O-CB 3.29Å; L325-S329 WeakPolarHBondContact O-CB 3.44Å; L325-S329 PolarHBondContact O-N 3.35Å; D326-S329 PolarHBondContact O-N 3.02Å; D326-S329 PolarHBondContact O-OG 3.35Å; K327-S329 VanDerWaalsContact C-N 3.27Å; K327-S329 PolarHBondContact O-N 3.46Å; S329-R338 WeakPolarHBondContact O-CD 3.24Å
330	V	94.3	Very high	93.3	Very high	86 Å²	86	37.3 Å²	37.3	52%	0.521	19%	0.192	S	C	.	.	H	α-helix	trans	-86.9	-42.4	179.5	-179.6	0	0	0	0	110.8	K327 L328 R338	K327-V330 PolarHBondContact O-N 3.21Å; L328-V330 PolarHBondContact O-N 3.03Å; V330-R338 PolarHBondContact O-NH1 3.29Å
331	T	92.2	Very high	94.1	Very high	54 Å²	54	36.6 Å²	36.6	33%	0.331	19%	0.188	S	C	.	.	H	α-helix	trans	-86.5	-32.8	-171	58.8	0	0	0	0	114.1	K327 L328 S511	K327-T331 PolarHBondContact O-N 3.13Å; K327-T331 VanDerWaalsContact O-N 3.12Å; K327-T331 PolarHBondContact O-OG1 3.24Å; K327-T331 VanDerWaalsContact O-OG1 3.1Å; L328-T331 PolarHBondContact O-N 2.96Å; T331-S511 PolarHBondContact O-OG 2.76Å; T331-S511 VanDerWaalsContact O-OG 3.1Å
332	S	93.9	Very high	94.5	Very high	1 Å²	1	37.3 Å²	37.3	1%	0.007	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-136.9	-9.9	-166.4	-60.4	0	0	0	0	115.5	L328 Y507 F508 S511 R512	L328-S332 CarbonylContact O-C 3.57Å; L328-S332 PolarHBondContact O-N 3.02Å; S332-Y507 WeakPolarHBondContact O-CD1 3.39Å; S332-F508 WeakPolarHBondContact O-CA 3.3Å; S332-F508 WeakPolarHBondContact O-CD2 3.33Å; S332-S511 VanDerWaalsContact CA-OG 3.28Å; S332-S511 WeakPolarHBondContact CA-OG 3.46Å; S332-S511 VanDerWaalsContact CB-OG 3.3Å; S332-S511 WeakPolarHBondContact CB-OG 3.17Å; S332-S511 PolarHBondContact OG-OG 3.36Å; S332-R512 VanDerWaalsContact OG-CD 3.29Å; S332-R512 WeakPolarHBondContact OG-CD 3.26Å
333	F	97	Very high	94.7	Very high	5 Å²	5	36.3 Å²	36.3	2%	0.022	18%	0.18	C	C	.	.			trans	-71.6	136.6	176.8	-78.9	19.4	0	0	0	111.2	L325 L328 M337 R338 F341 F361 L362 L365 F508	L325-F333 HydrophobicContact CD2-CZ 4.32Å; L328-F333 HydrophobicContact CB-CD1 4.34Å; L328-F333 HydrophobicContact CB-CE1 3.86Å; L328-F333 VanDerWaalsContact O-CD1 3.3Å; L328-F333 WeakPolarHBondContact O-CD1 3.22Å; L328-F333 PolarHBondContact O-N 2.87Å; F333-M337 HydrophobicContact CB-CB 4.38Å; F333-M337 HydrophobicContact CD2-CB 4.06Å; F333-M337 HydrophobicContact CG-CB 4.37Å; F333-R338 HydrophobicContact CB-CB 4.02Å; F333-F341 HydrophobicContact CD2-CB 4.25Å; F333-F341 HydrophobicContact CE2-CB 4.08Å; F333-F341 HydrophobicContact CE2-CD2 4.04Å; F333-F341 AromaticContact CE2-CG 3.98Å; F333-F341 HydrophobicContact CE2-CG 3.98Å; F333-F361 AromaticContact CD1-CE1 3.91Å; F333-F361 HydrophobicContact CD1-CE1 3.91Å; F333-F361 HydrophobicContact CD1-CZ 4.03Å; F333-F361 HydrophobicContact CD2-CE1 4.15Å; F333-F361 AromaticContact CE1-CE1 3.79Å; F333-F361 HydrophobicContact CE1-CE1 3.79Å; F333-F361 HydrophobicContact CE1-CZ 4.22Å; F333-F361 HydrophobicContact CE2-CE1 4.05Å; F333-F361 HydrophobicContact CG-CE1 4.09Å; F333-F361 HydrophobicContact CG-CZ 4.34Å; F333-F361 AromaticContact CZ-CE1 3.87Å; F333-F361 HydrophobicContact CZ-CE1 3.87Å; F333-L362 HydrophobicContact CE2-CD2 4.39Å; F333-L362 HydrophobicContact CZ-CD2 3.86Å; F333-L365 HydrophobicContact CE1-CD1 3.78Å; F333-L365 HydrophobicContact CZ-CD1 4.27Å; F333-F508 AromaticContact CD1-CD2 3.84Å; F333-F508 HydrophobicContact CD1-CD2 3.84Å; F333-F508 AromaticContact CD1-CE2 3.92Å; F333-F508 HydrophobicContact CD1-CE2 3.92Å; F333-F508 HydrophobicContact CE1-CD2 4.2Å; F333-F508 AromaticContact CE1-CE2 3.92Å; F333-F508 HydrophobicContact CE1-CE2 3.92Å
334	P	96.9	Very high	95	Very high	1 Å²	1	29.2 Å²	29.2	1%	0.006	15%	0.147	C	C	.	.			trans	-64.2	154.1	167.6	26.8	-33.4	0	0	0	110.2	C336 M337 R338 F361 P504 Y507	P334-C336 PolarHBondContact O-N 2.81Å; P334-M337 HydrophobicContact CG-CB 4.03Å; P334-M337 HydrophobicContact CG-CG 3.74Å; P334-M337 PolarHBondContact O-N 3.01Å; P334-R338 PolarHBondContact O-N 2.63Å; P334-F361 HydrophobicContact CG-CE2 4.42Å; P334-P504 HydrophobicContact CG-CB 3.79Å; P334-Y507 HydrophobicContact CB-CD1 3.72Å; P334-Y507 HydrophobicContact CB-CD2 3.94Å; P334-Y507 HydrophobicContact CB-CE1 4.24Å; P334-Y507 HydrophobicContact CB-CE2 4.36Å; P334-Y507 HydrophobicContact CB-CG 3.61Å; P334-Y507 HydrophobicContact CG-CD1 4.31Å; P334-Y507 HydrophobicContact CG-CG 4.41Å
335	P	98	Very high	95.2	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-47.5	-38.7	179.1	-35.4	39.3	0	0	0	115.2	M337 R339 P443 F444 W459 F485	P335-M337 VanDerWaalsContact C-N 3.3Å; P335-M337 PolarHBondContact O-N 2.98Å; P335-R339 WeakPolarHBondContact O-CB 3.46Å; P335-R339 PolarHBondContact O-N 3.17Å; P335-R339 VanDerWaalsContact O-N 3.11Å; P335-P443 HydrophobicContact CB-CG 4.16Å; P335-F444 HydrophobicContact CB-CE2 4.05Å; P335-F444 HydrophobicContact CB-CZ 3.99Å; P335-F444 HydrophobicContact CG-CE2 3.96Å; P335-F444 HydrophobicContact CG-CZ 3.72Å; P335-W459 HydrophobicContact CB-CH2 3.89Å; P335-W459 HydrophobicContact CB-CZ3 3.68Å; P335-W459 HydrophobicContact CG-CZ3 4.27Å; P335-F485 HydrophobicContact CG-CB 4.48Å; P335-F485 HydrophobicContact CG-CD1 3.34Å; P335-F485 HydrophobicContact CG-CD2 4.23Å; P335-F485 HydrophobicContact CG-CE1 3.48Å; P335-F485 VanDerWaalsContact CG-CE1 3.48Å; P335-F485 HydrophobicContact CG-CE2 4.34Å; P335-F485 HydrophobicContact CG-CG 3.75Å; P335-F485 HydrophobicContact CG-CZ 3.99Å
336	C	97.5	Very high	95.1	Very high	13 Å²	13	33.7 Å²	33.7	9%	0.088	18%	0.175	C	C	.	.	H	α-helix	trans	-67.4	-28	179.4	62.2	0	0	0	0	113.8	P334 L340 P443	P334-C336 PolarHBondContact O-N 2.81Å; C336-L340 WeakPolarHBondContact O-CD1 3.24Å; C336-L340 VanDerWaalsContact O-CG 3.28Å; C336-L340 WeakPolarHBondContact O-CG 3.35Å; C336-P443 HydrophobicContact CB-CG 4.35Å
337	M	98	Very high	94.9	Very high	0 Å²	0	37 Å²	37	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-95.5	-37.3	177.9	-59.6	-58	172	0	0	111.2	F333 P334 P335 R339 L340 F341 Q357 L358 F361 I428 P504	F333-M337 HydrophobicContact CB-CB 4.38Å; F333-M337 HydrophobicContact CD2-CB 4.06Å; F333-M337 HydrophobicContact CG-CB 4.37Å; P334-M337 HydrophobicContact CG-CB 4.03Å; P334-M337 HydrophobicContact CG-CG 3.74Å; P334-M337 PolarHBondContact O-N 3.01Å; P335-M337 VanDerWaalsContact C-N 3.3Å; P335-M337 PolarHBondContact O-N 2.98Å; M337-R339 PolarHBondContact O-N 3.24Å; M337-L340 PolarHBondContact O-N 3.11Å; M337-L340 HydrophobicContact SD-CD1 4.15Å; M337-F341 WeakPolarHBondContact O-CB 3.46Å; M337-F341 PolarHBondContact O-N 2.97Å; M337-Q357 HydrophobicContact CE-CG 3.62Å; M337-Q357 WeakPolarHBondContact CE-O 2.79Å; M337-Q357 HydrophobicContact SD-CG 3.98Å; M337-L358 HydrophobicContact SD-CD1 4.47Å; M337-F361 HydrophobicContact CB-CD1 3.95Å; M337-F361 HydrophobicContact CB-CE1 3.81Å; M337-F361 HydrophobicContact CB-CG 4.45Å; M337-F361 HydrophobicContact CB-CZ 4.2Å; M337-F361 HydrophobicContact CE-CB 3.7Å; M337-F361 HydrophobicContact CE-CD2 4.14Å; M337-F361 HydrophobicContact CE-CG 3.98Å; M337-F361 HydrophobicContact CG-CB 4.3Å; M337-F361 HydrophobicContact CG-CD1 3.67Å; M337-F361 HydrophobicContact CG-CD2 3.85Å; M337-F361 HydrophobicContact CG-CE1 3.85Å; M337-F361 HydrophobicContact CG-CE2 4.04Å; M337-F361 HydrophobicContact CG-CG 3.66Å; M337-F361 HydrophobicContact CG-CZ 4.04Å; M337-F361 HydrophobicContact SD-CB 3.73Å; M337-F361 HydrophobicContact SD-CD1 4.01Å; M337-F361 HydrophobicContact SD-CD2 4.35Å; M337-F361 HydrophobicContact SD-CG 3.78Å; M337-I428 HydrophobicContact CE-CD1 3.85Å; M337-P504 HydrophobicContact CE-CB 3.63Å; M337-P504 HydrophobicContact CE-CG 3.72Å; M337-P504 HydrophobicContact CG-CB 4.2Å
338	R	97.8	Very high	94.9	Very high	30 Å²	30	34.3 Å²	34.3	11%	0.113	17%	0.171	C	C	.	.	H	α-helix	trans	-55.7	-49.9	174.3	-178.7	170.4	178.5	169.4	-4.9	111.3	S329 V330 F333 P334 L340 F341 E342 W459	S329-R338 WeakPolarHBondContact O-CD 3.24Å; V330-R338 PolarHBondContact O-NH1 3.29Å; F333-R338 HydrophobicContact CB-CB 4.02Å; P334-R338 PolarHBondContact O-N 2.63Å; R338-L340 VanDerWaalsContact C-N 3.33Å; R338-L340 PolarHBondContact O-N 2.89Å; R338-F341 PolarHBondContact O-N 3.47Å; R338-E342 HydrophobicContact CG-CG 4.41Å; R338-E342 WeakPolarHBondContact CG-OE1 3.28Å; R338-E342 IonicContact CZ-OE1 3.84Å; R338-E342 IonicContact NE-OE1 2.79Å; R338-E342 PolarHBondContact NE-OE1 3.33Å; R338-E342 IonicContact NH2-OE1 3.26Å; R338-E342 WeakPolarHBondContact O-CG 3.42Å; R338-E342 PolarHBondContact O-N 3.04Å; R338-W459 HydrophobicContact CG-CZ2 4.44Å; R338-W459 VanDerWaalsContact NH2-CD1 3.35Å
339	R	96.6	Very high	94.7	Very high	45 Å²	45	37.7 Å²	37.7	17%	0.17	19%	0.186	C	C	.	.	H	α-helix	trans	-57.9	-43	175.9	-176.5	-179	169.2	-154.3	-6.2	112.7	P335 M337 F341 E343 C447 W459	P335-R339 WeakPolarHBondContact O-CB 3.46Å; P335-R339 PolarHBondContact O-N 3.17Å; P335-R339 VanDerWaalsContact O-N 3.11Å; M337-R339 PolarHBondContact O-N 3.24Å; R339-F341 VanDerWaalsContact C-N 3.33Å; R339-E343 WeakPolarHBondContact O-CB 3.5Å; R339-E343 PolarHBondContact O-N 3.22Å; R339-C447 PolarHBondContact NH1-SG 3.42Å; R339-W459 HydrophobicContact CB-CH2 4.33Å; R339-W459 HydrophobicContact CB-CZ2 4.05Å
340	L	97.3	Very high	94.6	Very high	4 Å²	4	37.5 Å²	37.5	2%	0.021	18%	0.184	C	C	.	.	H	α-helix	trans	-65.1	-39.3	178.8	-73.1	176.9	0	0	0	112.3	C336 M337 R338 L344 L350 Q357 L358 F439	C336-L340 WeakPolarHBondContact O-CD1 3.24Å; C336-L340 VanDerWaalsContact O-CG 3.28Å; C336-L340 WeakPolarHBondContact O-CG 3.35Å; M337-L340 PolarHBondContact O-N 3.11Å; M337-L340 HydrophobicContact SD-CD1 4.15Å; R338-L340 VanDerWaalsContact C-N 3.33Å; R338-L340 PolarHBondContact O-N 2.89Å; L340-L344 WeakPolarHBondContact O-CB 3.38Å; L340-L344 PolarHBondContact O-N 3.11Å; L340-L350 HydrophobicContact CD2-CD2 4.24Å; L340-Q357 HydrophobicContact CD1-CB 3.88Å; L340-Q357 HydrophobicContact CD1-CG 3.63Å; L340-L358 HydrophobicContact CB-CB 4.26Å; L340-L358 HydrophobicContact CB-CD1 4.43Å; L340-L358 HydrophobicContact CB-CD2 4.26Å; L340-L358 HydrophobicContact CD1-CB 4.08Å; L340-F439 HydrophobicContact CD2-CB 4.13Å; L340-F439 WeakPolarHBondContact CD2-O 3.31Å
341	F	97.5	Very high	94.5	Very high	4 Å²	4	38.5 Å²	38.5	2%	0.018	18%	0.179	C	C	.	.	H	α-helix	trans	-68.5	-45.8	178.8	-170	-100.9	0	0	0	111.1	L325 D326 F333 M337 R338 R339 E343 L344 K345 F375	L325-F341 HydrophobicContact CB-CE2 3.92Å; L325-F341 HydrophobicContact CB-CZ 3.76Å; L325-F341 HydrophobicContact CD1-CE2 4.33Å; D326-F341 VanDerWaalsContact OD1-CE1 3.29Å; D326-F341 WeakPolarHBondContact OD1-CE1 3.41Å; D326-F341 WeakPolarHBondContact OD1-CZ 3.39Å; F333-F341 HydrophobicContact CD2-CB 4.25Å; F333-F341 HydrophobicContact CE2-CB 4.08Å; F333-F341 HydrophobicContact CE2-CD2 4.04Å; F333-F341 AromaticContact CE2-CG 3.98Å; F333-F341 HydrophobicContact CE2-CG 3.98Å; M337-F341 WeakPolarHBondContact O-CB 3.46Å; M337-F341 PolarHBondContact O-N 2.97Å; R338-F341 PolarHBondContact O-N 3.47Å; R339-F341 VanDerWaalsContact C-N 3.33Å; F341-E343 VanDerWaalsContact C-N 3.34Å; F341-E343 PolarHBondContact O-N 2.9Å; F341-L344 PolarHBondContact O-N 3.5Å; F341-K345 HydrophobicContact CD1-CD 4.21Å; F341-K345 HydrophobicContact CD1-CG 4.45Å; F341-K345 HydrophobicContact CE1-CD 3.67Å; F341-K345 HydrophobicContact CE1-CG 4.22Å; F341-K345 HydrophobicContact CZ-CD 4.14Å; F341-K345 HydrophobicContact CZ-CG 4.5Å; F341-K345 WeakPolarHBondContact O-CG 3.49Å; F341-K345 PolarHBondContact O-N 2.92Å; F341-F375 HydrophobicContact CD2-CZ 4.35Å; F341-F375 AromaticContact CE2-CE2 3.96Å; F341-F375 HydrophobicContact CE2-CE2 3.96Å; F341-F375 AromaticContact CE2-CZ 3.92Å; F341-F375 HydrophobicContact CE2-CZ 3.92Å
342	E	95.7	Very high	94.4	Very high	64 Å²	64	40.9 Å²	40.9	30%	0.299	19%	0.186	S	C	.	.	H	α-helix	trans	-60.2	-41.3	174.4	-71.2	167.8	172.6	0	0	111.9	R338 K345 S346 W459	R338-E342 HydrophobicContact CG-CG 4.41Å; R338-E342 WeakPolarHBondContact CG-OE1 3.28Å; R338-E342 IonicContact CZ-OE1 3.84Å; R338-E342 IonicContact NE-OE1 2.79Å; R338-E342 PolarHBondContact NE-OE1 3.33Å; R338-E342 IonicContact NH2-OE1 3.26Å; R338-E342 WeakPolarHBondContact O-CG 3.42Å; R338-E342 PolarHBondContact O-N 3.04Å; E342-K345 PolarHBondContact O-N 3.46Å; E342-S346 WeakPolarHBondContact O-CB 3.47Å; E342-S346 PolarHBondContact O-N 2.85Å; E342-S346 PolarHBondContact O-OG 2.94Å; E342-W459 PolarHBondContact OE1-NE1 3.07Å; E342-W459 PolarHBondContact OE2-NE1 2.85Å
343	E	94.3	Very high	94.3	Very high	22 Å²	22	41.7 Å²	41.7	10%	0.103	19%	0.194	C	C	.	.	H	α-helix	trans	-65.4	-43.9	175.3	-173.4	70.1	-166.8	0	0	112.1	R339 F341 K345 S346 R347 L350 F439	R339-E343 WeakPolarHBondContact O-CB 3.5Å; R339-E343 PolarHBondContact O-N 3.22Å; F341-E343 VanDerWaalsContact C-N 3.34Å; F341-E343 PolarHBondContact O-N 2.9Å; E343-K345 VanDerWaalsContact C-N 3.31Å; E343-K345 PolarHBondContact O-N 3.13Å; E343-S346 WeakPolarHBondContact CA-OG 3.11Å; E343-S346 PolarHBondContact O-N 2.93Å; E343-S346 PolarHBondContact O-OG 3.37Å; E343-S346 VanDerWaalsContact O-OG 3.1Å; E343-R347 WeakPolarHBondContact O-CB 3.41Å; E343-R347 PolarHBondContact O-N 3.11Å; E343-R347 WeakPolarHBondContact OE1-CD 3.31Å; E343-R347 WeakPolarHBondContact OE1-CG 3.33Å; E343-R347 IonicContact OE1-CZ 2.91Å; E343-R347 IonicContact OE1-NE 3.28Å; E343-R347 PolarHBondContact OE1-NE 3.08Å; E343-R347 IonicContact OE1-NH1 3.19Å; E343-R347 PolarHBondContact OE1-NH1 3.33Å; E343-R347 IonicContact OE1-NH2 2.85Å; E343-L350 HydrophobicContact CB-CD2 4.3Å; E343-L350 HydrophobicContact CG-CD2 4.07Å; E343-F439 HydrophobicContact CB-CB 4.41Å; E343-F439 HydrophobicContact CB-CD1 4.32Å; E343-F439 HydrophobicContact CB-CG 4.37Å; E343-F439 VanDerWaalsContact CD-CD1 3.49Å; E343-F439 VanDerWaalsContact CD-CE1 3.45Å; E343-F439 HydrophobicContact CG-CB 3.87Å; E343-F439 HydrophobicContact CG-CD1 3.71Å; E343-F439 HydrophobicContact CG-CD2 3.82Å; E343-F439 HydrophobicContact CG-CE1 4.21Å; E343-F439 HydrophobicContact CG-CE2 4.34Å; E343-F439 HydrophobicContact CG-CG 3.51Å; E343-F439 WeakPolarHBondContact OE1-CD2 3.4Å; E343-F439 WeakPolarHBondContact OE1-CE2 3.47Å; E343-F439 VanDerWaalsContact OE1-CZ 3.24Å; E343-F439 WeakPolarHBondContact OE1-CZ 3.31Å; E343-F439 VanDerWaalsContact OE2-CE1 3.32Å; E343-F439 WeakPolarHBondContact OE2-CE1 3.27Å
344	L	94.5	Very high	94.2	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-60.4	-42.5	176.2	-179.6	63.7	0	0	0	111.3	L340 F341 H348 L350 L358 F375 W376 H379 F380	L340-L344 WeakPolarHBondContact O-CB 3.38Å; L340-L344 PolarHBondContact O-N 3.11Å; F341-L344 PolarHBondContact O-N 3.5Å; L344-H348 VanDerWaalsContact O-CA 3.23Å; L344-H348 WeakPolarHBondContact O-CA 3.4Å; L344-H348 PolarHBondContact O-N 3.04Å; L344-L350 HydrophobicContact CB-CD1 3.88Å; L344-L350 HydrophobicContact CB-CG 4.06Å; L344-L350 HydrophobicContact CD1-CD1 4.12Å; L344-L350 HydrophobicContact CD1-CG 3.98Å; L344-L350 HydrophobicContact CD2-CD1 4.39Å; L344-L350 HydrophobicContact CG-CD1 4.36Å; L344-L358 HydrophobicContact CD2-CD2 3.94Å; L344-F375 HydrophobicContact CD2-CE1 3.81Å; L344-F375 HydrophobicContact CD2-CZ 3.53Å; L344-W376 HydrophobicContact CD1-CE3 4.35Å; L344-W376 HydrophobicContact CD1-CZ3 3.87Å; L344-W376 HydrophobicContact CD2-CE3 4.14Å; L344-W376 HydrophobicContact CD2-CH2 4.23Å; L344-W376 HydrophobicContact CD2-CZ3 3.66Å; L344-W376 HydrophobicContact CG-CZ3 4.43Å; L344-H379 HydrophobicContact CD1-CB 3.74Å; L344-H379 HydrophobicContact CD2-CB 4.26Å; L344-H379 HydrophobicContact CG-CB 3.93Å; L344-F380 HydrophobicContact CD1-CZ 4.46Å
345	K	92.4	Very high	94.1	Very high	86 Å²	86	43.8 Å²	43.8	37%	0.374	20%	0.202	S	C	.	.	H	α-helix	trans	-68.3	-36.2	178.4	-70.9	-160.1	75.9	170.4	0	113.1	D326 F341 E342 E343 H348	D326-K345 WeakPolarHBondContact OD1-CD 3.41Å; D326-K345 WeakPolarHBondContact OD1-CE 3.47Å; D326-K345 IonicContact OD1-NZ 2.79Å; D326-K345 PolarHBondContact OD1-NZ 3.26Å; D326-K345 IonicContact OD2-NZ 3.67Å; D326-K345 PolarHBondContact OD2-NZ 2.79Å; F341-K345 HydrophobicContact CD1-CD 4.21Å; F341-K345 HydrophobicContact CD1-CG 4.45Å; F341-K345 HydrophobicContact CE1-CD 3.67Å; F341-K345 HydrophobicContact CE1-CG 4.22Å; F341-K345 HydrophobicContact CZ-CD 4.14Å; F341-K345 HydrophobicContact CZ-CG 4.5Å; F341-K345 WeakPolarHBondContact O-CG 3.49Å; F341-K345 PolarHBondContact O-N 2.92Å; E342-K345 PolarHBondContact O-N 3.46Å; E343-K345 VanDerWaalsContact C-N 3.31Å; E343-K345 PolarHBondContact O-N 3.13Å; K345-H348 PolarHBondContact O-NE2 2.76Å
346	S	90.3	Very high	93.8	Very high	82 Å²	82	45.6 Å²	45.6	57%	0.573	21%	0.212	S	C	*	.	H	α-helix	trans	-80.8	-39.2	-177.8	56.3	0	0	0	0	112.8	E342 E343	E342-S346 WeakPolarHBondContact O-CB 3.47Å; E342-S346 PolarHBondContact O-N 2.85Å; E342-S346 PolarHBondContact O-OG 2.94Å; E343-S346 WeakPolarHBondContact CA-OG 3.11Å; E343-S346 PolarHBondContact O-N 2.93Å; E343-S346 PolarHBondContact O-OG 3.37Å; E343-S346 VanDerWaalsContact O-OG 3.1Å
347	R	89.6	Confident	93.6	Very high	145 Å²	145	45.2 Å²	45.2	55%	0.547	21%	0.208	S	C	.	.	H	α-helix	trans	-102.8	-10.2	-174.4	-61.1	-151.1	-175.6	160.1	5.2	114.8	E343 H349	E343-R347 WeakPolarHBondContact O-CB 3.41Å; E343-R347 PolarHBondContact O-N 3.11Å; E343-R347 WeakPolarHBondContact OE1-CD 3.31Å; E343-R347 WeakPolarHBondContact OE1-CG 3.33Å; E343-R347 IonicContact OE1-CZ 2.91Å; E343-R347 IonicContact OE1-NE 3.28Å; E343-R347 PolarHBondContact OE1-NE 3.08Å; E343-R347 IonicContact OE1-NH1 3.19Å; E343-R347 PolarHBondContact OE1-NH1 3.33Å; E343-R347 IonicContact OE1-NH2 2.85Å; R347-H349 PolarHBondContact O-N 3.26Å; R347-H349 VanDerWaalsContact O-N 3.08Å
348	H	90.1	Very high	93.5	Very high	61 Å²	61	45.2 Å²	45.2	28%	0.282	21%	0.208	S	C	.	.	S	Bend	trans	53	32.1	-174.4	-71.7	-90.1	0	0	0	111.7	L344 K345 H379	L344-H348 VanDerWaalsContact O-CA 3.23Å; L344-H348 WeakPolarHBondContact O-CA 3.4Å; L344-H348 PolarHBondContact O-N 3.04Å; K345-H348 PolarHBondContact O-NE2 2.76Å; H348-H379 CarbonylContact C-O 3.1Å; H348-H379 WeakPolarHBondContact CA-O 3.34Å; H348-H379 WeakPolarHBondContact CB-O 3.1Å; H348-H379 AromaticContact ND1-ND1 3.98Å; H348-H379 PolarHBondContact ND1-O 3.42Å
349	H	89.9	Confident	93.4	Very high	81 Å²	81	44.3 Å²	44.3	38%	0.375	21%	0.208	S	C	.	.			trans	-160.9	134.4	-178	-176.1	-92.6	0	0	0	112.8	R347 F380	R347-H349 PolarHBondContact O-N 3.26Å; R347-H349 VanDerWaalsContact O-N 3.08Å; H349-F380 HydrophobicContact CB-CE1 4.3Å; H349-F380 AromaticContact CD2-CE1 3.74Å
350	L	92.3	Very high	93.1	Very high	3 Å²	3	42.3 Å²	42.3	2%	0.016	20%	0.201	C	C	.	.			trans	-129.5	139.6	163.8	-74.1	176	0	0	0	110.3	L340 E343 L344 R355 L358 W376 F380 F439	L340-L350 HydrophobicContact CD2-CD2 4.24Å; E343-L350 HydrophobicContact CB-CD2 4.3Å; E343-L350 HydrophobicContact CG-CD2 4.07Å; L344-L350 HydrophobicContact CB-CD1 3.88Å; L344-L350 HydrophobicContact CB-CG 4.06Å; L344-L350 HydrophobicContact CD1-CD1 4.12Å; L344-L350 HydrophobicContact CD1-CG 3.98Å; L344-L350 HydrophobicContact CD2-CD1 4.39Å; L344-L350 HydrophobicContact CG-CD1 4.36Å; L350-R355 HydrophobicContact CB-CG 3.85Å; L350-R355 WeakPolarHBondContact O-CG 3.2Å; L350-R355 PolarHBondContact O-NH1 3.41Å; L350-L358 HydrophobicContact CD1-CD2 3.88Å; L350-W376 HydrophobicContact CD1-CH2 4.09Å; L350-W376 HydrophobicContact CD1-CZ3 4.15Å; L350-F380 HydrophobicContact CB-CZ 4.34Å; L350-F380 VanDerWaalsContact N-CE1 3.32Å; L350-F439 HydrophobicContact CD2-CB 4.19Å
351	R	92.3	Very high	92.9	Very high	108 Å²	108	42.2 Å²	42.2	41%	0.408	20%	0.2	S	C	.	.			trans	-73.6	170.5	170.9	-70.8	179.9	170.6	-138.3	4	111	G353 G354 R355 D438	R351-G353 PolarHBondContact O-N 2.72Å; R351-G354 PolarHBondContact O-N 3.4Å; R351-G354 VanDerWaalsContact O-N 3.1Å; R351-R355 WeakPolarHBondContact O-CG 3.13Å; R351-R355 PolarHBondContact O-N 3.12Å; R351-D438 WeakPolarHBondContact CD-OD1 3.47Å; R351-D438 IonicContact NE-OD1 3.86Å; R351-D438 IonicContact NH1-OD1 3.8Å
352	H	90.8	Very high	92.7	Very high	103 Å²	103	42 Å²	42	48%	0.477	20%	0.2	S	C	.	.	H	α-helix	trans	-51.7	-47	-169.5	-179.2	67.5	0	0	0	114.2	G354 R355 L356	H352-G354 PolarHBondContact O-N 3.43Å; H352-R355 PolarHBondContact O-N 2.8Å; H352-L356 VanDerWaalsContact NE2-CD1 3.29Å; H352-L356 WeakPolarHBondContact NE2-CD1 3.43Å; H352-L356 PolarHBondContact O-N 3.36Å
353	G	91.4	Very high	92.3	Very high	18 Å²	18	40.3 Å²	40.3	19%	0.186	19%	0.191	C	C	.	.	H	α-helix	trans	-60	-44.3	178.9	0	0	0	0	0	113.2	R351 L356 Q357	R351-G353 PolarHBondContact O-N 2.72Å; G353-L356 PolarHBondContact O-N 2.93Å; G353-Q357 WeakPolarHBondContact O-CB 3.37Å; G353-Q357 PolarHBondContact O-N 2.8Å
354	G	95.1	Very high	91.6	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-65.4	-41.6	176.8	0	0	0	0	0	112.7	R351 H352 L356 Q357 L358 F439	R351-G354 PolarHBondContact O-N 3.4Å; R351-G354 VanDerWaalsContact O-N 3.1Å; H352-G354 PolarHBondContact O-N 3.43Å; G354-L356 PolarHBondContact O-N 2.68Å; G354-Q357 PolarHBondContact O-N 2.78Å; G354-L358 WeakPolarHBondContact O-CB 3.14Å; G354-L358 PolarHBondContact O-N 2.92Å; G354-F439 WeakPolarHBondContact CA-O 3.31Å
355	R	94	Very high	91.1	Very high	50 Å²	50	43 Å²	43	19%	0.189	20%	0.201	C	C	.	.	H	α-helix	trans	-61.6	-43.3	176	-67	-168	-58.7	-106.5	14.2	112.3	L350 R351 H352 G359 W376 F380	L350-R355 HydrophobicContact CB-CG 3.85Å; L350-R355 WeakPolarHBondContact O-CG 3.2Å; L350-R355 PolarHBondContact O-NH1 3.41Å; R351-R355 WeakPolarHBondContact O-CG 3.13Å; R351-R355 PolarHBondContact O-N 3.12Å; H352-R355 PolarHBondContact O-N 2.8Å; R355-G359 VanDerWaalsContact O-CA 3.29Å; R355-G359 WeakPolarHBondContact O-CA 3.21Å; R355-G359 PolarHBondContact O-N 2.81Å; R355-W376 HydrophobicContact CB-CH2 4.33Å; R355-W376 HydrophobicContact CG-CH2 4.24Å; R355-W376 HydrophobicContact CG-CZ3 4.19Å; R355-F380 VanDerWaalsContact CD-CZ 3.46Å; R355-F380 HydrophobicContact CG-CE2 4.31Å; R355-F380 HydrophobicContact CG-CZ 3.89Å
356	L	91.5	Very high	90.7	Very high	39 Å²	39	39.6 Å²	39.6	20%	0.204	19%	0.19	C	C	.	.	H	α-helix	trans	-66.6	-46.5	177.3	-72.2	-179.4	0	0	0	111.6	H352 G353 G354 L360 Y423	H352-L356 VanDerWaalsContact NE2-CD1 3.29Å; H352-L356 WeakPolarHBondContact NE2-CD1 3.43Å; H352-L356 PolarHBondContact O-N 3.36Å; G353-L356 PolarHBondContact O-N 2.93Å; G354-L356 PolarHBondContact O-N 2.68Å; L356-L360 WeakPolarHBondContact O-CB 3.16Å; L356-L360 VanDerWaalsContact O-CG 3.26Å; L356-L360 WeakPolarHBondContact O-CG 3.37Å; L356-L360 PolarHBondContact O-N 2.96Å; L356-L360 VanDerWaalsContact O-N 3.09Å; L356-Y423 HydrophobicContact CB-CE2 4.42Å; L356-Y423 WeakPolarHBondContact CD1-OH 3.41Å
357	Q	93.7	Very high	90.5	Very high	4 Å²	4	35.8 Å²	35.8	2%	0.019	16%	0.164	C	C	.	.	H	α-helix	trans	-62.7	-49.4	-178.7	-178.2	173.3	-34.9	0	0	112	M337 L340 G353 G354 F361 Y423 I428 G441	M337-Q357 HydrophobicContact CE-CG 3.62Å; M337-Q357 WeakPolarHBondContact CE-O 2.79Å; M337-Q357 HydrophobicContact SD-CG 3.98Å; L340-Q357 HydrophobicContact CD1-CB 3.88Å; L340-Q357 HydrophobicContact CD1-CG 3.63Å; G353-Q357 WeakPolarHBondContact O-CB 3.37Å; G353-Q357 PolarHBondContact O-N 2.8Å; G354-Q357 PolarHBondContact O-N 2.78Å; Q357-F361 WeakPolarHBondContact O-CB 3.21Å; Q357-F361 PolarHBondContact O-N 3.04Å; Q357-Y423 HydrophobicContact CB-CD2 4.18Å; Q357-Y423 HydrophobicContact CB-CE2 4.42Å; Q357-Y423 HydrophobicContact CG-CD2 4.41Å; Q357-I428 HydrophobicContact CG-CD1 4Å; Q357-I428 HydrophobicContact CG-CG1 4.21Å; Q357-G441 PolarHBondContact NE2-O 2.83Å
358	L	96.8	Very high	90.5	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-73.6	-43.9	179.1	-177.7	61.7	0	0	0	111.8	M337 L340 L344 L350 G354 L360 F361 L362 W376	M337-L358 HydrophobicContact SD-CD1 4.47Å; L340-L358 HydrophobicContact CB-CB 4.26Å; L340-L358 HydrophobicContact CB-CD1 4.43Å; L340-L358 HydrophobicContact CB-CD2 4.26Å; L340-L358 HydrophobicContact CD1-CB 4.08Å; L344-L358 HydrophobicContact CD2-CD2 3.94Å; L350-L358 HydrophobicContact CD1-CD2 3.88Å; G354-L358 WeakPolarHBondContact O-CB 3.14Å; G354-L358 PolarHBondContact O-N 2.92Å; L358-L360 PolarHBondContact O-N 3.25Å; L358-F361 HydrophobicContact CD1-CD1 4.3Å; L358-F361 WeakPolarHBondContact O-CB 2.99Å; L358-F361 PolarHBondContact O-N 3.47Å; L358-L362 HydrophobicContact CD1-CD1 4.19Å; L358-L362 HydrophobicContact CD1-CD2 4.47Å; L358-L362 HydrophobicContact CD1-CG 4.07Å; L358-L362 HydrophobicContact CG-CD1 3.95Å; L358-L362 HydrophobicContact CG-CG 4.24Å; L358-L362 WeakPolarHBondContact O-CG 3.42Å; L358-L362 PolarHBondContact O-N 2.9Å; L358-W376 HydrophobicContact CB-CH2 4.35Å; L358-W376 HydrophobicContact CD2-CH2 4.04Å; L358-W376 HydrophobicContact CG-CH2 4.38Å
359	G	94.7	Very high	90.4	Very high	11 Å²	11	30.3 Å²	30.3	11%	0.113	15%	0.151	C	C	.	.	H	α-helix	trans	-63.9	-43.4	-175.5	0	0	0	0	0	113.1	R355 F361 L362 K363	R355-G359 VanDerWaalsContact O-CA 3.29Å; R355-G359 WeakPolarHBondContact O-CA 3.21Å; R355-G359 PolarHBondContact O-N 2.81Å; G359-F361 VanDerWaalsContact C-N 3.31Å; G359-F361 PolarHBondContact O-N 3.17Å; G359-L362 PolarHBondContact O-N 3.03Å; G359-K363 VanDerWaalsContact O-CB 3.29Å; G359-K363 WeakPolarHBondContact O-CB 3.29Å; G359-K363 PolarHBondContact O-N 2.61Å
360	L	90.4	Very high	90.4	Very high	4 Å²	4	32.2 Å²	32.2	2%	0.021	16%	0.16	C	C	.	.	H	α-helix	trans	-70.7	-30.1	176.8	-62.7	171.9	0	0	0	112.1	L356 L358 K363 R364 Y423	L356-L360 WeakPolarHBondContact O-CB 3.16Å; L356-L360 VanDerWaalsContact O-CG 3.26Å; L356-L360 WeakPolarHBondContact O-CG 3.37Å; L356-L360 PolarHBondContact O-N 2.96Å; L356-L360 VanDerWaalsContact O-N 3.09Å; L358-L360 PolarHBondContact O-N 3.25Å; L360-K363 HydrophobicContact CD2-CD 4.44Å; L360-R364 WeakPolarHBondContact O-CB 3.33Å; L360-R364 PolarHBondContact O-N 3.28Å; L360-Y423 HydrophobicContact CD1-CD1 3.92Å; L360-Y423 HydrophobicContact CD1-CE1 3.58Å
361	F	93.1	Very high	90.3	Very high	1 Å²	1	33.8 Å²	33.8	0%	0.004	17%	0.171	C	C	.	.	H	α-helix	trans	-65.2	-50.2	171.7	169.6	-102.3	0	0	0	111.7	F333 P334 M337 Q357 L358 G359 R364 L365 P504 N505 F508	F333-F361 AromaticContact CD1-CE1 3.91Å; F333-F361 HydrophobicContact CD1-CE1 3.91Å; F333-F361 HydrophobicContact CD1-CZ 4.03Å; F333-F361 HydrophobicContact CD2-CE1 4.15Å; F333-F361 AromaticContact CE1-CE1 3.79Å; F333-F361 HydrophobicContact CE1-CE1 3.79Å; F333-F361 HydrophobicContact CE1-CZ 4.22Å; F333-F361 HydrophobicContact CE2-CE1 4.05Å; F333-F361 HydrophobicContact CG-CE1 4.09Å; F333-F361 HydrophobicContact CG-CZ 4.34Å; F333-F361 AromaticContact CZ-CE1 3.87Å; F333-F361 HydrophobicContact CZ-CE1 3.87Å; P334-F361 HydrophobicContact CG-CE2 4.42Å; M337-F361 HydrophobicContact CB-CD1 3.95Å; M337-F361 HydrophobicContact CB-CE1 3.81Å; M337-F361 HydrophobicContact CB-CG 4.45Å; M337-F361 HydrophobicContact CB-CZ 4.2Å; M337-F361 HydrophobicContact CE-CB 3.7Å; M337-F361 HydrophobicContact CE-CD2 4.14Å; M337-F361 HydrophobicContact CE-CG 3.98Å; M337-F361 HydrophobicContact CG-CB 4.3Å; M337-F361 HydrophobicContact CG-CD1 3.67Å; M337-F361 HydrophobicContact CG-CD2 3.85Å; M337-F361 HydrophobicContact CG-CE1 3.85Å; M337-F361 HydrophobicContact CG-CE2 4.04Å; M337-F361 HydrophobicContact CG-CG 3.66Å; M337-F361 HydrophobicContact CG-CZ 4.04Å; M337-F361 HydrophobicContact SD-CB 3.73Å; M337-F361 HydrophobicContact SD-CD1 4.01Å; M337-F361 HydrophobicContact SD-CD2 4.35Å; M337-F361 HydrophobicContact SD-CG 3.78Å; Q357-F361 WeakPolarHBondContact O-CB 3.21Å; Q357-F361 PolarHBondContact O-N 3.04Å; L358-F361 HydrophobicContact CD1-CD1 4.3Å; L358-F361 WeakPolarHBondContact O-CB 2.99Å; L358-F361 PolarHBondContact O-N 3.47Å; G359-F361 VanDerWaalsContact C-N 3.31Å; G359-F361 PolarHBondContact O-N 3.17Å; F361-R364 WeakPolarHBondContact O-CA 3.38Å; F361-R364 WeakPolarHBondContact O-CB 3.19Å; F361-R364 PolarHBondContact O-N 2.89Å; F361-R364 VanDerWaalsContact O-N 3.1Å; F361-L365 HydrophobicContact CD1-CD1 4.3Å; F361-L365 HydrophobicContact CE1-CD1 3.64Å; F361-L365 HydrophobicContact CE1-CG 4.23Å; F361-L365 HydrophobicContact CE2-CD2 4.22Å; F361-L365 HydrophobicContact CZ-CD1 3.81Å; F361-L365 HydrophobicContact CZ-CD2 4.13Å; F361-L365 HydrophobicContact CZ-CG 4.19Å; F361-L365 WeakPolarHBondContact O-CG 3.5Å; F361-L365 PolarHBondContact O-N 3.46Å; F361-L365 VanDerWaalsContact O-N 3.09Å; F361-P504 HydrophobicContact CD2-CB 3.95Å; F361-P504 HydrophobicContact CE2-CB 4.16Å; F361-N505 VanDerWaalsContact CD2-ND2 3.3Å; F361-N505 WeakPolarHBondContact CD2-ND2 3.13Å; F361-N505 PolarHBondContact O-ND2 2.83Å; F361-F508 HydrophobicContact CE2-CB 4.25Å; F361-F508 HydrophobicContact CZ-CB 4.24Å; F361-F508 HydrophobicContact CZ-CD2 4.18Å; F361-F508 HydrophobicContact CZ-CG 4.42Å
362	L	93.5	Very high	90.3	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-64.2	-42.8	179	-68.8	178	0	0	0	112.5	L325 F333 L358 G359 R364 L365 G366 L367 F375	L325-L362 HydrophobicContact CD1-CD2 4.36Å; L325-L362 HydrophobicContact CD2-CD2 3.73Å; F333-L362 HydrophobicContact CE2-CD2 4.39Å; F333-L362 HydrophobicContact CZ-CD2 3.86Å; L358-L362 HydrophobicContact CD1-CD1 4.19Å; L358-L362 HydrophobicContact CD1-CD2 4.47Å; L358-L362 HydrophobicContact CD1-CG 4.07Å; L358-L362 HydrophobicContact CG-CD1 3.95Å; L358-L362 HydrophobicContact CG-CG 4.24Å; L358-L362 WeakPolarHBondContact O-CG 3.42Å; L358-L362 PolarHBondContact O-N 2.9Å; G359-L362 PolarHBondContact O-N 3.03Å; L362-R364 PolarHBondContact O-N 3.22Å; L362-L365 HydrophobicContact CD2-CD1 4.22Å; L362-L365 WeakPolarHBondContact O-CB 3.36Å; L362-L365 PolarHBondContact O-N 3.4Å; L362-G366 PolarHBondContact O-N 2.89Å; L362-L367 HydrophobicContact CB-CB 4.45Å; L362-L367 HydrophobicContact CB-CD2 4.13Å; L362-L367 HydrophobicContact CD1-CD2 4.39Å; L362-L367 WeakPolarHBondContact O-CB 3.47Å; L362-L367 PolarHBondContact O-N 2.95Å; L362-F375 HydrophobicContact CD1-CD1 4.17Å; L362-F375 HydrophobicContact CD1-CE1 3.54Å; L362-F375 HydrophobicContact CD1-CZ 3.95Å
363	K	87.3	Confident	90.4	Very high	28 Å²	28	25 Å²	25	12%	0.122	14%	0.136	C	C	.	.	H	α-helix	trans	-51.4	-43.4	170.9	172.3	-178.2	170.8	-157.8	0	111	G359 L360 L365 G366 S410 Y411 N419 Y420	G359-K363 VanDerWaalsContact O-CB 3.29Å; G359-K363 WeakPolarHBondContact O-CB 3.29Å; G359-K363 PolarHBondContact O-N 2.61Å; L360-K363 HydrophobicContact CD2-CD 4.44Å; K363-L365 VanDerWaalsContact C-N 3.33Å; K363-L365 PolarHBondContact O-N 2.84Å; K363-G366 PolarHBondContact O-N 2.76Å; K363-G366 VanDerWaalsContact O-N 3.16Å; K363-S410 PolarHBondContact NZ-O 3.14Å; K363-Y411 WeakPolarHBondContact CA-OH 3.45Å; K363-Y411 HydrophobicContact CB-CE1 4.17Å; K363-Y411 HydrophobicContact CB-CE2 4Å; K363-Y411 WeakPolarHBondContact CB-OH 3.36Å; K363-Y411 HydrophobicContact CD-CD1 4.1Å; K363-Y411 HydrophobicContact CD-CD2 4Å; K363-Y411 HydrophobicContact CD-CE1 4.09Å; K363-Y411 HydrophobicContact CD-CE2 3.98Å; K363-Y411 HydrophobicContact CD-CG 4.07Å; K363-Y411 HydrophobicContact CG-CD1 4.1Å; K363-Y411 HydrophobicContact CG-CD2 4.48Å; K363-Y411 HydrophobicContact CG-CE1 3.63Å; K363-Y411 HydrophobicContact CG-CE2 4.04Å; K363-N419 WeakPolarHBondContact CE-OD1 3.42Å; K363-N419 PolarHBondContact NZ-OD1 2.85Å; K363-Y420 PolarHBondContact NZ-O 3.31Å
364	R	79.4	Confident	90.4	Very high	68 Å²	68	29.3 Å²	29.3	26%	0.257	15%	0.149	S	C	.	.	H	α-helix	trans	-71.6	-26.4	-179.1	-179.4	59	-175.3	83.6	19.7	113.5	Y311 L360 F361 L362 G366 A422 N505	Y311-R364 PolarHBondContact O-NH1 2.83Å; Y311-R364 PolarHBondContact O-NH2 2.89Å; L360-R364 WeakPolarHBondContact O-CB 3.33Å; L360-R364 PolarHBondContact O-N 3.28Å; F361-R364 WeakPolarHBondContact O-CA 3.38Å; F361-R364 WeakPolarHBondContact O-CB 3.19Å; F361-R364 PolarHBondContact O-N 2.89Å; F361-R364 VanDerWaalsContact O-N 3.1Å; L362-R364 PolarHBondContact O-N 3.22Å; R364-G366 PolarHBondContact O-N 3.39Å; R364-A422 HydrophobicContact CB-CB 4.05Å; R364-A422 HydrophobicContact CG-CB 4.33Å; R364-N505 HydrophobicContact CG-CB 4.16Å; R364-N505 VanDerWaalsContact CG-CG 3.48Å; R364-N505 WeakPolarHBondContact CG-ND2 3.49Å
365	L	84.6	Confident	90.3	Very high	10 Å²	10	29.5 Å²	29.5	5%	0.052	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-8.5	171.3	-62.1	-170.9	0	0	0	113.5	V320 F333 F361 L362 K363 N505 F508	V320-L365 HydrophobicContact CB-CB 4.34Å; V320-L365 HydrophobicContact CG2-CB 4.15Å; V320-L365 VanDerWaalsContact CG2-O 3.24Å; V320-L365 WeakPolarHBondContact CG2-O 3.34Å; F333-L365 HydrophobicContact CE1-CD1 3.78Å; F333-L365 HydrophobicContact CZ-CD1 4.27Å; F361-L365 HydrophobicContact CD1-CD1 4.3Å; F361-L365 HydrophobicContact CE1-CD1 3.64Å; F361-L365 HydrophobicContact CE1-CG 4.23Å; F361-L365 HydrophobicContact CE2-CD2 4.22Å; F361-L365 HydrophobicContact CZ-CD1 3.81Å; F361-L365 HydrophobicContact CZ-CD2 4.13Å; F361-L365 HydrophobicContact CZ-CG 4.19Å; F361-L365 WeakPolarHBondContact O-CG 3.5Å; F361-L365 PolarHBondContact O-N 3.46Å; F361-L365 VanDerWaalsContact O-N 3.09Å; L362-L365 HydrophobicContact CD2-CD1 4.22Å; L362-L365 WeakPolarHBondContact O-CB 3.36Å; L362-L365 PolarHBondContact O-N 3.4Å; K363-L365 VanDerWaalsContact C-N 3.33Å; K363-L365 PolarHBondContact O-N 2.84Å; L365-N505 WeakPolarHBondContact CD2-ND2 3.31Å; L365-F508 HydrophobicContact CD1-CD2 4.16Å; L365-F508 HydrophobicContact CD1-CE1 4.49Å; L365-F508 HydrophobicContact CD1-CE2 3.88Å; L365-F508 HydrophobicContact CD1-CZ 4.06Å; L365-F508 HydrophobicContact CD2-CB 4.28Å; L365-F508 HydrophobicContact CD2-CD1 3.38Å; L365-F508 HydrophobicContact CD2-CD2 4.06Å; L365-F508 HydrophobicContact CD2-CE1 3.59Å; L365-F508 HydrophobicContact CD2-CE2 4.23Å; L365-F508 HydrophobicContact CD2-CG 3.63Å; L365-F508 HydrophobicContact CD2-CZ 4.01Å
366	G	83.1	Confident	90.3	Very high	15 Å²	15	27.4 Å²	27.4	16%	0.155	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	102.5	10.5	-179.3	0	0	0	0	0	114.1	L362 K363 R364 S368	L362-G366 PolarHBondContact O-N 2.89Å; K363-G366 PolarHBondContact O-N 2.76Å; K363-G366 VanDerWaalsContact O-N 3.16Å; R364-G366 PolarHBondContact O-N 3.39Å; G366-S368 PolarHBondContact O-N 3.44Å; G366-S368 VanDerWaalsContact O-N 3.15Å
367	L	87.9	Confident	90.2	Very high	2 Å²	2	28.1 Å²	28.1	1%	0.01	15%	0.145	C	C	.	.			trans	-66.8	115.2	174	-167.8	68.5	0	0	0	109.6	V320 V322 L362 F375 Y411	V320-L367 WeakPolarHBondContact O-CD1 3.38Å; V322-L367 HydrophobicContact CG2-CD1 3.88Å; L362-L367 HydrophobicContact CB-CB 4.45Å; L362-L367 HydrophobicContact CB-CD2 4.13Å; L362-L367 HydrophobicContact CD1-CD2 4.39Å; L362-L367 WeakPolarHBondContact O-CB 3.47Å; L362-L367 PolarHBondContact O-N 2.95Å; L367-F375 HydrophobicContact CD2-CB 4.49Å; L367-Y411 WeakPolarHBondContact O-CE1 3.45Å; L367-Y411 PolarHBondContact O-OH 2.83Å
368	S	87.9	Confident	89.9	Confident	49 Å²	49	32.5 Å²	32.5	34%	0.343	17%	0.172	S	C	.	.			trans	-60.9	159.7	-179.6	77.6	0	0	0	0	111.9	G366 E370 S371 S372	G366-S368 PolarHBondContact O-N 3.44Å; G366-S368 VanDerWaalsContact O-N 3.15Å; S368-E370 VanDerWaalsContact C-N 3.29Å; S368-E370 PolarHBondContact O-N 3.4Å; S368-S371 PolarHBondContact O-N 2.91Å; S368-S371 WeakPolarHBondContact OG-CB 3.48Å; S368-S371 PolarHBondContact OG-N 3.2Å; S368-S371 VanDerWaalsContact OG-N 3.1Å; S368-S371 PolarHBondContact OG-OG 3.42Å; S368-S371 VanDerWaalsContact OG-OG 3.06Å; S368-S372 WeakPolarHBondContact O-CB 3.44Å; S368-S372 PolarHBondContact O-N 2.98Å
369	L	88.9	Confident	89.5	Confident	42 Å²	42	33.6 Å²	33.6	22%	0.22	18%	0.177	C	C	.	.	H	α-helix	trans	-59	-42.9	176.7	173.7	59.8	0	0	0	111.5	S372 L373 I407 R408 Y411 E413	L369-S372 PolarHBondContact O-N 3.07Å; L369-L373 HydrophobicContact CD1-CD1 4.13Å; L369-L373 HydrophobicContact CD1-CG 4.11Å; L369-L373 HydrophobicContact CG-CD1 4.19Å; L369-L373 WeakPolarHBondContact O-CG 3.4Å; L369-L373 PolarHBondContact O-N 2.85Å; L369-I407 HydrophobicContact CD1-CG2 3.94Å; L369-R408 HydrophobicContact CD1-CG 4.32Å; L369-Y411 HydrophobicContact CB-CD1 3.83Å; L369-Y411 HydrophobicContact CB-CE1 4.12Å; L369-Y411 HydrophobicContact CB-CG 4.15Å; L369-Y411 HydrophobicContact CD1-CD1 4.41Å; L369-Y411 HydrophobicContact CD1-CD2 3.86Å; L369-Y411 HydrophobicContact CD1-CE2 4.36Å; L369-Y411 HydrophobicContact CD1-CG 3.88Å; L369-Y411 HydrophobicContact CG-CG 4.5Å; L369-E413 HydrophobicContact CD2-CB 4.22Å; L369-E413 HydrophobicContact CD2-CG 3.67Å
370	E	89.7	Confident	89.1	Confident	121 Å²	121	34.4 Å²	34.4	57%	0.565	18%	0.177	S	C	*	.	H	α-helix	trans	-62.8	-48.2	179.1	-170.1	-172.2	156.2	0	0	111.2	S368 S372 L373 K374	S368-E370 VanDerWaalsContact C-N 3.29Å; S368-E370 PolarHBondContact O-N 3.4Å; E370-S372 VanDerWaalsContact C-N 3.3Å; E370-S372 PolarHBondContact O-N 3.5Å; E370-L373 PolarHBondContact O-N 3.38Å; E370-K374 WeakPolarHBondContact O-CG 3.24Å; E370-K374 PolarHBondContact O-N 3.06Å; E370-K374 WeakPolarHBondContact OE1-CE 3.49Å; E370-K374 IonicContact OE1-NZ 2.62Å; E370-K374 PolarHBondContact OE1-NZ 2.82Å
371	S	91	Very high	88.5	Confident	36 Å²	36	35.4 Å²	35.4	25%	0.252	19%	0.185	S	C	.	.	H	α-helix	trans	-64.7	-35.9	177.3	-63.5	0	0	0	0	112	S368 K374 F375	S368-S371 PolarHBondContact O-N 2.91Å; S368-S371 WeakPolarHBondContact OG-CB 3.48Å; S368-S371 PolarHBondContact OG-N 3.2Å; S368-S371 VanDerWaalsContact OG-N 3.1Å; S368-S371 PolarHBondContact OG-OG 3.42Å; S368-S371 VanDerWaalsContact OG-OG 3.06Å; S371-K374 PolarHBondContact O-N 2.87Å; S371-F375 WeakPolarHBondContact O-CB 3.01Å; S371-F375 PolarHBondContact O-N 3.47Å
372	S	92.5	Very high	87.1	Confident	1 Å²	1	39.3 Å²	39.3	1%	0.007	21%	0.21	C	C	.	.	H	α-helix	trans	-66.1	-44.5	176	-168.5	0	0	0	0	111.7	S368 L369 E370 F375 W376 Y411	S368-S372 WeakPolarHBondContact O-CB 3.44Å; S368-S372 PolarHBondContact O-N 2.98Å; L369-S372 PolarHBondContact O-N 3.07Å; E370-S372 VanDerWaalsContact C-N 3.3Å; E370-S372 PolarHBondContact O-N 3.5Å; S372-F375 PolarHBondContact O-N 3Å; S372-W376 PolarHBondContact O-N 3.3Å; S372-Y411 VanDerWaalsContact CB-OH 3.28Å; S372-Y411 WeakPolarHBondContact CB-OH 3.4Å; S372-Y411 PolarHBondContact OG-OH 3.34Å
373	L	91.9	Very high	85.4	Confident	26 Å²	26	46 Å²	46	14%	0.136	25%	0.245	C	C	.	.	H	α-helix	trans	-60.1	-47.6	174.8	-74.6	169.6	0	0	0	111.1	L369 E370 W376 Q377 F399 A404 I407	L369-L373 HydrophobicContact CD1-CD1 4.13Å; L369-L373 HydrophobicContact CD1-CG 4.11Å; L369-L373 HydrophobicContact CG-CD1 4.19Å; L369-L373 WeakPolarHBondContact O-CG 3.4Å; L369-L373 PolarHBondContact O-N 2.85Å; E370-L373 PolarHBondContact O-N 3.38Å; L373-W376 PolarHBondContact O-N 3.4Å; L373-Q377 WeakPolarHBondContact O-CB 3.3Å; L373-Q377 PolarHBondContact O-N 3.2Å; L373-F399 HydrophobicContact CD2-CE1 4.19Å; L373-F399 HydrophobicContact CD2-CZ 4.42Å; L373-F399 WeakPolarHBondContact O-CZ 3.33Å; L373-A404 HydrophobicContact CD2-CB 3.91Å; L373-I407 HydrophobicContact CD2-CB 4.03Å; L373-I407 HydrophobicContact CD2-CD1 4.11Å; L373-I407 HydrophobicContact CD2-CG2 3.9Å; L373-I407 HydrophobicContact CG-CG2 4.26Å
374	K	91.1	Very high	84	Confident	108 Å²	108	48.1 Å²	48.1	47%	0.47	26%	0.26	S	S	.	.	H	α-helix	trans	-60	-47.7	175.7	-70.2	175.1	-173.6	169.8	0	111.6	E370 S371 W376 Q377 T378	E370-K374 WeakPolarHBondContact O-CG 3.24Å; E370-K374 PolarHBondContact O-N 3.06Å; E370-K374 WeakPolarHBondContact OE1-CE 3.49Å; E370-K374 IonicContact OE1-NZ 2.62Å; E370-K374 PolarHBondContact OE1-NZ 2.82Å; S371-K374 PolarHBondContact O-N 2.87Å; K374-W376 PolarHBondContact O-N 2.95Å; K374-Q377 PolarHBondContact O-N 3.42Å; K374-T378 PolarHBondContact O-N 3.39Å; K374-T378 PolarHBondContact O-OG1 2.62Å
375	F	93.3	Very high	82.9	Confident	5 Å²	5	51.9 Å²	51.9	2%	0.022	29%	0.285	C	S	.	.	H	α-helix	trans	-56.3	-52.2	178.4	168.9	-104.1	0	0	0	112.3	V322 L325 F341 L344 L362 L367 S371 S372 Q377 T378 H379	V322-F375 HydrophobicContact CG1-CB 4.43Å; V322-F375 HydrophobicContact CG1-CD2 3.9Å; V322-F375 HydrophobicContact CG2-CB 4.04Å; L325-F375 HydrophobicContact CD1-CD2 3.94Å; L325-F375 HydrophobicContact CD1-CE2 3.79Å; L325-F375 HydrophobicContact CD1-CZ 4.31Å; F341-F375 HydrophobicContact CD2-CZ 4.35Å; F341-F375 AromaticContact CE2-CE2 3.96Å; F341-F375 HydrophobicContact CE2-CE2 3.96Å; F341-F375 AromaticContact CE2-CZ 3.92Å; F341-F375 HydrophobicContact CE2-CZ 3.92Å; L344-F375 HydrophobicContact CD2-CE1 3.81Å; L344-F375 HydrophobicContact CD2-CZ 3.53Å; L362-F375 HydrophobicContact CD1-CD1 4.17Å; L362-F375 HydrophobicContact CD1-CE1 3.54Å; L362-F375 HydrophobicContact CD1-CZ 3.95Å; L367-F375 HydrophobicContact CD2-CB 4.49Å; S371-F375 WeakPolarHBondContact O-CB 3.01Å; S371-F375 PolarHBondContact O-N 3.47Å; S372-F375 PolarHBondContact O-N 3Å; F375-Q377 VanDerWaalsContact C-N 3.34Å; F375-T378 PolarHBondContact O-N 2.78Å; F375-H379 AromaticContact CD2-CD2 3.71Å; F375-H379 AromaticContact CD2-NE2 3.92Å; F375-H379 AromaticContact CE2-CD2 3.37Å; F375-H379 WeakPolarHBondContact CE2-CD2 3.32Å; F375-H379 AromaticContact CE2-NE2 3.36Å; F375-H379 WeakPolarHBondContact CE2-NE2 3.39Å; F375-H379 AromaticContact CZ-CD2 3.76Å; F375-H379 PolarHBondContact O-CD2 3.5Å; F375-H379 VanDerWaalsContact O-CD2 3.31Å; F375-H379 PolarHBondContact O-N 3.29Å
376	W	93.5	Very high	81.6	Confident	5 Å²	5	61 Å²	61	2%	0.019	33%	0.327	C	S	.	.	H	α-helix	trans	-67.6	-36.4	179.7	-73.9	115	0	0	0	112.1	L344 L350 R355 L358 S372 L373 K374 H379 F380 F399 I407	L344-W376 HydrophobicContact CD1-CE3 4.35Å; L344-W376 HydrophobicContact CD1-CZ3 3.87Å; L344-W376 HydrophobicContact CD2-CE3 4.14Å; L344-W376 HydrophobicContact CD2-CH2 4.23Å; L344-W376 HydrophobicContact CD2-CZ3 3.66Å; L344-W376 HydrophobicContact CG-CZ3 4.43Å; L350-W376 HydrophobicContact CD1-CH2 4.09Å; L350-W376 HydrophobicContact CD1-CZ3 4.15Å; R355-W376 HydrophobicContact CB-CH2 4.33Å; R355-W376 HydrophobicContact CG-CH2 4.24Å; R355-W376 HydrophobicContact CG-CZ3 4.19Å; L358-W376 HydrophobicContact CB-CH2 4.35Å; L358-W376 HydrophobicContact CD2-CH2 4.04Å; L358-W376 HydrophobicContact CG-CH2 4.38Å; S372-W376 PolarHBondContact O-N 3.3Å; L373-W376 PolarHBondContact O-N 3.4Å; K374-W376 PolarHBondContact O-N 2.95Å; W376-H379 PolarHBondContact O-N 3.33Å; W376-F380 HydrophobicContact CB-CD2 4.32Å; W376-F380 HydrophobicContact CD2-CE2 4.16Å; W376-F380 AromaticContact CE3-CD2 3.96Å; W376-F380 HydrophobicContact CE3-CD2 3.96Å; W376-F380 AromaticContact CE3-CE2 3.25Å; W376-F380 HydrophobicContact CE3-CE2 3.25Å; W376-F380 HydrophobicContact CE3-CZ 4.06Å; W376-F380 AromaticContact CZ3-CE2 3.7Å; W376-F380 HydrophobicContact CZ3-CE2 3.7Å; W376-F380 HydrophobicContact CZ3-CZ 4.05Å; W376-F380 WeakPolarHBondContact O-CB 3.27Å; W376-F380 WeakPolarHBondContact O-CD2 3.27Å; W376-F380 PolarHBondContact O-N 3.4Å; W376-F399 HydrophobicContact CB-CE2 3.84Å; W376-F399 HydrophobicContact CB-CZ 3.92Å; W376-I407 HydrophobicContact CB-CD1 3.65Å; W376-I407 VanDerWaalsContact CD1-CD1 3.5Å; W376-I407 HydrophobicContact CG-CD1 3.69Å
377	Q	89.2	Confident	80.2	Confident	54 Å²	54	69.2 Å²	69.2	25%	0.252	36%	0.362	S	S	.	.	H	α-helix	trans	-59.3	-55.3	175.5	-172.7	179.6	-0.3	0	0	109.9	L373 K374 F375 H379 F380 S381 F399	L373-Q377 WeakPolarHBondContact O-CB 3.3Å; L373-Q377 PolarHBondContact O-N 3.2Å; K374-Q377 PolarHBondContact O-N 3.42Å; F375-Q377 VanDerWaalsContact C-N 3.34Å; Q377-H379 PolarHBondContact O-N 3.37Å; Q377-H379 VanDerWaalsContact O-N 3.11Å; Q377-F380 PolarHBondContact O-N 3.22Å; Q377-S381 PolarHBondContact O-N 3.47Å; Q377-S381 PolarHBondContact O-OG 2.79Å; Q377-F399 HydrophobicContact CB-CD1 4.14Å; Q377-F399 HydrophobicContact CB-CD2 4.27Å; Q377-F399 HydrophobicContact CB-CE1 3.94Å; Q377-F399 HydrophobicContact CB-CE2 4.09Å; Q377-F399 HydrophobicContact CB-CG 4.3Å; Q377-F399 HydrophobicContact CB-CZ 3.92Å; Q377-F399 HydrophobicContact CG-CD1 4.16Å; Q377-F399 HydrophobicContact CG-CE1 4.45Å; Q377-F399 HydrophobicContact CG-CG 4.19Å
378	T	88.2	Confident	78.5	Confident	97 Å²	97	75 Å²	75	60%	0.595	39%	0.388	S	S	*	.	H	α-helix	trans	-53	-36.8	178.9	-58.3	0	0	0	0	113.3	K374 F375	K374-T378 PolarHBondContact O-N 3.39Å; K374-T378 PolarHBondContact O-OG1 2.62Å; F375-T378 PolarHBondContact O-N 2.78Å
379	H	88.9	Confident	76.9	Confident	23 Å²	23	78 Å²	78	11%	0.106	40%	0.404	C	S	.	.	H	α-helix	trans	-84	-23.7	179.1	-77.7	-66.5	0	0	0	114.7	L344 H348 F375 W376 Q377	L344-H379 HydrophobicContact CD1-CB 3.74Å; L344-H379 HydrophobicContact CD2-CB 4.26Å; L344-H379 HydrophobicContact CG-CB 3.93Å; H348-H379 CarbonylContact C-O 3.1Å; H348-H379 WeakPolarHBondContact CA-O 3.34Å; H348-H379 WeakPolarHBondContact CB-O 3.1Å; H348-H379 AromaticContact ND1-ND1 3.98Å; H348-H379 PolarHBondContact ND1-O 3.42Å; F375-H379 AromaticContact CD2-CD2 3.71Å; F375-H379 AromaticContact CD2-NE2 3.92Å; F375-H379 AromaticContact CE2-CD2 3.37Å; F375-H379 WeakPolarHBondContact CE2-CD2 3.32Å; F375-H379 AromaticContact CE2-NE2 3.36Å; F375-H379 WeakPolarHBondContact CE2-NE2 3.39Å; F375-H379 AromaticContact CZ-CD2 3.76Å; F375-H379 PolarHBondContact O-CD2 3.5Å; F375-H379 VanDerWaalsContact O-CD2 3.31Å; F375-H379 PolarHBondContact O-N 3.29Å; W376-H379 PolarHBondContact O-N 3.33Å; Q377-H379 PolarHBondContact O-N 3.37Å; Q377-H379 VanDerWaalsContact O-N 3.11Å
380	F	86.5	Confident	75.2	Confident	27 Å²	27	82.8 Å²	82.8	12%	0.118	43%	0.429	C	S	.	.	H	α-helix	trans	-98.7	-5.5	178.2	-75.2	-64	0	0	0	113.7	L344 H349 L350 R355 W376 Q377 F399 Y403	L344-F380 HydrophobicContact CD1-CZ 4.46Å; H349-F380 HydrophobicContact CB-CE1 4.3Å; H349-F380 AromaticContact CD2-CE1 3.74Å; L350-F380 HydrophobicContact CB-CZ 4.34Å; L350-F380 VanDerWaalsContact N-CE1 3.32Å; R355-F380 VanDerWaalsContact CD-CZ 3.46Å; R355-F380 HydrophobicContact CG-CE2 4.31Å; R355-F380 HydrophobicContact CG-CZ 3.89Å; W376-F380 HydrophobicContact CB-CD2 4.32Å; W376-F380 HydrophobicContact CD2-CE2 4.16Å; W376-F380 AromaticContact CE3-CD2 3.96Å; W376-F380 HydrophobicContact CE3-CD2 3.96Å; W376-F380 AromaticContact CE3-CE2 3.25Å; W376-F380 HydrophobicContact CE3-CE2 3.25Å; W376-F380 HydrophobicContact CE3-CZ 4.06Å; W376-F380 AromaticContact CZ3-CE2 3.7Å; W376-F380 HydrophobicContact CZ3-CE2 3.7Å; W376-F380 HydrophobicContact CZ3-CZ 4.05Å; W376-F380 WeakPolarHBondContact O-CB 3.27Å; W376-F380 WeakPolarHBondContact O-CD2 3.27Å; W376-F380 PolarHBondContact O-N 3.4Å; Q377-F380 PolarHBondContact O-N 3.22Å; F380-F399 HydrophobicContact CB-CD2 4.37Å; F380-F399 HydrophobicContact CD2-CE2 4.42Å; F380-Y403 HydrophobicContact CB-CD2 4.46Å; F380-Y403 HydrophobicContact CB-CE2 4.29Å; F380-Y403 HydrophobicContact CD1-CE2 4.44Å; F380-Y403 HydrophobicContact CD2-CD2 4.47Å; F380-Y403 HydrophobicContact CG-CD2 4.44Å; F380-Y403 HydrophobicContact CG-CE2 4.26Å
381	S	78.3	Confident	73.5	Confident	25 Å²	25	78.1 Å²	78.1	18%	0.175	41%	0.411	C	S	.	.	S	Bend	trans	-59.6	122.3	162.6	-64.1	0	0	0	0	110.1	Q377 I383 E395	Q377-S381 PolarHBondContact O-N 3.47Å; Q377-S381 PolarHBondContact O-OG 2.79Å; S381-I383 PolarHBondContact O-N 3.49Å; S381-E395 WeakPolarHBondContact CA-OE1 3.15Å; S381-E395 WeakPolarHBondContact CB-OE1 3.4Å; S381-E395 PolarHBondContact OG-OE1 2.9Å
382	P	62.4	Low	71.9	Confident	83 Å²	83	81.3 Å²	81.3	54%	0.539	42%	0.424	S	S	.	.			trans	-59.5	139.1	167.4	4	3.5	0	0	0	109	V384	P382-V384 HydrophobicContact CB-CG2 4.32Å; P382-V384 VanDerWaalsContact O-CG2 3.29Å; P382-V384 WeakPolarHBondContact O-CG2 3.5Å; P382-V384 PolarHBondContact O-N 3.02Å
383	I	58.4	Low	70.2	Confident	142 Å²	142	88.3 Å²	88.3	73%	0.728	46%	0.457	S	S	*	.			trans	-65.5	101.5	168.4	-58.9	168.4	0	0	0	106.4	S381	S381-I383 PolarHBondContact O-N 3.49Å
384	V	57.7	Low	68.5	Low	72 Å²	72	93.4 Å²	93.4	44%	0.436	48%	0.478	S	S	.	.			trans	-103.8	131.6	172.5	-151	0	0	0	0	107.3	P382 E386	P382-V384 HydrophobicContact CB-CG2 4.32Å; P382-V384 VanDerWaalsContact O-CG2 3.29Å; P382-V384 WeakPolarHBondContact O-CG2 3.5Å; P382-V384 PolarHBondContact O-N 3.02Å; V384-E386 PolarHBondContact O-N 3.34Å
385	D	55.5	Low	67.1	Low	147 Å²	147	89.9 Å²	89.9	79%	0.786	46%	0.464	S	S	*	.			trans	-53.8	140.8	169.8	-71.1	-43	0	0	0	109.7	Q387	D385-Q387 PolarHBondContact O-N 2.82Å
386	E	57.2	Low	65.6	Low	200 Å²	200	95.5 Å²	95.5	94%	0.935	49%	0.485	S	S	*	.	S	Bend	trans	-52.9	5	-158.8	-151.1	171.7	-167.6	0	0	118.1	V384	V384-E386 PolarHBondContact O-N 3.34Å
387	Q	54.4	Low	64.5	Low	188 Å²	188	98 Å²	98	88%	0.879	50%	0.504	S	S	*	.			trans	-106.5	16.4	-164.7	-72.6	-175.5	-3.9	0	0	117.1	D385	D385-Q387 PolarHBondContact O-N 2.82Å
388	Q	53	Low	63.9	Low	123 Å²	123	99.9 Å²	99.9	58%	0.575	51%	0.513	S	S	*	.			trans	-134.2	95.7	-178.1	-64	-168.6	10.7	0	0	114.8	I390 A391	Q388-I390 VanDerWaalsContact C-N 3.3Å; Q388-I390 PolarHBondContact O-N 2.78Å; Q388-A391 HydrophobicContact CB-CB 3.78Å; Q388-A391 WeakPolarHBondContact O-CB 3.49Å; Q388-A391 PolarHBondContact O-N 3.48Å
389	V	53.7	Low	63.6	Low	112 Å²	112	95.8 Å²	95.8	68%	0.679	49%	0.487	S	S	*	.	H	α-helix	trans	-63.2	-33.8	170.7	177.8	0	0	0	0	112.1	A391 I392	V389-A391 VanDerWaalsContact C-N 3.29Å; V389-A391 PolarHBondContact O-N 3.28Å; V389-I392 WeakPolarHBondContact O-CB 3.24Å; V389-I392 PolarHBondContact O-N 2.91Å
390	I	52.3	Low	63.2	Low	143 Å²	143	97.1 Å²	97.1	73%	0.733	49%	0.493	S	S	*	.	H	α-helix	trans	-67.8	-29.8	178.4	-60.6	172.8	0	0	0	111.5	Q388 I392 F394	Q388-I390 VanDerWaalsContact C-N 3.3Å; Q388-I390 PolarHBondContact O-N 2.78Å; I390-I392 VanDerWaalsContact C-N 3.34Å; I390-F394 PolarHBondContact O-N 3.31Å
391	A	53.8	Low	62.9	Low	23 Å²	23	105.5 Å²	105.5	19%	0.19	52%	0.524	C	S	.	.	H	α-helix	trans	-66.4	-37.8	175.2	0	0	0	0	0	111.2	Q388 V389 E393 F394 E395	Q388-A391 HydrophobicContact CB-CB 3.78Å; Q388-A391 WeakPolarHBondContact O-CB 3.49Å; Q388-A391 PolarHBondContact O-N 3.48Å; V389-A391 VanDerWaalsContact C-N 3.29Å; V389-A391 PolarHBondContact O-N 3.28Å; A391-E393 PolarHBondContact O-N 3.13Å; A391-F394 PolarHBondContact O-N 3.45Å; A391-E395 WeakPolarHBondContact O-CB 3.13Å; A391-E395 PolarHBondContact O-N 3.09Å
392	I	57.2	Low	63	Low	103 Å²	103	109 Å²	109	53%	0.528	54%	0.537	S	S	.	.	H	α-helix	trans	-62.7	-44	-178.9	-57.9	172.7	0	0	0	111.7	V389 I390 E395 Y396	V389-I392 WeakPolarHBondContact O-CB 3.24Å; V389-I392 PolarHBondContact O-N 2.91Å; I390-I392 VanDerWaalsContact C-N 3.34Å; I392-E395 PolarHBondContact O-N 3.37Å; I392-Y396 WeakPolarHBondContact O-CB 3.18Å; I392-Y396 PolarHBondContact O-N 2.9Å
393	E	57.6	Low	64.2	Low	148 Å²	148	107.5 Å²	107.5	69%	0.692	52%	0.521	S	S	*	.	H	α-helix	trans	-67	-43.8	177.7	-73.1	-173.8	168.8	0	0	112.1	A391 E395 Y396 S397	A391-E393 PolarHBondContact O-N 3.13Å; E393-E395 VanDerWaalsContact C-N 3.31Å; E393-E395 PolarHBondContact O-N 3.09Å; E393-Y396 PolarHBondContact O-N 3.39Å; E393-S397 PolarHBondContact O-N 3.2Å; E393-S397 VanDerWaalsContact O-N 3.14Å
394	F	56.7	Low	65.5	Low	134 Å²	134	100.7 Å²	100.7	59%	0.588	49%	0.486	S	S	*	.	H	α-helix	trans	-63.8	-38.2	176.7	-174.9	-109.8	0	0	0	111.5	I390 A391 S397 Q398	I390-F394 PolarHBondContact O-N 3.31Å; A391-F394 PolarHBondContact O-N 3.45Å; F394-S397 PolarHBondContact O-N 3.4Å; F394-S397 PolarHBondContact O-OG 3.44Å; F394-Q398 HydrophobicContact CE1-CG 4.49Å; F394-Q398 PolarHBondContact O-N 2.88Å; F394-Q398 VanDerWaalsContact O-N 3.11Å
395	E	60.6	Low	66.8	Low	34 Å²	34	103.3 Å²	103.3	16%	0.159	49%	0.489	C	S	.	.	H	α-helix	trans	-66.6	-47.7	176.3	-178	-165.2	137.8	0	0	112.7	S381 A391 I392 E393 S397 Q398 F399	S381-E395 WeakPolarHBondContact CA-OE1 3.15Å; S381-E395 WeakPolarHBondContact CB-OE1 3.4Å; S381-E395 PolarHBondContact OG-OE1 2.9Å; A391-E395 WeakPolarHBondContact O-CB 3.13Å; A391-E395 PolarHBondContact O-N 3.09Å; I392-E395 PolarHBondContact O-N 3.37Å; E393-E395 VanDerWaalsContact C-N 3.31Å; E393-E395 PolarHBondContact O-N 3.09Å; E395-S397 PolarHBondContact O-N 3.04Å; E395-Q398 PolarHBondContact O-N 3.32Å; E395-F399 PolarHBondContact O-N 3.2Å
396	Y	63.1	Low	68.3	Low	123 Å²	123	99.1 Å²	99.1	48%	0.482	47%	0.467	S	S	.	.	H	α-helix	trans	-53.1	-42.6	173.1	179.4	-100.2	0	0	0	110.7	I392 E393 F399 E400	I392-Y396 WeakPolarHBondContact O-CB 3.18Å; I392-Y396 PolarHBondContact O-N 2.9Å; E393-Y396 PolarHBondContact O-N 3.39Å; Y396-F399 PolarHBondContact O-N 3.23Å; Y396-E400 HydrophobicContact CD1-CG 4.41Å; Y396-E400 HydrophobicContact CE1-CG 3.95Å; Y396-E400 HydrophobicContact CE2-CG 4.26Å; Y396-E400 WeakPolarHBondContact O-CB 3.44Å; Y396-E400 PolarHBondContact O-N 3.4Å
397	S	70	Confident	69.7	Low	58 Å²	58	90.5 Å²	90.5	41%	0.406	43%	0.426	S	S	.	.	H	α-helix	trans	-65.9	-37.7	178.1	85.4	0	0	0	0	113.6	E393 F394 E395 R401	E393-S397 PolarHBondContact O-N 3.2Å; E393-S397 VanDerWaalsContact O-N 3.14Å; F394-S397 PolarHBondContact O-N 3.4Å; F394-S397 PolarHBondContact O-OG 3.44Å; E395-S397 PolarHBondContact O-N 3.04Å; S397-R401 VanDerWaalsContact O-CB 3.26Å; S397-R401 WeakPolarHBondContact O-CB 3.35Å; S397-R401 PolarHBondContact O-N 3.29Å; S397-R401 VanDerWaalsContact O-N 3.08Å
398	Q	75.9	Confident	71.3	Confident	93 Å²	93	85.1 Å²	85.1	44%	0.435	40%	0.398	S	S	.	.	H	α-helix	trans	-69.6	-42.6	176.8	-77.8	-163.4	59.2	0	0	111.8	F394 E395 R401 H402	F394-Q398 HydrophobicContact CE1-CG 4.49Å; F394-Q398 PolarHBondContact O-N 2.88Å; F394-Q398 VanDerWaalsContact O-N 3.11Å; E395-Q398 PolarHBondContact O-N 3.32Å; Q398-R401 PolarHBondContact O-N 3.36Å; Q398-H402 WeakPolarHBondContact O-CB 3.5Å; Q398-H402 PolarHBondContact O-CD2 3.45Å; Q398-H402 PolarHBondContact O-N 2.95Å
399	F	83.1	Confident	72.5	Confident	11 Å²	11	81.2 Å²	81.2	5%	0.048	38%	0.38	C	S	.	.	H	α-helix	trans	-62.3	-47.6	177.7	176.9	-96.2	0	0	0	111.8	L373 W376 Q377 F380 E395 Y396 R401 H402 Y403 A404 I407	L373-F399 HydrophobicContact CD2-CE1 4.19Å; L373-F399 HydrophobicContact CD2-CZ 4.42Å; L373-F399 WeakPolarHBondContact O-CZ 3.33Å; W376-F399 HydrophobicContact CB-CE2 3.84Å; W376-F399 HydrophobicContact CB-CZ 3.92Å; Q377-F399 HydrophobicContact CB-CD1 4.14Å; Q377-F399 HydrophobicContact CB-CD2 4.27Å; Q377-F399 HydrophobicContact CB-CE1 3.94Å; Q377-F399 HydrophobicContact CB-CE2 4.09Å; Q377-F399 HydrophobicContact CB-CG 4.3Å; Q377-F399 HydrophobicContact CB-CZ 3.92Å; Q377-F399 HydrophobicContact CG-CD1 4.16Å; Q377-F399 HydrophobicContact CG-CE1 4.45Å; Q377-F399 HydrophobicContact CG-CG 4.19Å; F380-F399 HydrophobicContact CB-CD2 4.37Å; F380-F399 HydrophobicContact CD2-CE2 4.42Å; E395-F399 PolarHBondContact O-N 3.2Å; Y396-F399 PolarHBondContact O-N 3.23Å; F399-R401 VanDerWaalsContact C-N 3.3Å; F399-R401 PolarHBondContact O-N 3.42Å; F399-H402 PolarHBondContact O-N 3.25Å; F399-Y403 AromaticContact CD2-CD2 3.74Å; F399-Y403 HydrophobicContact CD2-CD2 3.74Å; F399-Y403 HydrophobicContact CD2-CG 4.27Å; F399-Y403 HydrophobicContact CE2-CD2 4.31Å; F399-Y403 HydrophobicContact CE2-CG 4.43Å; F399-Y403 PolarHBondContact O-N 3.41Å; F399-A404 HydrophobicContact CD1-CB 4.24Å; F399-A404 HydrophobicContact CE1-CB 3.95Å; F399-A404 PolarHBondContact O-N 2.87Å; F399-I407 HydrophobicContact CE2-CD1 4.34Å; F399-I407 HydrophobicContact CZ-CD1 3.82Å
400	E	80.9	Confident	73.8	Confident	50 Å²	50	76.8 Å²	76.8	23%	0.234	35%	0.354	C	S	.	.	I	π-helix	trans	-56.9	-44.5	175.9	-84.7	-66.7	165.7	0	0	111.8	Y396 A404 R408	Y396-E400 HydrophobicContact CD1-CG 4.41Å; Y396-E400 HydrophobicContact CE1-CG 3.95Å; Y396-E400 HydrophobicContact CE2-CG 4.26Å; Y396-E400 WeakPolarHBondContact O-CB 3.44Å; Y396-E400 PolarHBondContact O-N 3.4Å; E400-A404 VanDerWaalsContact OE2-CB 3.28Å; E400-A404 WeakPolarHBondContact OE2-CB 3.41Å; E400-R408 IonicContact OE1-CZ 2.78Å; E400-R408 IonicContact OE1-NH1 3.8Å; E400-R408 IonicContact OE1-NH2 3.17Å; E400-R408 PolarHBondContact OE1-NH2 2.96Å; E400-R408 IonicContact OE2-CZ 2.74Å; E400-R408 IonicContact OE2-NH1 2.99Å; E400-R408 PolarHBondContact OE2-NH1 3.26Å; E400-R408 IonicContact OE2-NH2 3.07Å; E400-R408 PolarHBondContact OE2-NH2 2.97Å; E400-R408 VanDerWaalsContact OE2-NH2 3.17Å
401	R	78.3	Confident	75.1	Confident	204 Å²	204	72 Å²	72	77%	0.77	33%	0.327	S	S	*	.	I	π-helix	trans	-69.3	-40.9	-177.9	-171.7	176.6	-174.7	172.1	0.9	113.8	S397 Q398 F399	S397-R401 VanDerWaalsContact O-CB 3.26Å; S397-R401 WeakPolarHBondContact O-CB 3.35Å; S397-R401 PolarHBondContact O-N 3.29Å; S397-R401 VanDerWaalsContact O-N 3.08Å; Q398-R401 PolarHBondContact O-N 3.36Å; F399-R401 VanDerWaalsContact C-N 3.3Å; F399-R401 PolarHBondContact O-N 3.42Å
402	H	80.3	Confident	76	Confident	97 Å²	97	71.6 Å²	71.6	45%	0.449	32%	0.324	S	S	.	.	I	π-helix	trans	-101.6	-28.9	-169.4	-70.8	-68.1	0	0	0	114.6	Q398 F399 N406	Q398-H402 WeakPolarHBondContact O-CB 3.5Å; Q398-H402 PolarHBondContact O-CD2 3.45Å; Q398-H402 PolarHBondContact O-N 2.95Å; F399-H402 PolarHBondContact O-N 3.25Å; H402-N406 PolarHBondContact O-ND2 3.38Å
403	Y	87.5	Confident	76.3	Confident	52 Å²	52	73.2 Å²	73.2	20%	0.204	33%	0.33	C	S	.	.	I	π-helix	trans	-122.4	-44	-169.5	-54.3	-63	0	0	0	113.5	F380 F399 Y405 N406 I407	F380-Y403 HydrophobicContact CB-CD2 4.46Å; F380-Y403 HydrophobicContact CB-CE2 4.29Å; F380-Y403 HydrophobicContact CD1-CE2 4.44Å; F380-Y403 HydrophobicContact CD2-CD2 4.47Å; F380-Y403 HydrophobicContact CG-CD2 4.44Å; F380-Y403 HydrophobicContact CG-CE2 4.26Å; F399-Y403 AromaticContact CD2-CD2 3.74Å; F399-Y403 HydrophobicContact CD2-CD2 3.74Å; F399-Y403 HydrophobicContact CD2-CG 4.27Å; F399-Y403 HydrophobicContact CE2-CD2 4.31Å; F399-Y403 HydrophobicContact CE2-CG 4.43Å; F399-Y403 PolarHBondContact O-N 3.41Å; Y403-Y405 VanDerWaalsContact C-N 3.31Å; Y403-Y405 PolarHBondContact O-N 2.97Å; Y403-N406 PolarHBondContact O-N 3.42Å; Y403-I407 PolarHBondContact O-N 2.81Å; Y403-I407 VanDerWaalsContact O-N 3.14Å
404	A	86.4	Confident	76.1	Confident	0 Å²	0	67 Å²	67	0%	0	30%	0.304	C	S	.	.	I	π-helix	trans	-59.7	-39.4	-171.8	0	0	0	0	0	113	L373 F399 E400 N406 I407 R408	L373-A404 HydrophobicContact CD2-CB 3.91Å; F399-A404 HydrophobicContact CD1-CB 4.24Å; F399-A404 HydrophobicContact CE1-CB 3.95Å; F399-A404 PolarHBondContact O-N 2.87Å; E400-A404 VanDerWaalsContact OE2-CB 3.28Å; E400-A404 WeakPolarHBondContact OE2-CB 3.41Å; A404-N406 VanDerWaalsContact C-N 3.35Å; A404-N406 PolarHBondContact O-N 3.49Å; A404-I407 PolarHBondContact O-N 3.32Å; A404-R408 VanDerWaalsContact CB-NH1 3.33Å; A404-R408 WeakPolarHBondContact O-CG 3.46Å; A404-R408 PolarHBondContact O-N 3.25Å
405	Y	86.1	Confident	75.7	Confident	126 Å²	126	63.2 Å²	63.2	49%	0.494	30%	0.302	S	S	.	.	H	α-helix	trans	-55.6	-47.6	174.2	177.4	-93.9	0	0	0	112.4	Y403 I407 R408 H409 A414	Y403-Y405 VanDerWaalsContact C-N 3.31Å; Y403-Y405 PolarHBondContact O-N 2.97Å; Y405-I407 VanDerWaalsContact C-N 3.31Å; Y405-I407 PolarHBondContact O-N 3.49Å; Y405-R408 PolarHBondContact O-N 2.85Å; Y405-H409 HydrophobicContact CE1-CB 4.47Å; Y405-H409 VanDerWaalsContact O-CB 3.24Å; Y405-H409 WeakPolarHBondContact O-CB 3.37Å; Y405-H409 PolarHBondContact O-N 3.15Å; Y405-A414 HydrophobicContact CD2-CB 4.43Å; Y405-A414 HydrophobicContact CE2-CB 4.03Å
406	N	85.5	Confident	74.8	Confident	60 Å²	60	70.3 Å²	70.3	32%	0.321	33%	0.328	S	S	.	.	H	α-helix	trans	-66.3	-35	-178.7	-70.8	-41.6	0	0	0	112	H402 Y403 A404 S410	H402-N406 PolarHBondContact O-ND2 3.38Å; Y403-N406 PolarHBondContact O-N 3.42Å; A404-N406 VanDerWaalsContact C-N 3.35Å; A404-N406 PolarHBondContact O-N 3.49Å; N406-S410 WeakPolarHBondContact O-CB 3.35Å; N406-S410 PolarHBondContact O-N 3.38Å; N406-S410 PolarHBondContact O-OG 3.03Å
407	I	87.9	Confident	74.2	Confident	18 Å²	18	74 Å²	74	9%	0.092	34%	0.341	C	S	.	.	H	α-helix	trans	-66.9	-52.2	175.3	-62.5	163.9	0	0	0	109.4	L369 L373 W376 F399 Y403 A404 Y405 H409 S410 Y411	L369-I407 HydrophobicContact CD1-CG2 3.94Å; L373-I407 HydrophobicContact CD2-CB 4.03Å; L373-I407 HydrophobicContact CD2-CD1 4.11Å; L373-I407 HydrophobicContact CD2-CG2 3.9Å; L373-I407 HydrophobicContact CG-CG2 4.26Å; W376-I407 HydrophobicContact CB-CD1 3.65Å; W376-I407 VanDerWaalsContact CD1-CD1 3.5Å; W376-I407 HydrophobicContact CG-CD1 3.69Å; F399-I407 HydrophobicContact CE2-CD1 4.34Å; F399-I407 HydrophobicContact CZ-CD1 3.82Å; Y403-I407 PolarHBondContact O-N 2.81Å; Y403-I407 VanDerWaalsContact O-N 3.14Å; A404-I407 PolarHBondContact O-N 3.32Å; Y405-I407 VanDerWaalsContact C-N 3.31Å; Y405-I407 PolarHBondContact O-N 3.49Å; I407-H409 VanDerWaalsContact C-N 3.3Å; I407-H409 PolarHBondContact O-N 3.17Å; I407-S410 WeakPolarHBondContact O-CB 3.34Å; I407-S410 PolarHBondContact O-N 3.19Å; I407-Y411 HydrophobicContact CG2-CD2 4.34Å; I407-Y411 HydrophobicContact CG2-CE2 4.27Å; I407-Y411 WeakPolarHBondContact O-CD2 3.46Å; I407-Y411 PolarHBondContact O-N 3.02Å; I407-Y411 VanDerWaalsContact O-N 3.15Å
408	R	87.2	Confident	73.3	Confident	76 Å²	76	73.6 Å²	73.6	29%	0.287	34%	0.337	S	S	.	.	H	α-helix	trans	-57	-43	176.6	-69.2	-178.4	-172.8	107.9	4.8	112.2	L369 E400 A404 Y405 S410 Y411 G412 E413 A414	L369-R408 HydrophobicContact CD1-CG 4.32Å; E400-R408 IonicContact OE1-CZ 2.78Å; E400-R408 IonicContact OE1-NH1 3.8Å; E400-R408 IonicContact OE1-NH2 3.17Å; E400-R408 PolarHBondContact OE1-NH2 2.96Å; E400-R408 IonicContact OE2-CZ 2.74Å; E400-R408 IonicContact OE2-NH1 2.99Å; E400-R408 PolarHBondContact OE2-NH1 3.26Å; E400-R408 IonicContact OE2-NH2 3.07Å; E400-R408 PolarHBondContact OE2-NH2 2.97Å; E400-R408 VanDerWaalsContact OE2-NH2 3.17Å; A404-R408 VanDerWaalsContact CB-NH1 3.33Å; A404-R408 WeakPolarHBondContact O-CG 3.46Å; A404-R408 PolarHBondContact O-N 3.25Å; Y405-R408 PolarHBondContact O-N 2.85Å; R408-S410 VanDerWaalsContact C-N 3.34Å; R408-S410 PolarHBondContact O-N 3.21Å; R408-Y411 PolarHBondContact O-N 3.08Å; R408-G412 PolarHBondContact O-N 3.46Å; R408-E413 HydrophobicContact CB-CB 4.4Å; R408-E413 PolarHBondContact O-N 3.12Å; R408-A414 HydrophobicContact CB-CB 4.27Å
409	H	79.3	Confident	72.4	Confident	41 Å²	41	72.9 Å²	72.9	19%	0.19	34%	0.337	C	S	.	.	H	α-helix	trans	-61.2	-41.6	175.4	-173.5	-99.4	0	0	0	112	Y405 I407 Y411 G412 A414 Y420	Y405-H409 HydrophobicContact CE1-CB 4.47Å; Y405-H409 VanDerWaalsContact O-CB 3.24Å; Y405-H409 WeakPolarHBondContact O-CB 3.37Å; Y405-H409 PolarHBondContact O-N 3.15Å; I407-H409 VanDerWaalsContact C-N 3.3Å; I407-H409 PolarHBondContact O-N 3.17Å; H409-Y411 VanDerWaalsContact C-N 3.25Å; H409-Y411 PolarHBondContact O-N 3.15Å; H409-G412 PolarHBondContact O-N 3.28Å; H409-A414 HydrophobicContact CB-CB 4.19Å; H409-A414 PolarHBondContact CD2-O 3.47Å; H409-Y420 AromaticContact CE1-CE2 3.44Å; H409-Y420 VanDerWaalsContact CE1-CE2 3.44Å; H409-Y420 WeakPolarHBondContact CE1-CE2 3.42Å; H409-Y420 AromaticContact CE1-CZ 3.73Å; H409-Y420 PolarHBondContact CE1-OH 2.92Å; H409-Y420 VanDerWaalsContact CE1-OH 3.24Å; H409-Y420 AromaticContact ND1-CE2 3.51Å
410	S	79.6	Confident	71.6	Confident	19 Å²	19	77.4 Å²	77.4	13%	0.133	35%	0.354	C	S	.	.	H	α-helix	trans	-62.9	-31	177.1	-61.4	0	0	0	0	112.7	K363 N406 I407 R408	K363-S410 PolarHBondContact NZ-O 3.14Å; N406-S410 WeakPolarHBondContact O-CB 3.35Å; N406-S410 PolarHBondContact O-N 3.38Å; N406-S410 PolarHBondContact O-OG 3.03Å; I407-S410 WeakPolarHBondContact O-CB 3.34Å; I407-S410 PolarHBondContact O-N 3.19Å; R408-S410 VanDerWaalsContact C-N 3.34Å; R408-S410 PolarHBondContact O-N 3.21Å
411	Y	81	Confident	71.2	Confident	43 Å²	43	77.5 Å²	77.5	17%	0.169	36%	0.361	C	S	.	.	H	α-helix	trans	-84.4	-6.1	175.7	-80.8	-107.8	0	0	0	113.8	K363 L367 L369 S372 I407 R408 H409	K363-Y411 WeakPolarHBondContact CA-OH 3.45Å; K363-Y411 HydrophobicContact CB-CE1 4.17Å; K363-Y411 HydrophobicContact CB-CE2 4Å; K363-Y411 WeakPolarHBondContact CB-OH 3.36Å; K363-Y411 HydrophobicContact CD-CD1 4.1Å; K363-Y411 HydrophobicContact CD-CD2 4Å; K363-Y411 HydrophobicContact CD-CE1 4.09Å; K363-Y411 HydrophobicContact CD-CE2 3.98Å; K363-Y411 HydrophobicContact CD-CG 4.07Å; K363-Y411 HydrophobicContact CG-CD1 4.1Å; K363-Y411 HydrophobicContact CG-CD2 4.48Å; K363-Y411 HydrophobicContact CG-CE1 3.63Å; K363-Y411 HydrophobicContact CG-CE2 4.04Å; L367-Y411 WeakPolarHBondContact O-CE1 3.45Å; L367-Y411 PolarHBondContact O-OH 2.83Å; L369-Y411 HydrophobicContact CB-CD1 3.83Å; L369-Y411 HydrophobicContact CB-CE1 4.12Å; L369-Y411 HydrophobicContact CB-CG 4.15Å; L369-Y411 HydrophobicContact CD1-CD1 4.41Å; L369-Y411 HydrophobicContact CD1-CD2 3.86Å; L369-Y411 HydrophobicContact CD1-CE2 4.36Å; L369-Y411 HydrophobicContact CD1-CG 3.88Å; L369-Y411 HydrophobicContact CG-CG 4.5Å; S372-Y411 VanDerWaalsContact CB-OH 3.28Å; S372-Y411 WeakPolarHBondContact CB-OH 3.4Å; S372-Y411 PolarHBondContact OG-OH 3.34Å; I407-Y411 HydrophobicContact CG2-CD2 4.34Å; I407-Y411 HydrophobicContact CG2-CE2 4.27Å; I407-Y411 WeakPolarHBondContact O-CD2 3.46Å; I407-Y411 PolarHBondContact O-N 3.02Å; I407-Y411 VanDerWaalsContact O-N 3.15Å; R408-Y411 PolarHBondContact O-N 3.08Å; H409-Y411 VanDerWaalsContact C-N 3.25Å; H409-Y411 PolarHBondContact O-N 3.15Å
412	G	71.8	Confident	71.2	Confident	13 Å²	13	68.4 Å²	68.4	13%	0.134	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	87.3	7.5	-178.7	0	0	0	0	0	114.8	R408 H409 R417	R408-G412 PolarHBondContact O-N 3.46Å; H409-G412 PolarHBondContact O-N 3.28Å; G412-R417 WeakPolarHBondContact O-CA 3.32Å; G412-R417 WeakPolarHBondContact O-CB 3.49Å; G412-R417 WeakPolarHBondContact O-CG 3.47Å
413	E	63.6	Low	71.3	Confident	137 Å²	137	65.9 Å²	65.9	64%	0.64	32%	0.316	S	S	*	.	S	Bend	trans	-86.2	-5.2	179.1	-71.2	-65.3	162.6	0	0	113.5	L369 R408	L369-E413 HydrophobicContact CD2-CB 4.22Å; L369-E413 HydrophobicContact CD2-CG 3.67Å; R408-E413 HydrophobicContact CB-CB 4.4Å; R408-E413 PolarHBondContact O-N 3.12Å
414	A	52.4	Low	70.8	Confident	18 Å²	18	63.8 Å²	63.8	15%	0.149	31%	0.309	C	S	.	.	S	Bend	trans	-136.1	152.1	177.7	0	0	0	0	0	112.1	Y405 R408 H409	Y405-A414 HydrophobicContact CD2-CB 4.43Å; Y405-A414 HydrophobicContact CE2-CB 4.03Å; R408-A414 HydrophobicContact CB-CB 4.27Å; H409-A414 HydrophobicContact CB-CB 4.19Å; H409-A414 PolarHBondContact CD2-O 3.47Å
415	G	49.6	Very low	70.6	Confident	54 Å²	54	64.9 Å²	64.9	56%	0.557	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.6	-136.5	176.2	0	0	0	0	0	113.9	R417	G415-R417 PolarHBondContact O-N 2.72Å
416	R	41.2	Very low	70	Confident	183 Å²	183	61 Å²	61	69%	0.691	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-2	-177.9	-64	-166.7	-135.7	-144	9	114.7	E108 C418	E108-R416 IonicContact OE1-CZ 3.73Å; E108-R416 IonicContact OE1-NH1 2.87Å; E108-R416 PolarHBondContact OE1-NH1 3.29Å; R416-C418 PolarHBondContact O-N 2.9Å
417	R	50.5	Low	69.6	Low	200 Å²	200	61.6 Å²	61.6	76%	0.755	30%	0.303	S	S	*	.			trans	55	32.8	-177	-56.4	-173.9	171.1	166.3	-4.1	113.7	G412 G415 N419	G412-R417 WeakPolarHBondContact O-CA 3.32Å; G412-R417 WeakPolarHBondContact O-CB 3.49Å; G412-R417 WeakPolarHBondContact O-CG 3.47Å; G415-R417 PolarHBondContact O-N 2.72Å; R417-N419 PolarHBondContact O-N 3.31Å
418	C	50.2	Low	69.4	Low	50 Å²	50	61.1 Å²	61.1	34%	0.338	30%	0.301	S	S	.	.			trans	-77.7	119.1	173.9	-61.6	0	0	0	0	109.6	R416 Y420	R416-C418 PolarHBondContact O-N 2.9Å; C418-Y420 HydrophobicContact CB-CE2 4.28Å; C418-Y420 WeakPolarHBondContact O-CD2 3.47Å; C418-Y420 PolarHBondContact O-N 3.26Å
419	N	58.2	Low	69.1	Low	79 Å²	79	58.8 Å²	58.8	42%	0.422	29%	0.294	S	S	.	.			trans	-74.1	88.9	175.5	-173.8	-1.9	0	0	0	109.7	S91 K363 R417 S421	S91-N419 WeakPolarHBondContact CB-O 3.37Å; K363-N419 WeakPolarHBondContact CE-OD1 3.42Å; K363-N419 PolarHBondContact NZ-OD1 2.85Å; R417-N419 PolarHBondContact O-N 3.31Å; N419-S421 PolarHBondContact O-N 3.33Å
420	Y	67.2	Low	68.9	Low	105 Å²	105	59 Å²	59	41%	0.412	30%	0.295	S	S	.	.	P	Polyproline II helix	trans	-59.6	128.8	-178.9	-72.9	-88.2	0	0	0	111.5	K363 H409 C418	K363-Y420 PolarHBondContact NZ-O 3.31Å; H409-Y420 AromaticContact CE1-CE2 3.44Å; H409-Y420 VanDerWaalsContact CE1-CE2 3.44Å; H409-Y420 WeakPolarHBondContact CE1-CE2 3.42Å; H409-Y420 AromaticContact CE1-CZ 3.73Å; H409-Y420 PolarHBondContact CE1-OH 2.92Å; H409-Y420 VanDerWaalsContact CE1-OH 3.24Å; H409-Y420 AromaticContact ND1-CE2 3.51Å; C418-Y420 HydrophobicContact CB-CE2 4.28Å; C418-Y420 WeakPolarHBondContact O-CD2 3.47Å; C418-Y420 PolarHBondContact O-N 3.26Å
421	S	71.5	Confident	68.7	Low	53 Å²	53	59.5 Å²	59.5	37%	0.371	30%	0.304	S	S	.	.	P	Polyproline II helix	trans	-83.1	149.7	176.4	60.8	0	0	0	0	111.9	N419	N419-S421 PolarHBondContact O-N 3.33Å
422	A	78.8	Confident	68.5	Low	12 Å²	12	61.8 Å²	61.8	10%	0.099	33%	0.326	C	S	.	.	P	Polyproline II helix	trans	-51.5	149.2	168.1	0	0	0	0	0	111.9	R364 N505	R364-A422 HydrophobicContact CB-CB 4.05Å; R364-A422 HydrophobicContact CG-CB 4.33Å; A422-N505 VanDerWaalsContact CB-OD1 3.24Å; A422-N505 WeakPolarHBondContact CB-OD1 3.13Å
423	Y	81.3	Confident	69.2	Low	45 Å²	45	66.2 Å²	66.2	18%	0.176	35%	0.35	C	S	.	.	P	Polyproline II helix	trans	-74.4	131.8	179.8	-69.2	-1.2	0	0	0	110.8	L356 Q357 L360 K427 I428 P504	L356-Y423 HydrophobicContact CB-CE2 4.42Å; L356-Y423 WeakPolarHBondContact CD1-OH 3.41Å; Q357-Y423 HydrophobicContact CB-CD2 4.18Å; Q357-Y423 HydrophobicContact CB-CE2 4.42Å; Q357-Y423 HydrophobicContact CG-CD2 4.41Å; L360-Y423 HydrophobicContact CD1-CD1 3.92Å; L360-Y423 HydrophobicContact CD1-CE1 3.58Å; Y423-K427 HydrophobicContact CD1-CD 3.69Å; Y423-K427 HydrophobicContact CD1-CG 4.42Å; Y423-K427 HydrophobicContact CD2-CD 4.5Å; Y423-K427 HydrophobicContact CD2-CG 4.4Å; Y423-K427 HydrophobicContact CE1-CD 4.04Å; Y423-K427 VanDerWaalsContact CE1-CE 3.49Å; Y423-K427 HydrophobicContact CG-CD 3.94Å; Y423-K427 HydrophobicContact CG-CG 4.18Å; Y423-I428 HydrophobicContact CD2-CG1 4.1Å; Y423-I428 HydrophobicContact CG-CG1 4.41Å; Y423-P504 VanDerWaalsContact O-CD 3.27Å; Y423-P504 WeakPolarHBondContact O-CD 3.45Å
424	S	77	Confident	70.5	Confident	8 Å²	8	60.9 Å²	60.9	6%	0.056	33%	0.328	C	S	.	.	P	Polyproline II helix	trans	-67.7	158.6	167.8	65.4	0	0	0	0	111.2	L426 K427 I428	S424-L426 PolarHBondContact O-N 3.04Å; S424-K427 PolarHBondContact O-N 3.4Å; S424-K427 VanDerWaalsContact O-N 3.16Å; S424-K427 WeakPolarHBondContact OG-CB 3.22Å; S424-K427 PolarHBondContact OG-N 2.99Å; S424-K427 VanDerWaalsContact OG-N 3.14Å; S424-I428 WeakPolarHBondContact O-CG1 3.44Å; S424-I428 PolarHBondContact O-N 2.8Å
425	C	81.9	Confident	72.2	Confident	22 Å²	22	61.2 Å²	61.2	15%	0.149	33%	0.333	C	S	.	.	H	α-helix	trans	-55.3	-38.3	174.1	-72.7	0	0	0	0	110.5	I428 I429 Y502 H503	C425-I428 PolarHBondContact O-N 3.12Å; C425-I429 HydrophobicContact CB-CD1 4.28Å; C425-I429 VanDerWaalsContact O-CB 3.25Å; C425-I429 WeakPolarHBondContact O-CB 3.43Å; C425-I429 WeakPolarHBondContact O-CD1 3.49Å; C425-I429 WeakPolarHBondContact O-CG1 3.48Å; C425-I429 PolarHBondContact O-N 3.12Å; C425-Y502 WeakPolarHBondContact CB-O 3.42Å; C425-Y502 PolarHBondContact N-O 3.44Å; C425-Y502 PolarHBondContact SG-O 3.41Å; C425-Y502 VanDerWaalsContact SG-O 3.4Å; C425-H503 PolarHBondContact SG-N 3.24Å
426	L	74.7	Confident	73.9	Confident	44 Å²	44	65.3 Å²	65.3	23%	0.23	35%	0.35	C	S	.	.	H	α-helix	trans	-63.4	-45.4	179.5	-166.9	51.6	0	0	0	112.5	F52 M300 S424 I428 I429 M430	F52-L426 HydrophobicContact CB-CD2 3.53Å; F52-L426 HydrophobicContact CB-CG 3.77Å; F52-L426 HydrophobicContact CD1-CD1 4.22Å; F52-L426 HydrophobicContact CD1-CD2 3.28Å; F52-L426 HydrophobicContact CD1-CG 4.01Å; F52-L426 HydrophobicContact CD2-CD1 4.23Å; F52-L426 HydrophobicContact CD2-CD2 4.38Å; F52-L426 HydrophobicContact CD2-CG 4.26Å; F52-L426 HydrophobicContact CE1-CD1 4.34Å; F52-L426 HydrophobicContact CE1-CD2 3.98Å; F52-L426 HydrophobicContact CE2-CD1 4.45Å; F52-L426 HydrophobicContact CG-CD1 4.13Å; F52-L426 HydrophobicContact CG-CD2 3.49Å; F52-L426 VanDerWaalsContact CG-CD2 3.49Å; F52-L426 HydrophobicContact CG-CG 3.77Å; F52-L426 HydrophobicContact CZ-CD1 4.49Å; M300-L426 HydrophobicContact CE-CD2 3.64Å; S424-L426 PolarHBondContact O-N 3.04Å; L426-I428 VanDerWaalsContact C-N 3.35Å; L426-I428 PolarHBondContact O-N 3.27Å; L426-I429 PolarHBondContact O-N 3.19Å; L426-M430 HydrophobicContact CD1-CG 4.18Å; L426-M430 HydrophobicContact CD1-SD 3.6Å; L426-M430 VanDerWaalsContact CD1-SD 3.6Å; L426-M430 HydrophobicContact CG-SD 4.28Å; L426-M430 VanDerWaalsContact O-CB 3.26Å; L426-M430 WeakPolarHBondContact O-CB 3.01Å; L426-M430 WeakPolarHBondContact O-CG 3.27Å; L426-M430 PolarHBondContact O-N 3.26Å
427	K	75.8	Confident	76	Confident	73 Å²	73	62.5 Å²	62.5	32%	0.317	35%	0.345	S	S	.	.	H	α-helix	trans	-62	-41.1	173.7	-177.3	166.5	-175	163.2	0	112.2	Y423 S424 G431	Y423-K427 HydrophobicContact CD1-CD 3.69Å; Y423-K427 HydrophobicContact CD1-CG 4.42Å; Y423-K427 HydrophobicContact CD2-CD 4.5Å; Y423-K427 HydrophobicContact CD2-CG 4.4Å; Y423-K427 HydrophobicContact CE1-CD 4.04Å; Y423-K427 VanDerWaalsContact CE1-CE 3.49Å; Y423-K427 HydrophobicContact CG-CD 3.94Å; Y423-K427 HydrophobicContact CG-CG 4.18Å; S424-K427 PolarHBondContact O-N 3.4Å; S424-K427 VanDerWaalsContact O-N 3.16Å; S424-K427 WeakPolarHBondContact OG-CB 3.22Å; S424-K427 PolarHBondContact OG-N 2.99Å; S424-K427 VanDerWaalsContact OG-N 3.14Å; K427-G431 WeakPolarHBondContact O-CA 3.13Å; K427-G431 PolarHBondContact O-N 3.12Å
428	I	83.8	Confident	77.9	Confident	8 Å²	8	54.8 Å²	54.8	4%	0.041	32%	0.318	C	S	.	.	H	α-helix	trans	-66.7	-40.9	177	-68.7	172	0	0	0	111.6	M337 Q357 Y423 S424 C425 L426 C442 H446 P504	M337-I428 HydrophobicContact CE-CD1 3.85Å; Q357-I428 HydrophobicContact CG-CD1 4Å; Q357-I428 HydrophobicContact CG-CG1 4.21Å; Y423-I428 HydrophobicContact CD2-CG1 4.1Å; Y423-I428 HydrophobicContact CG-CG1 4.41Å; S424-I428 WeakPolarHBondContact O-CG1 3.44Å; S424-I428 PolarHBondContact O-N 2.8Å; C425-I428 PolarHBondContact O-N 3.12Å; L426-I428 VanDerWaalsContact C-N 3.35Å; L426-I428 PolarHBondContact O-N 3.27Å; I428-C442 HydrophobicContact CG2-CB 4Å; I428-H446 PolarHBondContact O-CE1 2.77Å; I428-P504 HydrophobicContact CD1-CG 3.55Å
429	I	82.4	Confident	79.8	Confident	27 Å²	27	53.8 Å²	53.8	14%	0.138	31%	0.308	C	S	.	.	H	α-helix	trans	-69.9	-42.3	179.8	-72.9	163.6	0	0	0	109.3	C425 L426 C442 K445 Y478	C425-I429 HydrophobicContact CB-CD1 4.28Å; C425-I429 VanDerWaalsContact O-CB 3.25Å; C425-I429 WeakPolarHBondContact O-CB 3.43Å; C425-I429 WeakPolarHBondContact O-CD1 3.49Å; C425-I429 WeakPolarHBondContact O-CG1 3.48Å; C425-I429 PolarHBondContact O-N 3.12Å; L426-I429 PolarHBondContact O-N 3.19Å; I429-C442 HydrophobicContact CG1-CB 3.65Å; I429-K445 HydrophobicContact CB-CD 4.48Å; I429-K445 HydrophobicContact CG2-CD 3.65Å; I429-K445 WeakPolarHBondContact O-CD 3.12Å; I429-K445 WeakPolarHBondContact O-CE 3.31Å; I429-K445 PolarHBondContact O-NZ 3.18Å; I429-Y478 HydrophobicContact CD1-CD2 4.07Å; I429-Y478 HydrophobicContact CD1-CG 4.45Å; I429-Y478 HydrophobicContact CG1-CD2 4.33Å; I429-Y478 HydrophobicContact CG2-CD2 3.84Å; I429-Y478 HydrophobicContact CG2-CE2 4Å
430	M	75.3	Confident	81.5	Confident	46 Å²	46	50.9 Å²	50.9	23%	0.227	29%	0.292	C	S	.	.	H	α-helix	trans	-99.4	-10.5	-170.8	-68.9	-171.1	42.7	0	0	116.2	L48 A49 F52 L426	L48-M430 HydrophobicContact CB-CE 3.69Å; L48-M430 HydrophobicContact CD2-CE 3.42Å; L48-M430 VanDerWaalsContact CD2-CE 3.42Å; L48-M430 HydrophobicContact CD2-SD 4.45Å; L48-M430 HydrophobicContact CG-CE 3.48Å; L48-M430 VanDerWaalsContact CG-CE 3.48Å; A49-M430 HydrophobicContact CB-CB 4.48Å; A49-M430 HydrophobicContact CB-CE 4.47Å; F52-M430 HydrophobicContact CD2-CE 3.33Å; F52-M430 HydrophobicContact CD2-SD 3.17Å; F52-M430 WeakPolarHBondContact CD2-SD 3.4Å; F52-M430 HydrophobicContact CE2-CE 3.48Å; F52-M430 VanDerWaalsContact CE2-CE 3.48Å; F52-M430 HydrophobicContact CE2-SD 3.18Å; F52-M430 WeakPolarHBondContact CE2-SD 3.2Å; F52-M430 HydrophobicContact CG-SD 4.19Å; F52-M430 HydrophobicContact CZ-SD 4.17Å; L426-M430 HydrophobicContact CD1-CG 4.18Å; L426-M430 HydrophobicContact CD1-SD 3.6Å; L426-M430 VanDerWaalsContact CD1-SD 3.6Å; L426-M430 HydrophobicContact CG-SD 4.28Å; L426-M430 VanDerWaalsContact O-CB 3.26Å; L426-M430 WeakPolarHBondContact O-CB 3.01Å; L426-M430 WeakPolarHBondContact O-CG 3.27Å; L426-M430 PolarHBondContact O-N 3.26Å
431	G	74.4	Confident	82.7	Confident	30 Å²	30	46.1 Å²	46.1	31%	0.309	27%	0.274	S	S	.	.	S	Bend	trans	-64.5	-172	175.1	0	0	0	0	0	113	K427 T433	K427-G431 WeakPolarHBondContact O-CA 3.13Å; K427-G431 PolarHBondContact O-N 3.12Å; G431-T433 PolarHBondContact O-N 2.97Å
432	S	77.9	Confident	83.9	Confident	90 Å²	90	44.2 Å²	44.2	63%	0.629	26%	0.261	S	S	*	.	P	Polyproline II helix	trans	-54.1	123.2	179.8	52.3	0	0	0	0	112	H440	S432-H440 PolarHBondContact O-NE2 3.04Å
433	T	86.4	Confident	84.7	Confident	106 Å²	106	43.7 Å²	43.7	65%	0.65	26%	0.257	S	S	*	.	P	Polyproline II helix	trans	-54	129.3	172.1	-54.8	0	0	0	0	109.8	G431 G435	G431-T433 PolarHBondContact O-N 2.97Å; T433-G435 PolarHBondContact O-N 3.17Å
434	P	90.2	Very high	85.4	Confident	26 Å²	26	41.6 Å²	41.6	17%	0.169	25%	0.249	C	C	.	.	P	Polyproline II helix	trans	-60.2	132.9	176.2	-19.4	30.3	0	0	0	111.6	D438 H440 H446	P434-D438 HydrophobicContact CB-CB 3.98Å; P434-H440 WeakPolarHBondContact CG-O 3.46Å; P434-H446 HydrophobicContact CG-CB 4.04Å
435	G	88.6	Confident	86.2	Confident	25 Å²	25	44.8 Å²	44.8	26%	0.258	26%	0.261	S	S	.	.			trans	-71.8	174.6	168	0	0	0	0	0	112.6	T433 Q437 D438	T433-G435 PolarHBondContact O-N 3.17Å; G435-Q437 PolarHBondContact O-N 2.99Å; G435-D438 WeakPolarHBondContact CA-OD2 3.41Å; G435-D438 PolarHBondContact N-OD2 3.39Å; G435-D438 PolarHBondContact O-N 3.32Å
436	P	84.7	Confident	86.8	Confident	140 Å²	140	45.7 Å²	45.7	91%	0.909	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-24.9	-173.7	-26.4	34.7	0	0	0	115.7
437	Q	85.4	Confident	87.7	Confident	124 Å²	124	44.4 Å²	44.4	58%	0.579	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.1	4.8	177.4	-63.4	-176.1	-3.2	0	0	112.7	G435 F439	G435-Q437 PolarHBondContact O-N 2.99Å; Q437-F439 WeakPolarHBondContact O-CD2 3.35Å; Q437-F439 WeakPolarHBondContact O-CE2 3.48Å
438	D	90.5	Very high	88.6	Confident	37 Å²	37	45.3 Å²	45.3	20%	0.198	27%	0.266	C	S	.	.			trans	-92.4	131.2	178.1	-64.6	-45.1	0	0	0	110	R351 P434 G435	R351-D438 WeakPolarHBondContact CD-OD1 3.47Å; R351-D438 IonicContact NE-OD1 3.86Å; R351-D438 IonicContact NH1-OD1 3.8Å; P434-D438 HydrophobicContact CB-CB 3.98Å; G435-D438 WeakPolarHBondContact CA-OD2 3.41Å; G435-D438 PolarHBondContact N-OD2 3.39Å; G435-D438 PolarHBondContact O-N 3.32Å
439	F	89.7	Confident	89.1	Confident	29 Å²	29	46.9 Å²	46.9	13%	0.127	28%	0.276	C	S	.	.			trans	-113.5	97.7	173	-61.9	-99.4	0	0	0	105.1	L340 E343 L350 G354 Q437	L340-F439 HydrophobicContact CD2-CB 4.13Å; L340-F439 WeakPolarHBondContact CD2-O 3.31Å; E343-F439 HydrophobicContact CB-CB 4.41Å; E343-F439 HydrophobicContact CB-CD1 4.32Å; E343-F439 HydrophobicContact CB-CG 4.37Å; E343-F439 VanDerWaalsContact CD-CD1 3.49Å; E343-F439 VanDerWaalsContact CD-CE1 3.45Å; E343-F439 HydrophobicContact CG-CB 3.87Å; E343-F439 HydrophobicContact CG-CD1 3.71Å; E343-F439 HydrophobicContact CG-CD2 3.82Å; E343-F439 HydrophobicContact CG-CE1 4.21Å; E343-F439 HydrophobicContact CG-CE2 4.34Å; E343-F439 HydrophobicContact CG-CG 3.51Å; E343-F439 WeakPolarHBondContact OE1-CD2 3.4Å; E343-F439 WeakPolarHBondContact OE1-CE2 3.47Å; E343-F439 VanDerWaalsContact OE1-CZ 3.24Å; E343-F439 WeakPolarHBondContact OE1-CZ 3.31Å; E343-F439 VanDerWaalsContact OE2-CE1 3.32Å; E343-F439 WeakPolarHBondContact OE2-CE1 3.27Å; L350-F439 HydrophobicContact CD2-CB 4.19Å; G354-F439 WeakPolarHBondContact CA-O 3.31Å; Q437-F439 WeakPolarHBondContact O-CD2 3.35Å; Q437-F439 WeakPolarHBondContact O-CE2 3.48Å
440	H	93.3	Very high	89.8	Confident	19 Å²	19	52.8 Å²	52.8	9%	0.088	30%	0.303	C	S	.	.			trans	-162	-178.6	169.1	65.1	-94.4	0	0	0	108.5	S432 P434	S432-H440 PolarHBondContact O-NE2 3.04Å; P434-H440 WeakPolarHBondContact CG-O 3.46Å
441	G	93.9	Very high	90.7	Very high	4 Å²	4	53.6 Å²	53.6	4%	0.041	31%	0.31	C	S	.	.	S	Bend	trans	85.8	178.5	-178.4	0	0	0	0	0	113.7	Q357	Q357-G441 PolarHBondContact NE2-O 2.83Å
442	C	95.4	Very high	91.8	Very high	13 Å²	13	52.2 Å²	52.2	9%	0.088	30%	0.296	C	S	.	.			trans	-83.3	123.8	176.5	178.1	0	0	0	0	110.4	I428 I429 F444 K445 H446	I428-C442 HydrophobicContact CG2-CB 4Å; I429-C442 HydrophobicContact CG1-CB 3.65Å; C442-F444 PolarHBondContact O-N 3.46Å; C442-K445 HydrophobicContact CB-CB 4.25Å; C442-K445 PolarHBondContact O-N 2.85Å; C442-H446 PolarHBondContact N-ND1 2.94Å; C442-H446 PolarHBondContact O-N 3.18Å; C442-H446 PolarHBondContact O-ND1 3.4Å
443	P	96.7	Very high	92.8	Very high	1 Å²	1	51.8 Å²	51.8	1%	0.006	28%	0.281	C	S	.	.	H	α-helix	trans	-56.1	-38.2	176.9	-26.6	34.4	0	0	0	112.9	P335 C336 K445 C447 L452	P335-P443 HydrophobicContact CB-CG 4.16Å; C336-P443 HydrophobicContact CB-CG 4.35Å; P443-K445 PolarHBondContact O-N 3.01Å; P443-C447 WeakPolarHBondContact O-CB 3.46Å; P443-C447 PolarHBondContact O-N 3.12Å; P443-C447 VanDerWaalsContact O-N 3.08Å; P443-L452 HydrophobicContact CB-CD1 4.36Å
444	F	96.3	Very high	93.3	Very high	2 Å²	2	52.1 Å²	52.1	1%	0.009	28%	0.275	C	S	.	.	H	α-helix	trans	-68.8	-14.8	179.3	-51.6	-63.8	0	0	0	113.9	P335 C442 L452 I469 S473 Y478 A481 C482 F485	P335-F444 HydrophobicContact CB-CE2 4.05Å; P335-F444 HydrophobicContact CB-CZ 3.99Å; P335-F444 HydrophobicContact CG-CE2 3.96Å; P335-F444 HydrophobicContact CG-CZ 3.72Å; C442-F444 PolarHBondContact O-N 3.46Å; F444-L452 HydrophobicContact CD1-CD1 3.97Å; F444-L452 HydrophobicContact CD1-CD2 4.26Å; F444-L452 HydrophobicContact CE1-CD1 4.21Å; F444-I469 HydrophobicContact CD1-CG2 3.92Å; F444-I469 HydrophobicContact CE1-CG2 3.49Å; F444-I469 VanDerWaalsContact CE1-CG2 3.49Å; F444-I469 HydrophobicContact CZ-CG2 4.47Å; F444-S473 WeakPolarHBondContact O-CB 3.47Å; F444-S473 PolarHBondContact O-OG 3.43Å; F444-Y478 HydrophobicContact CB-CD1 3.9Å; F444-Y478 HydrophobicContact CB-CG 4.48Å; F444-Y478 WeakPolarHBondContact O-CD1 3.4Å; F444-Y478 WeakPolarHBondContact O-CE1 3.38Å; F444-A481 HydrophobicContact CB-CB 4.1Å; F444-A481 HydrophobicContact CD1-CB 3.74Å; F444-A481 HydrophobicContact CD2-CB 4.32Å; F444-A481 HydrophobicContact CE1-CB 4.22Å; F444-A481 HydrophobicContact CG-CB 3.78Å; F444-C482 HydrophobicContact CD2-CB 3.95Å; F444-C482 VanDerWaalsContact CE2-CA 3.42Å; F444-C482 HydrophobicContact CE2-CB 3.45Å; F444-C482 VanDerWaalsContact CE2-CB 3.45Å; F444-C482 HydrophobicContact CZ-CB 4.27Å; F444-F485 HydrophobicContact CZ-CB 4.04Å; F444-F485 HydrophobicContact CZ-CG 4.42Å
445	K	93.8	Very high	93.6	Very high	75 Å²	75	51.7 Å²	51.7	33%	0.326	27%	0.271	S	S	.	.	H	α-helix	trans	-105.9	-42.7	174.4	175.9	175	166.4	-172.3	0	112.5	I429 C442 P443 Y478	I429-K445 HydrophobicContact CB-CD 4.48Å; I429-K445 HydrophobicContact CG2-CD 3.65Å; I429-K445 WeakPolarHBondContact O-CD 3.12Å; I429-K445 WeakPolarHBondContact O-CE 3.31Å; I429-K445 PolarHBondContact O-NZ 3.18Å; C442-K445 HydrophobicContact CB-CB 4.25Å; C442-K445 PolarHBondContact O-N 2.85Å; P443-K445 PolarHBondContact O-N 3.01Å; K445-Y478 HydrophobicContact CB-CD1 4.12Å; K445-Y478 HydrophobicContact CB-CD2 4.25Å; K445-Y478 HydrophobicContact CB-CE1 3.76Å; K445-Y478 HydrophobicContact CB-CE2 3.9Å; K445-Y478 HydrophobicContact CB-CG 4.34Å; K445-Y478 HydrophobicContact CD-CE2 3.94Å; K445-Y478 HydrophobicContact CG-CE1 4.31Å; K445-Y478 HydrophobicContact CG-CE2 4.02Å
446	H	94.7	Very high	94.1	Very high	40 Å²	40	50.5 Å²	50.5	19%	0.185	26%	0.259	C	S	.	.	H	α-helix	trans	-106.4	-10.8	-163.7	-55.3	109.6	0	0	0	114.1	I428 P434 C442	I428-H446 PolarHBondContact O-CE1 2.77Å; P434-H446 HydrophobicContact CG-CB 4.04Å; C442-H446 PolarHBondContact N-ND1 2.94Å; C442-H446 PolarHBondContact O-N 3.18Å; C442-H446 PolarHBondContact O-ND1 3.4Å
447	C	93.2	Very high	94.7	Very high	17 Å²	17	48.3 Å²	48.3	12%	0.115	24%	0.243	C	C	.	.	S	Bend	trans	-77.2	145.3	167.6	-68.2	0	0	0	0	110	R339 P443 V451 L452	R339-C447 PolarHBondContact NH1-SG 3.42Å; P443-C447 WeakPolarHBondContact O-CB 3.46Å; P443-C447 PolarHBondContact O-N 3.12Å; P443-C447 VanDerWaalsContact O-N 3.08Å; C447-V451 HydrophobicContact CB-CB 4.49Å; C447-V451 HydrophobicContact CB-CG1 4.44Å; C447-L452 HydrophobicContact CB-CB 4.05Å
448	D	93.5	Very high	95.2	Very high	93 Å²	93	47.7 Å²	47.7	50%	0.497	24%	0.24	S	C	.	.			trans	-60.3	150.5	159	-179.8	-95.2	0	0	0	110	Q450 V451 L452	D448-Q450 VanDerWaalsContact C-N 3.27Å; D448-Q450 PolarHBondContact O-N 3.43Å; D448-Q450 WeakPolarHBondContact OD1-CB 3.5Å; D448-Q450 PolarHBondContact OD1-N 3.14Å; D448-V451 HydrophobicContact CB-CB 4.47Å; D448-V451 HydrophobicContact CB-CG2 4.2Å; D448-V451 PolarHBondContact O-N 3.48Å; D448-L452 WeakPolarHBondContact O-CB 3.35Å; D448-L452 PolarHBondContact O-N 2.92Å
449	V	95.6	Very high	95.5	Very high	41 Å²	41	46.9 Å²	46.9	25%	0.248	23%	0.234	C	C	.	.	H	α-helix	trans	-58	-38.5	-177.1	-176.8	0	0	0	0	112	L452 R453 V470	V449-L452 PolarHBondContact O-N 3.28Å; V449-R453 VanDerWaalsContact CG1-NH1 3.31Å; V449-R453 WeakPolarHBondContact O-CG 3.38Å; V449-R453 PolarHBondContact O-N 3.27Å; V449-V470 HydrophobicContact CG1-CG1 3.57Å
450	Q	96.1	Very high	95.8	Very high	150 Å²	150	48.6 Å²	48.6	70%	0.701	26%	0.26	S	S	*	.	H	α-helix	trans	-68.7	-43.9	178.7	-61.1	-177.5	-12	0	0	111.2	D448 L452 R453 Q454	D448-Q450 VanDerWaalsContact C-N 3.27Å; D448-Q450 PolarHBondContact O-N 3.43Å; D448-Q450 WeakPolarHBondContact OD1-CB 3.5Å; D448-Q450 PolarHBondContact OD1-N 3.14Å; Q450-L452 VanDerWaalsContact C-N 3.32Å; Q450-L452 PolarHBondContact O-N 3.44Å; Q450-R453 PolarHBondContact O-N 3.19Å; Q450-Q454 PolarHBondContact O-N 3.12Å
451	V	95.2	Very high	96	Very high	63 Å²	63	48.2 Å²	48.2	38%	0.382	26%	0.258	S	S	.	.	H	α-helix	trans	-62.9	-41.1	175.8	177.7	0	0	0	0	110.6	C447 D448 Q454 L455	C447-V451 HydrophobicContact CB-CB 4.49Å; C447-V451 HydrophobicContact CB-CG1 4.44Å; D448-V451 HydrophobicContact CB-CB 4.47Å; D448-V451 HydrophobicContact CB-CG2 4.2Å; D448-V451 PolarHBondContact O-N 3.48Å; V451-Q454 PolarHBondContact O-N 2.87Å; V451-L455 HydrophobicContact CG1-CD1 4.1Å; V451-L455 HydrophobicContact CG1-CG 4.44Å; V451-L455 WeakPolarHBondContact O-CG 3.44Å; V451-L455 PolarHBondContact O-N 3.12Å
452	L	97.4	Very high	96	Very high	1 Å²	1	50 Å²	50	1%	0.005	28%	0.277	C	S	.	.	H	α-helix	trans	-62	-44.7	176.5	-177.8	60.1	0	0	0	111.6	P443 F444 C447 D448 V449 Q450 Q454 L455 L456 V470	P443-L452 HydrophobicContact CB-CD1 4.36Å; F444-L452 HydrophobicContact CD1-CD1 3.97Å; F444-L452 HydrophobicContact CD1-CD2 4.26Å; F444-L452 HydrophobicContact CE1-CD1 4.21Å; C447-L452 HydrophobicContact CB-CB 4.05Å; D448-L452 WeakPolarHBondContact O-CB 3.35Å; D448-L452 PolarHBondContact O-N 2.92Å; V449-L452 PolarHBondContact O-N 3.28Å; Q450-L452 VanDerWaalsContact C-N 3.32Å; Q450-L452 PolarHBondContact O-N 3.44Å; L452-Q454 VanDerWaalsContact C-N 3.34Å; L452-Q454 PolarHBondContact O-N 3.3Å; L452-L455 PolarHBondContact O-N 3.03Å; L452-L456 HydrophobicContact CD1-CD1 4.35Å; L452-L456 HydrophobicContact CD1-CG 4.35Å; L452-L456 HydrophobicContact CG-CD1 4.1Å; L452-L456 VanDerWaalsContact O-CG 3.23Å; L452-L456 WeakPolarHBondContact O-CG 3.12Å; L452-L456 PolarHBondContact O-N 3.38Å; L452-V470 HydrophobicContact CD2-CG2 4.19Å; L452-V470 HydrophobicContact CG-CG2 4.34Å
453	R	97.7	Very high	96	Very high	82 Å²	82	57.3 Å²	57.3	31%	0.309	31%	0.308	S	S	.	.	H	α-helix	trans	-60.1	-42.5	175.4	-77.8	-177.2	176.7	113.9	2.6	112.6	V449 Q450 L456 T457 E467 V470	V449-R453 VanDerWaalsContact CG1-NH1 3.31Å; V449-R453 WeakPolarHBondContact O-CG 3.38Å; V449-R453 PolarHBondContact O-N 3.27Å; Q450-R453 PolarHBondContact O-N 3.19Å; R453-L456 PolarHBondContact O-N 3.43Å; R453-T457 PolarHBondContact O-N 3.02Å; R453-T457 PolarHBondContact O-OG1 3.43Å; R453-E467 IonicContact CZ-OE1 2.76Å; R453-E467 IonicContact CZ-OE2 3.59Å; R453-E467 IonicContact NE-OE1 3.61Å; R453-E467 PolarHBondContact NE-OE1 3.03Å; R453-E467 IonicContact NE-OE2 3.48Å; R453-E467 PolarHBondContact NE-OE2 3.01Å; R453-E467 IonicContact NH2-OE1 3.51Å; R453-E467 IonicContact NH2-OE2 3.63Å; R453-E467 PolarHBondContact NH2-OE2 3.01Å; R453-V470 HydrophobicContact CG-CG2 3.75Å
454	Q	97.3	Very high	96	Very high	112 Å²	112	63.5 Å²	63.5	52%	0.523	34%	0.341	S	S	.	.	H	α-helix	trans	-61.5	-51.1	177.2	-179.4	178.9	-7.8	0	0	110.9	Q450 V451 L452 L456 T457 E458	Q450-Q454 PolarHBondContact O-N 3.12Å; V451-Q454 PolarHBondContact O-N 2.87Å; L452-Q454 VanDerWaalsContact C-N 3.34Å; L452-Q454 PolarHBondContact O-N 3.3Å; Q454-L456 VanDerWaalsContact C-N 3.32Å; Q454-L456 PolarHBondContact O-N 2.94Å; Q454-T457 WeakPolarHBondContact O-CB 3.4Å; Q454-T457 PolarHBondContact O-N 3.49Å; Q454-T457 VanDerWaalsContact O-N 3.1Å; Q454-E458 HydrophobicContact CG-CG 4.41Å; Q454-E458 VanDerWaalsContact CG-OE1 3.26Å; Q454-E458 WeakPolarHBondContact CG-OE1 3.45Å; Q454-E458 PolarHBondContact NE2-OE1 3.1Å; Q454-E458 WeakPolarHBondContact O-CG 3.27Å; Q454-E458 PolarHBondContact O-N 2.89Å
455	L	97.5	Very high	95.9	Very high	18 Å²	18	65.8 Å²	65.8	9%	0.094	35%	0.353	C	S	.	.	H	α-helix	trans	-57.7	-43.5	178	-71.2	170.6	0	0	0	112.1	V451 L452 T457 E458 W459	V451-L455 HydrophobicContact CG1-CD1 4.1Å; V451-L455 HydrophobicContact CG1-CG 4.44Å; V451-L455 WeakPolarHBondContact O-CG 3.44Å; V451-L455 PolarHBondContact O-N 3.12Å; L452-L455 PolarHBondContact O-N 3.03Å; L455-T457 VanDerWaalsContact C-N 3.3Å; L455-T457 PolarHBondContact O-N 3.14Å; L455-E458 PolarHBondContact O-N 3.35Å; L455-W459 HydrophobicContact CB-CD2 4.42Å; L455-W459 HydrophobicContact CB-CE3 4.23Å; L455-W459 HydrophobicContact CB-CH2 3.99Å; L455-W459 HydrophobicContact CB-CZ2 4.16Å; L455-W459 HydrophobicContact CB-CZ3 4.01Å; L455-W459 HydrophobicContact CD1-CH2 4.19Å; L455-W459 HydrophobicContact CD1-CZ2 4.49Å; L455-W459 HydrophobicContact CD2-CH2 4.49Å; L455-W459 HydrophobicContact CD2-CZ2 4.01Å; L455-W459 HydrophobicContact CG-CH2 4.47Å; L455-W459 HydrophobicContact CG-CZ2 4.46Å; L455-W459 WeakPolarHBondContact O-CB 3.39Å; L455-W459 VanDerWaalsContact O-CD2 3.24Å; L455-W459 PolarHBondContact O-N 2.92Å
456	L	98.2	Very high	96.1	Very high	0 Å²	0	62.4 Å²	62.4	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-61.4	-40.2	177.4	-69.9	169.8	0	0	0	111.9	L452 R453 Q454 W459 G460 I461 A466 I469 V470 F485	L452-L456 HydrophobicContact CD1-CD1 4.35Å; L452-L456 HydrophobicContact CD1-CG 4.35Å; L452-L456 HydrophobicContact CG-CD1 4.1Å; L452-L456 VanDerWaalsContact O-CG 3.23Å; L452-L456 WeakPolarHBondContact O-CG 3.12Å; L452-L456 PolarHBondContact O-N 3.38Å; R453-L456 PolarHBondContact O-N 3.43Å; Q454-L456 VanDerWaalsContact C-N 3.32Å; Q454-L456 PolarHBondContact O-N 2.94Å; L456-W459 HydrophobicContact CD2-CE3 4.47Å; L456-W459 PolarHBondContact O-N 3.1Å; L456-G460 PolarHBondContact O-N 2.91Å; L456-I461 HydrophobicContact CB-CB 4.28Å; L456-I461 HydrophobicContact CD2-CG1 4.17Å; L456-I461 VanDerWaalsContact O-CB 3.28Å; L456-I461 WeakPolarHBondContact O-CB 3.49Å; L456-I461 WeakPolarHBondContact O-CG1 3.26Å; L456-I461 PolarHBondContact O-N 2.9Å; L456-A466 HydrophobicContact CB-CB 4.06Å; L456-A466 HydrophobicContact CD1-CB 4.11Å; L456-I469 HydrophobicContact CD1-CB 4.1Å; L456-I469 HydrophobicContact CD1-CG2 3.82Å; L456-I469 HydrophobicContact CD2-CD1 4.08Å; L456-I469 HydrophobicContact CD2-CG2 4.1Å; L456-V470 HydrophobicContact CD1-CG2 4.07Å; L456-F485 HydrophobicContact CD2-CD2 3.54Å; L456-F485 HydrophobicContact CD2-CE2 3.92Å
457	T	97.2	Very high	96.2	Very high	93 Å²	93	64 Å²	64	57%	0.571	35%	0.346	S	S	*	.	H	α-helix	trans	-66.9	-44.8	177	-53.9	0	0	0	0	111.1	R453 Q454 L455 W459 G460	R453-T457 PolarHBondContact O-N 3.02Å; R453-T457 PolarHBondContact O-OG1 3.43Å; Q454-T457 WeakPolarHBondContact O-CB 3.4Å; Q454-T457 PolarHBondContact O-N 3.49Å; Q454-T457 VanDerWaalsContact O-N 3.1Å; L455-T457 VanDerWaalsContact C-N 3.3Å; L455-T457 PolarHBondContact O-N 3.14Å; T457-W459 VanDerWaalsContact C-N 3.27Å; T457-W459 PolarHBondContact O-N 3.29Å; T457-G460 PolarHBondContact O-N 3.23Å
458	E	96.4	Very high	96.3	Very high	112 Å²	112	66.7 Å²	66.7	52%	0.523	36%	0.356	S	S	.	.	H	α-helix	trans	-62.7	-34.3	176.8	-72.2	171.2	-178.5	0	0	112.2	Q454 L455 G460	Q454-E458 HydrophobicContact CG-CG 4.41Å; Q454-E458 VanDerWaalsContact CG-OE1 3.26Å; Q454-E458 WeakPolarHBondContact CG-OE1 3.45Å; Q454-E458 PolarHBondContact NE2-OE1 3.1Å; Q454-E458 WeakPolarHBondContact O-CG 3.27Å; Q454-E458 PolarHBondContact O-N 2.89Å; L455-E458 PolarHBondContact O-N 3.35Å; E458-G460 PolarHBondContact O-N 3.31Å
459	W	97.5	Very high	96.5	Very high	19 Å²	19	62.2 Å²	62.2	7%	0.072	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.8	5.5	174.9	-61.1	-22.1	0	0	0	114	P335 R338 R339 E342 L455 L456 T457 F485	P335-W459 HydrophobicContact CB-CH2 3.89Å; P335-W459 HydrophobicContact CB-CZ3 3.68Å; P335-W459 HydrophobicContact CG-CZ3 4.27Å; R338-W459 HydrophobicContact CG-CZ2 4.44Å; R338-W459 VanDerWaalsContact NH2-CD1 3.35Å; R339-W459 HydrophobicContact CB-CH2 4.33Å; R339-W459 HydrophobicContact CB-CZ2 4.05Å; E342-W459 PolarHBondContact OE1-NE1 3.07Å; E342-W459 PolarHBondContact OE2-NE1 2.85Å; L455-W459 HydrophobicContact CB-CD2 4.42Å; L455-W459 HydrophobicContact CB-CE3 4.23Å; L455-W459 HydrophobicContact CB-CH2 3.99Å; L455-W459 HydrophobicContact CB-CZ2 4.16Å; L455-W459 HydrophobicContact CB-CZ3 4.01Å; L455-W459 HydrophobicContact CD1-CH2 4.19Å; L455-W459 HydrophobicContact CD1-CZ2 4.49Å; L455-W459 HydrophobicContact CD2-CH2 4.49Å; L455-W459 HydrophobicContact CD2-CZ2 4.01Å; L455-W459 HydrophobicContact CG-CH2 4.47Å; L455-W459 HydrophobicContact CG-CZ2 4.46Å; L455-W459 WeakPolarHBondContact O-CB 3.39Å; L455-W459 VanDerWaalsContact O-CD2 3.24Å; L455-W459 PolarHBondContact O-N 2.92Å; L456-W459 HydrophobicContact CD2-CE3 4.47Å; L456-W459 PolarHBondContact O-N 3.1Å; T457-W459 VanDerWaalsContact C-N 3.27Å; T457-W459 PolarHBondContact O-N 3.29Å; W459-F485 HydrophobicContact CB-CE2 4.11Å; W459-F485 HydrophobicContact CB-CZ 4.16Å; W459-F485 HydrophobicContact CD2-CE2 4.36Å; W459-F485 HydrophobicContact CD2-CZ 4.33Å; W459-F485 AromaticContact CE3-CE2 3.59Å; W459-F485 HydrophobicContact CE3-CE2 3.59Å; W459-F485 AromaticContact CE3-CZ 3.84Å; W459-F485 HydrophobicContact CE3-CZ 3.84Å; W459-F485 HydrophobicContact CZ3-CE2 4.39Å
460	G	95.2	Very high	96.6	Very high	65 Å²	65	60.3 Å²	60.3	67%	0.67	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.3	16.1	172.7	0	0	0	0	0	115.1	L456 T457 E458	L456-G460 PolarHBondContact O-N 2.91Å; T457-G460 PolarHBondContact O-N 3.23Å; E458-G460 PolarHBondContact O-N 3.31Å
461	I	96.9	Very high	96.6	Very high	11 Å²	11	57.1 Å²	57.1	6%	0.056	31%	0.306	C	S	.	.			trans	-78.6	129.1	176	-53.3	-59.2	0	0	0	109.7	L456 D465 A466 I469 F485 C488	L456-I461 HydrophobicContact CB-CB 4.28Å; L456-I461 HydrophobicContact CD2-CG1 4.17Å; L456-I461 VanDerWaalsContact O-CB 3.28Å; L456-I461 WeakPolarHBondContact O-CB 3.49Å; L456-I461 WeakPolarHBondContact O-CG1 3.26Å; L456-I461 PolarHBondContact O-N 2.9Å; I461-D465 HydrophobicContact CG2-CB 3.91Å; I461-A466 HydrophobicContact CG2-CB 4.17Å; I461-I469 HydrophobicContact CG2-CD1 4.02Å; I461-F485 HydrophobicContact CD1-CD2 3.82Å; I461-F485 HydrophobicContact CD1-CE2 3.69Å; I461-F485 HydrophobicContact CD1-CZ 4.41Å; I461-F485 HydrophobicContact CG1-CD2 3.72Å; I461-F485 HydrophobicContact CG1-CE2 3.52Å; I461-C488 HydrophobicContact CD1-CB 3.81Å; I461-C488 HydrophobicContact CG2-CB 4.46Å
462	G	94.7	Very high	96.5	Very high	43 Å²	43	55.9 Å²	55.9	44%	0.443	30%	0.295	S	S	.	.			trans	-60.7	148.9	177.2	0	0	0	0	0	112.5	D464 D465 A466	G462-D464 VanDerWaalsContact C-N 3.34Å; G462-D464 PolarHBondContact O-N 3.02Å; G462-D465 PolarHBondContact O-N 2.97Å; G462-A466 WeakPolarHBondContact O-CB 3.31Å; G462-A466 PolarHBondContact O-N 3.23Å
463	K	95.4	Very high	96.2	Very high	166 Å²	166	56.5 Å²	56.5	72%	0.722	30%	0.3	S	S	*	.	H	α-helix	trans	-53.5	-44.8	-172.4	-170.9	179.3	178.9	-177.3	0	113.7	A466 E467	K463-A466 PolarHBondContact O-N 3.4Å; K463-E467 PolarHBondContact O-N 2.95Å; K463-E467 VanDerWaalsContact O-N 3.07Å
464	D	95.5	Very high	95.9	Very high	131 Å²	131	57.7 Å²	57.7	70%	0.701	31%	0.309	S	S	*	.	H	α-helix	trans	-68.7	-40.6	-177.7	-62	-25.8	0	0	0	112.1	G462 E467 K468	G462-D464 VanDerWaalsContact C-N 3.34Å; G462-D464 PolarHBondContact O-N 3.02Å; D464-E467 PolarHBondContact O-N 3.34Å; D464-K468 PolarHBondContact O-N 3.39Å
465	D	95.6	Very high	95.4	Very high	49 Å²	49	59.3 Å²	59.3	26%	0.262	31%	0.31	S	S	.	.	H	α-helix	trans	-69.5	-35.5	175.1	-76.4	-42	0	0	0	111.7	I461 G462 E467 K468 I469 K484 C488	I461-D465 HydrophobicContact CG2-CB 3.91Å; G462-D465 PolarHBondContact O-N 2.97Å; D465-E467 VanDerWaalsContact C-N 3.33Å; D465-E467 PolarHBondContact O-N 3Å; D465-K468 PolarHBondContact O-N 3.47Å; D465-I469 VanDerWaalsContact O-CG1 3.3Å; D465-I469 WeakPolarHBondContact O-CG1 3.46Å; D465-I469 PolarHBondContact O-N 3.02Å; D465-K484 WeakPolarHBondContact OD1-CE 3.3Å; D465-K484 IonicContact OD1-NZ 2.8Å; D465-K484 PolarHBondContact OD1-NZ 3.2Å; D465-C488 VanDerWaalsContact CB-SG 3.57Å; D465-C488 PolarHBondContact OD2-SG 2.73Å; D465-C488 VanDerWaalsContact OD2-SG 3.42Å
466	A	97.1	Very high	94.7	Very high	4 Å²	4	66 Å²	66	3%	0.033	34%	0.339	C	S	.	.	H	α-helix	trans	-61.4	-41.4	174.9	0	0	0	0	0	111.4	L456 I461 G462 K463 I469 V470	L456-A466 HydrophobicContact CB-CB 4.06Å; L456-A466 HydrophobicContact CD1-CB 4.11Å; I461-A466 HydrophobicContact CG2-CB 4.17Å; G462-A466 WeakPolarHBondContact O-CB 3.31Å; G462-A466 PolarHBondContact O-N 3.23Å; K463-A466 PolarHBondContact O-N 3.4Å; A466-I469 PolarHBondContact O-N 3.42Å; A466-V470 WeakPolarHBondContact O-CB 3.45Å; A466-V470 VanDerWaalsContact O-CG2 3.27Å; A466-V470 WeakPolarHBondContact O-CG2 3.1Å; A466-V470 PolarHBondContact O-N 3.39Å
467	E	97.5	Very high	93.9	Very high	74 Å²	74	71.3 Å²	71.3	35%	0.346	36%	0.359	S	S	.	.	H	α-helix	trans	-65	-40.5	174.8	-69.4	-55.8	141.8	0	0	112.4	R453 K463 D464 D465 I469 V470 E471	R453-E467 IonicContact CZ-OE1 2.76Å; R453-E467 IonicContact CZ-OE2 3.59Å; R453-E467 IonicContact NE-OE1 3.61Å; R453-E467 PolarHBondContact NE-OE1 3.03Å; R453-E467 IonicContact NE-OE2 3.48Å; R453-E467 PolarHBondContact NE-OE2 3.01Å; R453-E467 IonicContact NH2-OE1 3.51Å; R453-E467 IonicContact NH2-OE2 3.63Å; R453-E467 PolarHBondContact NH2-OE2 3.01Å; K463-E467 PolarHBondContact O-N 2.95Å; K463-E467 VanDerWaalsContact O-N 3.07Å; D464-E467 PolarHBondContact O-N 3.34Å; D465-E467 VanDerWaalsContact C-N 3.33Å; D465-E467 PolarHBondContact O-N 3Å; E467-I469 VanDerWaalsContact C-N 3.34Å; E467-I469 PolarHBondContact O-N 2.75Å; E467-V470 PolarHBondContact O-N 3.38Å; E467-E471 WeakPolarHBondContact O-CB 3.36Å; E467-E471 PolarHBondContact O-N 3.1Å
468	K	95.9	Very high	93.4	Very high	73 Å²	73	68.8 Å²	68.8	32%	0.317	34%	0.339	S	S	.	.	H	α-helix	trans	-60.3	-42.7	173.6	-69.7	177	178	178.3	0	112.2	D464 D465 V470 E471 F472 E494	D464-K468 PolarHBondContact O-N 3.39Å; D465-K468 PolarHBondContact O-N 3.47Å; K468-V470 VanDerWaalsContact C-N 3.34Å; K468-E471 PolarHBondContact O-N 3.32Å; K468-F472 VanDerWaalsContact O-CD2 3.28Å; K468-F472 WeakPolarHBondContact O-CD2 3.43Å; K468-F472 PolarHBondContact O-N 2.99Å; K468-E494 IonicContact NZ-OE1 2.77Å; K468-E494 IonicContact NZ-OE2 3.31Å; K468-E494 PolarHBondContact NZ-OE2 3.44Å
469	I	97.2	Very high	92.7	Very high	0 Å²	0	65.8 Å²	65.8	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-63.9	-42.6	177.7	-69.3	166.5	0	0	0	110.6	F444 L456 I461 D465 A466 E467 F472 S473 A481 K484 F485	F444-I469 HydrophobicContact CD1-CG2 3.92Å; F444-I469 HydrophobicContact CE1-CG2 3.49Å; F444-I469 VanDerWaalsContact CE1-CG2 3.49Å; F444-I469 HydrophobicContact CZ-CG2 4.47Å; L456-I469 HydrophobicContact CD1-CB 4.1Å; L456-I469 HydrophobicContact CD1-CG2 3.82Å; L456-I469 HydrophobicContact CD2-CD1 4.08Å; L456-I469 HydrophobicContact CD2-CG2 4.1Å; I461-I469 HydrophobicContact CG2-CD1 4.02Å; D465-I469 VanDerWaalsContact O-CG1 3.3Å; D465-I469 WeakPolarHBondContact O-CG1 3.46Å; D465-I469 PolarHBondContact O-N 3.02Å; A466-I469 PolarHBondContact O-N 3.42Å; E467-I469 VanDerWaalsContact C-N 3.34Å; E467-I469 PolarHBondContact O-N 2.75Å; I469-F472 PolarHBondContact O-N 3.49Å; I469-S473 WeakPolarHBondContact O-CB 3.43Å; I469-S473 PolarHBondContact O-N 3.37Å; I469-A481 HydrophobicContact CG2-CB 4.14Å; I469-K484 HydrophobicContact CD1-CG 4.22Å; I469-K484 HydrophobicContact CG1-CB 3.94Å; I469-K484 HydrophobicContact CG1-CG 3.58Å; I469-F485 HydrophobicContact CD1-CB 4.04Å; I469-F485 HydrophobicContact CD1-CD2 4.39Å
470	V	97.7	Very high	92.2	Very high	1 Å²	1	70 Å²	70	1%	0.006	34%	0.343	C	S	.	.	H	α-helix	trans	-62.7	-42	175.6	167.3	0	0	0	0	111.3	V449 L452 R453 L456 A466 E467 K468 S473 Q474	V449-V470 HydrophobicContact CG1-CG1 3.57Å; L452-V470 HydrophobicContact CD2-CG2 4.19Å; L452-V470 HydrophobicContact CG-CG2 4.34Å; R453-V470 HydrophobicContact CG-CG2 3.75Å; L456-V470 HydrophobicContact CD1-CG2 4.07Å; A466-V470 WeakPolarHBondContact O-CB 3.45Å; A466-V470 VanDerWaalsContact O-CG2 3.27Å; A466-V470 WeakPolarHBondContact O-CG2 3.1Å; A466-V470 PolarHBondContact O-N 3.39Å; E467-V470 PolarHBondContact O-N 3.38Å; K468-V470 VanDerWaalsContact C-N 3.34Å; V470-S473 WeakPolarHBondContact O-CB 3.22Å; V470-S473 PolarHBondContact O-N 3.39Å; V470-Q474 HydrophobicContact CG1-CG 4.42Å; V470-Q474 WeakPolarHBondContact O-CG 3.44Å; V470-Q474 PolarHBondContact O-N 3.4Å
471	E	96	Very high	92.1	Very high	82 Å²	82	66.9 Å²	66.9	38%	0.383	31%	0.311	S	S	.	.	H	α-helix	trans	-60.6	-46.9	175.8	-175.5	177.3	-149.6	0	0	111.5	E467 K468 S473 Q474 W475	E467-E471 WeakPolarHBondContact O-CB 3.36Å; E467-E471 PolarHBondContact O-N 3.1Å; K468-E471 PolarHBondContact O-N 3.32Å; E471-S473 VanDerWaalsContact C-N 3.3Å; E471-S473 PolarHBondContact O-N 3Å; E471-Q474 PolarHBondContact O-N 2.96Å; E471-W475 VanDerWaalsContact CD-CH2 3.5Å; E471-W475 HydrophobicContact CG-CD2 4.11Å; E471-W475 HydrophobicContact CG-CE3 4.28Å; E471-W475 HydrophobicContact CG-CH2 3.81Å; E471-W475 HydrophobicContact CG-CZ2 3.63Å; E471-W475 HydrophobicContact CG-CZ3 4.13Å; E471-W475 PolarHBondContact O-N 3.05Å; E471-W475 WeakPolarHBondContact OE1-CH2 3.39Å; E471-W475 WeakPolarHBondContact OE1-CZ2 3.46Å
472	F	91.8	Very high	92	Very high	37 Å²	37	67 Å²	67	16%	0.162	31%	0.312	C	S	.	.	H	α-helix	trans	-59.3	-41	173.9	-72.1	-45.3	0	0	0	112.6	K468 I469 W475 K476 R477 R480 A481 K484	K468-F472 VanDerWaalsContact O-CD2 3.28Å; K468-F472 WeakPolarHBondContact O-CD2 3.43Å; K468-F472 PolarHBondContact O-N 2.99Å; I469-F472 PolarHBondContact O-N 3.49Å; F472-W475 HydrophobicContact CD1-CE3 4.29Å; F472-W475 CarbonylContact O-C 3.55Å; F472-W475 PolarHBondContact O-N 3.38Å; F472-K476 PolarHBondContact O-N 3.15Å; F472-R477 HydrophobicContact CB-CB 4.45Å; F472-R477 WeakPolarHBondContact O-CA 3.24Å; F472-R477 PolarHBondContact O-N 3.11Å; F472-R480 HydrophobicContact CB-CB 4.46Å; F472-R480 HydrophobicContact CD1-CB 4.14Å; F472-R480 HydrophobicContact CD2-CB 4.27Å; F472-R480 HydrophobicContact CE1-CB 4.47Å; F472-R480 HydrophobicContact CG-CB 4.05Å; F472-A481 HydrophobicContact CB-CB 3.86Å; F472-K484 HydrophobicContact CD2-CB 4.34Å; F472-K484 HydrophobicContact CE2-CB 4.24Å; F472-K484 HydrophobicContact CE2-CG 4.39Å
473	S	92.3	Very high	91.8	Very high	15 Å²	15	65.2 Å²	65.2	11%	0.105	29%	0.293	C	S	.	.	H	α-helix	trans	-60.8	-45.9	175	162.1	0	0	0	0	111.8	F444 I469 V470 E471 W475 K476 Y478	F444-S473 WeakPolarHBondContact O-CB 3.47Å; F444-S473 PolarHBondContact O-OG 3.43Å; I469-S473 WeakPolarHBondContact O-CB 3.43Å; I469-S473 PolarHBondContact O-N 3.37Å; V470-S473 WeakPolarHBondContact O-CB 3.22Å; V470-S473 PolarHBondContact O-N 3.39Å; E471-S473 VanDerWaalsContact C-N 3.3Å; E471-S473 PolarHBondContact O-N 3Å; S473-W475 VanDerWaalsContact C-N 3.32Å; S473-W475 PolarHBondContact O-N 3.27Å; S473-K476 WeakPolarHBondContact O-CA 3.45Å; S473-K476 PolarHBondContact O-N 2.7Å; S473-Y478 WeakPolarHBondContact O-CE1 3.3Å
474	Q	92.1	Very high	91.6	Very high	107 Å²	107	58 Å²	58	50%	0.5	26%	0.261	S	S	.	.	H	α-helix	trans	-63.9	-35.7	177.1	-72.6	177.3	-18.4	0	0	112.4	V470 E471 K476	V470-Q474 HydrophobicContact CG1-CG 4.42Å; V470-Q474 WeakPolarHBondContact O-CG 3.44Å; V470-Q474 PolarHBondContact O-N 3.4Å; E471-Q474 PolarHBondContact O-N 2.96Å; Q474-K476 PolarHBondContact O-N 3.2Å
475	W	86.8	Confident	91.7	Very high	145 Å²	145	52 Å²	52	55%	0.549	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77	7.8	171.8	-65.7	-12.1	0	0	0	114.2	E471 F472 S473 R477	E471-W475 VanDerWaalsContact CD-CH2 3.5Å; E471-W475 HydrophobicContact CG-CD2 4.11Å; E471-W475 HydrophobicContact CG-CE3 4.28Å; E471-W475 HydrophobicContact CG-CH2 3.81Å; E471-W475 HydrophobicContact CG-CZ2 3.63Å; E471-W475 HydrophobicContact CG-CZ3 4.13Å; E471-W475 PolarHBondContact O-N 3.05Å; E471-W475 WeakPolarHBondContact OE1-CH2 3.39Å; E471-W475 WeakPolarHBondContact OE1-CZ2 3.46Å; F472-W475 HydrophobicContact CD1-CE3 4.29Å; F472-W475 CarbonylContact O-C 3.55Å; F472-W475 PolarHBondContact O-N 3.38Å; S473-W475 VanDerWaalsContact C-N 3.32Å; S473-W475 PolarHBondContact O-N 3.27Å; W475-R477 HydrophobicContact CB-CG 4.27Å; W475-R477 PolarHBondContact O-N 3.1Å; W475-R477 VanDerWaalsContact O-N 3.17Å
476	K	81.9	Confident	91.7	Very high	159 Å²	159	50.1 Å²	50.1	69%	0.691	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.2	21.7	-179.1	-49.8	179.1	179.4	175.9	0	113.7	F472 S473 Q474 Y478	F472-K476 PolarHBondContact O-N 3.15Å; S473-K476 WeakPolarHBondContact O-CA 3.45Å; S473-K476 PolarHBondContact O-N 2.7Å; Q474-K476 PolarHBondContact O-N 3.2Å; K476-Y478 VanDerWaalsContact C-N 3.34Å; K476-Y478 HydrophobicContact CB-CE1 4.42Å; K476-Y478 HydrophobicContact CB-CE2 4.2Å; K476-Y478 PolarHBondContact O-N 2.82Å
477	R	81.2	Confident	91.5	Very high	112 Å²	112	50.2 Å²	50.2	42%	0.423	22%	0.218	S	C	.	.			trans	-93.8	63.6	174.9	-59.9	-166.6	-177.9	-138	2.7	110	F472 W475 D479 R480 A481	F472-R477 HydrophobicContact CB-CB 4.45Å; F472-R477 WeakPolarHBondContact O-CA 3.24Å; F472-R477 PolarHBondContact O-N 3.11Å; W475-R477 HydrophobicContact CB-CG 4.27Å; W475-R477 PolarHBondContact O-N 3.1Å; W475-R477 VanDerWaalsContact O-N 3.17Å; R477-D479 VanDerWaalsContact C-N 3.31Å; R477-D479 VanDerWaalsContact C-OD1 3.23Å; R477-D479 PolarHBondContact O-N 3.19Å; R477-R480 HydrophobicContact CB-CB 4.13Å; R477-R480 HydrophobicContact CB-CG 4.27Å; R477-R480 PolarHBondContact O-N 3.25Å; R477-A481 PolarHBondContact O-N 3.49Å
478	Y	87.1	Confident	91.4	Very high	40 Å²	40	48.1 Å²	48.1	16%	0.157	21%	0.211	C	C	.	.	H	α-helix	trans	-66.4	-32.3	-172.1	-49.5	-53.1	0	0	0	113.6	I429 F444 K445 S473 K476 A481 C482	I429-Y478 HydrophobicContact CD1-CD2 4.07Å; I429-Y478 HydrophobicContact CD1-CG 4.45Å; I429-Y478 HydrophobicContact CG1-CD2 4.33Å; I429-Y478 HydrophobicContact CG2-CD2 3.84Å; I429-Y478 HydrophobicContact CG2-CE2 4Å; F444-Y478 HydrophobicContact CB-CD1 3.9Å; F444-Y478 HydrophobicContact CB-CG 4.48Å; F444-Y478 WeakPolarHBondContact O-CD1 3.4Å; F444-Y478 WeakPolarHBondContact O-CE1 3.38Å; K445-Y478 HydrophobicContact CB-CD1 4.12Å; K445-Y478 HydrophobicContact CB-CD2 4.25Å; K445-Y478 HydrophobicContact CB-CE1 3.76Å; K445-Y478 HydrophobicContact CB-CE2 3.9Å; K445-Y478 HydrophobicContact CB-CG 4.34Å; K445-Y478 HydrophobicContact CD-CE2 3.94Å; K445-Y478 HydrophobicContact CG-CE1 4.31Å; K445-Y478 HydrophobicContact CG-CE2 4.02Å; S473-Y478 WeakPolarHBondContact O-CE1 3.3Å; K476-Y478 VanDerWaalsContact C-N 3.34Å; K476-Y478 HydrophobicContact CB-CE1 4.42Å; K476-Y478 HydrophobicContact CB-CE2 4.2Å; K476-Y478 PolarHBondContact O-N 2.82Å; Y478-A481 PolarHBondContact O-N 2.8Å; Y478-C482 WeakPolarHBondContact O-CB 3.43Å; Y478-C482 PolarHBondContact O-N 3.46Å
479	D	81.4	Confident	91.3	Very high	49 Å²	49	47.2 Å²	47.2	26%	0.262	21%	0.214	S	C	.	.	H	α-helix	trans	-58.8	-47.5	170.6	57	-22.5	0	0	0	111.3	R477 C482 T483	R477-D479 VanDerWaalsContact C-N 3.31Å; R477-D479 VanDerWaalsContact C-OD1 3.23Å; R477-D479 PolarHBondContact O-N 3.19Å; D479-C482 PolarHBondContact O-N 3.02Å; D479-T483 WeakPolarHBondContact O-CB 3.33Å; D479-T483 PolarHBondContact O-N 2.89Å; D479-T483 PolarHBondContact O-OG1 3.04Å
480	R	86	Confident	91.1	Very high	107 Å²	107	48.7 Å²	48.7	40%	0.404	22%	0.221	S	C	.	.	H	α-helix	trans	-68.2	-40.1	175.7	-63.9	-166.9	179.5	-161.2	-9	112.4	F472 R477 C482 T483 K484 L500	F472-R480 HydrophobicContact CB-CB 4.46Å; F472-R480 HydrophobicContact CD1-CB 4.14Å; F472-R480 HydrophobicContact CD2-CB 4.27Å; F472-R480 HydrophobicContact CE1-CB 4.47Å; F472-R480 HydrophobicContact CG-CB 4.05Å; R477-R480 HydrophobicContact CB-CB 4.13Å; R477-R480 HydrophobicContact CB-CG 4.27Å; R477-R480 PolarHBondContact O-N 3.25Å; R480-C482 VanDerWaalsContact C-N 3.33Å; R480-C482 PolarHBondContact O-N 3.18Å; R480-T483 PolarHBondContact O-N 3.06Å; R480-K484 VanDerWaalsContact O-CB 3.31Å; R480-K484 WeakPolarHBondContact O-CB 3.4Å; R480-K484 PolarHBondContact O-N 2.65Å; R480-L500 HydrophobicContact CG-CD2 4.05Å
481	A	93.8	Very high	90.7	Very high	0 Å²	0	52 Å²	52	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-58.3	-46.4	174.6	0	0	0	0	0	111.1	F444 I469 F472 R477 Y478 F485	F444-A481 HydrophobicContact CB-CB 4.1Å; F444-A481 HydrophobicContact CD1-CB 3.74Å; F444-A481 HydrophobicContact CD2-CB 4.32Å; F444-A481 HydrophobicContact CE1-CB 4.22Å; F444-A481 HydrophobicContact CG-CB 3.78Å; I469-A481 HydrophobicContact CG2-CB 4.14Å; F472-A481 HydrophobicContact CB-CB 3.86Å; R477-A481 PolarHBondContact O-N 3.49Å; Y478-A481 PolarHBondContact O-N 2.8Å; A481-F485 PolarHBondContact O-N 2.86Å
482	C	95.3	Very high	90.4	Very high	13 Å²	13	50.7 Å²	50.7	9%	0.088	25%	0.251	C	S	.	.	H	α-helix	trans	-68.6	-36.9	177.4	-165	0	0	0	0	112.9	F444 Y478 D479 R480 F485 F486 V501	F444-C482 HydrophobicContact CD2-CB 3.95Å; F444-C482 VanDerWaalsContact CE2-CA 3.42Å; F444-C482 HydrophobicContact CE2-CB 3.45Å; F444-C482 VanDerWaalsContact CE2-CB 3.45Å; F444-C482 HydrophobicContact CZ-CB 4.27Å; Y478-C482 WeakPolarHBondContact O-CB 3.43Å; Y478-C482 PolarHBondContact O-N 3.46Å; D479-C482 PolarHBondContact O-N 3.02Å; R480-C482 VanDerWaalsContact C-N 3.33Å; R480-C482 PolarHBondContact O-N 3.18Å; C482-F485 WeakPolarHBondContact O-CB 3.15Å; C482-F485 PolarHBondContact O-N 3.17Å; C482-F486 PolarHBondContact O-N 2.79Å; C482-V501 HydrophobicContact CB-CB 4.31Å; C482-V501 HydrophobicContact CB-CG1 4.44Å
483	T	89.3	Confident	90	Very high	6 Å²	6	57.5 Å²	57.5	4%	0.037	28%	0.28	C	S	.	.	H	α-helix	trans	-67.8	-43.1	177.2	-53.5	0	0	0	0	110.8	D479 R480 F485 F486 E487 T497 L500 V501	D479-T483 WeakPolarHBondContact O-CB 3.33Å; D479-T483 PolarHBondContact O-N 2.89Å; D479-T483 PolarHBondContact O-OG1 3.04Å; R480-T483 PolarHBondContact O-N 3.06Å; T483-F485 VanDerWaalsContact C-N 3.33Å; T483-F485 PolarHBondContact O-N 2.95Å; T483-F486 WeakPolarHBondContact O-CA 3.23Å; T483-F486 VanDerWaalsContact O-CB 3.29Å; T483-F486 WeakPolarHBondContact O-CB 3.28Å; T483-F486 PolarHBondContact O-N 2.95Å; T483-F486 VanDerWaalsContact O-N 3.11Å; T483-E487 WeakPolarHBondContact O-CG 3.35Å; T483-E487 PolarHBondContact O-N 3.25Å; T483-T497 WeakPolarHBondContact CG2-OG1 3.37Å; T483-L500 HydrophobicContact CG2-CD2 4.24Å; T483-V501 PolarHBondContact OG1-N 3.15Å
484	K	93	Very high	89.3	Confident	14 Å²	14	61.5 Å²	61.5	6%	0.061	30%	0.297	C	S	.	.	H	α-helix	trans	-63.3	-39.8	174.4	-179.2	60	177.2	167.7	0	111.5	D465 I469 F472 R480 E487 C488 E494	D465-K484 WeakPolarHBondContact OD1-CE 3.3Å; D465-K484 IonicContact OD1-NZ 2.8Å; D465-K484 PolarHBondContact OD1-NZ 3.2Å; I469-K484 HydrophobicContact CD1-CG 4.22Å; I469-K484 HydrophobicContact CG1-CB 3.94Å; I469-K484 HydrophobicContact CG1-CG 3.58Å; F472-K484 HydrophobicContact CD2-CB 4.34Å; F472-K484 HydrophobicContact CE2-CB 4.24Å; F472-K484 HydrophobicContact CE2-CG 4.39Å; R480-K484 VanDerWaalsContact O-CB 3.31Å; R480-K484 WeakPolarHBondContact O-CB 3.4Å; R480-K484 PolarHBondContact O-N 2.65Å; K484-E487 PolarHBondContact O-N 2.76Å; K484-C488 WeakPolarHBondContact O-CB 3.46Å; K484-C488 PolarHBondContact O-N 3.34Å; K484-C488 PolarHBondContact O-SG 3.38Å; K484-E494 IonicContact NZ-OE2 2.78Å
485	F	97.1	Very high	88.3	Confident	4 Å²	4	62.7 Å²	62.7	2%	0.018	31%	0.307	C	S	.	.	H	α-helix	trans	-59.1	-45.4	170.5	-179.1	-88.1	0	0	0	111.9	P335 F444 L456 W459 I461 I469 A481 C482 T483 E487 C488 S489 Y507	P335-F485 HydrophobicContact CG-CB 4.48Å; P335-F485 HydrophobicContact CG-CD1 3.34Å; P335-F485 HydrophobicContact CG-CD2 4.23Å; P335-F485 HydrophobicContact CG-CE1 3.48Å; P335-F485 VanDerWaalsContact CG-CE1 3.48Å; P335-F485 HydrophobicContact CG-CE2 4.34Å; P335-F485 HydrophobicContact CG-CG 3.75Å; P335-F485 HydrophobicContact CG-CZ 3.99Å; F444-F485 HydrophobicContact CZ-CB 4.04Å; F444-F485 HydrophobicContact CZ-CG 4.42Å; L456-F485 HydrophobicContact CD2-CD2 3.54Å; L456-F485 HydrophobicContact CD2-CE2 3.92Å; W459-F485 HydrophobicContact CB-CE2 4.11Å; W459-F485 HydrophobicContact CB-CZ 4.16Å; W459-F485 HydrophobicContact CD2-CE2 4.36Å; W459-F485 HydrophobicContact CD2-CZ 4.33Å; W459-F485 AromaticContact CE3-CE2 3.59Å; W459-F485 HydrophobicContact CE3-CE2 3.59Å; W459-F485 AromaticContact CE3-CZ 3.84Å; W459-F485 HydrophobicContact CE3-CZ 3.84Å; W459-F485 HydrophobicContact CZ3-CE2 4.39Å; I461-F485 HydrophobicContact CD1-CD2 3.82Å; I461-F485 HydrophobicContact CD1-CE2 3.69Å; I461-F485 HydrophobicContact CD1-CZ 4.41Å; I461-F485 HydrophobicContact CG1-CD2 3.72Å; I461-F485 HydrophobicContact CG1-CE2 3.52Å; I469-F485 HydrophobicContact CD1-CB 4.04Å; I469-F485 HydrophobicContact CD1-CD2 4.39Å; A481-F485 PolarHBondContact O-N 2.86Å; C482-F485 WeakPolarHBondContact O-CB 3.15Å; C482-F485 PolarHBondContact O-N 3.17Å; T483-F485 VanDerWaalsContact C-N 3.33Å; T483-F485 PolarHBondContact O-N 2.95Å; F485-E487 PolarHBondContact O-N 2.92Å; F485-C488 PolarHBondContact O-N 3.28Å; F485-S489 VanDerWaalsContact O-CB 3.31Å; F485-S489 WeakPolarHBondContact O-CB 3.31Å; F485-S489 PolarHBondContact O-N 3.49Å; F485-S489 PolarHBondContact O-OG 2.62Å; F485-Y507 HydrophobicContact CD1-CE2 4.28Å; F485-Y507 VanDerWaalsContact CD1-OH 3.28Å; F485-Y507 WeakPolarHBondContact CD1-OH 3.31Å; F485-Y507 VanDerWaalsContact CE1-OH 3.31Å; F485-Y507 WeakPolarHBondContact CE1-OH 3.45Å
486	F	95.2	Very high	87.5	Confident	10 Å²	10	58.6 Å²	58.6	4%	0.044	30%	0.301	C	S	.	.	H	α-helix	trans	-56.6	-50.2	175.6	-177.7	-86.8	0	0	0	111.2	C482 T483 C488 S489 H490 L492 T497 Y507 D510	C482-F486 PolarHBondContact O-N 2.79Å; T483-F486 WeakPolarHBondContact O-CA 3.23Å; T483-F486 VanDerWaalsContact O-CB 3.29Å; T483-F486 WeakPolarHBondContact O-CB 3.28Å; T483-F486 PolarHBondContact O-N 2.95Å; T483-F486 VanDerWaalsContact O-N 3.11Å; F486-C488 PolarHBondContact O-N 2.9Å; F486-S489 WeakPolarHBondContact CA-OG 3.3Å; F486-S489 PolarHBondContact O-N 3.19Å; F486-S489 PolarHBondContact O-OG 3.01Å; F486-H490 AromaticContact CD2-CE1 3.68Å; F486-H490 AromaticContact CD2-ND1 3.87Å; F486-H490 AromaticContact CE2-CE1 3.54Å; F486-H490 AromaticContact CE2-ND1 3.91Å; F486-H490 AromaticContact CG-ND1 3.98Å; F486-H490 AromaticContact CZ-CE1 3.99Å; F486-H490 PolarHBondContact O-N 3.13Å; F486-H490 PolarHBondContact O-ND1 3.06Å; F486-L492 HydrophobicContact CD1-CD1 4.25Å; F486-L492 HydrophobicContact CE1-CD1 3.92Å; F486-T497 HydrophobicContact CD1-CG2 3.9Å; F486-T497 HydrophobicContact CE1-CG2 4.07Å; F486-Y507 HydrophobicContact CB-CD2 4.21Å; F486-Y507 HydrophobicContact CB-CE2 3.61Å; F486-Y507 HydrophobicContact CD2-CD1 4.17Å; F486-Y507 AromaticContact CD2-CD2 3.73Å; F486-Y507 HydrophobicContact CD2-CD2 3.73Å; F486-Y507 AromaticContact CD2-CE1 3.93Å; F486-Y507 HydrophobicContact CD2-CE1 3.93Å; F486-Y507 AromaticContact CD2-CE2 3.53Å; F486-Y507 HydrophobicContact CD2-CE2 3.53Å; F486-Y507 HydrophobicContact CD2-CG 4.04Å; F486-Y507 AromaticContact CD2-CZ 3.58Å; F486-Y507 HydrophobicContact CE2-CE1 4.46Å; F486-Y507 HydrophobicContact CG-CD2 4.43Å; F486-Y507 HydrophobicContact CG-CE2 4.06Å; F486-D510 HydrophobicContact CE2-CB 4.06Å; F486-D510 HydrophobicContact CZ-CB 3.9Å
487	E	93.5	Very high	86.6	Confident	6 Å²	6	52.7 Å²	52.7	3%	0.028	28%	0.278	C	S	.	.	H	α-helix	trans	-57.6	-49.4	178.6	-70.5	179.9	151.4	0	0	111.9	T483 K484 F485 H490 G491 L492 N495 S496 T497	T483-E487 WeakPolarHBondContact O-CG 3.35Å; T483-E487 PolarHBondContact O-N 3.25Å; K484-E487 PolarHBondContact O-N 2.76Å; F485-E487 PolarHBondContact O-N 2.92Å; E487-H490 PolarHBondContact O-N 3.4Å; E487-G491 PolarHBondContact O-N 3.04Å; E487-G491 VanDerWaalsContact O-N 3.12Å; E487-L492 HydrophobicContact CB-CB 4.19Å; E487-L492 HydrophobicContact CG-CB 4.42Å; E487-L492 PolarHBondContact O-N 3.18Å; E487-N495 WeakPolarHBondContact OE1-CA 3.49Å; E487-N495 PolarHBondContact OE1-N 3.41Å; E487-N495 PolarHBondContact OE2-N 3Å; E487-S496 PolarHBondContact OE1-N 2.98Å; E487-T497 HydrophobicContact CG-CG2 3.87Å; E487-T497 PolarHBondContact OE1-N 3.34Å; E487-T497 PolarHBondContact OE1-OG1 3.41Å
488	C	94.7	Very high	85.4	Confident	30 Å²	30	52.9 Å²	52.9	20%	0.203	30%	0.303	C	S	.	.	H	α-helix	trans	-64	-46.2	-179.7	-68	0	0	0	0	112.3	I461 D465 K484 F485 F486 H490 G491	I461-C488 HydrophobicContact CD1-CB 3.81Å; I461-C488 HydrophobicContact CG2-CB 4.46Å; D465-C488 VanDerWaalsContact CB-SG 3.57Å; D465-C488 PolarHBondContact OD2-SG 2.73Å; D465-C488 VanDerWaalsContact OD2-SG 3.42Å; K484-C488 WeakPolarHBondContact O-CB 3.46Å; K484-C488 PolarHBondContact O-N 3.34Å; K484-C488 PolarHBondContact O-SG 3.38Å; F485-C488 PolarHBondContact O-N 3.28Å; F486-C488 PolarHBondContact O-N 2.9Å; C488-H490 PolarHBondContact O-N 2.8Å; C488-G491 PolarHBondContact O-N 2.69Å
489	S	93.7	Very high	84.3	Confident	54 Å²	54	53.7 Å²	53.7	38%	0.378	31%	0.308	S	S	.	.	H	α-helix	trans	-64.7	-20.9	-179.1	60.5	0	0	0	0	113.7	F485 F486 Y507	F485-S489 VanDerWaalsContact O-CB 3.31Å; F485-S489 WeakPolarHBondContact O-CB 3.31Å; F485-S489 PolarHBondContact O-N 3.49Å; F485-S489 PolarHBondContact O-OG 2.62Å; F486-S489 WeakPolarHBondContact CA-OG 3.3Å; F486-S489 PolarHBondContact O-N 3.19Å; F486-S489 PolarHBondContact O-OG 3.01Å; S489-Y507 PolarHBondContact OG-OH 2.85Å
490	H	93.3	Very high	84	Confident	32 Å²	32	54.8 Å²	54.8	15%	0.148	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.1	8.2	178.1	-63.5	84.6	0	0	0	113.9	F486 E487 C488 L492 S511 L514	F486-H490 AromaticContact CD2-CE1 3.68Å; F486-H490 AromaticContact CD2-ND1 3.87Å; F486-H490 AromaticContact CE2-CE1 3.54Å; F486-H490 AromaticContact CE2-ND1 3.91Å; F486-H490 AromaticContact CG-ND1 3.98Å; F486-H490 AromaticContact CZ-CE1 3.99Å; F486-H490 PolarHBondContact O-N 3.13Å; F486-H490 PolarHBondContact O-ND1 3.06Å; E487-H490 PolarHBondContact O-N 3.4Å; C488-H490 PolarHBondContact O-N 2.8Å; H490-L492 HydrophobicContact CB-CD1 4.44Å; H490-L492 HydrophobicContact CB-CG 4.08Å; H490-L492 PolarHBondContact O-N 3.29Å; H490-S511 WeakPolarHBondContact NE2-CB 3.02Å; H490-S511 PolarHBondContact NE2-OG 3.45Å; H490-L514 HydrophobicContact CB-CD2 3.42Å; H490-L514 VanDerWaalsContact CB-CD2 3.42Å
491	G	90.4	Very high	83.7	Confident	70 Å²	70	50 Å²	50	72%	0.722	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.6	24.2	179.2	0	0	0	0	0	114.4	E487 C488	E487-G491 PolarHBondContact O-N 3.04Å; E487-G491 VanDerWaalsContact O-N 3.12Å; C488-G491 PolarHBondContact O-N 2.69Å
492	L	88.7	Confident	82.9	Confident	54 Å²	54	50.9 Å²	50.9	28%	0.283	30%	0.3	S	S	.	.	P	Polyproline II helix	trans	-80	156.6	178.5	-59.9	-179.1	0	0	0	111.6	F486 E487 H490 S496 T497 L514	F486-L492 HydrophobicContact CD1-CD1 4.25Å; F486-L492 HydrophobicContact CE1-CD1 3.92Å; E487-L492 HydrophobicContact CB-CB 4.19Å; E487-L492 HydrophobicContact CG-CB 4.42Å; E487-L492 PolarHBondContact O-N 3.18Å; H490-L492 HydrophobicContact CB-CD1 4.44Å; H490-L492 HydrophobicContact CB-CG 4.08Å; H490-L492 PolarHBondContact O-N 3.29Å; L492-S496 WeakPolarHBondContact CB-OG 3.41Å; L492-T497 HydrophobicContact CD1-CG2 3.97Å; L492-L514 HydrophobicContact CD1-CD1 4.44Å; L492-L514 HydrophobicContact CD1-CD2 4.06Å; L492-L514 HydrophobicContact CD2-CD1 4.05Å; L492-L514 HydrophobicContact CD2-CD2 3.98Å; L492-L514 HydrophobicContact CG-CD2 4.14Å
493	K	83.4	Confident	82.2	Confident	181 Å²	181	51.1 Å²	51.1	79%	0.787	30%	0.3	S	S	*	.	P	Polyproline II helix	trans	-69.9	154.5	172.9	-66.9	-177.8	-179.7	178.3	0	110.4	N495 S496	K493-N495 PolarHBondContact O-N 3.46Å; K493-S496 WeakPolarHBondContact O-CB 3.48Å; K493-S496 PolarHBondContact O-N 2.88Å; K493-S496 VanDerWaalsContact O-N 3.14Å; K493-S496 PolarHBondContact O-OG 3.24Å
494	E	76.9	Confident	82.3	Confident	98 Å²	98	50.8 Å²	50.8	46%	0.458	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	134	177.2	-173	169.8	159.5	0	0	111.7	K468 K484 S496	K468-E494 IonicContact NZ-OE1 2.77Å; K468-E494 IonicContact NZ-OE2 3.31Å; K468-E494 PolarHBondContact NZ-OE2 3.44Å; K484-E494 IonicContact NZ-OE2 2.78Å; E494-S496 PolarHBondContact O-N 3.48Å
495	N	71.3	Confident	82.1	Confident	133 Å²	133	50.3 Å²	50.3	71%	0.711	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.8	26.5	-174.7	-55.1	-54.6	0	0	0	113.8	E487 K493	E487-N495 WeakPolarHBondContact OE1-CA 3.49Å; E487-N495 PolarHBondContact OE1-N 3.41Å; E487-N495 PolarHBondContact OE2-N 3Å; K493-N495 PolarHBondContact O-N 3.46Å
496	S	71.6	Confident	81.4	Confident	59 Å²	59	50.4 Å²	50.4	41%	0.413	30%	0.296	S	S	.	.			trans	-80.1	-26.5	176.5	61.1	0	0	0	0	112	E487 L492 K493 E494 A498	E487-S496 PolarHBondContact OE1-N 2.98Å; L492-S496 WeakPolarHBondContact CB-OG 3.41Å; K493-S496 WeakPolarHBondContact O-CB 3.48Å; K493-S496 PolarHBondContact O-N 2.88Å; K493-S496 VanDerWaalsContact O-N 3.14Å; K493-S496 PolarHBondContact O-OG 3.24Å; E494-S496 PolarHBondContact O-N 3.48Å; S496-A498 PolarHBondContact O-N 2.97Å
497	T	62.4	Low	81.2	Confident	35 Å²	35	50.1 Å²	50.1	22%	0.215	30%	0.295	C	S	.	.			trans	-72.8	112.5	170.4	56	0	0	0	0	108.2	T483 F486 E487 L492 Q499	T483-T497 WeakPolarHBondContact CG2-OG1 3.37Å; F486-T497 HydrophobicContact CD1-CG2 3.9Å; F486-T497 HydrophobicContact CE1-CG2 4.07Å; E487-T497 HydrophobicContact CG-CG2 3.87Å; E487-T497 PolarHBondContact OE1-N 3.34Å; E487-T497 PolarHBondContact OE1-OG1 3.41Å; L492-T497 HydrophobicContact CD1-CG2 3.97Å; T497-Q499 PolarHBondContact O-N 3.48Å; T497-Q499 VanDerWaalsContact O-N 3.07Å
498	A	54.7	Low	81.1	Confident	115 Å²	115	50.4 Å²	50.4	95%	0.95	30%	0.296	S	S	*	.	S	Bend	trans	-61.9	-14.3	173.4	0	0	0	0	0	112.7	S496	S496-A498 PolarHBondContact O-N 2.97Å
499	Q	64.3	Low	80.5	Confident	57 Å²	57	49.6 Å²	49.6	27%	0.266	29%	0.29	S	S	.	.	S	Bend	trans	-127.4	133	-168	-168.2	178	-58.8	0	0	111.7	C306 T497 Q506	C306-Q499 VanDerWaalsContact CB-CD 3.43Å; C306-Q499 HydrophobicContact CB-CG 4.12Å; C306-Q499 VanDerWaalsContact CB-NE2 3.29Å; C306-Q499 WeakPolarHBondContact SG-CG 3.41Å; C306-Q499 PolarHBondContact SG-NE2 3.45Å; T497-Q499 PolarHBondContact O-N 3.48Å; T497-Q499 VanDerWaalsContact O-N 3.07Å; Q499-Q506 VanDerWaalsContact NE2-NE2 3.11Å
500	L	75.9	Confident	80.1	Confident	73 Å²	73	48.7 Å²	48.7	38%	0.382	28%	0.281	S	S	.	.			trans	-76.9	151.2	174.1	-64.7	172.5	0	0	0	111.4	R480 T483 Y502	R480-L500 HydrophobicContact CG-CD2 4.05Å; T483-L500 HydrophobicContact CG2-CD2 4.24Å; L500-Y502 WeakPolarHBondContact O-CD1 3.28Å
501	V	80.3	Confident	79.9	Confident	6 Å²	6	47.2 Å²	47.2	4%	0.036	27%	0.274	C	S	.	.			trans	-74.9	124.6	172.6	178.5	0	0	0	0	110.6	C482 T483 Y507	C482-V501 HydrophobicContact CB-CB 4.31Å; C482-V501 HydrophobicContact CB-CG1 4.44Å; T483-V501 PolarHBondContact OG1-N 3.15Å; V501-Y507 HydrophobicContact CG1-CD2 4.07Å; V501-Y507 HydrophobicContact CG2-CD2 3.95Å
502	Y	75.5	Confident	79.7	Confident	19 Å²	19	46.2 Å²	46.2	8%	0.075	25%	0.249	C	C	.	.			trans	-131.2	-8.9	179.8	64.2	-86.2	0	0	0	114.2	I303 C306 V308 C425 L500 Q506	I303-Y502 HydrophobicContact CB-CG 4.49Å; I303-Y502 HydrophobicContact CD1-CG 4.22Å; I303-Y502 HydrophobicContact CG1-CD1 4.41Å; I303-Y502 HydrophobicContact CG1-CG 4.15Å; I303-Y502 HydrophobicContact CG2-CD1 3.71Å; I303-Y502 HydrophobicContact CG2-CD2 3.52Å; I303-Y502 HydrophobicContact CG2-CE1 3.97Å; I303-Y502 HydrophobicContact CG2-CE2 3.75Å; I303-Y502 HydrophobicContact CG2-CG 3.49Å; I303-Y502 VanDerWaalsContact CG2-CG 3.49Å; C306-Y502 HydrophobicContact CB-CD1 4.1Å; C306-Y502 HydrophobicContact CB-CE1 3.17Å; C306-Y502 VanDerWaalsContact CB-CZ 3.47Å; C306-Y502 WeakPolarHBondContact CB-OH 3.26Å; C306-Y502 WeakPolarHBondContact SG-CE1 3.44Å; V308-Y502 HydrophobicContact CG2-CE2 4.17Å; C425-Y502 WeakPolarHBondContact CB-O 3.42Å; C425-Y502 PolarHBondContact N-O 3.44Å; C425-Y502 PolarHBondContact SG-O 3.41Å; C425-Y502 VanDerWaalsContact SG-O 3.4Å; L500-Y502 WeakPolarHBondContact O-CD1 3.28Å; Y502-Q506 HydrophobicContact CD1-CG 4.49Å; Y502-Q506 HydrophobicContact CE1-CB 4.43Å; Y502-Q506 HydrophobicContact CE1-CG 3.72Å; Y502-Q506 VanDerWaalsContact CE1-OE1 3.28Å
503	H	81.1	Confident	79.5	Confident	17 Å²	17	46.3 Å²	46.3	8%	0.079	25%	0.246	C	C	.	.			trans	-143	137.1	175.6	-164.6	-75.4	0	0	0	111.2	Y56 C425 N505 Q506 Y507	Y56-H503 PolarHBondContact OH-CD2 3.35Å; C425-H503 PolarHBondContact SG-N 3.24Å; H503-N505 VanDerWaalsContact C-N 3.33Å; H503-N505 PolarHBondContact CE1-OD1 3.5Å; H503-N505 PolarHBondContact ND1-N 3.07Å; H503-N505 PolarHBondContact O-N 2.93Å; H503-Q506 HydrophobicContact CB-CB 3.92Å; H503-Q506 WeakPolarHBondContact O-CB 3.46Å; H503-Q506 PolarHBondContact O-N 3.41Å; H503-Y507 PolarHBondContact O-N 2.93Å
504	P	92	Very high	79.4	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-55.5	-43.7	177.7	-27.5	35.7	0	0	0	113.7	P334 M337 F361 Y423 I428 Y507 F508	P334-P504 HydrophobicContact CG-CB 3.79Å; M337-P504 HydrophobicContact CE-CB 3.63Å; M337-P504 HydrophobicContact CE-CG 3.72Å; M337-P504 HydrophobicContact CG-CB 4.2Å; F361-P504 HydrophobicContact CD2-CB 3.95Å; F361-P504 HydrophobicContact CE2-CB 4.16Å; Y423-P504 VanDerWaalsContact O-CD 3.27Å; Y423-P504 WeakPolarHBondContact O-CD 3.45Å; I428-P504 HydrophobicContact CD1-CG 3.55Å; P504-Y507 WeakPolarHBondContact O-CB 3.36Å; P504-Y507 PolarHBondContact O-N 2.94Å; P504-F508 PolarHBondContact O-N 2.95Å; P504-F508 VanDerWaalsContact O-N 3.11Å
505	N	87.3	Confident	79.6	Confident	4 Å²	4	41 Å²	41	2%	0.021	23%	0.229	C	C	.	.	H	α-helix	trans	-67.2	-33.6	174.7	-63.1	93.5	0	0	0	113.7	F361 R364 L365 A422 H503 F508 D509	F361-N505 VanDerWaalsContact CD2-ND2 3.3Å; F361-N505 WeakPolarHBondContact CD2-ND2 3.13Å; F361-N505 PolarHBondContact O-ND2 2.83Å; R364-N505 HydrophobicContact CG-CB 4.16Å; R364-N505 VanDerWaalsContact CG-CG 3.48Å; R364-N505 WeakPolarHBondContact CG-ND2 3.49Å; L365-N505 WeakPolarHBondContact CD2-ND2 3.31Å; A422-N505 VanDerWaalsContact CB-OD1 3.24Å; A422-N505 WeakPolarHBondContact CB-OD1 3.13Å; H503-N505 VanDerWaalsContact C-N 3.33Å; H503-N505 PolarHBondContact CE1-OD1 3.5Å; H503-N505 PolarHBondContact ND1-N 3.07Å; H503-N505 PolarHBondContact O-N 2.93Å; N505-F508 WeakPolarHBondContact O-CB 3.44Å; N505-F508 PolarHBondContact O-N 3.31Å; N505-D509 VanDerWaalsContact O-CG 3.23Å; N505-D509 PolarHBondContact O-N 3.44Å; N505-D509 VanDerWaalsContact O-OD2 3.07Å
506	Q	82.8	Confident	79.9	Confident	5 Å²	5	37.7 Å²	37.7	2%	0.023	21%	0.209	C	C	.	.	H	α-helix	trans	-64.2	-43.2	173.3	170.2	-111.2	-23.3	0	0	111	Y311 Q499 Y502 H503 F508 D509 D510	Y311-Q506 HydrophobicContact CE2-CG 4.35Å; Q499-Q506 VanDerWaalsContact NE2-NE2 3.11Å; Y502-Q506 HydrophobicContact CD1-CG 4.49Å; Y502-Q506 HydrophobicContact CE1-CB 4.43Å; Y502-Q506 HydrophobicContact CE1-CG 3.72Å; Y502-Q506 VanDerWaalsContact CE1-OE1 3.28Å; H503-Q506 HydrophobicContact CB-CB 3.92Å; H503-Q506 WeakPolarHBondContact O-CB 3.46Å; H503-Q506 PolarHBondContact O-N 3.41Å; Q506-F508 VanDerWaalsContact C-N 3.29Å; Q506-F508 PolarHBondContact O-N 3.01Å; Q506-D509 PolarHBondContact O-N 3.41Å; Q506-D510 PolarHBondContact NE2-OD2 2.95Å; Q506-D510 WeakPolarHBondContact O-CB 3.29Å; Q506-D510 PolarHBondContact O-N 3.04Å
507	Y	90.5	Very high	79.4	Confident	4 Å²	4	36.7 Å²	36.7	2%	0.016	21%	0.208	C	C	.	.	H	α-helix	trans	-53.6	-49.6	171.8	179.5	-69.7	0	0	0	111.1	S332 P334 F485 F486 S489 V501 H503 P504 D509 D510 S511	S332-Y507 WeakPolarHBondContact O-CD1 3.39Å; P334-Y507 HydrophobicContact CB-CD1 3.72Å; P334-Y507 HydrophobicContact CB-CD2 3.94Å; P334-Y507 HydrophobicContact CB-CE1 4.24Å; P334-Y507 HydrophobicContact CB-CE2 4.36Å; P334-Y507 HydrophobicContact CB-CG 3.61Å; P334-Y507 HydrophobicContact CG-CD1 4.31Å; P334-Y507 HydrophobicContact CG-CG 4.41Å; F485-Y507 HydrophobicContact CD1-CE2 4.28Å; F485-Y507 VanDerWaalsContact CD1-OH 3.28Å; F485-Y507 WeakPolarHBondContact CD1-OH 3.31Å; F485-Y507 VanDerWaalsContact CE1-OH 3.31Å; F485-Y507 WeakPolarHBondContact CE1-OH 3.45Å; F486-Y507 HydrophobicContact CB-CD2 4.21Å; F486-Y507 HydrophobicContact CB-CE2 3.61Å; F486-Y507 HydrophobicContact CD2-CD1 4.17Å; F486-Y507 AromaticContact CD2-CD2 3.73Å; F486-Y507 HydrophobicContact CD2-CD2 3.73Å; F486-Y507 AromaticContact CD2-CE1 3.93Å; F486-Y507 HydrophobicContact CD2-CE1 3.93Å; F486-Y507 AromaticContact CD2-CE2 3.53Å; F486-Y507 HydrophobicContact CD2-CE2 3.53Å; F486-Y507 HydrophobicContact CD2-CG 4.04Å; F486-Y507 AromaticContact CD2-CZ 3.58Å; F486-Y507 HydrophobicContact CE2-CE1 4.46Å; F486-Y507 HydrophobicContact CG-CD2 4.43Å; F486-Y507 HydrophobicContact CG-CE2 4.06Å; S489-Y507 PolarHBondContact OG-OH 2.85Å; V501-Y507 HydrophobicContact CG1-CD2 4.07Å; V501-Y507 HydrophobicContact CG2-CD2 3.95Å; H503-Y507 PolarHBondContact O-N 2.93Å; P504-Y507 WeakPolarHBondContact O-CB 3.36Å; P504-Y507 PolarHBondContact O-N 2.94Å; Y507-D509 PolarHBondContact O-N 3.4Å; Y507-D510 PolarHBondContact O-N 2.76Å; Y507-S511 WeakPolarHBondContact O-CB 3.28Å; Y507-S511 PolarHBondContact O-N 2.64Å
508	F	91.3	Very high	78.7	Confident	12 Å²	12	41.9 Å²	41.9	5%	0.053	24%	0.239	C	C	.	.	H	α-helix	trans	-59.7	-48	-179.1	178.2	-86.3	0	0	0	111.2	L328 S332 F333 F361 L365 P504 N505 Q506 S511 R512	L328-F508 HydrophobicContact CB-CE2 4.16Å; L328-F508 HydrophobicContact CD1-CE2 4.32Å; L328-F508 HydrophobicContact CD1-CZ 4.06Å; L328-F508 HydrophobicContact CD2-CE2 3.98Å; L328-F508 HydrophobicContact CD2-CZ 3.83Å; L328-F508 HydrophobicContact CG-CE2 4.38Å; L328-F508 HydrophobicContact CG-CZ 4.4Å; S332-F508 WeakPolarHBondContact O-CA 3.3Å; S332-F508 WeakPolarHBondContact O-CD2 3.33Å; F333-F508 AromaticContact CD1-CD2 3.84Å; F333-F508 HydrophobicContact CD1-CD2 3.84Å; F333-F508 AromaticContact CD1-CE2 3.92Å; F333-F508 HydrophobicContact CD1-CE2 3.92Å; F333-F508 HydrophobicContact CE1-CD2 4.2Å; F333-F508 AromaticContact CE1-CE2 3.92Å; F333-F508 HydrophobicContact CE1-CE2 3.92Å; F361-F508 HydrophobicContact CE2-CB 4.25Å; F361-F508 HydrophobicContact CZ-CB 4.24Å; F361-F508 HydrophobicContact CZ-CD2 4.18Å; F361-F508 HydrophobicContact CZ-CG 4.42Å; L365-F508 HydrophobicContact CD1-CD2 4.16Å; L365-F508 HydrophobicContact CD1-CE1 4.49Å; L365-F508 HydrophobicContact CD1-CE2 3.88Å; L365-F508 HydrophobicContact CD1-CZ 4.06Å; L365-F508 HydrophobicContact CD2-CB 4.28Å; L365-F508 HydrophobicContact CD2-CD1 3.38Å; L365-F508 HydrophobicContact CD2-CD2 4.06Å; L365-F508 HydrophobicContact CD2-CE1 3.59Å; L365-F508 HydrophobicContact CD2-CE2 4.23Å; L365-F508 HydrophobicContact CD2-CG 3.63Å; L365-F508 HydrophobicContact CD2-CZ 4.01Å; P504-F508 PolarHBondContact O-N 2.95Å; P504-F508 VanDerWaalsContact O-N 3.11Å; N505-F508 WeakPolarHBondContact O-CB 3.44Å; N505-F508 PolarHBondContact O-N 3.31Å; Q506-F508 VanDerWaalsContact C-N 3.29Å; Q506-F508 PolarHBondContact O-N 3.01Å; F508-S511 WeakPolarHBondContact O-CB 3.21Å; F508-S511 PolarHBondContact O-N 3.14Å; F508-R512 HydrophobicContact CD1-CG 4.02Å; F508-R512 HydrophobicContact CE1-CG 3.59Å; F508-R512 HydrophobicContact CZ-CG 3.92Å; F508-R512 WeakPolarHBondContact O-CG 3.38Å; F508-R512 PolarHBondContact O-N 3.1Å
509	D	83.1	Confident	78.2	Confident	14 Å²	14	39.4 Å²	39.4	8%	0.075	22%	0.224	C	C	.	.	H	α-helix	trans	-68.3	-39.7	-177.2	-65.2	-40.9	0	0	0	112.3	Y311 N505 Q506 Y507 S511 R512 K513	Y311-D509 HydrophobicContact CD1-CB 3.5Å; Y311-D509 VanDerWaalsContact CD1-CG 3.46Å; Y311-D509 WeakPolarHBondContact CD1-OD2 3.44Å; Y311-D509 HydrophobicContact CE1-CB 3.12Å; Y311-D509 HydrophobicContact CG-CB 4.46Å; N505-D509 VanDerWaalsContact O-CG 3.23Å; N505-D509 PolarHBondContact O-N 3.44Å; N505-D509 VanDerWaalsContact O-OD2 3.07Å; Q506-D509 PolarHBondContact O-N 3.41Å; Y507-D509 PolarHBondContact O-N 3.4Å; D509-S511 VanDerWaalsContact C-N 3.3Å; D509-S511 PolarHBondContact O-N 3.46Å; D509-R512 PolarHBondContact O-N 3.34Å; D509-K513 WeakPolarHBondContact O-CB 3.48Å; D509-K513 WeakPolarHBondContact O-CG 3.24Å; D509-K513 PolarHBondContact O-N 2.93Å
510	D	85.1	Confident	76.6	Confident	35 Å²	35	43 Å²	43	19%	0.187	25%	0.246	C	C	.	.	H	α-helix	trans	-62.9	-39	174.9	-68.9	-10	0	0	0	110.9	Y311 F486 Q506 Y507 K513 L514	Y311-D510 PolarHBondContact OH-OD1 2.87Å; F486-D510 HydrophobicContact CE2-CB 4.06Å; F486-D510 HydrophobicContact CZ-CB 3.9Å; Q506-D510 PolarHBondContact NE2-OD2 2.95Å; Q506-D510 WeakPolarHBondContact O-CB 3.29Å; Q506-D510 PolarHBondContact O-N 3.04Å; Y507-D510 PolarHBondContact O-N 2.76Å; D510-K513 PolarHBondContact O-N 2.97Å; D510-L514 WeakPolarHBondContact O-CB 3.17Å; D510-L514 PolarHBondContact O-N 3.43Å
511	S	90.2	Very high	74.9	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-60.6	-48.5	172.8	169.7	0	0	0	0	111	T331 S332 H490 Y507 F508 D509 K513 L514 L515	T331-S511 PolarHBondContact O-OG 2.76Å; T331-S511 VanDerWaalsContact O-OG 3.1Å; S332-S511 VanDerWaalsContact CA-OG 3.28Å; S332-S511 WeakPolarHBondContact CA-OG 3.46Å; S332-S511 VanDerWaalsContact CB-OG 3.3Å; S332-S511 WeakPolarHBondContact CB-OG 3.17Å; S332-S511 PolarHBondContact OG-OG 3.36Å; H490-S511 WeakPolarHBondContact NE2-CB 3.02Å; H490-S511 PolarHBondContact NE2-OG 3.45Å; Y507-S511 WeakPolarHBondContact O-CB 3.28Å; Y507-S511 PolarHBondContact O-N 2.64Å; F508-S511 WeakPolarHBondContact O-CB 3.21Å; F508-S511 PolarHBondContact O-N 3.14Å; D509-S511 VanDerWaalsContact C-N 3.3Å; D509-S511 PolarHBondContact O-N 3.46Å; S511-K513 PolarHBondContact O-N 2.76Å; S511-L514 PolarHBondContact O-N 2.79Å; S511-L515 WeakPolarHBondContact O-CB 3.45Å; S511-L515 WeakPolarHBondContact O-CG 3.38Å; S511-L515 PolarHBondContact O-N 2.66Å
512	R	86	Confident	73	Confident	50 Å²	50	51.7 Å²	51.7	19%	0.189	28%	0.284	C	S	.	.	H	α-helix	trans	-62.8	-43.9	178.7	-68.2	-56.4	-59.3	-169.3	-0.6	112.2	L328 S332 F508 D509 L514 L515 F516	L328-R512 VanDerWaalsContact CD2-NH1 3.28Å; S332-R512 VanDerWaalsContact OG-CD 3.29Å; S332-R512 WeakPolarHBondContact OG-CD 3.26Å; F508-R512 HydrophobicContact CD1-CG 4.02Å; F508-R512 HydrophobicContact CE1-CG 3.59Å; F508-R512 HydrophobicContact CZ-CG 3.92Å; F508-R512 WeakPolarHBondContact O-CG 3.38Å; F508-R512 PolarHBondContact O-N 3.1Å; D509-R512 PolarHBondContact O-N 3.34Å; R512-L514 VanDerWaalsContact C-N 3.3Å; R512-L514 PolarHBondContact O-N 3.49Å; R512-L515 PolarHBondContact O-N 3.44Å; R512-F516 VanDerWaalsContact NH2-CD2 3.35Å; R512-F516 WeakPolarHBondContact O-CD2 3.38Å; R512-F516 PolarHBondContact O-N 2.9Å
513	K	82.8	Confident	70.7	Confident	55 Å²	55	57.2 Å²	57.2	24%	0.239	32%	0.32	C	S	.	.	H	α-helix	trans	-60.5	-39.3	175.8	-76.5	177.3	175.2	-179.5	0	112	D310 Y311 D509 D510 S511 G517	D310-K513 VanDerWaalsContact CB-NZ 3.33Å; D310-K513 IonicContact OD2-NZ 3.1Å; D310-K513 PolarHBondContact OD2-NZ 2.71Å; Y311-K513 HydrophobicContact CE1-CD 4.48Å; Y311-K513 WeakPolarHBondContact OH-CE 3.46Å; Y311-K513 PolarHBondContact OH-NZ 2.71Å; D509-K513 WeakPolarHBondContact O-CB 3.48Å; D509-K513 WeakPolarHBondContact O-CG 3.24Å; D509-K513 PolarHBondContact O-N 2.93Å; D510-K513 PolarHBondContact O-N 2.97Å; S511-K513 PolarHBondContact O-N 2.76Å; K513-G517 CarbonylContact O-C 3.53Å; K513-G517 WeakPolarHBondContact O-CA 3.2Å; K513-G517 PolarHBondContact O-N 3.45Å
514	L	83.1	Confident	68.2	Low	84 Å²	84	64.7 Å²	64.7	44%	0.44	36%	0.355	S	S	.	.	H	α-helix	trans	-69.5	-42.5	178.6	-169.6	84	0	0	0	112	H490 L492 D510 S511 R512	H490-L514 HydrophobicContact CB-CD2 3.42Å; H490-L514 VanDerWaalsContact CB-CD2 3.42Å; L492-L514 HydrophobicContact CD1-CD1 4.44Å; L492-L514 HydrophobicContact CD1-CD2 4.06Å; L492-L514 HydrophobicContact CD2-CD1 4.05Å; L492-L514 HydrophobicContact CD2-CD2 3.98Å; L492-L514 HydrophobicContact CG-CD2 4.14Å; D510-L514 WeakPolarHBondContact O-CB 3.17Å; D510-L514 PolarHBondContact O-N 3.43Å; S511-L514 PolarHBondContact O-N 2.79Å; R512-L514 VanDerWaalsContact C-N 3.3Å; R512-L514 PolarHBondContact O-N 3.49Å
515	L	81	Confident	65.2	Low	84 Å²	84	70.7 Å²	70.7	44%	0.44	39%	0.394	S	S	.	.	H	α-helix	trans	-76.4	-31.9	-175.6	-69.3	173.7	0	0	0	113.6	S511 R512	S511-L515 WeakPolarHBondContact O-CB 3.45Å; S511-L515 WeakPolarHBondContact O-CG 3.38Å; S511-L515 PolarHBondContact O-N 2.66Å; R512-L515 PolarHBondContact O-N 3.44Å
516	F	77	Confident	62.5	Low	64 Å²	64	77 Å²	77	28%	0.281	43%	0.432	S	S	.	.	H	α-helix	trans	-124.4	4.6	-171.5	-59.1	-86.2	0	0	0	113.7	R512 D520 E522	R512-F516 VanDerWaalsContact NH2-CD2 3.35Å; R512-F516 WeakPolarHBondContact O-CD2 3.38Å; R512-F516 PolarHBondContact O-N 2.9Å; F516-D520 WeakPolarHBondContact O-CB 3.3Å; F516-E522 HydrophobicContact CE1-CG 4.18Å
517	G	61.4	Low	60.2	Low	38 Å²	38	82.1 Å²	82.1	39%	0.392	47%	0.469	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.9	179.8	-176.1	0	0	0	0	0	113.7	K513 G519	K513-G517 CarbonylContact O-C 3.53Å; K513-G517 WeakPolarHBondContact O-CA 3.2Å; K513-G517 PolarHBondContact O-N 3.45Å; G517-G519 PolarHBondContact O-N 3.48Å
518	V	47	Very low	57.4	Low	143 Å²	143	91.2 Å²	91.2	87%	0.867	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.6	80.1	172.1	-175.2	0	0	0	0	107.5
519	G	43.6	Very low	55.7	Low	63 Å²	63	95.2 Å²	95.2	65%	0.649	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	128	-2.4	168.8	0	0	0	0	0	118	G517 E521	G517-G519 PolarHBondContact O-N 3.48Å; G519-E521 PolarHBondContact O-N 3.19Å
520	D	31.6	Very low	54.2	Low	134 Å²	134	99.5 Å²	99.5	72%	0.717	58%	0.583	S	S	*	*			trans	-92.4	100	176.2	-68	-34.9	0	0	0	110.3	F516	F516-D520 WeakPolarHBondContact O-CB 3.3Å
521	E	39.8	Very low	52.5	Low	175 Å²	175	103.1 Å²	103.1	82%	0.818	61%	0.605	S	S	*	*			trans	-60.3	150.9	176.3	-63.8	176.7	160.9	0	0	111.4	G519 T523	G519-E521 PolarHBondContact O-N 3.19Å; E521-T523 VanDerWaalsContact C-N 3.28Å; E521-T523 PolarHBondContact O-N 3.24Å
522	E	39.8	Very low	50.3	Low	85 Å²	85	109.1 Å²	109.1	40%	0.397	64%	0.64	S	S	.	*			trans	-58.5	99.3	161.7	-79	-172.3	158.7	0	0	106.9	K327 F516 Q524	K327-E522 IonicContact NZ-OE1 3.39Å; K327-E522 PolarHBondContact NZ-OE1 3.01Å; F516-E522 HydrophobicContact CE1-CG 4.18Å; E522-Q524 VanDerWaalsContact C-N 3.35Å; E522-Q524 PolarHBondContact O-N 3.13Å
523	T	29.3	Very low	48	Very low	136 Å²	136	112.8 Å²	112.8	83%	0.834	67%	0.668	S	S	*	*			trans	-54.4	105.8	165	18.6	0	0	0	0	106	E521	E521-T523 VanDerWaalsContact C-N 3.28Å; E521-T523 PolarHBondContact O-N 3.24Å
524	Q	28.6	Very low	45.7	Very low	174 Å²	174	116.7 Å²	116.7	81%	0.813	70%	0.697	S	S	*	*			trans	-52.9	134.5	171.9	-75.7	-165.9	-13.6	0	0	107.7	E522 T526	E522-Q524 VanDerWaalsContact C-N 3.35Å; E522-Q524 PolarHBondContact O-N 3.13Å; Q524-T526 PolarHBondContact O-N 2.87Å
525	P	28.6	Very low	43.1	Very low	126 Å²	126	119 Å²	119	82%	0.818	72%	0.715	S	S	*	*			trans	-60.1	114.6	179.5	23	-30	0	0	0	107.9	S527	P525-S527 PolarHBondContact O-N 3.09Å
526	T	30.8	Very low	40.1	Very low	135 Å²	135	121.7 Å²	121.7	83%	0.828	74%	0.737	S	S	*	*			trans	-54.7	114.3	171.2	47.6	0	0	0	0	107.7	Q524 S528	Q524-T526 PolarHBondContact O-N 2.87Å; T526-S528 PolarHBondContact O-N 2.99Å
527	S	33.5	Very low	37.1	Very low	114 Å²	114	126.5 Å²	126.5	80%	0.797	78%	0.775	S	S	*	*			trans	-49.9	130.1	168.9	52.1	0	0	0	0	109.2	P525	P525-S527 PolarHBondContact O-N 3.09Å
528	S	31.1	Very low	34.9	Very low	195 Å²	195	134.5 Å²	134.5	100%	1.364	81%	0.809	S	S	*	*			trans	-55.1	0	176.9	-34.5	0	0	0	0	112.6	T526	T526-S528 PolarHBondContact O-N 2.99Å

Retrieved 528 of 528 residues in 1366.6 ms (Link to these results)

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