A0A2K5N1J7_CERAT Loading...

Pogo transposable element derived with KRAB domain

AlphaFold DB , UniProt , Accession A0A2K5N1J7, Species CERAT (Cercocebus atys, Sooty mangabey), Gene POGK, Length 591 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	39.5	Very low	35.1	Very low	250 Å²	250	141.6 Å²	141.6	100%	1.232	77%	0.773	S	S	*	*				0	102	0	-77.3	177.2	179.6	0	0	105.9
2	E	28.8	Very low	35.5	Very low	191 Å²	191	138.5 Å²	138.5	89%	0.893	75%	0.754	S	S	*	*			trans	-72.3	143.1	-170.8	-74.8	167.4	146.9	0	0	111.9
3	S	35	Very low	35.8	Very low	116 Å²	116	139.8 Å²	139.8	81%	0.811	75%	0.747	S	S	*	*			trans	-92.1	117.4	169.3	163.6	0	0	0	0	108
4	T	30.7	Very low	36.2	Very low	114 Å²	114	138.8 Å²	138.8	70%	0.699	74%	0.736	S	S	*	*			trans	-106.3	101	172.5	40.4	0	0	0	0	110.2
5	A	34.1	Very low	36.6	Very low	94 Å²	94	138.3 Å²	138.3	78%	0.777	73%	0.728	S	S	*	*	P	Polyproline II helix	trans	-79.6	131.7	161.1	0	0	0	0	0	108.8
6	Y	33.3	Very low	37	Very low	211 Å²	211	138.8 Å²	138.8	83%	0.827	73%	0.725	S	S	*	*	P	Polyproline II helix	trans	-90	139.2	169.3	-76.6	-88.2	0	0	0	109.9
7	P	36.4	Very low	37.3	Very low	97 Å²	97	138.6 Å²	138.6	63%	0.63	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-89.8	132.6	-170.1	33	-31.8	0	0	0	113.8	N9	P7-N9 PolarHBondContact O-N 3.37Å; P7-N9 VanDerWaalsContact O-N 3.07Å
8	L	38.2	Very low	37.6	Very low	150 Å²	150	137.8 Å²	137.8	79%	0.785	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.9	23.1	173.8	-90.5	158.7	0	0	0	114.8
9	N	34.3	Very low	37.8	Very low	124 Å²	124	137.8 Å²	137.8	66%	0.663	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.5	6.5	-169.4	-91.8	-17.5	0	0	0	115.5	P7	P7-N9 PolarHBondContact O-N 3.37Å; P7-N9 VanDerWaalsContact O-N 3.07Å
10	L	35.8	Very low	37.7	Very low	127 Å²	127	136.5 Å²	136.5	67%	0.665	70%	0.699	S	S	*	*	S	Bend	trans	-93	-24.9	174.1	-98.1	92.3	0	0	0	114.1
11	T	40.7	Very low	37.8	Very low	84 Å²	84	135 Å²	135	52%	0.515	69%	0.691	S	S	.	*	H	α-helix	trans	-79.5	-20.1	-174.7	34.5	0	0	0	0	114.8
12	L	39.8	Very low	37.7	Very low	104 Å²	104	130.9 Å²	130.9	55%	0.545	66%	0.662	S	S	.	*	H	α-helix	trans	-83.6	-22.4	178.7	-75.4	166.7	0	0	0	113.4	E16	L12-E16 PolarHBondContact O-N 3.36Å
13	K	38.5	Very low	38	Very low	155 Å²	155	126 Å²	126	67%	0.674	65%	0.649	S	S	*	*	H	α-helix	trans	-79.4	-30.3	178	-79.2	-171	171.9	-172.5	0	113.1	E17	K13-E17 PolarHBondContact O-N 3.13Å
14	E	41.6	Very low	38.1	Very low	126 Å²	126	129.4 Å²	129.4	59%	0.589	64%	0.644	S	S	*	*	H	α-helix	trans	-74.5	-29.9	175	-68.3	177.7	165.7	0	0	111.4	E18	E14-E18 PolarHBondContact O-N 3.37Å
15	E	43.1	Very low	38.5	Very low	131 Å²	131	131.7 Å²	131.7	61%	0.612	65%	0.647	S	S	*	*	H	α-helix	trans	-75.6	-32.2	175.1	-73.1	-178	166.5	0	0	113.2
16	E	43.2	Very low	38.8	Very low	146 Å²	146	134.3 Å²	134.3	68%	0.682	65%	0.647	S	S	*	*	H	α-helix	trans	-75.5	-32.9	175.7	-77.6	-178.9	163.1	0	0	113	L12 E20	L12-E16 PolarHBondContact O-N 3.36Å; E16-E20 PolarHBondContact O-N 3.24Å
17	E	42.2	Very low	39.1	Very low	136 Å²	136	132.5 Å²	132.5	64%	0.636	65%	0.646	S	S	*	*	H	α-helix	trans	-70.8	-31.8	174.4	-86.6	-177	160	0	0	112.6	K13 I21	K13-E17 PolarHBondContact O-N 3.13Å; E17-I21 WeakPolarHBondContact O-CD1 3.41Å; E17-I21 VanDerWaalsContact O-CG1 3.27Å; E17-I21 WeakPolarHBondContact O-CG1 3.49Å; E17-I21 PolarHBondContact O-N 2.96Å
18	E	41.9	Very low	39.2	Very low	125 Å²	125	136.3 Å²	136.3	58%	0.584	66%	0.661	S	S	*	*	H	α-helix	trans	-72.9	-26.1	176.5	-81.1	-166.2	173.2	0	0	114.1	E14 R22	E14-E18 PolarHBondContact O-N 3.37Å; E18-R22 PolarHBondContact O-N 2.68Å
19	E	41.4	Very low	38.9	Very low	138 Å²	138	132.5 Å²	132.5	65%	0.645	66%	0.658	S	S	*	*	H	α-helix	trans	-80.2	-32.8	172.4	-81.7	-155.4	153.7	0	0	112.8	R22 S23	E19-R22 PolarHBondContact O-N 3.47Å; E19-S23 PolarHBondContact O-N 3.1Å; E19-S23 PolarHBondContact O-OG 3.09Å
20	E	36.3	Very low	38.8	Very low	110 Å²	110	133.1 Å²	133.1	51%	0.514	67%	0.669	S	S	.	*	H	α-helix	trans	-69.8	-33	176.6	-160.1	-176.4	153.6	0	0	111.9	E16 S23 R24	E16-E20 PolarHBondContact O-N 3.24Å; E20-S23 PolarHBondContact O-N 3.23Å; E20-R24 PolarHBondContact O-N 2.87Å; E20-R24 IonicContact OE1-CZ 3.34Å; E20-R24 IonicContact OE1-NH1 3.7Å; E20-R24 PolarHBondContact OE1-NH1 2.61Å
21	I	39.5	Very low	39	Very low	106 Å²	106	132 Å²	132	54%	0.544	68%	0.678	S	S	.	*	H	α-helix	trans	-69.2	-39.3	173.9	-66.2	166.4	0	0	0	111	E17 S23 R24	E17-I21 WeakPolarHBondContact O-CD1 3.41Å; E17-I21 VanDerWaalsContact O-CG1 3.27Å; E17-I21 WeakPolarHBondContact O-CG1 3.49Å; E17-I21 PolarHBondContact O-N 2.96Å; I21-S23 PolarHBondContact O-N 3.39Å; I21-R24 PolarHBondContact O-N 3.19Å
22	R	37.5	Very low	38.6	Very low	164 Å²	164	135.5 Å²	135.5	62%	0.619	69%	0.694	S	S	*	*	H	α-helix	trans	-68.8	-21.5	178.5	-134.7	179.7	-65.6	-170.4	-0.1	113.6	E18 E19	E18-R22 PolarHBondContact O-N 2.68Å; E19-R22 PolarHBondContact O-N 3.47Å
23	S	34.8	Very low	38	Very low	89 Å²	89	139.5 Å²	139.5	62%	0.622	71%	0.712	S	S	*	*	H	α-helix	trans	-86.7	-23.7	-179.8	-54.8	0	0	0	0	113.1	E19 E20 I21	E19-S23 PolarHBondContact O-N 3.1Å; E19-S23 PolarHBondContact O-OG 3.09Å; E20-S23 PolarHBondContact O-N 3.23Å; I21-S23 PolarHBondContact O-N 3.39Å
24	R	36.4	Very low	37.7	Very low	187 Å²	187	141.6 Å²	141.6	71%	0.706	72%	0.724	S	S	*	*	H	α-helix	trans	-89.2	-13.1	-178.1	-92.9	-179.3	166.7	130.6	1.9	114.9	E20 I21 L26	E20-R24 PolarHBondContact O-N 2.87Å; E20-R24 IonicContact OE1-CZ 3.34Å; E20-R24 IonicContact OE1-NH1 3.7Å; E20-R24 PolarHBondContact OE1-NH1 2.61Å; I21-R24 PolarHBondContact O-N 3.19Å; R24-L26 VanDerWaalsContact C-N 3.31Å; R24-L26 PolarHBondContact O-N 2.99Å
25	E	39.4	Very low	37.2	Very low	162 Å²	162	145.1 Å²	145.1	76%	0.757	74%	0.737	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88	10.3	179.7	-68.5	-174.5	152.1	0	0	114.2
26	L	41.2	Very low	36.5	Very low	149 Å²	149	145.9 Å²	145.9	78%	0.78	75%	0.751	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.9	0.2	-179.6	-87.3	162	0	0	0	115.4	R24	R24-L26 VanDerWaalsContact C-N 3.31Å; R24-L26 PolarHBondContact O-N 2.99Å
27	E	40	Very low	35.6	Very low	173 Å²	173	150.4 Å²	150.4	81%	0.808	76%	0.762	S	S	*	*	S	Bend	trans	-134.2	76.4	179.8	-68.8	-169.2	167	0	0	111.5
28	D	38.1	Very low	34.9	Very low	177 Å²	177	150.9 Å²	150.9	95%	0.947	77%	0.767	S	S	*	*			trans	170.4	114.4	138.5	-96	-24.1	0	0	0	112.1
29	G	32	Very low	34.2	Very low	70 Å²	70	149.9 Å²	149.9	72%	0.722	77%	0.773	S	S	*	*			trans	172.9	133.3	171.7	0	0	0	0	0	112.3
30	P	32.4	Very low	34	Very low	136 Å²	136	148.7 Å²	148.7	88%	0.883	78%	0.779	S	S	*	*			trans	-79.6	150.2	-156	32.2	-34.6	0	0	0	114.3	D32	P30-D32 PolarHBondContact O-N 3.28Å
31	A	38.1	Very low	33.8	Very low	103 Å²	103	152.5 Å²	152.5	85%	0.851	80%	0.797	S	S	*	*			trans	-69.8	109.7	-175.3	0	0	0	0	0	113.3
32	D	33.1	Very low	33.6	Very low	158 Å²	158	150.9 Å²	150.9	85%	0.845	81%	0.806	S	S	*	*			trans	-162.2	82.9	143.6	-127.3	-8.2	0	0	0	110.3	P30	P30-D32 PolarHBondContact O-N 3.28Å
33	M	28.1	Very low	33.4	Very low	188 Å²	188	146.3 Å²	146.3	93%	0.926	81%	0.811	S	S	*	*			trans	-173.1	61.5	163	-103.5	-162.7	-65.6	0	0	109.6	K35	M33-K35 PolarHBondContact O-N 3.47Å
34	Q	30.6	Very low	33.6	Very low	199 Å²	199	148.8 Å²	148.8	93%	0.93	81%	0.806	S	S	*	*			trans	-91.1	79.7	166.1	-99.8	-176.6	-11.5	0	0	110.2
35	K	31.5	Very low	33.6	Very low	201 Å²	201	142.1 Å²	142.1	87%	0.874	79%	0.787	S	S	*	*	S	Bend	trans	-166.3	76.3	149.5	-105.5	-178	-173.9	-177.3	0	106.9	M33	M33-K35 PolarHBondContact O-N 3.47Å
36	V	28.1	Very low	33.6	Very low	147 Å²	147	138.5 Å²	138.5	89%	0.891	78%	0.777	S	S	*	*			trans	-179	100.1	147.7	167.5	0	0	0	0	107
37	R	24.9	Very low	33.7	Very low	241 Å²	241	134 Å²	134	91%	0.909	76%	0.761	S	S	*	*			trans	-152.2	127	160.4	-98.7	-171.3	-163.7	-173.3	4.4	101.2
38	I	28.6	Very low	34.1	Very low	145 Å²	145	129.3 Å²	129.3	74%	0.744	74%	0.741	S	S	*	*			cis	-154.5	154.2	34.3	-45.7	178.4	0	0	0	102.9
39	C	26.3	Very low	34.5	Very low	105 Å²	105	121.2 Å²	121.2	71%	0.709	70%	0.698	S	S	*	*				-164.7	136.3	53.4	-64.1	0	0	0	0	113.1
40	S	36.5	Very low	35.4	Very low	112 Å²	112	121.8 Å²	121.8	78%	0.783	68%	0.684	S	S	*	*	S	Bend	trans	-59.6	141.1	138.7	42.1	0	0	0	0	110.3
41	E	32.4	Very low	36.2	Very low	191 Å²	191	122.1 Å²	122.1	89%	0.893	67%	0.674	S	S	*	*	S	Bend	trans	89.7	112.9	-170.3	-56.4	-175.6	167.9	0	0	114.8
42	G	35.1	Very low	36.6	Very low	71 Å²	71	120.4 Å²	120.4	73%	0.732	65%	0.653	S	S	*	*			trans	101.4	0.2	157.6	0	0	0	0	0	120.6	W44	G42-W44 PolarHBondContact O-N 3.1Å
43	G	34.1	Very low	37.3	Very low	69 Å²	69	113.5 Å²	113.5	71%	0.711	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.1	37.2	-169.2	0	0	0	0	0	119.1
44	W	38.8	Very low	38.2	Very low	140 Å²	140	109.4 Å²	109.4	53%	0.53	60%	0.598	S	S	.	*	T	Hydrogen-bonded Turn	trans	-104.7	-8.2	177.7	-77.2	70.2	0	0	0	114.5	G42 V378	G42-W44 PolarHBondContact O-N 3.1Å; W44-V378 HydrophobicContact CH2-CG1 4.22Å; W44-V378 HydrophobicContact CZ3-CG1 4.19Å; W44-V378 HydrophobicContact CZ3-CG2 4Å
45	V	36.3	Very low	39.3	Very low	48 Å²	48	105.5 Å²	105.5	29%	0.291	58%	0.576	S	S	.	*	S	Bend	trans	-107.3	-32.5	-162.4	-172.2	0	0	0	0	115.3	A47 L48 F49	V45-A47 PolarHBondContact O-N 3.45Å; V45-L48 PolarHBondContact O-N 3.39Å; V45-F49 PolarHBondContact O-N 3.48Å
46	P	38.7	Very low	40	Very low	85 Å²	85	99.6 Å²	99.6	55%	0.552	55%	0.55	S	S	*	*	H	α-helix	trans	-56.6	-39	169.6	-24	34	0	0	0	111.5	L48 F49 D50	P46-L48 VanDerWaalsContact C-N 3.31Å; P46-L48 PolarHBondContact O-N 2.67Å; P46-F49 PolarHBondContact O-N 3.2Å; P46-D50 VanDerWaalsContact O-CB 3.31Å; P46-D50 WeakPolarHBondContact O-CB 3.48Å; P46-D50 PolarHBondContact O-N 3.32Å
47	A	44.9	Very low	40.9	Very low	54 Å²	54	94.9 Å²	94.9	45%	0.446	52%	0.524	S	S	.	.	H	α-helix	trans	-61.1	-33.1	176.1	0	0	0	0	0	113.9	V45 E51	V45-A47 PolarHBondContact O-N 3.45Å; A47-E51 VanDerWaalsContact O-CG 3.3Å; A47-E51 WeakPolarHBondContact O-CG 3.43Å; A47-E51 PolarHBondContact O-N 2.72Å; A47-E51 VanDerWaalsContact O-N 3.09Å
48	L	46.6	Very low	42.1	Very low	76 Å²	76	89 Å²	89	40%	0.398	51%	0.51	S	S	.	.	H	α-helix	trans	-79.2	-34	-178.6	-147	91.6	0	0	0	112.2	V45 P46 L86	V45-L48 PolarHBondContact O-N 3.39Å; P46-L48 VanDerWaalsContact C-N 3.31Å; P46-L48 PolarHBondContact O-N 2.67Å; L48-L86 HydrophobicContact CD2-CD1 4.26Å
49	F	47.1	Very low	43	Very low	7 Å²	7	88.6 Å²	88.6	3%	0.031	51%	0.505	C	S	.	.	H	α-helix	trans	-72.2	-40.2	171.2	-175.6	-106.7	0	0	0	110.4	V45 P46 E51 V52 A53 N79 Y80 P93 M95 I96	V45-F49 PolarHBondContact O-N 3.48Å; P46-F49 PolarHBondContact O-N 3.2Å; F49-E51 PolarHBondContact O-N 3.4Å; F49-V52 CarbonylContact O-C 3.59Å; F49-V52 WeakPolarHBondContact O-CG2 3.47Å; F49-V52 PolarHBondContact O-N 2.95Å; F49-V52 VanDerWaalsContact O-N 3.08Å; F49-A53 HydrophobicContact CD1-CB 4.14Å; F49-A53 HydrophobicContact CE1-CB 3.98Å; F49-A53 HydrophobicContact CZ-CB 4.29Å; F49-A53 WeakPolarHBondContact O-CB 3.41Å; F49-A53 PolarHBondContact O-N 3.42Å; F49-N79 HydrophobicContact CE2-CB 4.48Å; F49-Y80 HydrophobicContact CE2-CD2 4.34Å; F49-P93 HydrophobicContact CD1-CB 4.21Å; F49-P93 HydrophobicContact CD1-CG 4.13Å; F49-P93 HydrophobicContact CE1-CB 4.16Å; F49-P93 HydrophobicContact CE1-CG 4.31Å; F49-P93 HydrophobicContact CG-CG 4.43Å; F49-M95 HydrophobicContact CD1-CE 4.44Å; F49-M95 HydrophobicContact CE1-CE 3.31Å; F49-M95 HydrophobicContact CZ-CE 3.6Å; F49-I96 HydrophobicContact CE1-CG1 4.27Å; F49-I96 HydrophobicContact CE2-CD1 4.26Å; F49-I96 HydrophobicContact CE2-CG1 4.34Å; F49-I96 HydrophobicContact CZ-CD1 3.73Å; F49-I96 HydrophobicContact CZ-CG1 3.72Å
50	D	50.9	Low	43.9	Very low	82 Å²	82	88.7 Å²	88.7	44%	0.439	50%	0.495	S	S	.	.	H	α-helix	trans	-62.4	-24.7	174.7	-71.5	-24.3	0	0	0	113.5	P46 Y55	P46-D50 VanDerWaalsContact O-CB 3.31Å; P46-D50 WeakPolarHBondContact O-CB 3.48Å; P46-D50 PolarHBondContact O-N 3.32Å; D50-Y55 PolarHBondContact OD1-OH 3.5Å
51	E	48.8	Very low	44.8	Very low	143 Å²	143	85.3 Å²	85.3	67%	0.668	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.2	-26	174	-84.2	175.6	-165.8	0	0	113.6	A47 F49	A47-E51 VanDerWaalsContact O-CG 3.3Å; A47-E51 WeakPolarHBondContact O-CG 3.43Å; A47-E51 PolarHBondContact O-N 2.72Å; A47-E51 VanDerWaalsContact O-N 3.09Å; F49-E51 PolarHBondContact O-N 3.4Å
52	V	46.7	Very low	45.6	Very low	67 Å²	67	83.2 Å²	83.2	41%	0.406	46%	0.455	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.3	-13.1	-178.2	-61	0	0	0	0	113	F49 N79 V83	F49-V52 CarbonylContact O-C 3.59Å; F49-V52 WeakPolarHBondContact O-CG2 3.47Å; F49-V52 PolarHBondContact O-N 2.95Å; F49-V52 VanDerWaalsContact O-N 3.08Å; V52-N79 HydrophobicContact CG2-CB 4.14Å; V52-N79 PolarHBondContact O-ND2 3.34Å; V52-V83 HydrophobicContact CG2-CG2 4.38Å
53	A	47.7	Very low	46.5	Very low	12 Å²	12	85.8 Å²	85.8	10%	0.099	46%	0.457	C	S	.	.			trans	-78.8	137.8	175	0	0	0	0	0	110.3	F49 Y55 M76 M95	F49-A53 HydrophobicContact CD1-CB 4.14Å; F49-A53 HydrophobicContact CE1-CB 3.98Å; F49-A53 HydrophobicContact CZ-CB 4.29Å; F49-A53 WeakPolarHBondContact O-CB 3.41Å; F49-A53 PolarHBondContact O-N 3.42Å; A53-Y55 HydrophobicContact CB-CE2 3.81Å; A53-M76 HydrophobicContact CB-SD 4.12Å; A53-M95 HydrophobicContact CB-CE 3.71Å
54	I	48.5	Very low	47.2	Very low	103 Å²	103	83.9 Å²	83.9	53%	0.528	43%	0.43	S	S	.	.			trans	-105.7	134.8	170.5	-63	173.9	0	0	0	105.5	Y72 M76	I54-Y72 HydrophobicContact CB-CE2 4.5Å; I54-Y72 WeakPolarHBondContact O-CE2 3.44Å; I54-Y72 PolarHBondContact O-OH 3.49Å; I54-M76 HydrophobicContact CB-CE 4.13Å; I54-M76 HydrophobicContact CG1-CE 4.42Å
55	Y	52.6	Low	48	Very low	117 Å²	117	80.9 Å²	80.9	46%	0.459	43%	0.427	S	S	.	.			trans	-113.8	132.5	179.3	-65.7	-81.1	0	0	0	109.1	D50 A53 M95	D50-Y55 PolarHBondContact OD1-OH 3.5Å; A53-Y55 HydrophobicContact CB-CE2 3.81Å; Y55-M95 HydrophobicContact CD1-CE 4.42Å; Y55-M95 HydrophobicContact CD1-SD 3.66Å; Y55-M95 HydrophobicContact CE1-CE 3.72Å; Y55-M95 HydrophobicContact CE1-SD 3.35Å; Y55-M95 WeakPolarHBondContact CE1-SD 3.36Å
56	F	47.3	Very low	48.8	Very low	77 Å²	77	84 Å²	84	34%	0.338	44%	0.439	S	S	.	.			trans	-99.5	142.5	169.2	-69	-67.4	0	0	0	109.8	E60 W61 L64 Y72	F56-E60 HydrophobicContact CB-CB 4.21Å; F56-E60 HydrophobicContact CD1-CB 3.99Å; F56-W61 HydrophobicContact CB-CB 4.36Å; F56-W61 HydrophobicContact CB-CE3 4.2Å; F56-W61 AromaticContact CD2-CE3 3.82Å; F56-W61 HydrophobicContact CD2-CE3 3.82Å; F56-W61 HydrophobicContact CD2-CZ3 4.02Å; F56-W61 HydrophobicContact CG-CE3 4.33Å; F56-L64 HydrophobicContact CD1-CD1 4.44Å; F56-L64 HydrophobicContact CD2-CD1 3.82Å; F56-L64 HydrophobicContact CE1-CD1 4.31Å; F56-L64 HydrophobicContact CE2-CD1 3.64Å; F56-L64 HydrophobicContact CG-CD1 4.21Å; F56-L64 HydrophobicContact CZ-CD1 3.92Å; F56-L64 HydrophobicContact CZ-CD2 4.48Å; F56-Y72 AromaticContact CD2-CD2 3.78Å; F56-Y72 HydrophobicContact CD2-CD2 3.78Å; F56-Y72 AromaticContact CD2-CE2 3.54Å; F56-Y72 HydrophobicContact CD2-CE2 3.54Å; F56-Y72 HydrophobicContact CD2-CG 4.33Å; F56-Y72 AromaticContact CD2-CZ 3.97Å; F56-Y72 AromaticContact CE2-CD2 3.32Å; F56-Y72 HydrophobicContact CE2-CD2 3.32Å; F56-Y72 AromaticContact CE2-CE2 3.52Å; F56-Y72 HydrophobicContact CE2-CE2 3.52Å; F56-Y72 AromaticContact CE2-CG 3.98Å; F56-Y72 HydrophobicContact CE2-CG 3.98Å; F56-Y72 HydrophobicContact CZ-CD2 4.43Å
57	S	45.8	Very low	49.1	Very low	47 Å²	47	88 Å²	88	33%	0.329	45%	0.45	S	S	.	.			trans	-69.1	162.6	163.4	90.2	0	0	0	0	110.5	E59 E60 W61	S57-E59 WeakPolarHBondContact CB-OE2 3.3Å; S57-E59 PolarHBondContact O-N 2.99Å; S57-E59 PolarHBondContact OG-N 3.19Å; S57-E59 PolarHBondContact OG-OE2 2.92Å; S57-E60 PolarHBondContact N-OE2 3.39Å; S57-E60 PolarHBondContact O-N 3.35Å; S57-E60 VanDerWaalsContact O-N 3.13Å; S57-E60 PolarHBondContact OG-N 3.29Å; S57-W61 WeakPolarHBondContact O-CB 3.34Å; S57-W61 PolarHBondContact O-N 3.42Å
58	D	50.3	Low	49	Very low	118 Å²	118	90 Å²	90	63%	0.631	45%	0.45	S	S	*	.	H	α-helix	trans	-59.2	-35.6	178	-66.8	-29	0	0	0	111	E62	D58-E62 WeakPolarHBondContact O-CG 3.28Å; D58-E62 PolarHBondContact O-N 3.27Å
59	E	48.7	Very low	49.3	Very low	137 Å²	137	87.4 Å²	87.4	64%	0.64	44%	0.436	S	S	*	.	H	α-helix	trans	-70.2	-37	176	-56.3	78.1	-170	0	0	113.2	S57 V63	S57-E59 WeakPolarHBondContact CB-OE2 3.3Å; S57-E59 PolarHBondContact O-N 2.99Å; S57-E59 PolarHBondContact OG-N 3.19Å; S57-E59 PolarHBondContact OG-OE2 2.92Å; E59-V63 WeakPolarHBondContact O-CG2 3.33Å
60	E	43.6	Very low	49.4	Very low	106 Å²	106	89.6 Å²	89.6	50%	0.495	46%	0.455	S	S	.	.	H	α-helix	trans	-71.6	-36.3	176.4	-68.6	174.8	145.2	0	0	111.4	F56 S57 V63	F56-E60 HydrophobicContact CB-CB 4.21Å; F56-E60 HydrophobicContact CD1-CB 3.99Å; S57-E60 PolarHBondContact N-OE2 3.39Å; S57-E60 PolarHBondContact O-N 3.35Å; S57-E60 VanDerWaalsContact O-N 3.13Å; S57-E60 PolarHBondContact OG-N 3.29Å; E60-V63 PolarHBondContact O-N 2.85Å
61	W	55.4	Low	49.2	Very low	42 Å²	42	90.6 Å²	90.6	16%	0.159	46%	0.46	C	S	.	.	H	α-helix	trans	-64.5	-40	178.6	-173.9	-107.2	0	0	0	112.7	F56 S57 V63 L64 K69 Y72	F56-W61 HydrophobicContact CB-CB 4.36Å; F56-W61 HydrophobicContact CB-CE3 4.2Å; F56-W61 AromaticContact CD2-CE3 3.82Å; F56-W61 HydrophobicContact CD2-CE3 3.82Å; F56-W61 HydrophobicContact CD2-CZ3 4.02Å; F56-W61 HydrophobicContact CG-CE3 4.33Å; S57-W61 WeakPolarHBondContact O-CB 3.34Å; S57-W61 PolarHBondContact O-N 3.42Å; W61-V63 PolarHBondContact O-N 3.44Å; W61-L64 HydrophobicContact CE3-CD1 3.74Å; W61-L64 HydrophobicContact CZ3-CD1 4.04Å; W61-L64 PolarHBondContact O-N 3.38Å; W61-K69 HydrophobicContact CD2-CG 4.48Å; W61-K69 HydrophobicContact CH2-CB 3.97Å; W61-K69 HydrophobicContact CH2-CG 3.96Å; W61-K69 HydrophobicContact CZ2-CB 4.1Å; W61-K69 HydrophobicContact CZ2-CD 4.02Å; W61-K69 HydrophobicContact CZ2-CG 3.9Å; W61-K69 HydrophobicContact CZ3-CG 4.27Å; W61-K69 WeakPolarHBondContact O-CE 2.99Å; W61-Y72 AromaticContact CH2-CD1 3.51Å; W61-Y72 HydrophobicContact CH2-CD1 3.51Å; W61-Y72 AromaticContact CH2-CE1 3.92Å; W61-Y72 HydrophobicContact CH2-CE1 3.92Å; W61-Y72 HydrophobicContact CH2-CG 4.33Å; W61-Y72 AromaticContact CZ3-CD1 3.3Å; W61-Y72 HydrophobicContact CZ3-CD1 3.3Å; W61-Y72 AromaticContact CZ3-CE1 3.57Å; W61-Y72 HydrophobicContact CZ3-CE1 3.57Å; W61-Y72 AromaticContact CZ3-CG 3.84Å; W61-Y72 HydrophobicContact CZ3-CG 3.84Å
62	E	50.3	Low	49.3	Very low	146 Å²	146	85 Å²	85	68%	0.682	43%	0.433	S	S	*	.	H	α-helix	trans	-66.1	-24	178.4	-74	-63.4	141.7	0	0	113.4	D58	D58-E62 WeakPolarHBondContact O-CG 3.28Å; D58-E62 PolarHBondContact O-N 3.27Å
63	V	54.3	Low	49.7	Very low	125 Å²	125	83.3 Å²	83.3	76%	0.758	42%	0.419	S	S	*	.	H	α-helix	trans	-85.2	-14.7	179.7	-178.9	0	0	0	0	111.9	E59 E60 W61	E59-V63 WeakPolarHBondContact O-CG2 3.33Å; E60-V63 PolarHBondContact O-N 2.85Å; W61-V63 PolarHBondContact O-N 3.44Å
64	L	48.1	Very low	49.8	Very low	30 Å²	30	87.8 Å²	87.8	16%	0.157	44%	0.438	C	S	.	.	S	Bend	trans	-72.7	136.9	178.2	-62.5	179.9	0	0	0	111.7	F56 W61 Q68 K69	F56-L64 HydrophobicContact CD1-CD1 4.44Å; F56-L64 HydrophobicContact CD2-CD1 3.82Å; F56-L64 HydrophobicContact CE1-CD1 4.31Å; F56-L64 HydrophobicContact CE2-CD1 3.64Å; F56-L64 HydrophobicContact CG-CD1 4.21Å; F56-L64 HydrophobicContact CZ-CD1 3.92Å; F56-L64 HydrophobicContact CZ-CD2 4.48Å; W61-L64 HydrophobicContact CE3-CD1 3.74Å; W61-L64 HydrophobicContact CZ3-CD1 4.04Å; W61-L64 PolarHBondContact O-N 3.38Å; L64-Q68 HydrophobicContact CB-CB 4.21Å; L64-Q68 HydrophobicContact CD2-CB 4.28Å; L64-K69 HydrophobicContact CB-CG 3.77Å; L64-K69 HydrophobicContact CD1-CG 4.34Å; L64-K69 VanDerWaalsContact O-CE 3.29Å; L64-K69 WeakPolarHBondContact O-CE 3.33Å
65	T	55.6	Low	49.8	Very low	76 Å²	76	85.2 Å²	85.2	47%	0.466	43%	0.427	S	S	.	.			trans	-67.6	155.6	168.9	63.5	0	0	0	0	110.7	Q67 Q68 K69	T65-Q67 PolarHBondContact O-N 3.07Å; T65-Q67 VanDerWaalsContact O-N 3.15Å; T65-Q68 WeakPolarHBondContact O-CA 3.34Å; T65-Q68 WeakPolarHBondContact O-CB 3.27Å; T65-Q68 PolarHBondContact O-N 3.35Å; T65-Q68 VanDerWaalsContact OG1-CD 3.32Å; T65-Q68 WeakPolarHBondContact OG1-CG 3.34Å; T65-Q68 PolarHBondContact OG1-N 2.95Å; T65-Q68 PolarHBondContact OG1-OE1 3.44Å; T65-K69 PolarHBondContact O-N 3.25Å
66	E	53.8	Low	50.4	Low	114 Å²	114	79.7 Å²	79.7	53%	0.533	41%	0.405	S	S	.	.	H	α-helix	trans	-57.5	-32.1	178.1	-67.2	-56	119.8	0	0	113	K69 A70	E66-K69 IonicContact OE1-NZ 2.69Å; E66-K69 PolarHBondContact OE1-NZ 3.4Å; E66-A70 WeakPolarHBondContact O-CB 3.12Å; E66-A70 PolarHBondContact O-N 3.36Å
67	Q	43.5	Very low	50.6	Low	169 Å²	169	80.4 Å²	80.4	79%	0.79	41%	0.406	S	S	*	.	H	α-helix	trans	-67.4	-36.1	174	-68.9	-179.6	-5.6	0	0	112.5	T65 L71	T65-Q67 PolarHBondContact O-N 3.07Å; T65-Q67 VanDerWaalsContact O-N 3.15Å; Q67-L71 WeakPolarHBondContact O-CB 3.29Å; Q67-L71 PolarHBondContact O-N 3.02Å
68	Q	42.4	Very low	50.7	Low	96 Å²	96	83.3 Å²	83.3	45%	0.449	42%	0.415	S	S	.	.	H	α-helix	trans	-73.8	-37.2	176.7	-72.2	165.6	-45.4	0	0	112.1	L64 T65 L71 Y72	L64-Q68 HydrophobicContact CB-CB 4.21Å; L64-Q68 HydrophobicContact CD2-CB 4.28Å; T65-Q68 WeakPolarHBondContact O-CA 3.34Å; T65-Q68 WeakPolarHBondContact O-CB 3.27Å; T65-Q68 PolarHBondContact O-N 3.35Å; T65-Q68 VanDerWaalsContact OG1-CD 3.32Å; T65-Q68 WeakPolarHBondContact OG1-CG 3.34Å; T65-Q68 PolarHBondContact OG1-N 2.95Å; T65-Q68 PolarHBondContact OG1-OE1 3.44Å; Q68-L71 PolarHBondContact O-N 3.36Å; Q68-Y72 WeakPolarHBondContact O-CB 3.33Å; Q68-Y72 PolarHBondContact O-N 3.33Å
69	K	54.8	Low	50.7	Low	22 Å²	22	79.5 Å²	79.5	10%	0.096	40%	0.395	C	S	.	.	H	α-helix	trans	-64.9	-40.4	173	-66.2	178.4	-175.7	165.3	0	111.7	W61 L64 T65 E66 Y72 R73	W61-K69 HydrophobicContact CD2-CG 4.48Å; W61-K69 HydrophobicContact CH2-CB 3.97Å; W61-K69 HydrophobicContact CH2-CG 3.96Å; W61-K69 HydrophobicContact CZ2-CB 4.1Å; W61-K69 HydrophobicContact CZ2-CD 4.02Å; W61-K69 HydrophobicContact CZ2-CG 3.9Å; W61-K69 HydrophobicContact CZ3-CG 4.27Å; W61-K69 WeakPolarHBondContact O-CE 2.99Å; L64-K69 HydrophobicContact CB-CG 3.77Å; L64-K69 HydrophobicContact CD1-CG 4.34Å; L64-K69 VanDerWaalsContact O-CE 3.29Å; L64-K69 WeakPolarHBondContact O-CE 3.33Å; T65-K69 PolarHBondContact O-N 3.25Å; E66-K69 IonicContact OE1-NZ 2.69Å; E66-K69 PolarHBondContact OE1-NZ 3.4Å; K69-Y72 PolarHBondContact O-N 3.46Å; K69-R73 WeakPolarHBondContact O-CG 3.24Å; K69-R73 PolarHBondContact O-N 2.88Å
70	A	48.2	Very low	50.9	Low	53 Å²	53	74 Å²	74	44%	0.438	37%	0.369	S	S	.	.	H	α-helix	trans	-62.9	-45.7	174.4	0	0	0	0	0	112.1	E66 Y72 R73 E74	E66-A70 WeakPolarHBondContact O-CB 3.12Å; E66-A70 PolarHBondContact O-N 3.36Å; A70-Y72 VanDerWaalsContact C-N 3.34Å; A70-Y72 PolarHBondContact O-N 2.63Å; A70-R73 PolarHBondContact O-N 3.07Å; A70-E74 PolarHBondContact O-N 3.04Å
71	L	46.9	Very low	51.4	Low	102 Å²	102	74.2 Å²	74.2	53%	0.534	37%	0.369	S	S	.	.	H	α-helix	trans	-62	-42.4	175.2	-178.7	63.4	0	0	0	111.6	Q67 Q68 R73 E74 V75	Q67-L71 WeakPolarHBondContact O-CB 3.29Å; Q67-L71 PolarHBondContact O-N 3.02Å; Q68-L71 PolarHBondContact O-N 3.36Å; L71-R73 PolarHBondContact O-N 2.86Å; L71-E74 PolarHBondContact O-N 3.47Å; L71-V75 HydrophobicContact CD1-CG2 4.13Å; L71-V75 HydrophobicContact CG-CG2 4.33Å; L71-V75 WeakPolarHBondContact O-CB 3.27Å; L71-V75 VanDerWaalsContact O-CG2 3.25Å; L71-V75 WeakPolarHBondContact O-CG2 3.35Å; L71-V75 PolarHBondContact O-N 3.36Å
72	Y	51.7	Low	51.3	Low	27 Å²	27	76 Å²	76	11%	0.106	39%	0.385	C	S	.	.	H	α-helix	trans	-59.4	-46	176.2	173.3	-96.3	0	0	0	112.2	I54 F56 W61 Q68 K69 A70 E74 V75 M76 M95 L99	I54-Y72 HydrophobicContact CB-CE2 4.5Å; I54-Y72 WeakPolarHBondContact O-CE2 3.44Å; I54-Y72 PolarHBondContact O-OH 3.49Å; F56-Y72 AromaticContact CD2-CD2 3.78Å; F56-Y72 HydrophobicContact CD2-CD2 3.78Å; F56-Y72 AromaticContact CD2-CE2 3.54Å; F56-Y72 HydrophobicContact CD2-CE2 3.54Å; F56-Y72 HydrophobicContact CD2-CG 4.33Å; F56-Y72 AromaticContact CD2-CZ 3.97Å; F56-Y72 AromaticContact CE2-CD2 3.32Å; F56-Y72 HydrophobicContact CE2-CD2 3.32Å; F56-Y72 AromaticContact CE2-CE2 3.52Å; F56-Y72 HydrophobicContact CE2-CE2 3.52Å; F56-Y72 AromaticContact CE2-CG 3.98Å; F56-Y72 HydrophobicContact CE2-CG 3.98Å; F56-Y72 HydrophobicContact CZ-CD2 4.43Å; W61-Y72 AromaticContact CH2-CD1 3.51Å; W61-Y72 HydrophobicContact CH2-CD1 3.51Å; W61-Y72 AromaticContact CH2-CE1 3.92Å; W61-Y72 HydrophobicContact CH2-CE1 3.92Å; W61-Y72 HydrophobicContact CH2-CG 4.33Å; W61-Y72 AromaticContact CZ3-CD1 3.3Å; W61-Y72 HydrophobicContact CZ3-CD1 3.3Å; W61-Y72 AromaticContact CZ3-CE1 3.57Å; W61-Y72 HydrophobicContact CZ3-CE1 3.57Å; W61-Y72 AromaticContact CZ3-CG 3.84Å; W61-Y72 HydrophobicContact CZ3-CG 3.84Å; Q68-Y72 WeakPolarHBondContact O-CB 3.33Å; Q68-Y72 PolarHBondContact O-N 3.33Å; K69-Y72 PolarHBondContact O-N 3.46Å; A70-Y72 VanDerWaalsContact C-N 3.34Å; A70-Y72 PolarHBondContact O-N 2.63Å; Y72-E74 VanDerWaalsContact C-N 3.34Å; Y72-E74 PolarHBondContact O-N 2.93Å; Y72-V75 PolarHBondContact O-N 3.11Å; Y72-M76 HydrophobicContact CD1-CG 4.26Å; Y72-M76 HydrophobicContact CD2-CE 4.35Å; Y72-M76 HydrophobicContact CD2-CG 4.11Å; Y72-M76 HydrophobicContact CE1-CG 3.96Å; Y72-M76 HydrophobicContact CE2-CE 4.19Å; Y72-M76 HydrophobicContact CE2-CG 3.82Å; Y72-M76 HydrophobicContact CE2-SD 4.27Å; Y72-M76 HydrophobicContact CG-CG 4.37Å; Y72-M76 WeakPolarHBondContact O-CB 3.42Å; Y72-M76 VanDerWaalsContact O-CG 3.32Å; Y72-M76 WeakPolarHBondContact O-CG 3.29Å; Y72-M76 PolarHBondContact O-N 3.04Å; Y72-M95 PolarHBondContact OH-SD 3.23Å; Y72-L99 HydrophobicContact CD1-CD2 4.24Å; Y72-L99 HydrophobicContact CE1-CD1 4.42Å; Y72-L99 HydrophobicContact CE1-CD2 3.96Å
73	R	54.7	Low	51.5	Low	30 Å²	30	69.9 Å²	69.9	11%	0.113	36%	0.358	C	S	.	.	H	α-helix	trans	-58.7	-45.1	175.5	-74.8	168.8	-176.2	170	-2.2	111.7	K69 A70 L71 R77 L99 E102	K69-R73 WeakPolarHBondContact O-CG 3.24Å; K69-R73 PolarHBondContact O-N 2.88Å; A70-R73 PolarHBondContact O-N 3.07Å; L71-R73 PolarHBondContact O-N 2.86Å; R73-R77 VanDerWaalsContact O-CB 3.25Å; R73-R77 WeakPolarHBondContact O-CB 3.29Å; R73-R77 PolarHBondContact O-N 2.82Å; R73-L99 HydrophobicContact CG-CD2 3.65Å; R73-E102 IonicContact CZ-OE2 2.85Å; R73-E102 IonicContact NE-OE2 2.7Å; R73-E102 IonicContact NH2-OE2 3.18Å; R73-E102 PolarHBondContact NH2-OE2 2.92Å
74	E	49.2	Very low	51.4	Low	107 Å²	107	67.4 Å²	67.4	50%	0.5	34%	0.34	S	S	.	.	H	α-helix	trans	-64.9	-43	179.3	-173.6	171.7	-160.7	0	0	112.3	A70 L71 Y72 R77 M78	A70-E74 PolarHBondContact O-N 3.04Å; L71-E74 PolarHBondContact O-N 3.47Å; Y72-E74 VanDerWaalsContact C-N 3.34Å; Y72-E74 PolarHBondContact O-N 2.93Å; E74-R77 PolarHBondContact O-N 3.04Å; E74-M78 WeakPolarHBondContact O-CB 3.45Å; E74-M78 PolarHBondContact O-N 3.33Å
75	V	49.3	Very low	51.6	Low	48 Å²	48	70 Å²	70	29%	0.291	36%	0.361	S	S	.	.	H	α-helix	trans	-67.6	-43.7	178.1	176.1	0	0	0	0	111.1	L71 Y72 R77 M78 N79	L71-V75 HydrophobicContact CD1-CG2 4.13Å; L71-V75 HydrophobicContact CG-CG2 4.33Å; L71-V75 WeakPolarHBondContact O-CB 3.27Å; L71-V75 VanDerWaalsContact O-CG2 3.25Å; L71-V75 WeakPolarHBondContact O-CG2 3.35Å; L71-V75 PolarHBondContact O-N 3.36Å; Y72-V75 PolarHBondContact O-N 3.11Å; V75-R77 VanDerWaalsContact C-N 3.33Å; V75-R77 PolarHBondContact O-N 3.24Å; V75-M78 PolarHBondContact O-N 3.16Å; V75-N79 WeakPolarHBondContact O-CB 3.28Å; V75-N79 PolarHBondContact O-N 2.9Å; V75-N79 PolarHBondContact O-OD1 3.17Å
76	M	64.8	Low	51.4	Low	2 Å²	2	71 Å²	71	1%	0.01	36%	0.363	C	S	.	.	H	α-helix	trans	-65.8	-36.6	177.7	-68.8	-54.3	113.1	0	0	112	A53 I54 Y72 Y80 M95 I96 L99	A53-M76 HydrophobicContact CB-SD 4.12Å; I54-M76 HydrophobicContact CB-CE 4.13Å; I54-M76 HydrophobicContact CG1-CE 4.42Å; Y72-M76 HydrophobicContact CD1-CG 4.26Å; Y72-M76 HydrophobicContact CD2-CE 4.35Å; Y72-M76 HydrophobicContact CD2-CG 4.11Å; Y72-M76 HydrophobicContact CE1-CG 3.96Å; Y72-M76 HydrophobicContact CE2-CE 4.19Å; Y72-M76 HydrophobicContact CE2-CG 3.82Å; Y72-M76 HydrophobicContact CE2-SD 4.27Å; Y72-M76 HydrophobicContact CG-CG 4.37Å; Y72-M76 WeakPolarHBondContact O-CB 3.42Å; Y72-M76 VanDerWaalsContact O-CG 3.32Å; Y72-M76 WeakPolarHBondContact O-CG 3.29Å; Y72-M76 PolarHBondContact O-N 3.04Å; M76-Y80 VanDerWaalsContact O-CB 3.31Å; M76-Y80 WeakPolarHBondContact O-CB 3.25Å; M76-Y80 PolarHBondContact O-N 3.49Å; M76-M95 HydrophobicContact CG-CE 4.36Å; M76-M95 HydrophobicContact SD-CE 3.99Å; M76-I96 HydrophobicContact CB-CD1 4.4Å; M76-I96 WeakPolarHBondContact O-CD1 3.42Å; M76-L99 HydrophobicContact CB-CD1 3.76Å; M76-L99 HydrophobicContact CG-CD1 4.29Å
77	R	51.3	Low	50.7	Low	92 Å²	92	74.2 Å²	74.2	35%	0.347	38%	0.378	S	S	.	.	H	α-helix	trans	-64.4	-46.4	171.7	176.1	176.8	53.9	-154.8	-6.5	112	R73 E74 V75 N79 Y80 E81 E103	R73-R77 VanDerWaalsContact O-CB 3.25Å; R73-R77 WeakPolarHBondContact O-CB 3.29Å; R73-R77 PolarHBondContact O-N 2.82Å; E74-R77 PolarHBondContact O-N 3.04Å; V75-R77 VanDerWaalsContact C-N 3.33Å; V75-R77 PolarHBondContact O-N 3.24Å; R77-N79 VanDerWaalsContact C-N 3.33Å; R77-N79 PolarHBondContact O-N 2.76Å; R77-Y80 WeakPolarHBondContact O-CB 3.5Å; R77-Y80 PolarHBondContact O-N 3.33Å; R77-Y80 VanDerWaalsContact O-N 3.16Å; R77-E81 WeakPolarHBondContact O-CG 3.36Å; R77-E81 PolarHBondContact O-N 3.49Å; R77-E103 IonicContact NH1-OE1 2.68Å; R77-E103 PolarHBondContact NH1-OE1 3.46Å; R77-E103 IonicContact NH1-OE2 2.77Å
78	M	46.8	Very low	50.7	Low	107 Å²	107	73.1 Å²	73.1	53%	0.527	37%	0.37	S	S	.	.	H	α-helix	trans	-66.4	-36.8	179	-171.7	168.4	58.2	0	0	111.8	E74 V75 Y80 E81 T82	E74-M78 WeakPolarHBondContact O-CB 3.45Å; E74-M78 PolarHBondContact O-N 3.33Å; V75-M78 PolarHBondContact O-N 3.16Å; M78-Y80 VanDerWaalsContact C-N 3.33Å; M78-E81 PolarHBondContact O-N 2.57Å; M78-T82 VanDerWaalsContact O-CB 3.29Å; M78-T82 WeakPolarHBondContact O-CB 3.28Å; M78-T82 PolarHBondContact O-N 3.3Å; M78-T82 PolarHBondContact O-OG1 3.46Å
79	N	51.1	Low	50.6	Low	38 Å²	38	74.9 Å²	74.9	20%	0.203	39%	0.39	C	S	.	.	H	α-helix	trans	-62.5	-43	171.9	-72.7	-6.5	0	0	0	110.7	F49 V52 V75 R77 T82 V83	F49-N79 HydrophobicContact CE2-CB 4.48Å; V52-N79 HydrophobicContact CG2-CB 4.14Å; V52-N79 PolarHBondContact O-ND2 3.34Å; V75-N79 WeakPolarHBondContact O-CB 3.28Å; V75-N79 PolarHBondContact O-N 2.9Å; V75-N79 PolarHBondContact O-OD1 3.17Å; R77-N79 VanDerWaalsContact C-N 3.33Å; R77-N79 PolarHBondContact O-N 2.76Å; N79-T82 PolarHBondContact O-N 3.18Å; N79-V83 VanDerWaalsContact O-CG2 3.28Å; N79-V83 WeakPolarHBondContact O-CG2 3.4Å; N79-V83 PolarHBondContact O-N 3.46Å
80	Y	52.6	Low	50.3	Low	22 Å²	22	76.3 Å²	76.3	9%	0.086	40%	0.396	C	S	.	.	H	α-helix	trans	-63.1	-45.8	175.7	179.2	-115.1	0	0	0	113	F49 M76 R77 M78 T82 V83 L84 F90 P93 I96	F49-Y80 HydrophobicContact CE2-CD2 4.34Å; M76-Y80 VanDerWaalsContact O-CB 3.31Å; M76-Y80 WeakPolarHBondContact O-CB 3.25Å; M76-Y80 PolarHBondContact O-N 3.49Å; R77-Y80 WeakPolarHBondContact O-CB 3.5Å; R77-Y80 PolarHBondContact O-N 3.33Å; R77-Y80 VanDerWaalsContact O-N 3.16Å; M78-Y80 VanDerWaalsContact C-N 3.33Å; Y80-T82 VanDerWaalsContact C-N 3.32Å; Y80-T82 PolarHBondContact O-N 2.88Å; Y80-V83 PolarHBondContact O-N 2.75Å; Y80-L84 HydrophobicContact CD1-CD1 3.69Å; Y80-L84 HydrophobicContact CD1-CG 4.49Å; Y80-L84 HydrophobicContact CE1-CD1 3.31Å; Y80-L84 HydrophobicContact CE1-CG 4.13Å; Y80-L84 HydrophobicContact CE2-CD1 4.35Å; Y80-L84 HydrophobicContact CE2-CG 4.3Å; Y80-L84 HydrophobicContact CG-CD1 4.35Å; Y80-L84 WeakPolarHBondContact O-CB 3.27Å; Y80-L84 WeakPolarHBondContact O-CG 3.36Å; Y80-L84 PolarHBondContact O-N 3.18Å; Y80-F90 HydrophobicContact CD2-CE2 4.5Å; Y80-F90 HydrophobicContact CD2-CZ 4.3Å; Y80-F90 AromaticContact CE2-CE2 3.36Å; Y80-F90 HydrophobicContact CE2-CE2 3.36Å; Y80-F90 AromaticContact CE2-CZ 3.41Å; Y80-F90 HydrophobicContact CE2-CZ 3.41Å; Y80-F90 VanDerWaalsContact CE2-CZ 3.41Å; Y80-F90 AromaticContact CZ-CE2 3.72Å; Y80-F90 AromaticContact CZ-CZ 3.81Å; Y80-F90 VanDerWaalsContact OH-CE2 3.28Å; Y80-F90 WeakPolarHBondContact OH-CE2 3.49Å; Y80-P93 HydrophobicContact CD2-CG 4.19Å; Y80-P93 HydrophobicContact CE2-CG 3.98Å; Y80-I96 HydrophobicContact CD1-CD1 4.45Å; Y80-I96 HydrophobicContact CD1-CG1 4.33Å; Y80-I96 HydrophobicContact CD1-CG2 3.86Å; Y80-I96 HydrophobicContact CD2-CD1 4.43Å; Y80-I96 HydrophobicContact CD2-CG1 3.85Å; Y80-I96 HydrophobicContact CE1-CG2 3.98Å; Y80-I96 HydrophobicContact CE2-CG1 4.45Å; Y80-I96 HydrophobicContact CG-CD1 3.93Å; Y80-I96 HydrophobicContact CG-CG1 3.79Å; Y80-I96 HydrophobicContact CG-CG2 4.19Å
81	E	54.8	Low	50.3	Low	110 Å²	110	79.4 Å²	79.4	51%	0.514	41%	0.412	S	S	.	.	H	α-helix	trans	-63.9	-36.6	175.5	-73.2	176.7	-175.6	0	0	112.4	R77 M78 L84 S85	R77-E81 WeakPolarHBondContact O-CG 3.36Å; R77-E81 PolarHBondContact O-N 3.49Å; M78-E81 PolarHBondContact O-N 2.57Å; E81-L84 WeakPolarHBondContact O-CB 3.26Å; E81-L84 PolarHBondContact O-N 3.25Å; E81-S85 PolarHBondContact O-N 3.18Å
82	T	54.3	Low	50.4	Low	80 Å²	80	78.5 Å²	78.5	49%	0.491	40%	0.404	S	S	.	.	H	α-helix	trans	-65.4	-43	174.8	-59.4	0	0	0	0	110.7	M78 N79 Y80 S85	M78-T82 VanDerWaalsContact O-CB 3.29Å; M78-T82 WeakPolarHBondContact O-CB 3.28Å; M78-T82 PolarHBondContact O-N 3.3Å; M78-T82 PolarHBondContact O-OG1 3.46Å; N79-T82 PolarHBondContact O-N 3.18Å; Y80-T82 VanDerWaalsContact C-N 3.32Å; Y80-T82 PolarHBondContact O-N 2.88Å; T82-S85 PolarHBondContact O-N 2.86Å; T82-S85 PolarHBondContact O-OG 3.46Å
83	V	54.4	Low	50.6	Low	17 Å²	17	78.8 Å²	78.8	10%	0.103	41%	0.409	C	S	.	.	H	α-helix	trans	-67.4	-36.5	174.8	174	0	0	0	0	111.3	V52 N79 Y80 S85 L86	V52-V83 HydrophobicContact CG2-CG2 4.38Å; N79-V83 VanDerWaalsContact O-CG2 3.28Å; N79-V83 WeakPolarHBondContact O-CG2 3.4Å; N79-V83 PolarHBondContact O-N 3.46Å; Y80-V83 PolarHBondContact O-N 2.75Å; V83-S85 VanDerWaalsContact C-N 3.33Å; V83-S85 PolarHBondContact O-N 3.44Å; V83-L86 WeakPolarHBondContact O-CB 3.46Å; V83-L86 PolarHBondContact O-N 2.93Å
84	L	50.4	Low	50.6	Low	74 Å²	74	83.9 Å²	83.9	39%	0.387	44%	0.438	S	S	.	.	H	α-helix	trans	-61.8	-36.3	172.5	-81.6	167.6	0	0	0	113.2	Y80 E81 L86 E87 F90	Y80-L84 HydrophobicContact CD1-CD1 3.69Å; Y80-L84 HydrophobicContact CD1-CG 4.49Å; Y80-L84 HydrophobicContact CE1-CD1 3.31Å; Y80-L84 HydrophobicContact CE1-CG 4.13Å; Y80-L84 HydrophobicContact CE2-CD1 4.35Å; Y80-L84 HydrophobicContact CE2-CG 4.3Å; Y80-L84 HydrophobicContact CG-CD1 4.35Å; Y80-L84 WeakPolarHBondContact O-CB 3.27Å; Y80-L84 WeakPolarHBondContact O-CG 3.36Å; Y80-L84 PolarHBondContact O-N 3.18Å; E81-L84 WeakPolarHBondContact O-CB 3.26Å; E81-L84 PolarHBondContact O-N 3.25Å; L84-L86 PolarHBondContact O-N 3.46Å; L84-E87 PolarHBondContact O-N 3.3Å; L84-F90 HydrophobicContact CD2-CD1 4.41Å; L84-F90 HydrophobicContact CD2-CE1 3.33Å; L84-F90 HydrophobicContact CD2-CE2 4.04Å; L84-F90 HydrophobicContact CD2-CZ 3.1Å; L84-F90 HydrophobicContact CG-CE1 3.92Å; L84-F90 HydrophobicContact CG-CZ 3.53Å
85	S	53.8	Low	51.1	Low	85 Å²	85	80.2 Å²	80.2	59%	0.594	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-5.7	-179	78.4	0	0	0	0	114.4	E81 T82 V83 E87	E81-S85 PolarHBondContact O-N 3.18Å; T82-S85 PolarHBondContact O-N 2.86Å; T82-S85 PolarHBondContact O-OG 3.46Å; V83-S85 VanDerWaalsContact C-N 3.33Å; V83-S85 PolarHBondContact O-N 3.44Å; S85-E87 VanDerWaalsContact C-N 3.31Å
86	L	50.5	Low	51.8	Low	97 Å²	97	78.2 Å²	78.2	51%	0.508	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87	8.1	178.1	-57.6	174.2	0	0	0	113.7	L48 V83 L84 F88	L48-L86 HydrophobicContact CD2-CD1 4.26Å; V83-L86 WeakPolarHBondContact O-CB 3.46Å; V83-L86 PolarHBondContact O-N 2.93Å; L84-L86 PolarHBondContact O-N 3.46Å; L86-F88 WeakPolarHBondContact O-CD2 3.44Å; L86-F88 WeakPolarHBondContact O-CE2 3.33Å
87	E	39.3	Very low	51.8	Low	180 Å²	180	81.4 Å²	81.4	84%	0.841	43%	0.429	S	S	*	.			trans	57.8	51	170.6	-65.2	-173.4	170.5	0	0	116.5	L84 S85	L84-E87 PolarHBondContact O-N 3.3Å; S85-E87 VanDerWaalsContact C-N 3.31Å
88	F	44	Very low	52.4	Low	146 Å²	146	85 Å²	85	64%	0.64	44%	0.442	S	S	*	.			trans	-122.3	137.6	168.6	-67.9	-82.7	0	0	0	111.7	L86 F90	L86-F88 WeakPolarHBondContact O-CD2 3.44Å; L86-F88 WeakPolarHBondContact O-CE2 3.33Å; F88-F90 VanDerWaalsContact O-CD1 3.29Å; F88-F90 WeakPolarHBondContact O-CD1 3.34Å; F88-F90 PolarHBondContact O-N 2.76Å
89	P	39.7	Very low	53.3	Low	133 Å²	133	80.6 Å²	80.6	86%	0.864	42%	0.421	S	S	*	.			trans	-75.8	122.9	173.6	29.5	-30.4	0	0	0	109.9
90	F	49.1	Very low	53.7	Low	52 Å²	52	82.1 Å²	82.1	23%	0.228	43%	0.427	C	S	.	.			trans	-144	158	-179.4	67.2	-107.4	0	0	0	112.4	Y80 L84 F88	Y80-F90 HydrophobicContact CD2-CE2 4.5Å; Y80-F90 HydrophobicContact CD2-CZ 4.3Å; Y80-F90 AromaticContact CE2-CE2 3.36Å; Y80-F90 HydrophobicContact CE2-CE2 3.36Å; Y80-F90 AromaticContact CE2-CZ 3.41Å; Y80-F90 HydrophobicContact CE2-CZ 3.41Å; Y80-F90 VanDerWaalsContact CE2-CZ 3.41Å; Y80-F90 AromaticContact CZ-CE2 3.72Å; Y80-F90 AromaticContact CZ-CZ 3.81Å; Y80-F90 VanDerWaalsContact OH-CE2 3.28Å; Y80-F90 WeakPolarHBondContact OH-CE2 3.49Å; L84-F90 HydrophobicContact CD2-CD1 4.41Å; L84-F90 HydrophobicContact CD2-CE1 3.33Å; L84-F90 HydrophobicContact CD2-CE2 4.04Å; L84-F90 HydrophobicContact CD2-CZ 3.1Å; L84-F90 HydrophobicContact CG-CE1 3.92Å; L84-F90 HydrophobicContact CG-CZ 3.53Å; F88-F90 VanDerWaalsContact O-CD1 3.29Å; F88-F90 WeakPolarHBondContact O-CD1 3.34Å; F88-F90 PolarHBondContact O-N 2.76Å
91	P	47.1	Very low	53.5	Low	118 Å²	118	82.5 Å²	82.5	77%	0.766	44%	0.438	S	S	*	.	P	Polyproline II helix	trans	-78.6	134.4	170.6	29.5	-30.9	0	0	0	112.2
92	K	48.9	Very low	53.3	Low	84 Å²	84	79.9 Å²	79.9	37%	0.365	43%	0.425	S	S	.	.	P	Polyproline II helix	trans	-56.1	128.2	-176.4	-166.4	167.1	-152.4	166.6	0	112	I96 E100	K92-I96 HydrophobicContact CD-CG2 4.36Å; K92-I96 HydrophobicContact CG-CB 4.37Å; K92-I96 HydrophobicContact CG-CG2 4.12Å; K92-E100 WeakPolarHBondContact CE-OE1 3.49Å; K92-E100 WeakPolarHBondContact CE-OE2 3.43Å; K92-E100 IonicContact NZ-OE1 2.94Å; K92-E100 PolarHBondContact NZ-OE1 3.38Å; K92-E100 IonicContact NZ-OE2 2.67Å; K92-E100 PolarHBondContact NZ-OE2 3.21Å
93	P	57.3	Low	53	Low	33 Å²	33	79.8 Å²	79.8	21%	0.214	42%	0.42	C	S	.	.	P	Polyproline II helix	trans	-60.1	137.8	179.8	-23.3	32.3	0	0	0	112.2	F49 Y80 M95 I96 T97	F49-P93 HydrophobicContact CD1-CB 4.21Å; F49-P93 HydrophobicContact CD1-CG 4.13Å; F49-P93 HydrophobicContact CE1-CB 4.16Å; F49-P93 HydrophobicContact CE1-CG 4.31Å; F49-P93 HydrophobicContact CG-CG 4.43Å; Y80-P93 HydrophobicContact CD2-CG 4.19Å; Y80-P93 HydrophobicContact CE2-CG 3.98Å; P93-M95 PolarHBondContact O-N 3.33Å; P93-M95 VanDerWaalsContact O-N 3.11Å; P93-I96 HydrophobicContact CB-CG1 4.32Å; P93-I96 HydrophobicContact CG-CG1 4.37Å; P93-I96 PolarHBondContact O-N 3.3Å; P93-T97 PolarHBondContact O-N 2.67Å; P93-T97 PolarHBondContact O-OG1 3Å; P93-T97 VanDerWaalsContact O-OG1 3.09Å
94	D	53.3	Low	52.2	Low	136 Å²	136	86.1 Å²	86.1	73%	0.727	45%	0.448	S	S	*	.	H	α-helix	trans	-54.2	-34.2	-179.4	-71.1	-15.5	0	0	0	112.9	T97 R98	D94-T97 PolarHBondContact O-N 3.41Å; D94-R98 WeakPolarHBondContact O-CB 3.46Å; D94-R98 VanDerWaalsContact O-CG 3.3Å; D94-R98 WeakPolarHBondContact O-CG 3.29Å; D94-R98 PolarHBondContact O-N 2.96Å
95	M	59.8	Low	51.6	Low	31 Å²	31	85.1 Å²	85.1	15%	0.153	45%	0.447	C	S	.	.	H	α-helix	trans	-64.5	-43.3	174.8	-178.1	174.1	64.1	0	0	112.4	F49 A53 Y55 Y72 M76 P93 T97 R98 L99	F49-M95 HydrophobicContact CD1-CE 4.44Å; F49-M95 HydrophobicContact CE1-CE 3.31Å; F49-M95 HydrophobicContact CZ-CE 3.6Å; A53-M95 HydrophobicContact CB-CE 3.71Å; Y55-M95 HydrophobicContact CD1-CE 4.42Å; Y55-M95 HydrophobicContact CD1-SD 3.66Å; Y55-M95 HydrophobicContact CE1-CE 3.72Å; Y55-M95 HydrophobicContact CE1-SD 3.35Å; Y55-M95 WeakPolarHBondContact CE1-SD 3.36Å; Y72-M95 PolarHBondContact OH-SD 3.23Å; M76-M95 HydrophobicContact CG-CE 4.36Å; M76-M95 HydrophobicContact SD-CE 3.99Å; P93-M95 PolarHBondContact O-N 3.33Å; P93-M95 VanDerWaalsContact O-N 3.11Å; M95-T97 VanDerWaalsContact C-N 3.34Å; M95-R98 PolarHBondContact O-N 3.49Å; M95-L99 HydrophobicContact CG-CD1 4.08Å; M95-L99 HydrophobicContact CG-CG 4.48Å; M95-L99 VanDerWaalsContact O-CG 3.25Å; M95-L99 WeakPolarHBondContact O-CG 2.94Å; M95-L99 PolarHBondContact O-N 3.36Å
96	I	65.4	Low	51	Low	5 Å²	5	85.6 Å²	85.6	3%	0.026	44%	0.44	C	S	.	.	H	α-helix	trans	-66.6	-40.8	176.5	-64.4	-67.1	0	0	0	109.9	F49 M76 Y80 K92 P93 R98 L99 E100	F49-I96 HydrophobicContact CE1-CG1 4.27Å; F49-I96 HydrophobicContact CE2-CD1 4.26Å; F49-I96 HydrophobicContact CE2-CG1 4.34Å; F49-I96 HydrophobicContact CZ-CD1 3.73Å; F49-I96 HydrophobicContact CZ-CG1 3.72Å; M76-I96 HydrophobicContact CB-CD1 4.4Å; M76-I96 WeakPolarHBondContact O-CD1 3.42Å; Y80-I96 HydrophobicContact CD1-CD1 4.45Å; Y80-I96 HydrophobicContact CD1-CG1 4.33Å; Y80-I96 HydrophobicContact CD1-CG2 3.86Å; Y80-I96 HydrophobicContact CD2-CD1 4.43Å; Y80-I96 HydrophobicContact CD2-CG1 3.85Å; Y80-I96 HydrophobicContact CE1-CG2 3.98Å; Y80-I96 HydrophobicContact CE2-CG1 4.45Å; Y80-I96 HydrophobicContact CG-CD1 3.93Å; Y80-I96 HydrophobicContact CG-CG1 3.79Å; Y80-I96 HydrophobicContact CG-CG2 4.19Å; K92-I96 HydrophobicContact CD-CG2 4.36Å; K92-I96 HydrophobicContact CG-CB 4.37Å; K92-I96 HydrophobicContact CG-CG2 4.12Å; P93-I96 HydrophobicContact CB-CG1 4.32Å; P93-I96 HydrophobicContact CG-CG1 4.37Å; P93-I96 PolarHBondContact O-N 3.3Å; I96-R98 VanDerWaalsContact C-N 3.28Å; I96-R98 PolarHBondContact O-N 2.9Å; I96-L99 HydrophobicContact CD1-CD1 4.34Å; I96-L99 PolarHBondContact O-N 3.27Å; I96-E100 HydrophobicContact CG2-CG 4.39Å; I96-E100 WeakPolarHBondContact O-CB 3.34Å; I96-E100 WeakPolarHBondContact O-CG 3.36Å; I96-E100 PolarHBondContact O-N 2.95Å
97	T	64.5	Low	50.2	Low	69 Å²	69	85.2 Å²	85.2	42%	0.423	44%	0.439	S	S	.	.	H	α-helix	trans	-60.4	-36.9	174.9	-45.6	0	0	0	0	112	P93 D94 M95 G101	P93-T97 PolarHBondContact O-N 2.67Å; P93-T97 PolarHBondContact O-OG1 3Å; P93-T97 VanDerWaalsContact O-OG1 3.09Å; D94-T97 PolarHBondContact O-N 3.41Å; M95-T97 VanDerWaalsContact C-N 3.34Å; T97-G101 PolarHBondContact O-N 3.43Å
98	R	63	Low	50	Low	167 Å²	167	78.9 Å²	78.9	63%	0.63	41%	0.414	S	S	*	.	H	α-helix	trans	-69	-43.6	173.3	-74.6	174.1	66.8	178.6	0.3	112.5	D94 M95 I96 E100 G101 E102	D94-R98 WeakPolarHBondContact O-CB 3.46Å; D94-R98 VanDerWaalsContact O-CG 3.3Å; D94-R98 WeakPolarHBondContact O-CG 3.29Å; D94-R98 PolarHBondContact O-N 2.96Å; M95-R98 PolarHBondContact O-N 3.49Å; I96-R98 VanDerWaalsContact C-N 3.28Å; I96-R98 PolarHBondContact O-N 2.9Å; R98-E100 VanDerWaalsContact C-N 3.31Å; R98-E100 PolarHBondContact O-N 3.17Å; R98-G101 PolarHBondContact O-N 3.32Å; R98-E102 WeakPolarHBondContact O-CB 3.47Å; R98-E102 WeakPolarHBondContact O-CG 3.35Å; R98-E102 PolarHBondContact O-N 2.8Å
99	L	65.1	Low	49.4	Very low	16 Å²	16	76.8 Å²	76.8	8%	0.084	41%	0.41	C	S	.	.	H	α-helix	trans	-64.8	-36.1	179.2	-67.1	167.1	0	0	0	112	Y72 R73 M76 M95 I96 E103	Y72-L99 HydrophobicContact CD1-CD2 4.24Å; Y72-L99 HydrophobicContact CE1-CD1 4.42Å; Y72-L99 HydrophobicContact CE1-CD2 3.96Å; R73-L99 HydrophobicContact CG-CD2 3.65Å; M76-L99 HydrophobicContact CB-CD1 3.76Å; M76-L99 HydrophobicContact CG-CD1 4.29Å; M95-L99 HydrophobicContact CG-CD1 4.08Å; M95-L99 HydrophobicContact CG-CG 4.48Å; M95-L99 VanDerWaalsContact O-CG 3.25Å; M95-L99 WeakPolarHBondContact O-CG 2.94Å; M95-L99 PolarHBondContact O-N 3.36Å; I96-L99 HydrophobicContact CD1-CD1 4.34Å; I96-L99 PolarHBondContact O-N 3.27Å; L99-E103 PolarHBondContact O-N 3.48Å
100	E	60.7	Low	49	Very low	70 Å²	70	77.1 Å²	77.1	33%	0.327	40%	0.4	S	S	.	.	H	α-helix	trans	-75.2	-36.9	174.2	-69.2	175.1	168.8	0	0	112.8	K92 I96 R98 E102 E103 E104	K92-E100 WeakPolarHBondContact CE-OE1 3.49Å; K92-E100 WeakPolarHBondContact CE-OE2 3.43Å; K92-E100 IonicContact NZ-OE1 2.94Å; K92-E100 PolarHBondContact NZ-OE1 3.38Å; K92-E100 IonicContact NZ-OE2 2.67Å; K92-E100 PolarHBondContact NZ-OE2 3.21Å; I96-E100 HydrophobicContact CG2-CG 4.39Å; I96-E100 WeakPolarHBondContact O-CB 3.34Å; I96-E100 WeakPolarHBondContact O-CG 3.36Å; I96-E100 PolarHBondContact O-N 2.95Å; R98-E100 VanDerWaalsContact C-N 3.31Å; R98-E100 PolarHBondContact O-N 3.17Å; E100-E102 VanDerWaalsContact C-N 3.27Å; E100-E102 PolarHBondContact O-N 3.43Å; E100-E103 PolarHBondContact O-N 2.95Å; E100-E104 PolarHBondContact O-N 3.39Å
101	G	49	Very low	48.1	Very low	30 Å²	30	84.5 Å²	84.5	31%	0.309	43%	0.426	S	S	.	.	H	α-helix	trans	-66.2	-27.5	172.2	0	0	0	0	0	113.4	T97 R98 S105	T97-G101 PolarHBondContact O-N 3.43Å; R98-G101 PolarHBondContact O-N 3.32Å; G101-S105 WeakPolarHBondContact O-CB 3.3Å; G101-S105 PolarHBondContact O-N 3.31Å; G101-S105 PolarHBondContact O-OG 2.81Å
102	E	50	Low	47.2	Very low	54 Å²	54	86.2 Å²	86.2	25%	0.252	42%	0.424	S	S	.	.	H	α-helix	trans	-74	-35	171.4	-76.5	177.2	-161.2	0	0	112.3	R73 R98 E100 S105 Q106	R73-E102 IonicContact CZ-OE2 2.85Å; R73-E102 IonicContact NE-OE2 2.7Å; R73-E102 IonicContact NH2-OE2 3.18Å; R73-E102 PolarHBondContact NH2-OE2 2.92Å; R98-E102 WeakPolarHBondContact O-CB 3.47Å; R98-E102 WeakPolarHBondContact O-CG 3.35Å; R98-E102 PolarHBondContact O-N 2.8Å; E100-E102 VanDerWaalsContact C-N 3.27Å; E100-E102 PolarHBondContact O-N 3.43Å; E102-S105 VanDerWaalsContact CA-OG 3.25Å; E102-S105 WeakPolarHBondContact CA-OG 3.33Å; E102-S105 PolarHBondContact O-OG 3.06Å; E102-Q106 WeakPolarHBondContact O-CB 3.11Å; E102-Q106 VanDerWaalsContact O-CG 3.3Å; E102-Q106 WeakPolarHBondContact O-CG 3.48Å; E102-Q106 PolarHBondContact O-N 3.01Å
103	E	47.6	Very low	46.4	Very low	79 Å²	79	89 Å²	89	37%	0.369	44%	0.442	S	S	.	.	H	α-helix	trans	-69.6	-34.8	169.7	-85.8	-175.5	163.4	0	0	112	R77 L99 E100 N107	R77-E103 IonicContact NH1-OE1 2.68Å; R77-E103 PolarHBondContact NH1-OE1 3.46Å; R77-E103 IonicContact NH1-OE2 2.77Å; L99-E103 PolarHBondContact O-N 3.48Å; E100-E103 PolarHBondContact O-N 2.95Å; E103-N107 WeakPolarHBondContact O-CB 3.47Å; E103-N107 PolarHBondContact O-N 2.91Å
104	E	38.7	Very low	44.9	Very low	150 Å²	150	96 Å²	96	70%	0.701	47%	0.471	S	S	*	.	H	α-helix	trans	-72.5	-33.7	173.6	-83.3	-173.5	163.2	0	0	113.2	E100 S108	E100-E104 PolarHBondContact O-N 3.39Å; E104-S108 WeakPolarHBondContact O-CA 3.39Å; E104-S108 WeakPolarHBondContact O-CB 3.46Å; E104-S108 PolarHBondContact O-N 3.33Å
105	S	37.4	Very low	43.6	Very low	53 Å²	53	93.3 Å²	93.3	37%	0.371	48%	0.476	S	S	.	.	H	α-helix	trans	-75.7	-35.5	173.8	45.2	0	0	0	0	112.5	G101 E102 S108 D109	G101-S105 WeakPolarHBondContact O-CB 3.3Å; G101-S105 PolarHBondContact O-N 3.31Å; G101-S105 PolarHBondContact O-OG 2.81Å; E102-S105 VanDerWaalsContact CA-OG 3.25Å; E102-S105 WeakPolarHBondContact CA-OG 3.33Å; E102-S105 PolarHBondContact O-OG 3.06Å; S105-S108 PolarHBondContact O-N 2.98Å; S105-D109 WeakPolarHBondContact O-CB 3.48Å; S105-D109 PolarHBondContact O-N 3.24Å
106	Q	41	Very low	41.8	Very low	95 Å²	95	95.3 Å²	95.3	44%	0.444	50%	0.504	S	S	.	.	H	α-helix	trans	-68.9	-33.5	170.2	-73.3	-176.8	-35.6	0	0	112.9	E102 E110	E102-Q106 WeakPolarHBondContact O-CB 3.11Å; E102-Q106 VanDerWaalsContact O-CG 3.3Å; E102-Q106 WeakPolarHBondContact O-CG 3.48Å; E102-Q106 PolarHBondContact O-N 3.01Å; Q106-E110 PolarHBondContact O-N 2.92Å
107	N	33.6	Very low	39.9	Very low	89 Å²	89	101.2 Å²	101.2	48%	0.476	54%	0.541	S	S	.	.	H	α-helix	trans	-73.7	-36.5	169.2	-102.4	-58.1	0	0	0	112.4	E103 E110 W111	E103-N107 WeakPolarHBondContact O-CB 3.47Å; E103-N107 PolarHBondContact O-N 2.91Å; N107-E110 PolarHBondContact O-N 3.2Å; N107-W111 PolarHBondContact O-N 2.72Å; N107-W111 VanDerWaalsContact O-N 3.11Å
108	S	33.8	Very low	37.9	Very low	46 Å²	46	103.3 Å²	103.3	32%	0.322	56%	0.558	S	S	.	*	H	α-helix	trans	-64.5	-39.8	176.6	160.6	0	0	0	0	112	E104 S105 E110 W111 Q112	E104-S108 WeakPolarHBondContact O-CA 3.39Å; E104-S108 WeakPolarHBondContact O-CB 3.46Å; E104-S108 PolarHBondContact O-N 3.33Å; S105-S108 PolarHBondContact O-N 2.98Å; S108-E110 VanDerWaalsContact C-N 3.25Å; S108-E110 PolarHBondContact O-N 3.15Å; S108-W111 CarbonylContact O-C 3.52Å; S108-W111 PolarHBondContact O-N 2.69Å; S108-W111 VanDerWaalsContact O-N 3.16Å; S108-Q112 WeakPolarHBondContact O-CG 3.28Å; S108-Q112 PolarHBondContact O-N 2.85Å
109	D	32.3	Very low	36.1	Very low	103 Å²	103	99.6 Å²	99.6	55%	0.551	56%	0.563	S	S	*	*	H	α-helix	trans	-70.7	-23.4	177.7	-70.8	-14.3	0	0	0	112	S105	S105-D109 WeakPolarHBondContact O-CB 3.48Å; S105-D109 PolarHBondContact O-N 3.24Å
110	E	32.2	Very low	34.2	Very low	140 Å²	140	107 Å²	107	65%	0.654	60%	0.598	S	S	*	*	H	α-helix	trans	-77.8	-29.5	169.9	-161.5	169.6	-173.1	0	0	112.2	Q106 N107 S108	Q106-E110 PolarHBondContact O-N 2.92Å; N107-E110 PolarHBondContact O-N 3.2Å; S108-E110 VanDerWaalsContact C-N 3.25Å; S108-E110 PolarHBondContact O-N 3.15Å
111	W	28.7	Very low	32.5	Very low	207 Å²	207	110.1 Å²	110.1	78%	0.784	62%	0.616	S	S	*	*	H	α-helix	trans	-92.1	-5.5	177.2	-71.2	108.5	0	0	0	115.6	N107 S108	N107-W111 PolarHBondContact O-N 2.72Å; N107-W111 VanDerWaalsContact O-N 3.11Å; S108-W111 CarbonylContact O-C 3.52Å; S108-W111 PolarHBondContact O-N 2.69Å; S108-W111 VanDerWaalsContact O-N 3.16Å
112	Q	29.1	Very low	31.6	Very low	153 Å²	153	116.9 Å²	116.9	72%	0.715	64%	0.64	S	S	*	*	S	Bend	trans	-95.6	-1.1	173.4	-73.9	-177.3	15.6	0	0	114.5	S108	S108-Q112 WeakPolarHBondContact O-CG 3.28Å; S108-Q112 PolarHBondContact O-N 2.85Å
113	L	31.6	Very low	30.7	Very low	143 Å²	143	123.3 Å²	123.3	75%	0.749	67%	0.67	S	S	*	*	S	Bend	trans	-105.7	7	-179.7	-96.5	158.6	0	0	0	115.7
114	H	27.1	Very low	29.7	Very low	180 Å²	180	125.1 Å²	125.1	83%	0.833	69%	0.691	S	S	*	*	S	Bend	trans	-134.9	93.1	170.1	-77.6	-29.3	0	0	0	113.8
115	G	25.5	Very low	29.4	Very low	79 Å²	79	125.2 Å²	125.2	81%	0.814	70%	0.697	S	S	*	*			trans	94.2	93.8	138	0	0	0	0	0	117.2
116	G	22.6	Very low	28.9	Very low	73 Å²	73	128.9 Å²	128.9	75%	0.753	72%	0.716	S	S	*	*			trans	-65.6	142.2	149.8	0	0	0	0	0	110.6
117	T	24.4	Very low	28.3	Very low	130 Å²	130	133.6 Å²	133.6	80%	0.798	74%	0.735	S	S	*	*				168.2	115.1	117.4	-56.4	0	0	0	0	109.8
118	S	22.1	Very low	28	Very low	112 Å²	112	134.7 Å²	134.7	78%	0.783	75%	0.748	S	S	*	*			trans	57.8	130.1	143.2	-51.6	0	0	0	0	124.4
119	A	25.3	Very low	27.8	Very low	90 Å²	90	138.1 Å²	138.1	74%	0.744	77%	0.769	S	S	*	*				106.1	104.9	129.8	0	0	0	0	0	119.1
120	E	25.6	Very low	27.5	Very low	171 Å²	171	141 Å²	141	80%	0.799	78%	0.784	S	S	*	*				63.6	121.4	126.9	-63.4	-178	179.7	0	0	121.8
121	N	25.7	Very low	27.2	Very low	135 Å²	135	145.8 Å²	145.8	72%	0.722	80%	0.796	S	S	*	*			trans	94.7	131.3	132.4	-72.7	-6.1	0	0	0	122.4
122	E	29.1	Very low	27.3	Very low	173 Å²	173	141.6 Å²	141.6	81%	0.808	80%	0.796	S	S	*	*			trans	81.2	101.1	142.9	-71.3	-179.7	-170	0	0	121.3
123	E	30.6	Very low	27.3	Very low	188 Å²	188	143.2 Å²	143.2	88%	0.879	80%	0.803	S	S	*	*				17.2	114.3	119.5	-165.1	164.3	-160.6	0	0	118.1
124	S	28.2	Very low	27.2	Very low	117 Å²	117	142.3 Å²	142.3	82%	0.818	81%	0.806	S	S	*	*				-178.8	145.4	130	41.8	0	0	0	0	114.3
125	D	31	Very low	27.1	Very low	153 Å²	153	142.9 Å²	142.9	82%	0.818	81%	0.811	S	S	*	*			trans	-32.5	146.2	163.9	-137.5	-17.1	0	0	0	116.6
126	V	27.1	Very low	27.2	Very low	129 Å²	129	147.2 Å²	147.2	78%	0.782	82%	0.816	S	S	*	*			trans	157.4	114.5	136.9	166.3	0	0	0	0	113.8
127	K	28.3	Very low	27.3	Very low	194 Å²	194	148 Å²	148	84%	0.843	82%	0.815	S	S	*	*			trans	44.4	141.7	149	-80.3	-176	173.1	-179.8	0	124.5
128	P	27.9	Very low	27.4	Very low	113 Å²	113	147.9 Å²	147.9	73%	0.734	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-82.4	152.6	173.1	35.6	-33	0	0	0	112.6
129	P	28.7	Very low	27.7	Very low	117 Å²	117	148.2 Å²	148.2	76%	0.76	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-84.1	146.6	173.7	-1	19.6	0	0	0	113.1
130	D	26	Very low	27.7	Very low	163 Å²	163	152.8 Å²	152.8	87%	0.872	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-65.3	136	-179.2	-70.5	-51.5	0	0	0	114.5
131	W	26.7	Very low	27.6	Very low	241 Å²	241	154.1 Å²	154.1	91%	0.913	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-95.7	125.4	167.1	-64.7	100.5	0	0	0	110.5
132	P	31	Very low	27.6	Very low	120 Å²	120	153.4 Å²	153.4	78%	0.779	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-80.9	133.4	174	30.5	-29.6	0	0	0	111.5
133	H	28.2	Very low	27.4	Very low	186 Å²	186	153.8 Å²	153.8	86%	0.861	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-61.8	144.1	170.7	-69.6	-70	0	0	0	112.5
134	P	29.7	Very low	27.3	Very low	125 Å²	125	150.9 Å²	150.9	81%	0.812	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-87.3	130.1	172	31.2	-28.8	0	0	0	112.1
135	M	25.4	Very low	27.2	Very low	192 Å²	192	153.8 Å²	153.8	95%	0.946	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-98.8	141.8	162.2	-80.7	-167	178.3	0	0	110.9
136	N	27.8	Very low	26.9	Very low	169 Å²	169	153.8 Å²	153.8	90%	0.904	82%	0.824	S	S	*	*			trans	-44.8	139.9	174.5	-72.6	-36.2	0	0	0	115.9
137	A	25.8	Very low	26.8	Very low	90 Å²	90	157.2 Å²	157.2	74%	0.744	83%	0.829	S	S	*	*				178.5	116.9	120	0	0	0	0	0	113.3
138	T	24.9	Very low	26.7	Very low	128 Å²	128	154.1 Å²	154.1	79%	0.785	82%	0.821	S	S	*	*			trans	65.5	100.7	135.4	-30.2	0	0	0	0	120.2
139	S	28.1	Very low	26.5	Very low	119 Å²	119	153.5 Å²	153.5	83%	0.832	82%	0.819	S	S	*	*			trans	-116.5	122.4	153.6	-84	0	0	0	0	110.5
140	Q	25.1	Very low	26.3	Very low	185 Å²	185	157.7 Å²	157.7	86%	0.864	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-73.4	132.5	178.2	-70.2	166.2	-21.3	0	0	110.7
141	F	24.9	Very low	26.3	Very low	199 Å²	199	153.3 Å²	153.3	87%	0.873	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-92.2	140.7	163.4	-87.7	-89.4	0	0	0	109.9
142	P	26	Very low	26.2	Very low	120 Å²	120	150.3 Å²	150.3	78%	0.779	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-73.5	146.6	-178.5	28	-31.5	0	0	0	112.7
143	Q	24.9	Very low	26	Very low	181 Å²	181	156.4 Å²	156.4	85%	0.846	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-73.3	147.5	176.4	-75.1	-160.1	-28	0	0	112.7
144	P	28.2	Very low	26	Very low	128 Å²	128	155.1 Å²	155.1	83%	0.831	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-76.2	131.2	172.8	29.2	-30	0	0	0	111.5
145	Q	25.2	Very low	25.8	Very low	177 Å²	177	154.7 Å²	154.7	83%	0.827	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-78.9	143.6	176.2	-66.7	177.2	-6.5	0	0	111.4
146	H	24.8	Very low	26.2	Very low	154 Å²	154	157.7 Å²	157.7	71%	0.713	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-62.9	131.6	173.3	-132.6	-98	0	0	0	110.7	D148	H146-D148 IonicContact CE1-OD1 3.71Å; H146-D148 IonicContact CE1-OD2 3.59Å; H146-D148 PolarHBondContact CE1-OD2 3.31Å; H146-D148 VanDerWaalsContact CE1-OD2 3.31Å; H146-D148 IonicContact ND1-OD2 3.14Å; H146-D148 PolarHBondContact ND1-OD2 3.17Å; H146-D148 VanDerWaalsContact ND1-OD2 3.12Å
147	F	25.1	Very low	26.3	Very low	201 Å²	201	155.4 Å²	155.4	88%	0.882	81%	0.812	S	S	*	*			trans	-138.2	106.7	156.9	-106.9	-87.4	0	0	0	108.6
148	D	26.7	Very low	26.6	Very low	129 Å²	129	158.9 Å²	158.9	69%	0.69	82%	0.817	S	S	*	*			trans	-82.3	135.7	165.9	-73	-58.7	0	0	0	109.3	H146	H146-D148 IonicContact CE1-OD1 3.71Å; H146-D148 IonicContact CE1-OD2 3.59Å; H146-D148 PolarHBondContact CE1-OD2 3.31Å; H146-D148 VanDerWaalsContact CE1-OD2 3.31Å; H146-D148 IonicContact ND1-OD2 3.14Å; H146-D148 PolarHBondContact ND1-OD2 3.17Å; H146-D148 VanDerWaalsContact ND1-OD2 3.12Å
149	S	23.3	Very low	27.1	Very low	99 Å²	99	158.5 Å²	158.5	69%	0.692	81%	0.814	S	S	*	*				168.6	153	127.2	-168.5	0	0	0	0	112.4
150	F	24.2	Very low	27.4	Very low	206 Å²	206	161.2 Å²	161.2	90%	0.904	81%	0.814	S	S	*	*			trans	79.8	106.8	-176.8	-55.2	-78.7	0	0	0	114.4
151	G	25.5	Very low	27.7	Very low	71 Å²	71	160.3 Å²	160.3	73%	0.732	81%	0.814	S	S	*	*			cis	141	80.2	13.4	0	0	0	0	0	109.1
152	L	24.8	Very low	27.8	Very low	178 Å²	178	156 Å²	156	93%	0.932	81%	0.806	S	S	*	*			trans	-135.5	113	166.2	-73.6	174.9	0	0	0	109.6
153	R	27.4	Very low	28.2	Very low	247 Å²	247	159.2 Å²	159.2	93%	0.932	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-68.5	131.8	174.5	-97.2	179.2	176.9	169.7	0	110
154	L	28.4	Very low	28.3	Very low	160 Å²	160	162 Å²	162	84%	0.838	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-72.7	136.2	161.4	-84.8	154.2	0	0	0	110.3
155	P	25.1	Very low	28.3	Very low	116 Å²	116	160.8 Å²	160.8	75%	0.753	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-62.9	143.7	172.7	-17.8	30.7	0	0	0	111.3
156	R	34	Very low	28.5	Very low	254 Å²	254	161.7 Å²	161.7	96%	0.958	81%	0.812	S	S	*	*	S	Bend	trans	-98.1	7.2	-174.4	-80.2	-173.1	175.3	-176.6	-1.5	114.9
157	D	30.5	Very low	28.8	Very low	121 Å²	121	157.9 Å²	157.9	65%	0.647	81%	0.814	S	S	*	*			trans	-144.4	148.6	-178.2	-142.9	-24.3	0	0	0	113.4
158	I	31.7	Very low	29.1	Very low	164 Å²	164	157 Å²	157	84%	0.841	81%	0.807	S	S	*	*	S	Bend	trans	-94.5	3.4	-162.7	-54.6	167.8	0	0	0	111.6
159	T	35.1	Very low	29.5	Very low	119 Å²	119	154.2 Å²	154.2	73%	0.73	80%	0.795	S	S	*	*	S	Bend	trans	-92.8	6.9	-173	52.2	0	0	0	0	115.4
160	E	34.7	Very low	29.7	Very low	177 Å²	177	158.9 Å²	158.9	83%	0.827	80%	0.803	S	S	*	*			trans	-125.2	55.6	-177.5	-67.3	-173.2	177.5	0	0	113.6
161	L	31.3	Very low	30.1	Very low	166 Å²	166	157.3 Å²	157.3	87%	0.869	79%	0.793	S	S	*	*			trans	-131	130.8	160.3	-80.9	171.9	0	0	0	111.3
162	P	26.4	Very low	30.3	Very low	107 Å²	107	159.8 Å²	159.8	70%	0.695	79%	0.787	S	S	*	*			trans	-79.1	150.1	-175.4	30.9	-32.3	0	0	0	113	W164	P162-W164 PolarHBondContact O-N 3.12Å
163	E	35.5	Very low	30.6	Very low	188 Å²	188	155 Å²	155	88%	0.879	77%	0.773	S	S	*	*			trans	-55.4	122.9	179.5	-65	176.5	146.3	0	0	113.3
164	W	27.5	Very low	30.6	Very low	241 Å²	241	151.4 Å²	151.4	91%	0.913	77%	0.769	S	S	*	*			trans	-140.3	133.8	153.3	-71.8	87.3	0	0	0	111.2	P162	P162-W164 PolarHBondContact O-N 3.12Å
165	S	28.1	Very low	30.9	Very low	101 Å²	101	146.8 Å²	146.8	71%	0.706	76%	0.76	S	S	*	*			trans	-94.1	165.1	-166.4	48.2	0	0	0	0	114.1
166	E	29.4	Very low	30.9	Very low	196 Å²	196	151 Å²	151	92%	0.916	77%	0.766	S	S	*	*			trans	95.2	101	162.5	-58.9	-168.7	157.4	0	0	117.9
167	G	29.3	Very low	31.1	Very low	74 Å²	74	144.6 Å²	144.6	76%	0.763	76%	0.758	S	S	*	*			trans	158.1	9.8	167.9	0	0	0	0	0	117.4	P169	G167-P169 WeakPolarHBondContact O-CD 3.46Å
168	Y	32.5	Very low	31.1	Very low	184 Å²	184	142.1 Å²	142.1	72%	0.722	76%	0.761	S	S	*	*			trans	-81.2	121.8	-174.5	-122.5	-96.8	0	0	0	113.3	M172	Y168-M172 HydrophobicContact CD1-CB 4.22Å; Y168-M172 HydrophobicContact CD1-CG 4.48Å; Y168-M172 HydrophobicContact CE1-CB 3.81Å; Y168-M172 HydrophobicContact CE1-CE 3.83Å; Y168-M172 HydrophobicContact CE1-CG 3.83Å; Y168-M172 HydrophobicContact CE1-SD 3.98Å; Y168-M172 WeakPolarHBondContact OH-CE 3.39Å
169	P	34.3	Very low	31	Very low	69 Å²	69	144.9 Å²	144.9	45%	0.448	76%	0.762	S	S	.	*			trans	-84.4	135.5	175.6	-11.1	29.1	0	0	0	113.5	G167 Y171	G167-P169 WeakPolarHBondContact O-CD 3.46Å; P169-Y171 HydrophobicContact CB-CD1 3.91Å; P169-Y171 HydrophobicContact CB-CE1 3.57Å; P169-Y171 HydrophobicContact CG-CE1 4.06Å; P169-Y171 PolarHBondContact O-N 3.3Å
170	F	27.6	Very low	30.9	Very low	197 Å²	197	147.5 Å²	147.5	86%	0.864	77%	0.772	S	S	*	*	G	3₁₀ helix	trans	-30.1	-14.4	176.5	-171.7	-107.4	0	0	0	120.7
171	Y	32.8	Very low	30.9	Very low	174 Å²	174	144.8 Å²	144.8	68%	0.682	76%	0.762	S	S	*	*	G	3₁₀ helix	trans	-89.1	-7.5	-175.7	60.9	-95.1	0	0	0	114.8	P169	P169-Y171 HydrophobicContact CB-CD1 3.91Å; P169-Y171 HydrophobicContact CB-CE1 3.57Å; P169-Y171 HydrophobicContact CG-CE1 4.06Å; P169-Y171 PolarHBondContact O-N 3.3Å
172	M	31	Very low	31.2	Very low	123 Å²	123	139.8 Å²	139.8	61%	0.606	74%	0.741	S	S	*	*	G	3₁₀ helix	trans	-86.5	-3.1	170.1	-74.9	-118.9	-139.5	0	0	113.7	Y168 M174	Y168-M172 HydrophobicContact CD1-CB 4.22Å; Y168-M172 HydrophobicContact CD1-CG 4.48Å; Y168-M172 HydrophobicContact CE1-CB 3.81Å; Y168-M172 HydrophobicContact CE1-CE 3.83Å; Y168-M172 HydrophobicContact CE1-CG 3.83Å; Y168-M172 HydrophobicContact CE1-SD 3.98Å; Y168-M172 WeakPolarHBondContact OH-CE 3.39Å; M172-M174 VanDerWaalsContact C-N 3.26Å; M172-M174 PolarHBondContact O-N 3.08Å
173	A	30.4	Very low	31.6	Very low	77 Å²	77	138.6 Å²	138.6	64%	0.636	74%	0.74	S	S	*	*	S	Bend	trans	-81.7	4.6	177.5	0	0	0	0	0	114.3
174	M	27.3	Very low	31.7	Very low	172 Å²	172	135.9 Å²	135.9	85%	0.847	73%	0.732	S	S	*	*			trans	-111.6	44	-179.8	-67	-67	-70.9	0	0	112.3	M172	M172-M174 VanDerWaalsContact C-N 3.26Å; M172-M174 PolarHBondContact O-N 3.08Å
175	G	33.6	Very low	32.1	Very low	63 Å²	63	129.5 Å²	129.5	65%	0.649	72%	0.716	S	S	*	*			trans	-86.3	100.4	157.1	0	0	0	0	0	109.5
176	F	26.8	Very low	32.5	Very low	203 Å²	203	129.6 Å²	129.6	89%	0.89	71%	0.708	S	S	*	*			trans	-132.1	126.4	155.9	-104.8	-79.7	0	0	0	110.6
177	P	36.9	Very low	32.8	Very low	121 Å²	121	123.5 Å²	123.5	79%	0.786	69%	0.691	S	S	*	*			trans	-82.8	141.5	168.2	32.3	-29.1	0	0	0	110.7
178	G	30.7	Very low	32.9	Very low	69 Å²	69	122.7 Å²	122.7	71%	0.711	68%	0.683	S	S	*	*			trans	102	69.6	161.8	0	0	0	0	0	116.7
179	Y	30	Very low	32.8	Very low	222 Å²	222	122.8 Å²	122.8	87%	0.871	69%	0.687	S	S	*	*			trans	-153.8	113.9	146.8	-98.8	-83.8	0	0	0	107.5	L181	Y179-L181 PolarHBondContact O-N 2.99Å; Y179-L181 VanDerWaalsContact O-N 3.09Å
180	D	34	Very low	32.8	Very low	174 Å²	174	125.9 Å²	125.9	93%	0.93	69%	0.693	S	S	*	*			trans	-68.6	101.9	172.3	-95.3	-25	0	0	0	108.9
181	L	33.8	Very low	33.1	Very low	119 Å²	119	125.3 Å²	125.3	62%	0.623	69%	0.693	S	S	*	*			trans	-107	119.8	162.9	-73.5	168.6	0	0	0	107.4	Y179	Y179-L181 PolarHBondContact O-N 2.99Å; Y179-L181 VanDerWaalsContact O-N 3.09Å
182	S	36.4	Very low	33.5	Very low	62 Å²	62	123.8 Å²	123.8	43%	0.434	69%	0.69	S	S	.	*			trans	-52.6	141.9	176.7	168.6	0	0	0	0	110.9	D184 D185	S182-D184 PolarHBondContact O-N 2.72Å; S182-D184 PolarHBondContact OG-N 2.94Å; S182-D185 PolarHBondContact O-N 3.45Å
183	A	36.8	Very low	33.6	Very low	81 Å²	81	122.5 Å²	122.5	67%	0.669	69%	0.694	S	S	*	*	H	α-helix	trans	-54.5	-23.9	177.6	0	0	0	0	0	113.1	A187	A183-A187 PolarHBondContact O-N 3.13Å
184	D	36.8	Very low	34	Very low	131 Å²	131	131.2 Å²	131.2	70%	0.701	71%	0.71	S	S	*	*	H	α-helix	trans	-76	-28.7	178	-66.2	-32.8	0	0	0	113	S182 A187 G188	S182-D184 PolarHBondContact O-N 2.72Å; S182-D184 PolarHBondContact OG-N 2.94Å; D184-A187 PolarHBondContact O-N 2.97Å; D184-G188 PolarHBondContact O-N 3.42Å
185	D	35.4	Very low	34.5	Very low	108 Å²	108	126.5 Å²	126.5	58%	0.578	71%	0.706	S	S	*	*	H	α-helix	trans	-76.7	-29.6	178	-78.5	-33.1	0	0	0	112.7	S182	S182-D185 PolarHBondContact O-N 3.45Å
186	L	36.8	Very low	34.7	Very low	103 Å²	103	130.5 Å²	130.5	54%	0.539	71%	0.71	S	S	.	*	H	α-helix	trans	-75.6	-31.4	173.1	-102.4	153.1	0	0	0	112.3	G188	L186-G188 VanDerWaalsContact C-N 3.35Å
187	A	34.8	Very low	35.8	Very low	68 Å²	68	132.7 Å²	132.7	56%	0.562	71%	0.712	S	S	*	*	H	α-helix	trans	-69.7	-30.5	177.6	0	0	0	0	0	112.7	A183 D184	A183-A187 PolarHBondContact O-N 3.13Å; D184-A187 PolarHBondContact O-N 2.97Å
188	G	31.4	Very low	37	Very low	57 Å²	57	134.7 Å²	134.7	59%	0.588	70%	0.704	S	S	*	*	H	α-helix	trans	-75.7	-31.5	179.3	0	0	0	0	0	115	D184 L186	D184-G188 PolarHBondContact O-N 3.42Å; L186-G188 VanDerWaalsContact C-N 3.35Å
189	K	32.3	Very low	39	Very low	186 Å²	186	134.5 Å²	134.5	81%	0.809	69%	0.691	S	S	*	*	H	α-helix	trans	-82.7	-18.3	-176.3	-92	179.8	176	174.2	0	114.9
190	F	33.7	Very low	41.5	Very low	134 Å²	134	125.9 Å²	125.9	59%	0.588	66%	0.658	S	S	*	*			trans	-116.1	78.1	175.2	-73.3	-82.4	0	0	0	110.2	F192	F190-F192 HydrophobicContact CB-CD2 4.25Å; F190-F192 HydrophobicContact CB-CE2 3.89Å; F190-F192 HydrophobicContact CB-CZ 4.33Å; F190-F192 WeakPolarHBondContact O-CD2 3.32Å; F190-F192 PolarHBondContact O-N 3.45Å
191	Q	33.8	Very low	43.8	Very low	184 Å²	184	120.3 Å²	120.3	86%	0.86	63%	0.628	S	S	*	*			trans	-62.6	94.8	159.2	-78.1	-179.5	-10.4	0	0	108.2	S193	Q191-S193 PolarHBondContact O-N 3.3Å
192	F	41.9	Very low	46.2	Very low	142 Å²	142	114.6 Å²	114.6	62%	0.623	60%	0.598	S	S	*	*			trans	-62.3	100.3	175.7	-75.8	-88.8	0	0	0	109.2	F190 R194	F190-F192 HydrophobicContact CB-CD2 4.25Å; F190-F192 HydrophobicContact CB-CE2 3.89Å; F190-F192 HydrophobicContact CB-CZ 4.33Å; F190-F192 WeakPolarHBondContact O-CD2 3.32Å; F190-F192 PolarHBondContact O-N 3.45Å; F192-R194 PolarHBondContact O-N 2.93Å
193	S	32.8	Very low	48.2	Very low	96 Å²	96	113 Å²	113	67%	0.671	59%	0.59	S	S	*	*			trans	-63.8	109	174.7	53.6	0	0	0	0	109.8	Q191 G195	Q191-S193 PolarHBondContact O-N 3.3Å; S193-G195 VanDerWaalsContact C-N 3.34Å; S193-G195 PolarHBondContact O-N 3.29Å
194	R	38.1	Very low	50.6	Low	260 Å²	260	111.6 Å²	111.6	98%	0.981	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.1	95.1	168.1	-76.9	-177.9	175.9	-175.1	-0.1	108	F192	F192-R194 PolarHBondContact O-N 2.93Å
195	G	37.1	Very low	53.2	Low	74 Å²	74	106.2 Å²	106.2	76%	0.763	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	163.9	-22.3	175.4	0	0	0	0	0	116.6	S193 R197	S193-G195 VanDerWaalsContact C-N 3.34Å; S193-G195 PolarHBondContact O-N 3.29Å; G195-R197 PolarHBondContact O-N 3.38Å
196	M	38.2	Very low	55.8	Low	147 Å²	147	102.4 Å²	102.4	72%	0.724	52%	0.52	S	S	*	.			trans	-83.3	110.3	-178	-166.2	67.2	83.6	0	0	111.4	R198	M196-R198 PolarHBondContact O-N 2.9Å
197	R	49.4	Very low	58.3	Low	248 Å²	248	101.1 Å²	101.1	94%	0.936	51%	0.512	S	S	*	.			trans	-63.3	116.5	171.7	-81.9	-173.2	173.7	-151.8	0.5	109.8	G195	G195-R197 PolarHBondContact O-N 3.38Å
198	R	63.7	Low	60.9	Low	164 Å²	164	97.9 Å²	97.9	62%	0.619	49%	0.485	S	S	*	.			trans	-96.1	144.9	174.8	-64.7	-172.8	179.4	-152.8	-1	111.2	M196 Y200	M196-R198 PolarHBondContact O-N 2.9Å; R198-Y200 HydrophobicContact CB-CE1 4.39Å; R198-Y200 HydrophobicContact CB-CE2 3.96Å
199	S	71.6	Confident	63.8	Low	64 Å²	64	95.2 Å²	95.2	45%	0.448	46%	0.457	S	S	.	.			trans	-117.4	132	176.5	179.9	0	0	0	0	109.6	R249	S199-R249 PolarHBondContact O-NH2 2.87Å; S199-R249 PolarHBondContact OG-NE 2.81Å
200	Y	82.9	Confident	66.6	Low	42 Å²	42	91.4 Å²	91.4	17%	0.165	44%	0.442	C	S	.	.			trans	-118.6	136.4	-174.4	-53.7	-84.7	0	0	0	109.9	R198 F204 K205 V226 W234 R249	R198-Y200 HydrophobicContact CB-CE1 4.39Å; R198-Y200 HydrophobicContact CB-CE2 3.96Å; Y200-F204 AromaticContact CD1-CD1 3.51Å; Y200-F204 HydrophobicContact CD1-CD1 3.51Å; Y200-F204 AromaticContact CD1-CE1 3.26Å; Y200-F204 HydrophobicContact CD1-CE1 3.26Å; Y200-F204 HydrophobicContact CD1-CG 4.42Å; Y200-F204 HydrophobicContact CD1-CZ 4.03Å; Y200-F204 HydrophobicContact CE1-CD1 4.41Å; Y200-F204 AromaticContact CE1-CE1 3.73Å; Y200-F204 HydrophobicContact CE1-CE1 3.73Å; Y200-F204 HydrophobicContact CE1-CZ 4.18Å; Y200-F204 HydrophobicContact CG-CD1 4.05Å; Y200-F204 HydrophobicContact CG-CE1 4.09Å; Y200-K205 WeakPolarHBondContact O-CE 3.31Å; Y200-K205 PolarHBondContact O-NZ 2.86Å; Y200-V226 HydrophobicContact CD1-CG1 4.49Å; Y200-V226 HydrophobicContact CE1-CG1 3.7Å; Y200-W234 HydrophobicContact CD1-CH2 4.13Å; Y200-W234 AromaticContact CD2-CH2 3.59Å; Y200-W234 HydrophobicContact CD2-CH2 3.59Å; Y200-W234 AromaticContact CD2-CZ2 3.46Å; Y200-W234 HydrophobicContact CD2-CZ2 3.46Å; Y200-W234 VanDerWaalsContact CD2-CZ2 3.46Å; Y200-W234 HydrophobicContact CE1-CH2 4.45Å; Y200-W234 AromaticContact CE2-CH2 3.96Å; Y200-W234 HydrophobicContact CE2-CH2 3.96Å; Y200-W234 HydrophobicContact CE2-CZ2 4.03Å; Y200-W234 AromaticContact CG-CH2 3.68Å; Y200-W234 HydrophobicContact CG-CH2 3.68Å; Y200-W234 AromaticContact CG-CZ2 3.85Å; Y200-W234 HydrophobicContact CG-CZ2 3.85Å; Y200-R249 WeakPolarHBondContact O-CA 3.3Å
201	D	83.1	Confident	69.2	Low	56 Å²	56	88.7 Å²	88.7	30%	0.299	43%	0.429	S	S	.	.			trans	-78.1	171.8	173.8	59.9	59.6	0	0	0	112.5	G203 F204 K205 A246 R248 R249	D201-G203 PolarHBondContact OD1-N 2.9Å; D201-F204 VanDerWaalsContact OD1-CB 3.28Å; D201-F204 WeakPolarHBondContact OD1-CB 3.34Å; D201-F204 PolarHBondContact OD1-N 2.99Å; D201-K205 WeakPolarHBondContact O-CD 3.4Å; D201-K205 WeakPolarHBondContact O-CG 3.49Å; D201-K205 PolarHBondContact O-N 3.42Å; D201-A246 WeakPolarHBondContact CB-O 3.43Å; D201-R248 CarbonylContact C-O 3.57Å; D201-R249 HydrophobicContact CB-CG 3.9Å
202	A	83.2	Confident	72.1	Confident	0 Å²	0	80 Å²	80	0%	0	39%	0.388	C	S	.	.	H	α-helix	trans	-71.6	-36.8	-173.8	0	0	0	0	0	111.5	K205 L206 L241 A244 A246 R248	A202-K205 PolarHBondContact O-N 2.94Å; A202-L206 WeakPolarHBondContact O-CG 3.41Å; A202-L206 PolarHBondContact O-N 2.85Å; A202-L241 HydrophobicContact CB-CD2 3.96Å; A202-A244 HydrophobicContact CB-CB 4.3Å; A202-A246 PolarHBondContact N-O 3.46Å; A202-R248 HydrophobicContact CB-CB 4.33Å; A202-R248 WeakPolarHBondContact CB-O 3.44Å; A202-R248 PolarHBondContact N-O 3.09Å
203	G	78.7	Confident	74.5	Confident	27 Å²	27	77.4 Å²	77.4	28%	0.278	38%	0.378	S	S	.	.	H	α-helix	trans	-62.2	-47.8	176.5	0	0	0	0	0	112.1	D201 K205 L206 M207 A246	D201-G203 PolarHBondContact OD1-N 2.9Å; G203-K205 VanDerWaalsContact C-N 3.33Å; G203-K205 PolarHBondContact O-N 3.32Å; G203-L206 PolarHBondContact O-N 3.46Å; G203-M207 PolarHBondContact O-N 2.95Å; G203-A246 PolarHBondContact N-O 3.2Å
204	F	87.3	Confident	77.2	Confident	53 Å²	53	77.3 Å²	77.3	23%	0.232	38%	0.377	C	S	.	.	H	α-helix	trans	-59.4	-43.7	174.9	179	-89.3	0	0	0	111.9	Y200 D201 L206 M207 V208 F224 V226 W234	Y200-F204 AromaticContact CD1-CD1 3.51Å; Y200-F204 HydrophobicContact CD1-CD1 3.51Å; Y200-F204 AromaticContact CD1-CE1 3.26Å; Y200-F204 HydrophobicContact CD1-CE1 3.26Å; Y200-F204 HydrophobicContact CD1-CG 4.42Å; Y200-F204 HydrophobicContact CD1-CZ 4.03Å; Y200-F204 HydrophobicContact CE1-CD1 4.41Å; Y200-F204 AromaticContact CE1-CE1 3.73Å; Y200-F204 HydrophobicContact CE1-CE1 3.73Å; Y200-F204 HydrophobicContact CE1-CZ 4.18Å; Y200-F204 HydrophobicContact CG-CD1 4.05Å; Y200-F204 HydrophobicContact CG-CE1 4.09Å; D201-F204 VanDerWaalsContact OD1-CB 3.28Å; D201-F204 WeakPolarHBondContact OD1-CB 3.34Å; D201-F204 PolarHBondContact OD1-N 2.99Å; F204-L206 VanDerWaalsContact C-N 3.33Å; F204-L206 PolarHBondContact O-N 2.95Å; F204-M207 HydrophobicContact CD2-CE 3.7Å; F204-M207 HydrophobicContact CE2-CE 3.97Å; F204-M207 HydrophobicContact CG-CE 4.48Å; F204-M207 PolarHBondContact O-N 2.99Å; F204-V208 HydrophobicContact CD1-CG2 4.08Å; F204-V208 HydrophobicContact CE1-CG2 3.67Å; F204-V208 HydrophobicContact CE2-CG2 4.44Å; F204-V208 HydrophobicContact CZ-CG2 3.87Å; F204-V208 VanDerWaalsContact O-CG2 3.26Å; F204-V208 WeakPolarHBondContact O-CG2 3.31Å; F204-V208 PolarHBondContact O-N 3.35Å; F204-V208 VanDerWaalsContact O-N 3.09Å; F204-F224 HydrophobicContact CZ-CB 4.22Å; F204-V226 HydrophobicContact CE1-CG1 3.9Å; F204-V226 HydrophobicContact CZ-CG1 4.02Å; F204-W234 HydrophobicContact CD1-CZ3 4.48Å; F204-W234 HydrophobicContact CE1-CH2 4.21Å; F204-W234 HydrophobicContact CE1-CZ3 4.17Å
205	K	91.9	Very high	79.8	Confident	18 Å²	18	67.5 Å²	67.5	8%	0.078	35%	0.346	C	S	.	.	H	α-helix	trans	-63.3	-39	178.2	-68.6	169.5	-170.4	157	0	112	Y200 D201 A202 G203 V208 V209 W234 L241 R249	Y200-K205 WeakPolarHBondContact O-CE 3.31Å; Y200-K205 PolarHBondContact O-NZ 2.86Å; D201-K205 WeakPolarHBondContact O-CD 3.4Å; D201-K205 WeakPolarHBondContact O-CG 3.49Å; D201-K205 PolarHBondContact O-N 3.42Å; A202-K205 PolarHBondContact O-N 2.94Å; G203-K205 VanDerWaalsContact C-N 3.33Å; G203-K205 PolarHBondContact O-N 3.32Å; K205-V208 PolarHBondContact O-N 2.95Å; K205-V209 WeakPolarHBondContact O-CB 3.19Å; K205-V209 WeakPolarHBondContact O-CG2 3.32Å; K205-V209 PolarHBondContact O-N 2.94Å; K205-W234 HydrophobicContact CB-CB 4.48Å; K205-W234 HydrophobicContact CB-CD2 4.03Å; K205-W234 HydrophobicContact CB-CE3 4.15Å; K205-W234 HydrophobicContact CB-CG 4.16Å; K205-W234 HydrophobicContact CD-CD2 4.14Å; K205-W234 HydrophobicContact CD-CG 4.15Å; K205-W234 HydrophobicContact CD-CZ2 4.48Å; K205-W234 HydrophobicContact CG-CD2 3.57Å; K205-W234 HydrophobicContact CG-CE3 3.89Å; K205-W234 HydrophobicContact CG-CG 3.97Å; K205-W234 HydrophobicContact CG-CH2 4.26Å; K205-W234 HydrophobicContact CG-CZ2 3.99Å; K205-W234 HydrophobicContact CG-CZ3 4.21Å; K205-L241 HydrophobicContact CB-CD1 3.88Å; K205-L241 HydrophobicContact CB-CD2 4Å; K205-L241 HydrophobicContact CD-CD2 3.75Å; K205-R249 PolarHBondContact NZ-O 2.7Å
206	L	89.6	Confident	82.4	Confident	28 Å²	28	67 Å²	67	15%	0.147	33%	0.326	C	S	.	.	H	α-helix	trans	-64.8	-47.3	176.8	-76.1	171.2	0	0	0	111.7	A202 G203 F204 V208 V209 E210 K238 L241 Q242	A202-L206 WeakPolarHBondContact O-CG 3.41Å; A202-L206 PolarHBondContact O-N 2.85Å; G203-L206 PolarHBondContact O-N 3.46Å; F204-L206 VanDerWaalsContact C-N 3.33Å; F204-L206 PolarHBondContact O-N 2.95Å; L206-V208 VanDerWaalsContact C-N 3.3Å; L206-V208 PolarHBondContact O-N 3.17Å; L206-V209 CarbonylContact O-C 3.52Å; L206-V209 WeakPolarHBondContact O-CA 3.44Å; L206-V209 WeakPolarHBondContact O-CB 3.37Å; L206-V209 PolarHBondContact O-N 3.33Å; L206-E210 WeakPolarHBondContact O-CG 3.42Å; L206-E210 PolarHBondContact O-N 3.25Å; L206-K238 HydrophobicContact CD2-CG 4.4Å; L206-L241 HydrophobicContact CD1-CB 4.37Å; L206-L241 HydrophobicContact CD2-CB 3.54Å; L206-L241 HydrophobicContact CG-CB 3.81Å; L206-Q242 HydrophobicContact CD2-CG 3.71Å
207	M	88.4	Confident	84.9	Confident	76 Å²	76	61.3 Å²	61.3	37%	0.374	30%	0.299	S	S	.	.	H	α-helix	trans	-56	-44.7	176.1	179.5	-174.4	60.8	0	0	111.9	G203 F204 V209 Y211 F224	G203-M207 PolarHBondContact O-N 2.95Å; F204-M207 HydrophobicContact CD2-CE 3.7Å; F204-M207 HydrophobicContact CE2-CE 3.97Å; F204-M207 HydrophobicContact CG-CE 4.48Å; F204-M207 PolarHBondContact O-N 2.99Å; M207-V209 VanDerWaalsContact C-N 3.33Å; M207-V209 PolarHBondContact O-N 3.44Å; M207-Y211 WeakPolarHBondContact O-CB 3.41Å; M207-Y211 PolarHBondContact O-N 2.92Å; M207-F224 HydrophobicContact CE-CD1 3.88Å; M207-F224 HydrophobicContact CE-CE1 3.56Å; M207-F224 HydrophobicContact CE-CZ 4.49Å; M207-F224 HydrophobicContact CG-CE1 4.17Å; M207-F224 HydrophobicContact CG-CZ 4.25Å; M207-F224 HydrophobicContact SD-CE1 3.98Å
208	V	90	Very high	86.6	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-64.8	-38	176.5	176.1	0	0	0	0	111.6	F204 K205 L206 A212 A220 F224 V226 V231 W234	F204-V208 HydrophobicContact CD1-CG2 4.08Å; F204-V208 HydrophobicContact CE1-CG2 3.67Å; F204-V208 HydrophobicContact CE2-CG2 4.44Å; F204-V208 HydrophobicContact CZ-CG2 3.87Å; F204-V208 VanDerWaalsContact O-CG2 3.26Å; F204-V208 WeakPolarHBondContact O-CG2 3.31Å; F204-V208 PolarHBondContact O-N 3.35Å; F204-V208 VanDerWaalsContact O-N 3.09Å; K205-V208 PolarHBondContact O-N 2.95Å; L206-V208 VanDerWaalsContact C-N 3.3Å; L206-V208 PolarHBondContact O-N 3.17Å; V208-A212 VanDerWaalsContact O-CB 3.32Å; V208-A212 WeakPolarHBondContact O-CB 3.31Å; V208-A212 PolarHBondContact O-N 3.15Å; V208-A220 HydrophobicContact CG1-CB 4.38Å; V208-F224 HydrophobicContact CB-CD2 4.32Å; V208-F224 HydrophobicContact CG1-CD2 4.23Å; V208-F224 HydrophobicContact CG2-CB 3.85Å; V208-F224 HydrophobicContact CG2-CD1 4.08Å; V208-F224 HydrophobicContact CG2-CD2 3.84Å; V208-F224 HydrophobicContact CG2-CE2 4.44Å; V208-F224 HydrophobicContact CG2-CG 3.65Å; V208-V226 HydrophobicContact CG1-CG2 4.21Å; V208-V231 HydrophobicContact CG1-CB 4.44Å; V208-V231 HydrophobicContact CG1-CG1 4.17Å; V208-V231 HydrophobicContact CG1-CG2 3.76Å; V208-W234 HydrophobicContact CB-CE3 4.36Å; V208-W234 HydrophobicContact CB-CZ3 4.31Å; V208-W234 HydrophobicContact CG1-CE3 4.19Å; V208-W234 HydrophobicContact CG1-CZ3 4.12Å; V208-W234 HydrophobicContact CG2-CZ3 4.34Å
209	V	92.4	Very high	87.5	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-69	-44.5	178.7	162.1	0	0	0	0	111.7	K205 L206 M207 A212 E213 W234 R235 K238	K205-V209 WeakPolarHBondContact O-CB 3.19Å; K205-V209 WeakPolarHBondContact O-CG2 3.32Å; K205-V209 PolarHBondContact O-N 2.94Å; L206-V209 CarbonylContact O-C 3.52Å; L206-V209 WeakPolarHBondContact O-CA 3.44Å; L206-V209 WeakPolarHBondContact O-CB 3.37Å; L206-V209 PolarHBondContact O-N 3.33Å; M207-V209 VanDerWaalsContact C-N 3.33Å; M207-V209 PolarHBondContact O-N 3.44Å; V209-A212 WeakPolarHBondContact O-CB 3.12Å; V209-A212 PolarHBondContact O-N 3.3Å; V209-E213 WeakPolarHBondContact O-CG 3.35Å; V209-E213 PolarHBondContact O-N 2.81Å; V209-W234 HydrophobicContact CG2-CB 3.71Å; V209-R235 HydrophobicContact CB-CG 4.38Å; V209-R235 HydrophobicContact CG1-CG 4.03Å; V209-R235 HydrophobicContact CG2-CG 3.9Å; V209-K238 HydrophobicContact CG1-CB 4.2Å; V209-K238 HydrophobicContact CG1-CD 3.67Å; V209-K238 HydrophobicContact CG1-CG 3.94Å
210	E	91.4	Very high	88.2	Confident	107 Å²	107	47.6 Å²	47.6	50%	0.5	25%	0.254	S	S	.	.	H	α-helix	trans	-63.4	-41.7	177.2	-73.7	171	-174.5	0	0	111.5	L206 A212 E213 S214	L206-E210 WeakPolarHBondContact O-CG 3.42Å; L206-E210 PolarHBondContact O-N 3.25Å; E210-A212 VanDerWaalsContact C-N 3.35Å; E210-A212 PolarHBondContact O-N 2.97Å; E210-E213 PolarHBondContact O-N 2.88Å; E210-S214 PolarHBondContact O-N 2.8Å; E210-S214 VanDerWaalsContact O-N 3.12Å; E210-S214 PolarHBondContact O-OG 3.01Å
211	Y	88.8	Confident	88.1	Confident	77 Å²	77	46.2 Å²	46.2	30%	0.302	25%	0.251	S	S	.	.	H	α-helix	trans	-64.3	-40	172.7	-172.2	-89.1	0	0	0	111.9	M207 E213 S214 T215 A220 Q223 F224	M207-Y211 WeakPolarHBondContact O-CB 3.41Å; M207-Y211 PolarHBondContact O-N 2.92Å; Y211-E213 VanDerWaalsContact C-N 3.27Å; Y211-E213 PolarHBondContact O-N 2.87Å; Y211-S214 WeakPolarHBondContact CA-OG 3.29Å; Y211-S214 PolarHBondContact O-N 3.04Å; Y211-S214 PolarHBondContact O-OG 3.46Å; Y211-T215 WeakPolarHBondContact CD1-OG1 3.49Å; Y211-T215 HydrophobicContact CE1-CG2 4.11Å; Y211-T215 WeakPolarHBondContact CE1-OG1 3.12Å; Y211-T215 WeakPolarHBondContact O-CB 3Å; Y211-T215 PolarHBondContact O-N 3.2Å; Y211-T215 PolarHBondContact O-OG1 2.69Å; Y211-A220 HydrophobicContact CD1-CB 3.79Å; Y211-A220 HydrophobicContact CE1-CB 4.45Å; Y211-Q223 HydrophobicContact CE1-CB 4.01Å; Y211-Q223 HydrophobicContact CE1-CG 4.18Å; Y211-Q223 HydrophobicContact CE2-CG 4.44Å; Y211-F224 HydrophobicContact CD1-CD2 4.47Å; Y211-F224 AromaticContact CD1-CE2 3.68Å; Y211-F224 HydrophobicContact CD1-CE2 3.68Å; Y211-F224 HydrophobicContact CD2-CE2 4.15Å; Y211-F224 HydrophobicContact CD2-CZ 4.29Å; Y211-F224 HydrophobicContact CE1-CE2 4.39Å; Y211-F224 AromaticContact CG-CE2 3.53Å; Y211-F224 HydrophobicContact CG-CE2 3.53Å; Y211-F224 HydrophobicContact CG-CZ 4.05Å
212	A	92.7	Very high	88	Confident	1 Å²	1	52.4 Å²	52.4	1%	0.008	28%	0.275	C	S	.	.	H	α-helix	trans	-67.6	-25.1	177.3	0	0	0	0	0	113.6	V208 V209 E210 T215 N216 A220 V231	V208-A212 VanDerWaalsContact O-CB 3.32Å; V208-A212 WeakPolarHBondContact O-CB 3.31Å; V208-A212 PolarHBondContact O-N 3.15Å; V209-A212 WeakPolarHBondContact O-CB 3.12Å; V209-A212 PolarHBondContact O-N 3.3Å; E210-A212 VanDerWaalsContact C-N 3.35Å; E210-A212 PolarHBondContact O-N 2.97Å; A212-T215 CarbonylContact O-C 3.45Å; A212-N216 WeakPolarHBondContact O-CA 3.37Å; A212-N216 PolarHBondContact O-N 3.42Å; A212-A220 HydrophobicContact CB-CB 3.66Å; A212-V231 HydrophobicContact CB-CG1 3.56Å
213	E	92.7	Very high	87.8	Confident	87 Å²	87	58.4 Å²	58.4	41%	0.407	30%	0.303	S	S	.	.	H	α-helix	trans	-79.3	-35.1	175.4	-75.7	174.8	164	0	0	112.9	V209 E210 Y211 T215 K238	V209-E213 WeakPolarHBondContact O-CG 3.35Å; V209-E213 PolarHBondContact O-N 2.81Å; E210-E213 PolarHBondContact O-N 2.88Å; Y211-E213 VanDerWaalsContact C-N 3.27Å; Y211-E213 PolarHBondContact O-N 2.87Å; E213-T215 VanDerWaalsContact C-N 3.3Å; E213-K238 VanDerWaalsContact OE1-CD 3.24Å; E213-K238 WeakPolarHBondContact OE1-CD 3.31Å; E213-K238 IonicContact OE1-NZ 3.12Å; E213-K238 PolarHBondContact OE1-NZ 3.35Å; E213-K238 IonicContact OE2-NZ 3.31Å; E213-K238 PolarHBondContact OE2-NZ 3.16Å
214	S	90.3	Very high	87.9	Confident	95 Å²	95	59.6 Å²	59.6	66%	0.664	30%	0.301	S	S	*	.	H	α-helix	trans	-78	-16.9	172.2	52.9	0	0	0	0	113.2	E210 Y211	E210-S214 PolarHBondContact O-N 2.8Å; E210-S214 VanDerWaalsContact O-N 3.12Å; E210-S214 PolarHBondContact O-OG 3.01Å; Y211-S214 WeakPolarHBondContact CA-OG 3.29Å; Y211-S214 PolarHBondContact O-N 3.04Å; Y211-S214 PolarHBondContact O-OG 3.46Å
215	T	92.5	Very high	87.6	Confident	53 Å²	53	58.8 Å²	58.8	33%	0.325	31%	0.308	S	S	.	.	S	Bend	trans	-128	-111.8	179.7	65.4	0	0	0	0	111.4	Y211 A212 E213	Y211-T215 WeakPolarHBondContact CD1-OG1 3.49Å; Y211-T215 HydrophobicContact CE1-CG2 4.11Å; Y211-T215 WeakPolarHBondContact CE1-OG1 3.12Å; Y211-T215 WeakPolarHBondContact O-CB 3Å; Y211-T215 PolarHBondContact O-N 3.2Å; Y211-T215 PolarHBondContact O-OG1 2.69Å; A212-T215 CarbonylContact O-C 3.45Å; E213-T215 VanDerWaalsContact C-N 3.3Å
216	N	92.4	Very high	87.1	Confident	64 Å²	64	58.5 Å²	58.5	34%	0.342	31%	0.307	S	S	.	.			trans	-154.9	167.8	170.1	62.4	70.2	0	0	0	111.1	A212 C218 Q219 A220	A212-N216 WeakPolarHBondContact O-CA 3.37Å; A212-N216 PolarHBondContact O-N 3.42Å; N216-C218 VanDerWaalsContact C-N 3.31Å; N216-C218 PolarHBondContact O-N 3.37Å; N216-C218 WeakPolarHBondContact OD1-CB 3.36Å; N216-C218 PolarHBondContact OD1-N 3.44Å; N216-C218 VanDerWaalsContact OD1-N 3.12Å; N216-Q219 VanDerWaalsContact ND2-CD 3.3Å; N216-Q219 PolarHBondContact ND2-OE1 3.35Å; N216-Q219 PolarHBondContact O-N 3.07Å; N216-Q219 PolarHBondContact OD1-N 3.41Å; N216-A220 PolarHBondContact O-N 3.26Å
217	N	89.4	Confident	86.9	Confident	28 Å²	28	62.9 Å²	62.9	15%	0.15	33%	0.33	C	S	.	.	H	α-helix	trans	-62	-35.9	-175.4	-59.9	-13.8	0	0	0	113.3	A221 E228 V231 R235	N217-A221 WeakPolarHBondContact O-CB 3.18Å; N217-A221 PolarHBondContact O-N 3Å; N217-E228 HydrophobicContact CB-CG 3.71Å; N217-E228 WeakPolarHBondContact CB-OE1 3.09Å; N217-E228 PolarHBondContact ND2-OE1 2.93Å; N217-E228 VanDerWaalsContact ND2-OE1 3.13Å; N217-V231 HydrophobicContact CB-CB 4.43Å; N217-V231 HydrophobicContact CB-CG1 4.14Å; N217-R235 WeakPolarHBondContact OD1-CD 3.47Å; N217-R235 PolarHBondContact OD1-NH1 3.4Å
218	C	85.3	Confident	86.9	Confident	86 Å²	86	61.5 Å²	61.5	58%	0.581	32%	0.323	S	S	*	.	H	α-helix	trans	-69.9	-40.7	-178	-64.1	0	0	0	0	111.2	N216 A221 K222	N216-C218 VanDerWaalsContact C-N 3.31Å; N216-C218 PolarHBondContact O-N 3.37Å; N216-C218 WeakPolarHBondContact OD1-CB 3.36Å; N216-C218 PolarHBondContact OD1-N 3.44Å; N216-C218 VanDerWaalsContact OD1-N 3.12Å; C218-A221 PolarHBondContact O-N 2.81Å; C218-K222 PolarHBondContact O-N 3.03Å; C218-K222 VanDerWaalsContact O-N 3.11Å
219	Q	82.7	Confident	86.8	Confident	102 Å²	102	68 Å²	68	48%	0.477	35%	0.351	S	S	.	.	H	α-helix	trans	-67	-44.4	175.1	-76.3	-179.7	-27.3	0	0	111.3	N216 A221 K222 Q223	N216-Q219 VanDerWaalsContact ND2-CD 3.3Å; N216-Q219 PolarHBondContact ND2-OE1 3.35Å; N216-Q219 PolarHBondContact O-N 3.07Å; N216-Q219 PolarHBondContact OD1-N 3.41Å; Q219-A221 PolarHBondContact O-N 3.22Å; Q219-K222 PolarHBondContact O-N 2.81Å; Q219-Q223 VanDerWaalsContact O-CB 3.3Å; Q219-Q223 WeakPolarHBondContact O-CB 3.49Å; Q219-Q223 PolarHBondContact O-N 3.3Å
220	A	85.5	Confident	86.6	Confident	0 Å²	0	69.9 Å²	69.9	0%	0	36%	0.361	C	S	.	.	H	α-helix	trans	-60.2	-44	174.2	0	0	0	0	0	112.5	V208 Y211 A212 N216 K222 Q223 F224 V231	V208-A220 HydrophobicContact CG1-CB 4.38Å; Y211-A220 HydrophobicContact CD1-CB 3.79Å; Y211-A220 HydrophobicContact CE1-CB 4.45Å; A212-A220 HydrophobicContact CB-CB 3.66Å; N216-A220 PolarHBondContact O-N 3.26Å; A220-K222 VanDerWaalsContact C-N 3.32Å; A220-K222 PolarHBondContact O-N 2.69Å; A220-Q223 PolarHBondContact O-N 3.46Å; A220-F224 VanDerWaalsContact O-CD2 3.25Å; A220-F224 WeakPolarHBondContact O-CD2 3.36Å; A220-F224 PolarHBondContact O-N 3.08Å; A220-V231 HydrophobicContact CB-CG1 4.11Å; A220-V231 HydrophobicContact CB-CG2 4.43Å
221	A	81.7	Confident	86.5	Confident	12 Å²	12	64.8 Å²	64.8	10%	0.099	34%	0.337	C	S	.	.	H	α-helix	trans	-58.1	-45.2	177.4	0	0	0	0	0	112.2	N217 C218 Q219 G225 V226 E228 V231	N217-A221 WeakPolarHBondContact O-CB 3.18Å; N217-A221 PolarHBondContact O-N 3Å; C218-A221 PolarHBondContact O-N 2.81Å; Q219-A221 PolarHBondContact O-N 3.22Å; A221-G225 PolarHBondContact O-N 3.39Å; A221-G225 VanDerWaalsContact O-N 3.09Å; A221-V226 CarbonylContact C-O 2.96Å; A221-V226 WeakPolarHBondContact CA-O 3.48Å; A221-V226 VanDerWaalsContact CB-O 3.29Å; A221-V226 WeakPolarHBondContact CB-O 3.41Å; A221-V226 PolarHBondContact O-N 2.81Å; A221-V226 VanDerWaalsContact O-O 3.11Å; A221-E228 HydrophobicContact CB-CB 3.8Å; A221-V231 HydrophobicContact CB-CG2 4.2Å
222	K	81.9	Confident	86.7	Confident	187 Å²	187	66.9 Å²	66.9	81%	0.813	35%	0.345	S	S	*	.	H	α-helix	trans	-67.2	-45.9	178	-168.7	178.7	-179.8	-176	0	111.6	C218 Q219 A220 F224	C218-K222 PolarHBondContact O-N 3.03Å; C218-K222 VanDerWaalsContact O-N 3.11Å; Q219-K222 PolarHBondContact O-N 2.81Å; A220-K222 VanDerWaalsContact C-N 3.32Å; A220-K222 PolarHBondContact O-N 2.69Å; K222-F224 PolarHBondContact O-N 3.49Å
223	Q	78.9	Confident	86.5	Confident	126 Å²	126	69.8 Å²	69.8	59%	0.589	36%	0.36	S	S	*	.	H	α-helix	trans	-62.5	-42.6	-177.6	-175.7	64.9	8.4	0	0	112.5	Y211 Q219 A220	Y211-Q223 HydrophobicContact CE1-CB 4.01Å; Y211-Q223 HydrophobicContact CE1-CG 4.18Å; Y211-Q223 HydrophobicContact CE2-CG 4.44Å; Q219-Q223 VanDerWaalsContact O-CB 3.3Å; Q219-Q223 WeakPolarHBondContact O-CB 3.49Å; Q219-Q223 PolarHBondContact O-N 3.3Å; A220-Q223 PolarHBondContact O-N 3.46Å
224	F	79.9	Confident	86.5	Confident	51 Å²	51	66.9 Å²	66.9	22%	0.224	35%	0.346	C	S	.	.	H	α-helix	trans	-100.4	4.6	-174.7	-63.3	-78.5	0	0	0	113.9	F204 M207 V208 Y211 A220 K222 V226	F204-F224 HydrophobicContact CZ-CB 4.22Å; M207-F224 HydrophobicContact CE-CD1 3.88Å; M207-F224 HydrophobicContact CE-CE1 3.56Å; M207-F224 HydrophobicContact CE-CZ 4.49Å; M207-F224 HydrophobicContact CG-CE1 4.17Å; M207-F224 HydrophobicContact CG-CZ 4.25Å; M207-F224 HydrophobicContact SD-CE1 3.98Å; V208-F224 HydrophobicContact CB-CD2 4.32Å; V208-F224 HydrophobicContact CG1-CD2 4.23Å; V208-F224 HydrophobicContact CG2-CB 3.85Å; V208-F224 HydrophobicContact CG2-CD1 4.08Å; V208-F224 HydrophobicContact CG2-CD2 3.84Å; V208-F224 HydrophobicContact CG2-CE2 4.44Å; V208-F224 HydrophobicContact CG2-CG 3.65Å; Y211-F224 HydrophobicContact CD1-CD2 4.47Å; Y211-F224 AromaticContact CD1-CE2 3.68Å; Y211-F224 HydrophobicContact CD1-CE2 3.68Å; Y211-F224 HydrophobicContact CD2-CE2 4.15Å; Y211-F224 HydrophobicContact CD2-CZ 4.29Å; Y211-F224 HydrophobicContact CE1-CE2 4.39Å; Y211-F224 AromaticContact CG-CE2 3.53Å; Y211-F224 HydrophobicContact CG-CE2 3.53Å; Y211-F224 HydrophobicContact CG-CZ 4.05Å; A220-F224 VanDerWaalsContact O-CD2 3.25Å; A220-F224 WeakPolarHBondContact O-CD2 3.36Å; A220-F224 PolarHBondContact O-N 3.08Å; K222-F224 PolarHBondContact O-N 3.49Å; F224-V226 VanDerWaalsContact C-N 3.31Å; F224-V226 HydrophobicContact CB-CG2 4.35Å; F224-V226 PolarHBondContact O-N 3Å
225	G	80.5	Confident	86.6	Confident	37 Å²	37	66.9 Å²	66.9	38%	0.381	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.1	37.3	178.8	0	0	0	0	0	113.5	A221	A221-G225 PolarHBondContact O-N 3.39Å; A221-G225 VanDerWaalsContact O-N 3.09Å
226	V	82.9	Confident	86.6	Confident	12 Å²	12	71.4 Å²	71.4	7%	0.073	35%	0.346	C	S	.	.			trans	-118.5	159.2	179.1	-61.8	0	0	0	0	111.1	Y200 F204 V208 A221 F224 V231 W234	Y200-V226 HydrophobicContact CD1-CG1 4.49Å; Y200-V226 HydrophobicContact CE1-CG1 3.7Å; F204-V226 HydrophobicContact CE1-CG1 3.9Å; F204-V226 HydrophobicContact CZ-CG1 4.02Å; V208-V226 HydrophobicContact CG1-CG2 4.21Å; A221-V226 CarbonylContact C-O 2.96Å; A221-V226 WeakPolarHBondContact CA-O 3.48Å; A221-V226 VanDerWaalsContact CB-O 3.29Å; A221-V226 WeakPolarHBondContact CB-O 3.41Å; A221-V226 PolarHBondContact O-N 2.81Å; A221-V226 VanDerWaalsContact O-O 3.11Å; F224-V226 VanDerWaalsContact C-N 3.31Å; F224-V226 HydrophobicContact CB-CG2 4.35Å; F224-V226 PolarHBondContact O-N 3Å; V226-V231 HydrophobicContact CG2-CG2 3.65Å; V226-W234 HydrophobicContact CB-CH2 4.45Å; V226-W234 HydrophobicContact CB-CZ3 4.5Å; V226-W234 HydrophobicContact CG1-CH2 4.14Å; V226-W234 HydrophobicContact CG1-CZ3 4.32Å; V226-W234 HydrophobicContact CG2-CZ3 4.31Å
227	L	84.1	Confident	86.4	Confident	119 Å²	119	70.4 Å²	70.4	62%	0.623	34%	0.342	S	S	*	.			trans	-68.1	135.7	174	-63.7	174	0	0	0	110	K229 N230 V231	L227-K229 PolarHBondContact O-N 3.16Å; L227-N230 WeakPolarHBondContact O-CA 3.47Å; L227-N230 VanDerWaalsContact O-CB 3.27Å; L227-N230 WeakPolarHBondContact O-CB 3.28Å; L227-N230 PolarHBondContact O-N 2.86Å; L227-V231 PolarHBondContact O-N 3.09Å
228	E	89.2	Confident	86.4	Confident	48 Å²	48	71 Å²	71	22%	0.224	34%	0.343	C	S	.	.	H	α-helix	trans	-54.5	-36.8	175.7	-176.9	-76	151.8	0	0	112	N217 A221 N230 V231 R232	N217-E228 HydrophobicContact CB-CG 3.71Å; N217-E228 WeakPolarHBondContact CB-OE1 3.09Å; N217-E228 PolarHBondContact ND2-OE1 2.93Å; N217-E228 VanDerWaalsContact ND2-OE1 3.13Å; A221-E228 HydrophobicContact CB-CB 3.8Å; E228-N230 VanDerWaalsContact C-N 3.26Å; E228-N230 PolarHBondContact O-N 3.2Å; E228-V231 WeakPolarHBondContact O-CB 3.43Å; E228-V231 PolarHBondContact O-N 3.09Å; E228-V231 VanDerWaalsContact O-N 3.08Å; E228-R232 VanDerWaalsContact CD-NH2 3.27Å; E228-R232 PolarHBondContact O-N 3.41Å; E228-R232 IonicContact OE1-CZ 2.75Å; E228-R232 IonicContact OE1-NE 3.37Å; E228-R232 PolarHBondContact OE1-NE 3.31Å; E228-R232 VanDerWaalsContact OE1-NE 3.16Å; E228-R232 IonicContact OE1-NH2 3.82Å; E228-R232 PolarHBondContact OE1-NH2 3.19Å; E228-R232 VanDerWaalsContact OE1-NH2 3.14Å; E228-R232 IonicContact OE2-CZ 3.45Å; E228-R232 IonicContact OE2-NE 2.81Å; E228-R232 IonicContact OE2-NH2 3.14Å; E228-R232 PolarHBondContact OE2-NH2 2.89Å
229	K	88.1	Confident	86.4	Confident	135 Å²	135	70.7 Å²	70.7	59%	0.587	34%	0.34	S	S	*	.	H	α-helix	trans	-54.4	-41.7	172.6	-176.6	-176.9	175.7	-173.9	0	112.4	L227 R232 D233	L227-K229 PolarHBondContact O-N 3.16Å; K229-R232 PolarHBondContact O-N 2.9Å; K229-D233 WeakPolarHBondContact O-CB 3.35Å; K229-D233 PolarHBondContact O-N 3.34Å
230	N	87.3	Confident	86.2	Confident	40 Å²	40	70.9 Å²	70.9	21%	0.214	34%	0.341	C	S	.	.	H	α-helix	trans	-65.2	-42.5	178.4	-66.6	-12.6	0	0	0	110.9	L227 E228 R232 D233 W234	L227-N230 WeakPolarHBondContact O-CA 3.47Å; L227-N230 VanDerWaalsContact O-CB 3.27Å; L227-N230 WeakPolarHBondContact O-CB 3.28Å; L227-N230 PolarHBondContact O-N 2.86Å; E228-N230 VanDerWaalsContact C-N 3.26Å; E228-N230 PolarHBondContact O-N 3.2Å; N230-R232 VanDerWaalsContact C-N 3.31Å; N230-R232 PolarHBondContact O-N 2.8Å; N230-D233 PolarHBondContact O-N 3.37Å; N230-W234 HydrophobicContact CB-CD2 4.32Å; N230-W234 HydrophobicContact CB-CE3 4.46Å; N230-W234 HydrophobicContact CB-CH2 3.93Å; N230-W234 HydrophobicContact CB-CZ2 3.74Å; N230-W234 HydrophobicContact CB-CZ3 4.28Å; N230-W234 WeakPolarHBondContact O-CB 3.36Å; N230-W234 PolarHBondContact O-N 3.09Å
231	V	90.3	Very high	86.1	Confident	0 Å²	0	70.9 Å²	70.9	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-57.2	-48.7	175.9	-175.8	0	0	0	0	109.9	V208 A212 N217 A220 A221 V226 L227 E228 D233 W234 R235	V208-V231 HydrophobicContact CG1-CB 4.44Å; V208-V231 HydrophobicContact CG1-CG1 4.17Å; V208-V231 HydrophobicContact CG1-CG2 3.76Å; A212-V231 HydrophobicContact CB-CG1 3.56Å; N217-V231 HydrophobicContact CB-CB 4.43Å; N217-V231 HydrophobicContact CB-CG1 4.14Å; A220-V231 HydrophobicContact CB-CG1 4.11Å; A220-V231 HydrophobicContact CB-CG2 4.43Å; A221-V231 HydrophobicContact CB-CG2 4.2Å; V226-V231 HydrophobicContact CG2-CG2 3.65Å; L227-V231 PolarHBondContact O-N 3.09Å; E228-V231 WeakPolarHBondContact O-CB 3.43Å; E228-V231 PolarHBondContact O-N 3.09Å; E228-V231 VanDerWaalsContact O-N 3.08Å; V231-D233 PolarHBondContact O-N 2.88Å; V231-W234 PolarHBondContact O-N 3.15Å; V231-R235 WeakPolarHBondContact O-CG 3.46Å; V231-R235 PolarHBondContact O-N 2.98Å
232	R	92.8	Very high	86.1	Confident	121 Å²	121	75.4 Å²	75.4	46%	0.457	36%	0.36	S	S	.	.	H	α-helix	trans	-60.3	-44.2	178	-164.4	-170.6	-51.7	174.9	1.1	112.7	E228 K229 N230 R235 K236	E228-R232 VanDerWaalsContact CD-NH2 3.27Å; E228-R232 PolarHBondContact O-N 3.41Å; E228-R232 IonicContact OE1-CZ 2.75Å; E228-R232 IonicContact OE1-NE 3.37Å; E228-R232 PolarHBondContact OE1-NE 3.31Å; E228-R232 VanDerWaalsContact OE1-NE 3.16Å; E228-R232 IonicContact OE1-NH2 3.82Å; E228-R232 PolarHBondContact OE1-NH2 3.19Å; E228-R232 VanDerWaalsContact OE1-NH2 3.14Å; E228-R232 IonicContact OE2-CZ 3.45Å; E228-R232 IonicContact OE2-NE 2.81Å; E228-R232 IonicContact OE2-NH2 3.14Å; E228-R232 PolarHBondContact OE2-NH2 2.89Å; K229-R232 PolarHBondContact O-N 2.9Å; N230-R232 VanDerWaalsContact C-N 3.31Å; N230-R232 PolarHBondContact O-N 2.8Å; R232-R235 PolarHBondContact O-N 3.26Å; R232-K236 PolarHBondContact O-N 2.88Å
233	D	88.4	Confident	85.7	Confident	62 Å²	62	73.6 Å²	73.6	33%	0.332	36%	0.359	S	S	.	.	H	α-helix	trans	-70	-34.8	179.8	-72.9	-23	0	0	0	112	K229 N230 V231 K236	K229-D233 WeakPolarHBondContact O-CB 3.35Å; K229-D233 PolarHBondContact O-N 3.34Å; N230-D233 PolarHBondContact O-N 3.37Å; V231-D233 PolarHBondContact O-N 2.88Å; D233-K236 PolarHBondContact O-N 2.68Å; D233-K236 IonicContact OD1-NZ 3.52Å; D233-K236 PolarHBondContact OD1-NZ 3.37Å
234	W	92.9	Very high	85.3	Confident	27 Å²	27	68.5 Å²	68.5	10%	0.102	34%	0.339	C	S	.	.	H	α-helix	trans	-70.1	-36.6	175.1	-61.7	-21.9	0	0	0	112.7	Y200 F204 K205 V208 V209 V226 N230 V231 K236 V237 K238 L241	Y200-W234 HydrophobicContact CD1-CH2 4.13Å; Y200-W234 AromaticContact CD2-CH2 3.59Å; Y200-W234 HydrophobicContact CD2-CH2 3.59Å; Y200-W234 AromaticContact CD2-CZ2 3.46Å; Y200-W234 HydrophobicContact CD2-CZ2 3.46Å; Y200-W234 VanDerWaalsContact CD2-CZ2 3.46Å; Y200-W234 HydrophobicContact CE1-CH2 4.45Å; Y200-W234 AromaticContact CE2-CH2 3.96Å; Y200-W234 HydrophobicContact CE2-CH2 3.96Å; Y200-W234 HydrophobicContact CE2-CZ2 4.03Å; Y200-W234 AromaticContact CG-CH2 3.68Å; Y200-W234 HydrophobicContact CG-CH2 3.68Å; Y200-W234 AromaticContact CG-CZ2 3.85Å; Y200-W234 HydrophobicContact CG-CZ2 3.85Å; F204-W234 HydrophobicContact CD1-CZ3 4.48Å; F204-W234 HydrophobicContact CE1-CH2 4.21Å; F204-W234 HydrophobicContact CE1-CZ3 4.17Å; K205-W234 HydrophobicContact CB-CB 4.48Å; K205-W234 HydrophobicContact CB-CD2 4.03Å; K205-W234 HydrophobicContact CB-CE3 4.15Å; K205-W234 HydrophobicContact CB-CG 4.16Å; K205-W234 HydrophobicContact CD-CD2 4.14Å; K205-W234 HydrophobicContact CD-CG 4.15Å; K205-W234 HydrophobicContact CD-CZ2 4.48Å; K205-W234 HydrophobicContact CG-CD2 3.57Å; K205-W234 HydrophobicContact CG-CE3 3.89Å; K205-W234 HydrophobicContact CG-CG 3.97Å; K205-W234 HydrophobicContact CG-CH2 4.26Å; K205-W234 HydrophobicContact CG-CZ2 3.99Å; K205-W234 HydrophobicContact CG-CZ3 4.21Å; V208-W234 HydrophobicContact CB-CE3 4.36Å; V208-W234 HydrophobicContact CB-CZ3 4.31Å; V208-W234 HydrophobicContact CG1-CE3 4.19Å; V208-W234 HydrophobicContact CG1-CZ3 4.12Å; V208-W234 HydrophobicContact CG2-CZ3 4.34Å; V209-W234 HydrophobicContact CG2-CB 3.71Å; V226-W234 HydrophobicContact CB-CH2 4.45Å; V226-W234 HydrophobicContact CB-CZ3 4.5Å; V226-W234 HydrophobicContact CG1-CH2 4.14Å; V226-W234 HydrophobicContact CG1-CZ3 4.32Å; V226-W234 HydrophobicContact CG2-CZ3 4.31Å; N230-W234 HydrophobicContact CB-CD2 4.32Å; N230-W234 HydrophobicContact CB-CE3 4.46Å; N230-W234 HydrophobicContact CB-CH2 3.93Å; N230-W234 HydrophobicContact CB-CZ2 3.74Å; N230-W234 HydrophobicContact CB-CZ3 4.28Å; N230-W234 WeakPolarHBondContact O-CB 3.36Å; N230-W234 PolarHBondContact O-N 3.09Å; V231-W234 PolarHBondContact O-N 3.15Å; W234-K236 VanDerWaalsContact C-N 3.3Å; W234-K236 PolarHBondContact O-N 3.12Å; W234-V237 CarbonylContact O-C 3.56Å; W234-V237 WeakPolarHBondContact O-CG2 3.48Å; W234-V237 PolarHBondContact O-N 3Å; W234-V237 VanDerWaalsContact O-N 3.1Å; W234-K238 PolarHBondContact O-N 3.25Å; W234-K238 VanDerWaalsContact O-N 3.12Å; W234-L241 HydrophobicContact CB-CD1 4.22Å
235	R	92.5	Very high	85	Confident	95 Å²	95	72.6 Å²	72.6	36%	0.358	36%	0.358	S	S	.	.	H	α-helix	trans	-58.2	-40.6	173.9	-74.1	-177.5	74.3	170.5	5.6	112.2	V209 N217 V231 R232 V237 K238	V209-R235 HydrophobicContact CB-CG 4.38Å; V209-R235 HydrophobicContact CG1-CG 4.03Å; V209-R235 HydrophobicContact CG2-CG 3.9Å; N217-R235 WeakPolarHBondContact OD1-CD 3.47Å; N217-R235 PolarHBondContact OD1-NH1 3.4Å; V231-R235 WeakPolarHBondContact O-CG 3.46Å; V231-R235 PolarHBondContact O-N 2.98Å; R232-R235 PolarHBondContact O-N 3.26Å; R235-V237 PolarHBondContact O-N 3.47Å; R235-K238 WeakPolarHBondContact O-CB 3.37Å; R235-K238 PolarHBondContact O-N 3.42Å
236	K	92.3	Very high	84.5	Confident	148 Å²	148	73.6 Å²	73.6	64%	0.643	36%	0.363	S	S	*	.	H	α-helix	trans	-61	-28.8	177.3	-67.5	173.1	-175	166	0	113.5	R232 D233 W234	R232-K236 PolarHBondContact O-N 2.88Å; D233-K236 PolarHBondContact O-N 2.68Å; D233-K236 IonicContact OD1-NZ 3.52Å; D233-K236 PolarHBondContact OD1-NZ 3.37Å; W234-K236 VanDerWaalsContact C-N 3.3Å; W234-K236 PolarHBondContact O-N 3.12Å
237	V	86.9	Confident	84	Confident	42 Å²	42	80.1 Å²	80.1	26%	0.255	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.6	17.2	-178.1	-60.2	0	0	0	0	112.5	W234 R235 P239 Q240 L241	W234-V237 CarbonylContact O-C 3.56Å; W234-V237 WeakPolarHBondContact O-CG2 3.48Å; W234-V237 PolarHBondContact O-N 3Å; W234-V237 VanDerWaalsContact O-N 3.1Å; R235-V237 PolarHBondContact O-N 3.47Å; V237-P239 VanDerWaalsContact C-CD 3.49Å; V237-Q240 HydrophobicContact CB-CB 4.46Å; V237-Q240 WeakPolarHBondContact O-CB 3.33Å; V237-Q240 PolarHBondContact O-N 3.1Å; V237-L241 HydrophobicContact CG2-CD1 4.05Å; V237-L241 HydrophobicContact CG2-CG 4.25Å; V237-L241 PolarHBondContact O-N 3.12Å
238	K	89.3	Confident	83.4	Confident	41 Å²	41	79.8 Å²	79.8	18%	0.178	39%	0.385	C	S	.	.	H	α-helix	trans	-50.1	-45.6	180	179.8	-176.6	175.9	-178.5	0	113.4	L206 V209 E213 W234 R235 Q240 L241 Q242	L206-K238 HydrophobicContact CD2-CG 4.4Å; V209-K238 HydrophobicContact CG1-CB 4.2Å; V209-K238 HydrophobicContact CG1-CD 3.67Å; V209-K238 HydrophobicContact CG1-CG 3.94Å; E213-K238 VanDerWaalsContact OE1-CD 3.24Å; E213-K238 WeakPolarHBondContact OE1-CD 3.31Å; E213-K238 IonicContact OE1-NZ 3.12Å; E213-K238 PolarHBondContact OE1-NZ 3.35Å; E213-K238 IonicContact OE2-NZ 3.31Å; E213-K238 PolarHBondContact OE2-NZ 3.16Å; W234-K238 PolarHBondContact O-N 3.25Å; W234-K238 VanDerWaalsContact O-N 3.12Å; R235-K238 WeakPolarHBondContact O-CB 3.37Å; R235-K238 PolarHBondContact O-N 3.42Å; K238-Q240 VanDerWaalsContact C-N 3.26Å; K238-Q240 PolarHBondContact O-N 3.05Å; K238-L241 WeakPolarHBondContact O-CB 3.21Å; K238-L241 PolarHBondContact O-N 2.85Å; K238-L241 VanDerWaalsContact O-N 3.1Å; K238-Q242 HydrophobicContact CG-CG 4.46Å; K238-Q242 WeakPolarHBondContact O-CG 3.49Å; K238-Q242 PolarHBondContact O-N 2.82Å
239	P	86.2	Confident	82.8	Confident	79 Å²	79	84.3 Å²	84.3	51%	0.513	40%	0.4	S	S	.	.	H	α-helix	trans	-61.8	-32.9	177.8	-23.4	34.6	0	0	0	113.3	V237 N243	V237-P239 VanDerWaalsContact C-CD 3.49Å; P239-N243 PolarHBondContact O-N 2.97Å; P239-N243 PolarHBondContact O-ND2 2.79Å
240	Q	78.1	Confident	81.8	Confident	106 Å²	106	80.5 Å²	80.5	50%	0.495	39%	0.394	S	S	.	.	H	α-helix	trans	-74.8	-31.8	178.1	-60.5	166.4	3.1	0	0	111.6	V237 K238 A244 F251	V237-Q240 HydrophobicContact CB-CB 4.46Å; V237-Q240 WeakPolarHBondContact O-CB 3.33Å; V237-Q240 PolarHBondContact O-N 3.1Å; K238-Q240 VanDerWaalsContact C-N 3.26Å; K238-Q240 PolarHBondContact O-N 3.05Å; Q240-A244 WeakPolarHBondContact O-CB 3.49Å; Q240-A244 PolarHBondContact O-N 3.02Å; Q240-F251 HydrophobicContact CB-CE1 4.22Å; Q240-F251 HydrophobicContact CB-CZ 4.31Å; Q240-F251 WeakPolarHBondContact O-CE1 3.31Å; Q240-F251 WeakPolarHBondContact O-CZ 3.32Å
241	L	83.4	Confident	80.5	Confident	1 Å²	1	82.5 Å²	82.5	1%	0.005	40%	0.401	C	S	.	.	H	α-helix	trans	-69.9	-42.1	174.8	-70.6	167.9	0	0	0	111.9	A202 K205 L206 W234 V237 K238 N243 A244 F251	A202-L241 HydrophobicContact CB-CD2 3.96Å; K205-L241 HydrophobicContact CB-CD1 3.88Å; K205-L241 HydrophobicContact CB-CD2 4Å; K205-L241 HydrophobicContact CD-CD2 3.75Å; L206-L241 HydrophobicContact CD1-CB 4.37Å; L206-L241 HydrophobicContact CD2-CB 3.54Å; L206-L241 HydrophobicContact CG-CB 3.81Å; W234-L241 HydrophobicContact CB-CD1 4.22Å; V237-L241 HydrophobicContact CG2-CD1 4.05Å; V237-L241 HydrophobicContact CG2-CG 4.25Å; V237-L241 PolarHBondContact O-N 3.12Å; K238-L241 WeakPolarHBondContact O-CB 3.21Å; K238-L241 PolarHBondContact O-N 2.85Å; K238-L241 VanDerWaalsContact O-N 3.1Å; L241-N243 VanDerWaalsContact C-N 3.29Å; L241-N243 PolarHBondContact O-N 3.4Å; L241-A244 PolarHBondContact O-N 3.09Å; L241-A244 VanDerWaalsContact O-N 3.14Å; L241-F251 HydrophobicContact CD2-CE2 3.54Å; L241-F251 HydrophobicContact CD2-CZ 3.82Å; L241-F251 HydrophobicContact CG-CE2 4.2Å; L241-F251 HydrophobicContact CG-CZ 4.3Å
242	Q	81.4	Confident	79	Confident	107 Å²	107	93.4 Å²	93.4	50%	0.5	44%	0.442	S	S	.	.	H	α-helix	trans	-63.3	-35	177.3	-70.9	174.8	-46.8	0	0	112.4	L206 K238 A244	L206-Q242 HydrophobicContact CD2-CG 3.71Å; K238-Q242 HydrophobicContact CG-CG 4.46Å; K238-Q242 WeakPolarHBondContact O-CG 3.49Å; K238-Q242 PolarHBondContact O-N 2.82Å; Q242-A244 VanDerWaalsContact C-N 3.29Å; Q242-A244 PolarHBondContact O-N 3.38Å
243	N	74.3	Confident	77.3	Confident	148 Å²	148	89.9 Å²	89.9	79%	0.791	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.5	5.9	177.3	-69.3	-53.7	0	0	0	113.9	P239 L241	P239-N243 PolarHBondContact O-N 2.97Å; P239-N243 PolarHBondContact O-ND2 2.79Å; L241-N243 VanDerWaalsContact C-N 3.29Å; L241-N243 PolarHBondContact O-N 3.4Å
244	A	70.8	Confident	75.7	Confident	19 Å²	19	91.6 Å²	91.6	16%	0.157	46%	0.458	C	S	.	.	S	Bend	trans	-108.4	147.5	-178.9	0	0	0	0	0	112.1	A202 Q240 L241 Q242 A246 F251	A202-A244 HydrophobicContact CB-CB 4.3Å; Q240-A244 WeakPolarHBondContact O-CB 3.49Å; Q240-A244 PolarHBondContact O-N 3.02Å; L241-A244 PolarHBondContact O-N 3.09Å; L241-A244 VanDerWaalsContact O-N 3.14Å; Q242-A244 VanDerWaalsContact C-N 3.29Å; Q242-A244 PolarHBondContact O-N 3.38Å; A244-A246 PolarHBondContact O-N 3.04Å; A244-F251 HydrophobicContact CB-CE1 3.72Å; A244-F251 HydrophobicContact CB-CZ 3.74Å
245	H	72.5	Confident	74	Confident	138 Å²	138	99.6 Å²	99.6	64%	0.639	49%	0.494	S	S	*	.			trans	-56.8	134.1	170.7	-173.6	-85.8	0	0	0	111.2	M247 R248	H245-M247 VanDerWaalsContact C-N 3.28Å; H245-M247 PolarHBondContact ND1-N 3.12Å; H245-M247 PolarHBondContact O-N 3.28Å; H245-M247 VanDerWaalsContact O-N 3.12Å; H245-R248 WeakPolarHBondContact O-CB 3.26Å; H245-R248 PolarHBondContact O-N 3.36Å
246	A	71.2	Confident	72.5	Confident	58 Å²	58	100.1 Å²	100.1	48%	0.479	50%	0.503	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.5	-40.6	-171.4	0	0	0	0	0	113.7	D201 A202 G203 A244 R248	D201-A246 WeakPolarHBondContact CB-O 3.43Å; A202-A246 PolarHBondContact N-O 3.46Å; G203-A246 PolarHBondContact N-O 3.2Å; A244-A246 PolarHBondContact O-N 3.04Å; A246-R248 PolarHBondContact O-N 2.78Å
247	M	71.3	Confident	71.4	Confident	149 Å²	149	93.6 Å²	93.6	73%	0.734	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.6	0	178.5	-65	-175.3	161	0	0	115	H245 R249	H245-M247 VanDerWaalsContact C-N 3.28Å; H245-M247 PolarHBondContact ND1-N 3.12Å; H245-M247 PolarHBondContact O-N 3.28Å; H245-M247 VanDerWaalsContact O-N 3.12Å; M247-R249 PolarHBondContact O-N 3.36Å
248	R	73	Confident	71.1	Confident	112 Å²	112	101.9 Å²	101.9	42%	0.423	51%	0.505	S	S	.	.			trans	-74.9	114.8	-174.7	-173.7	174.7	-173.5	149	-4	112.1	D201 A202 H245 A246 A250	D201-R248 CarbonylContact C-O 3.57Å; A202-R248 HydrophobicContact CB-CB 4.33Å; A202-R248 WeakPolarHBondContact CB-O 3.44Å; A202-R248 PolarHBondContact N-O 3.09Å; H245-R248 WeakPolarHBondContact O-CB 3.26Å; H245-R248 PolarHBondContact O-N 3.36Å; A246-R248 PolarHBondContact O-N 2.78Å; R248-A250 PolarHBondContact NE-O 3.37Å; R248-A250 VanDerWaalsContact NE-O 3.09Å
249	R	75.6	Confident	70.9	Confident	142 Å²	142	102.1 Å²	102.1	54%	0.536	51%	0.506	S	S	.	.			trans	-88.6	-26.1	-175.2	-57	179	90.3	164.4	7.4	115.1	S199 Y200 D201 K205 M247	S199-R249 PolarHBondContact O-NH2 2.87Å; S199-R249 PolarHBondContact OG-NE 2.81Å; Y200-R249 WeakPolarHBondContact O-CA 3.3Å; D201-R249 HydrophobicContact CB-CG 3.9Å; K205-R249 PolarHBondContact NZ-O 2.7Å; M247-R249 PolarHBondContact O-N 3.36Å
250	A	66.4	Low	70.9	Confident	56 Å²	56	100.1 Å²	100.1	46%	0.463	50%	0.497	S	S	.	.			trans	-141.1	145.1	178.5	0	0	0	0	0	112.6	R248 R252	R248-A250 PolarHBondContact NE-O 3.37Å; R248-A250 VanDerWaalsContact NE-O 3.09Å; A250-R252 PolarHBondContact O-N 3.42Å
251	F	60.2	Low	71.3	Confident	82 Å²	82	99 Å²	99	36%	0.36	49%	0.494	S	S	.	.	S	Bend	trans	-87.3	21.6	169.1	-67.8	-84.2	0	0	0	112.5	Q240 L241 A244	Q240-F251 HydrophobicContact CB-CE1 4.22Å; Q240-F251 HydrophobicContact CB-CZ 4.31Å; Q240-F251 WeakPolarHBondContact O-CE1 3.31Å; Q240-F251 WeakPolarHBondContact O-CZ 3.32Å; L241-F251 HydrophobicContact CD2-CE2 3.54Å; L241-F251 HydrophobicContact CD2-CZ 3.82Å; L241-F251 HydrophobicContact CG-CE2 4.2Å; L241-F251 HydrophobicContact CG-CZ 4.3Å; A244-F251 HydrophobicContact CB-CE1 3.72Å; A244-F251 HydrophobicContact CB-CZ 3.74Å
252	R	60.4	Low	71.6	Confident	228 Å²	228	99 Å²	99	86%	0.86	49%	0.494	S	S	*	.			trans	-109.7	87.7	177.9	-59	-173.3	-175.4	-168.9	1	108.3	A250	A250-R252 PolarHBondContact O-N 3.42Å
253	G	56.4	Low	72	Confident	48 Å²	48	94 Å²	94	50%	0.495	47%	0.47	S	S	.	.			trans	-65.8	147	147	0	0	0	0	0	107.2	K255	G253-K255 PolarHBondContact O-N 2.86Å; G253-K255 VanDerWaalsContact O-N 3.13Å
254	P	53.8	Low	72.8	Confident	98 Å²	98	90.9 Å²	90.9	64%	0.636	45%	0.451	S	S	*	.			trans	-61.2	124.5	176.1	29.2	-34.8	0	0	0	107.9	N256	P254-N256 VanDerWaalsContact CB-O 3.31Å; P254-N256 WeakPolarHBondContact CB-O 3.38Å; P254-N256 PolarHBondContact O-N 3.13Å; P254-N256 VanDerWaalsContact O-N 3.16Å
255	K	57.8	Low	73.8	Confident	194 Å²	194	93.9 Å²	93.9	84%	0.843	46%	0.458	S	S	*	.	S	Bend	trans	-56.2	-29.2	178.8	-71.1	-170.6	175.5	-171.3	0	111	G253 R316	G253-K255 PolarHBondContact O-N 2.86Å; G253-K255 VanDerWaalsContact O-N 3.13Å; K255-R316 WeakPolarHBondContact O-CD 3.45Å
256	N	60.6	Low	74.7	Confident	106 Å²	106	87.3 Å²	87.3	57%	0.567	43%	0.428	S	S	*	.	S	Bend	trans	-119.2	142.2	178.2	-58.7	-11.2	0	0	0	109.4	P254 A260	P254-N256 VanDerWaalsContact CB-O 3.31Å; P254-N256 WeakPolarHBondContact CB-O 3.38Å; P254-N256 PolarHBondContact O-N 3.13Å; P254-N256 VanDerWaalsContact O-N 3.16Å; N256-A260 HydrophobicContact CB-CB 3.94Å
257	G	70.7	Confident	75.5	Confident	11 Å²	11	84.6 Å²	84.6	11%	0.113	41%	0.405	C	S	.	.			trans	-64.3	166.1	170.2	0	0	0	0	0	112	F259 A260 D263	G257-F259 PolarHBondContact O-N 3.43Å; G257-F259 VanDerWaalsContact O-N 3.11Å; G257-A260 PolarHBondContact O-N 3.16Å; G257-D263 VanDerWaalsContact CA-OD2 3.28Å; G257-D263 WeakPolarHBondContact CA-OD2 3.33Å; G257-D263 PolarHBondContact N-OD2 3.21Å
258	R	78.6	Confident	76.4	Confident	216 Å²	216	82 Å²	82	82%	0.815	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.5	-31.5	172.3	-178.6	179.1	178.3	-174.2	0.3	112
259	F	86.6	Confident	77.1	Confident	46 Å²	46	79.8 Å²	79.8	20%	0.202	38%	0.383	C	S	.	.	T	Hydrogen-bonded Turn	trans	-117	70.6	177.1	-59	-78.4	0	0	0	109.3	G257 L261 V262 D263 I298 G302 F303	G257-F259 PolarHBondContact O-N 3.43Å; G257-F259 VanDerWaalsContact O-N 3.11Å; F259-L261 VanDerWaalsContact C-N 3.27Å; F259-L261 PolarHBondContact O-N 3Å; F259-V262 HydrophobicContact CB-CB 3.95Å; F259-V262 HydrophobicContact CB-CG2 3.83Å; F259-V262 PolarHBondContact O-N 3.12Å; F259-V262 VanDerWaalsContact O-N 3.16Å; F259-D263 PolarHBondContact O-N 3.39Å; F259-I298 HydrophobicContact CD1-CD1 3.62Å; F259-I298 HydrophobicContact CD1-CG2 4.49Å; F259-I298 HydrophobicContact CE1-CD1 3.97Å; F259-I298 HydrophobicContact CE1-CG1 4.46Å; F259-I298 HydrophobicContact CE1-CG2 3.8Å; F259-I298 HydrophobicContact CG-CD1 4.44Å; F259-I298 HydrophobicContact CZ-CG2 4.18Å; F259-G302 WeakPolarHBondContact CE2-O 3.48Å; F259-G302 WeakPolarHBondContact CZ-O 3.43Å; F259-F303 HydrophobicContact CB-CD2 4.45Å; F259-F303 HydrophobicContact CD2-CB 4.29Å; F259-F303 AromaticContact CD2-CD2 3.29Å; F259-F303 HydrophobicContact CD2-CD2 3.29Å; F259-F303 AromaticContact CD2-CE2 3.94Å; F259-F303 HydrophobicContact CD2-CE2 3.94Å; F259-F303 HydrophobicContact CD2-CG 4.15Å; F259-F303 HydrophobicContact CE2-CB 3.88Å; F259-F303 AromaticContact CE2-CD2 3.6Å; F259-F303 HydrophobicContact CE2-CD2 3.6Å; F259-F303 HydrophobicContact CE2-CG 4.2Å; F259-F303 AromaticContact CG-CD2 3.96Å; F259-F303 HydrophobicContact CG-CD2 3.96Å; F259-F303 HydrophobicContact CG-CE2 4.48Å; F259-F303 HydrophobicContact CZ-CB 4.01Å; F259-F303 HydrophobicContact CZ-CD2 4.49Å
260	A	84.6	Confident	77.5	Confident	38 Å²	38	73.1 Å²	73.1	31%	0.314	36%	0.359	S	S	.	.	H	α-helix	trans	-58.4	-36.6	-173	0	0	0	0	0	113.3	N256 G257 D263 Q264	N256-A260 HydrophobicContact CB-CB 3.94Å; G257-A260 PolarHBondContact O-N 3.16Å; A260-D263 WeakPolarHBondContact O-CB 3.11Å; A260-D263 PolarHBondContact O-N 3.29Å; A260-Q264 WeakPolarHBondContact O-CB 3.15Å; A260-Q264 PolarHBondContact O-N 3.5Å
261	L	87.8	Confident	78.4	Confident	83 Å²	83	77 Å²	77	44%	0.435	36%	0.361	S	S	.	.	H	α-helix	trans	-71.6	-35.4	179	-167	62.6	0	0	0	112.4	F259 Q264 R265 M296	F259-L261 VanDerWaalsContact C-N 3.27Å; F259-L261 PolarHBondContact O-N 3Å; L261-Q264 PolarHBondContact O-N 3.44Å; L261-R265 PolarHBondContact O-N 2.89Å; L261-M296 HydrophobicContact CB-CE 3.92Å; L261-M296 HydrophobicContact CB-SD 4.1Å; L261-M296 HydrophobicContact CD2-CE 3.57Å; L261-M296 HydrophobicContact CD2-SD 3.88Å; L261-M296 HydrophobicContact CG-CE 4.18Å; L261-M296 HydrophobicContact CG-SD 4.1Å
262	V	90.3	Very high	79.4	Confident	1 Å²	1	80 Å²	80	1%	0.006	37%	0.371	C	S	.	.	H	α-helix	trans	-63.9	-47.3	172.1	-179.5	0	0	0	0	109.6	F259 Q264 R265 V266 A289 I292 M296 I298 F303 W309	F259-V262 HydrophobicContact CB-CB 3.95Å; F259-V262 HydrophobicContact CB-CG2 3.83Å; F259-V262 PolarHBondContact O-N 3.12Å; F259-V262 VanDerWaalsContact O-N 3.16Å; V262-Q264 VanDerWaalsContact C-N 3.29Å; V262-Q264 PolarHBondContact O-N 3.16Å; V262-R265 PolarHBondContact O-N 2.65Å; V262-V266 HydrophobicContact CG1-CG2 4.35Å; V262-V266 VanDerWaalsContact O-CG2 3.23Å; V262-V266 WeakPolarHBondContact O-CG2 3.37Å; V262-V266 PolarHBondContact O-N 3.2Å; V262-A289 HydrophobicContact CG1-CB 3.97Å; V262-I292 HydrophobicContact CB-CG2 4.44Å; V262-I292 HydrophobicContact CG1-CG2 4.45Å; V262-I292 HydrophobicContact CG2-CG2 4.15Å; V262-M296 HydrophobicContact CG2-SD 3.83Å; V262-I298 HydrophobicContact CG2-CD1 3.84Å; V262-F303 HydrophobicContact CG1-CE1 4.04Å; V262-F303 HydrophobicContact CG1-CE2 4.44Å; V262-F303 HydrophobicContact CG1-CZ 3.77Å; V262-W309 HydrophobicContact CG1-CZ2 4.3Å
263	D	90	Very high	80.2	Confident	0 Å²	0	70.4 Å²	70.4	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-56.2	-44.8	176	-70.7	-1.5	0	0	0	111.5	G257 F259 A260 A267 W309 M313 R316 Y317	G257-D263 VanDerWaalsContact CA-OD2 3.28Å; G257-D263 WeakPolarHBondContact CA-OD2 3.33Å; G257-D263 PolarHBondContact N-OD2 3.21Å; F259-D263 PolarHBondContact O-N 3.39Å; A260-D263 WeakPolarHBondContact O-CB 3.11Å; A260-D263 PolarHBondContact O-N 3.29Å; D263-A267 WeakPolarHBondContact O-CB 3.24Å; D263-A267 PolarHBondContact O-N 2.95Å; D263-W309 PolarHBondContact OD1-NE1 3Å; D263-M313 HydrophobicContact CB-CG 3.76Å; D263-R316 IonicContact OD1-NH2 3.18Å; D263-R316 PolarHBondContact OD1-NH2 2.87Å; D263-R316 IonicContact OD2-CZ 2.9Å; D263-R316 IonicContact OD2-NE 3.2Å; D263-R316 PolarHBondContact OD2-NE 3.2Å; D263-R316 IonicContact OD2-NH2 3.24Å; D263-R316 PolarHBondContact OD2-NH2 2.87Å; D263-Y317 HydrophobicContact CB-CE2 3.67Å
264	Q	90.2	Very high	81	Confident	83 Å²	83	73 Å²	73	39%	0.388	34%	0.335	S	S	.	.	H	α-helix	trans	-62.9	-53.3	179.9	178.6	-178.7	-8.8	0	0	112.3	A260 L261 V262 V266 A267 E268 Y317	A260-Q264 WeakPolarHBondContact O-CB 3.15Å; A260-Q264 PolarHBondContact O-N 3.5Å; L261-Q264 PolarHBondContact O-N 3.44Å; V262-Q264 VanDerWaalsContact C-N 3.29Å; V262-Q264 PolarHBondContact O-N 3.16Å; Q264-V266 VanDerWaalsContact C-N 3.3Å; Q264-V266 PolarHBondContact O-N 2.96Å; Q264-A267 WeakPolarHBondContact O-CB 2.86Å; Q264-A267 PolarHBondContact O-N 3.13Å; Q264-A267 VanDerWaalsContact O-N 3.07Å; Q264-E268 VanDerWaalsContact CG-OE1 3.3Å; Q264-E268 WeakPolarHBondContact CG-OE1 3.42Å; Q264-E268 PolarHBondContact NE2-OE1 3.17Å; Q264-E268 WeakPolarHBondContact O-CG 3.06Å; Q264-E268 PolarHBondContact O-N 3.28Å; Q264-Y317 VanDerWaalsContact CA-OH 3.3Å; Q264-Y317 WeakPolarHBondContact CA-OH 3.47Å; Q264-Y317 PolarHBondContact N-OH 3.17Å
265	R	92.6	Very high	82	Confident	83 Å²	83	72.7 Å²	72.7	31%	0.313	34%	0.342	S	S	.	.	H	α-helix	trans	-65.8	-32.8	-176.5	-74.6	-173.4	69	-167	-3.9	112.5	L261 V262 Y269 I292 E295	L261-R265 PolarHBondContact O-N 2.89Å; V262-R265 PolarHBondContact O-N 2.65Å; R265-Y269 WeakPolarHBondContact O-CB 3.35Å; R265-Y269 PolarHBondContact O-N 2.63Å; R265-I292 HydrophobicContact CB-CD1 3.47Å; R265-I292 VanDerWaalsContact CB-CD1 3.47Å; R265-I292 HydrophobicContact CB-CG1 4.18Å; R265-I292 HydrophobicContact CB-CG2 4.21Å; R265-E295 IonicContact CZ-OE2 2.59Å; R265-E295 IonicContact NH1-OE2 2.89Å; R265-E295 PolarHBondContact NH1-OE2 3.02Å; R265-E295 IonicContact NH2-OE1 3.21Å; R265-E295 IonicContact NH2-OE2 2.77Å; R265-E295 PolarHBondContact NH2-OE2 3.08Å
266	V	90.9	Very high	82.7	Confident	0 Å²	0	69.5 Å²	69.5	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-69.1	-39.7	172.2	-179.5	0	0	0	0	110.8	V262 Q264 Y269 V270 M285 K288 A289 I292 W309 M313	V262-V266 HydrophobicContact CG1-CG2 4.35Å; V262-V266 VanDerWaalsContact O-CG2 3.23Å; V262-V266 WeakPolarHBondContact O-CG2 3.37Å; V262-V266 PolarHBondContact O-N 3.2Å; Q264-V266 VanDerWaalsContact C-N 3.3Å; Q264-V266 PolarHBondContact O-N 2.96Å; V266-Y269 PolarHBondContact O-N 3.32Å; V266-V270 HydrophobicContact CG1-CG2 4.4Å; V266-V270 WeakPolarHBondContact O-CG2 3.41Å; V266-V270 PolarHBondContact O-N 2.89Å; V266-M285 HydrophobicContact CG1-CB 4.04Å; V266-M285 HydrophobicContact CG1-CE 4.48Å; V266-M285 HydrophobicContact CG1-CG 4.44Å; V266-K288 HydrophobicContact CG2-CB 4.5Å; V266-K288 HydrophobicContact CG2-CG 4.39Å; V266-A289 HydrophobicContact CG2-CB 3.74Å; V266-I292 HydrophobicContact CG2-CD1 3.59Å; V266-W309 HydrophobicContact CB-CH2 4.44Å; V266-W309 HydrophobicContact CG1-CH2 4.27Å; V266-W309 HydrophobicContact CG2-CH2 4.12Å; V266-M313 HydrophobicContact CB-CE 3.76Å; V266-M313 HydrophobicContact CG1-CE 3.34Å
267	A	88.4	Confident	82.8	Confident	1 Å²	1	66.7 Å²	66.7	1%	0.008	32%	0.324	C	S	.	.	H	α-helix	trans	-66	-36.6	176.5	0	0	0	0	0	112.7	D263 Q264 V270 R271 Y317	D263-A267 WeakPolarHBondContact O-CB 3.24Å; D263-A267 PolarHBondContact O-N 2.95Å; Q264-A267 WeakPolarHBondContact O-CB 2.86Å; Q264-A267 PolarHBondContact O-N 3.13Å; Q264-A267 VanDerWaalsContact O-N 3.07Å; A267-V270 PolarHBondContact O-N 2.96Å; A267-R271 WeakPolarHBondContact O-CG 3.38Å; A267-R271 PolarHBondContact O-N 2.91Å; A267-R271 VanDerWaalsContact O-N 3.08Å; A267-Y317 HydrophobicContact CB-CD1 3.24Å; A267-Y317 HydrophobicContact CB-CD2 4.33Å; A267-Y317 HydrophobicContact CB-CE1 3.67Å; A267-Y317 HydrophobicContact CB-CG 3.62Å
268	E	90.4	Very high	82.3	Confident	93 Å²	93	68.8 Å²	68.8	44%	0.435	33%	0.333	S	S	.	.	H	α-helix	trans	-62.7	-45.8	171.7	-73.1	165.6	-174.2	0	0	111.2	Q264 V270 R271 Y272	Q264-E268 VanDerWaalsContact CG-OE1 3.3Å; Q264-E268 WeakPolarHBondContact CG-OE1 3.42Å; Q264-E268 PolarHBondContact NE2-OE1 3.17Å; Q264-E268 WeakPolarHBondContact O-CG 3.06Å; Q264-E268 PolarHBondContact O-N 3.28Å; E268-V270 PolarHBondContact O-N 3.46Å; E268-R271 PolarHBondContact O-N 3.21Å; E268-Y272 PolarHBondContact O-N 3.24Å
269	Y	85.9	Confident	81.6	Confident	66 Å²	66	61 Å²	61	26%	0.259	31%	0.31	S	S	.	.	H	α-helix	trans	-59.5	-43.3	174	174.3	-107.5	0	0	0	112.6	R265 V266 R271 Y272 M273 I280 K288	R265-Y269 WeakPolarHBondContact O-CB 3.35Å; R265-Y269 PolarHBondContact O-N 2.63Å; V266-Y269 PolarHBondContact O-N 3.32Å; Y269-R271 VanDerWaalsContact C-N 3.34Å; Y269-R271 PolarHBondContact O-N 2.9Å; Y269-Y272 WeakPolarHBondContact O-CB 3.12Å; Y269-Y272 PolarHBondContact O-N 2.74Å; Y269-M273 HydrophobicContact CD1-CG 4.41Å; Y269-M273 HydrophobicContact CD2-CG 4.2Å; Y269-M273 HydrophobicContact CE1-CG 3.99Å; Y269-M273 HydrophobicContact CE2-CG 3.74Å; Y269-M273 HydrophobicContact CE2-SD 3.8Å; Y269-M273 WeakPolarHBondContact O-CG 3.35Å; Y269-M273 PolarHBondContact O-N 3.23Å; Y269-I280 HydrophobicContact CD1-CD1 3.76Å; Y269-I280 HydrophobicContact CE1-CD1 3.61Å; Y269-K288 HydrophobicContact CD1-CB 3.92Å; Y269-K288 HydrophobicContact CD1-CD 4.35Å; Y269-K288 HydrophobicContact CD1-CG 3.61Å; Y269-K288 HydrophobicContact CD2-CD 4.39Å; Y269-K288 HydrophobicContact CD2-CG 4.41Å; Y269-K288 HydrophobicContact CE1-CB 4.1Å; Y269-K288 HydrophobicContact CE1-CG 4.14Å; Y269-K288 HydrophobicContact CG-CD 4.21Å; Y269-K288 HydrophobicContact CG-CG 3.76Å
270	V	84.4	Confident	80.9	Confident	3 Å²	3	60.2 Å²	60.2	2%	0.018	31%	0.308	C	S	.	.	H	α-helix	trans	-57.6	-47	175.8	170.2	0	0	0	0	111.2	V266 A267 E268 Y272 M273 Q274 I280 M285 L319	V266-V270 HydrophobicContact CG1-CG2 4.4Å; V266-V270 WeakPolarHBondContact O-CG2 3.41Å; V266-V270 PolarHBondContact O-N 2.89Å; A267-V270 PolarHBondContact O-N 2.96Å; E268-V270 PolarHBondContact O-N 3.46Å; V270-Y272 VanDerWaalsContact C-N 3.35Å; V270-M273 PolarHBondContact O-N 3.4Å; V270-Q274 HydrophobicContact CG1-CG 4.43Å; V270-Q274 WeakPolarHBondContact O-CB 3.41Å; V270-Q274 VanDerWaalsContact O-CG 3.23Å; V270-Q274 WeakPolarHBondContact O-CG 3.49Å; V270-Q274 PolarHBondContact O-N 3.25Å; V270-I280 HydrophobicContact CB-CD1 4.12Å; V270-I280 HydrophobicContact CG1-CG2 4.09Å; V270-I280 HydrophobicContact CG2-CD1 3.59Å; V270-M285 HydrophobicContact CG2-CE 3.86Å; V270-M285 HydrophobicContact CG2-CG 3.85Å; V270-M285 HydrophobicContact CG2-SD 4.11Å; V270-L319 HydrophobicContact CB-CD1 4.25Å; V270-L319 HydrophobicContact CG1-CD1 3.94Å; V270-L319 HydrophobicContact CG1-CD2 3.91Å; V270-L319 HydrophobicContact CG2-CD1 4.23Å
271	R	85.8	Confident	80.5	Confident	137 Å²	137	60.5 Å²	60.5	52%	0.517	31%	0.305	S	S	.	.	H	α-helix	trans	-66.1	-37.7	179.4	-71.3	176.2	-177.3	159.8	0.4	112.2	A267 E268 Y269 Q274 A275	A267-R271 WeakPolarHBondContact O-CG 3.38Å; A267-R271 PolarHBondContact O-N 2.91Å; A267-R271 VanDerWaalsContact O-N 3.08Å; E268-R271 PolarHBondContact O-N 3.21Å; Y269-R271 VanDerWaalsContact C-N 3.34Å; Y269-R271 PolarHBondContact O-N 2.9Å; R271-Q274 PolarHBondContact O-N 2.94Å; R271-A275 WeakPolarHBondContact O-CB 3.45Å; R271-A275 PolarHBondContact O-N 2.8Å
272	Y	82.3	Confident	79.9	Confident	144 Å²	144	60.1 Å²	60.1	57%	0.565	30%	0.298	S	S	*	.	H	α-helix	trans	-60.7	-49.4	173.7	171.1	-98.4	0	0	0	111.6	E268 Y269 V270 Q274 A275 K276	E268-Y272 PolarHBondContact O-N 3.24Å; Y269-Y272 WeakPolarHBondContact O-CB 3.12Å; Y269-Y272 PolarHBondContact O-N 2.74Å; V270-Y272 VanDerWaalsContact C-N 3.35Å; Y272-Q274 VanDerWaalsContact C-N 3.31Å; Y272-Q274 PolarHBondContact O-N 3.39Å; Y272-A275 PolarHBondContact O-N 3.35Å; Y272-K276 HydrophobicContact CE1-CD 4.45Å; Y272-K276 PolarHBondContact O-N 3.04Å
273	M	75.3	Confident	79.2	Confident	28 Å²	28	62.7 Å²	62.7	14%	0.138	31%	0.31	C	S	.	.	H	α-helix	trans	-61.6	-40.6	177.2	-66	-58.5	-71.4	0	0	111.7	Y269 V270 K276 G277 D278 I280	Y269-M273 HydrophobicContact CD1-CG 4.41Å; Y269-M273 HydrophobicContact CD2-CG 4.2Å; Y269-M273 HydrophobicContact CE1-CG 3.99Å; Y269-M273 HydrophobicContact CE2-CG 3.74Å; Y269-M273 HydrophobicContact CE2-SD 3.8Å; Y269-M273 WeakPolarHBondContact O-CG 3.35Å; Y269-M273 PolarHBondContact O-N 3.23Å; V270-M273 PolarHBondContact O-N 3.4Å; M273-K276 PolarHBondContact O-N 2.96Å; M273-G277 PolarHBondContact O-N 3.12Å; M273-D278 HydrophobicContact CE-CB 3.5Å; M273-D278 VanDerWaalsContact CE-CB 3.5Å; M273-D278 PolarHBondContact O-N 3.27Å; M273-I280 HydrophobicContact CB-CB 4.43Å; M273-I280 HydrophobicContact CB-CD1 4.42Å; M273-I280 HydrophobicContact CG-CD1 4.27Å
274	Q	75.2	Confident	78.5	Confident	101 Å²	101	63.6 Å²	63.6	47%	0.472	32%	0.318	S	S	.	.	H	α-helix	trans	-61.9	-42.1	174.7	-74.5	171.9	-18.2	0	0	112.7	V270 R271 Y272 K276 G277	V270-Q274 HydrophobicContact CG1-CG 4.43Å; V270-Q274 WeakPolarHBondContact O-CB 3.41Å; V270-Q274 VanDerWaalsContact O-CG 3.23Å; V270-Q274 WeakPolarHBondContact O-CG 3.49Å; V270-Q274 PolarHBondContact O-N 3.25Å; R271-Q274 PolarHBondContact O-N 2.94Å; Y272-Q274 VanDerWaalsContact C-N 3.31Å; Y272-Q274 PolarHBondContact O-N 3.39Å; Q274-K276 VanDerWaalsContact C-N 3.28Å; Q274-K276 PolarHBondContact O-N 3.47Å; Q274-G277 PolarHBondContact O-N 3.41Å; Q274-G277 VanDerWaalsContact O-N 3.15Å
275	A	73.6	Confident	78.1	Confident	93 Å²	93	59.9 Å²	59.9	77%	0.769	30%	0.3	S	S	*	.	H	α-helix	trans	-66.9	-31.1	177.2	0	0	0	0	0	112.4	R271 Y272 G277	R271-A275 WeakPolarHBondContact O-CB 3.45Å; R271-A275 PolarHBondContact O-N 2.8Å; Y272-A275 PolarHBondContact O-N 3.35Å; A275-G277 VanDerWaalsContact C-N 3.26Å; A275-G277 PolarHBondContact O-N 2.99Å
276	K	72.7	Confident	77.7	Confident	126 Å²	126	56.4 Å²	56.4	55%	0.548	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-10.5	173.9	-169.7	168.4	175.6	-109.5	0	113.5	Y272 M273 Q274 D278	Y272-K276 HydrophobicContact CE1-CD 4.45Å; Y272-K276 PolarHBondContact O-N 3.04Å; M273-K276 PolarHBondContact O-N 2.96Å; Q274-K276 VanDerWaalsContact C-N 3.28Å; Q274-K276 PolarHBondContact O-N 3.47Å; K276-D278 VanDerWaalsContact C-N 3.29Å; K276-D278 WeakPolarHBondContact CD-OD2 3.2Å; K276-D278 IonicContact NZ-OD2 3.77Å; K276-D278 PolarHBondContact NZ-OD2 3.45Å
277	G	62.2	Low	77.1	Confident	48 Å²	48	57.8 Å²	57.8	50%	0.495	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.8	1.3	-177.1	0	0	0	0	0	114.7	M273 Q274 A275	M273-G277 PolarHBondContact O-N 3.12Å; Q274-G277 PolarHBondContact O-N 3.41Å; Q274-G277 VanDerWaalsContact O-N 3.15Å; A275-G277 VanDerWaalsContact C-N 3.26Å; A275-G277 PolarHBondContact O-N 2.99Å
278	D	60.7	Low	77	Confident	55 Å²	55	59.6 Å²	59.6	29%	0.294	30%	0.302	S	S	.	.			trans	-81.3	130.6	-178.1	-73.7	-30.2	0	0	0	111.3	M273 K276	M273-D278 HydrophobicContact CE-CB 3.5Å; M273-D278 VanDerWaalsContact CE-CB 3.5Å; M273-D278 PolarHBondContact O-N 3.27Å; K276-D278 VanDerWaalsContact C-N 3.29Å; K276-D278 WeakPolarHBondContact CD-OD2 3.2Å; K276-D278 IonicContact NZ-OD2 3.77Å; K276-D278 PolarHBondContact NZ-OD2 3.45Å
279	P	64.3	Low	76.9	Confident	52 Å²	52	55.1 Å²	55.1	34%	0.338	28%	0.282	S	S	.	.			trans	-68.7	136.8	176.6	28	-32.3	0	0	0	111.1	S374	P279-S374 WeakPolarHBondContact CG-OG 3.24Å
280	I	71.5	Confident	76.9	Confident	30 Å²	30	54.7 Å²	54.7	15%	0.154	28%	0.283	C	S	.	.			trans	-115.6	125.4	178	-170	168.2	0	0	0	111.5	Y269 V270 M273 A284 M285	Y269-I280 HydrophobicContact CD1-CD1 3.76Å; Y269-I280 HydrophobicContact CE1-CD1 3.61Å; V270-I280 HydrophobicContact CB-CD1 4.12Å; V270-I280 HydrophobicContact CG1-CG2 4.09Å; V270-I280 HydrophobicContact CG2-CD1 3.59Å; M273-I280 HydrophobicContact CB-CB 4.43Å; M273-I280 HydrophobicContact CB-CD1 4.42Å; M273-I280 HydrophobicContact CG-CD1 4.27Å; I280-A284 HydrophobicContact CG1-CB 4.06Å; I280-M285 HydrophobicContact CD1-CG 3.92Å; I280-M285 HydrophobicContact CG1-CG 4.04Å
281	T	75.5	Confident	77	Confident	43 Å²	43	58.3 Å²	58.3	26%	0.264	30%	0.3	S	S	.	.			trans	-92.9	165.2	179.4	65.7	0	0	0	0	111.5	E283 A284 M285 P373	T281-E283 VanDerWaalsContact CB-OE2 3.29Å; T281-E283 WeakPolarHBondContact CB-OE2 3.27Å; T281-E283 PolarHBondContact O-N 2.78Å; T281-E283 PolarHBondContact OG1-OE2 3.39Å; T281-A284 PolarHBondContact O-N 3.35Å; T281-A284 PolarHBondContact OG1-N 2.82Å; T281-M285 WeakPolarHBondContact O-CG 3.19Å; T281-M285 PolarHBondContact O-N 3.41Å; T281-M285 VanDerWaalsContact O-N 3.13Å; T281-P373 HydrophobicContact CG2-CB 3.66Å
282	R	75.3	Confident	77.2	Confident	76 Å²	76	51.8 Å²	51.8	29%	0.287	28%	0.276	S	S	.	.	H	α-helix	trans	-63.2	-33.8	176.6	-73.3	178.7	174.5	141.8	4.4	111.1	M285 Q286 L321	R282-M285 WeakPolarHBondContact O-CB 3.45Å; R282-M285 PolarHBondContact O-N 3.42Å; R282-Q286 VanDerWaalsContact O-CG 3.28Å; R282-Q286 WeakPolarHBondContact O-CG 3.33Å; R282-Q286 PolarHBondContact O-N 3.33Å; R282-Q286 PolarHBondContact O-OE1 3.15Å; R282-L321 HydrophobicContact CG-CD1 4.13Å; R282-L321 HydrophobicContact CG-CD2 4.35Å; R282-L321 VanDerWaalsContact NH2-CD1 3.3Å
283	E	75.2	Confident	77.5	Confident	54 Å²	54	45.2 Å²	45.2	25%	0.252	25%	0.251	S	S	.	.	H	α-helix	trans	-68.5	-44.8	-178.9	-62.5	70.3	-151.4	0	0	110	T281 M285 Q286 L287 S505	T281-E283 VanDerWaalsContact CB-OE2 3.29Å; T281-E283 WeakPolarHBondContact CB-OE2 3.27Å; T281-E283 PolarHBondContact O-N 2.78Å; T281-E283 PolarHBondContact OG1-OE2 3.39Å; E283-M285 VanDerWaalsContact C-N 3.29Å; E283-M285 PolarHBondContact O-N 2.9Å; E283-Q286 WeakPolarHBondContact O-CB 3.38Å; E283-Q286 PolarHBondContact O-N 3.49Å; E283-Q286 VanDerWaalsContact O-N 3.1Å; E283-L287 WeakPolarHBondContact O-CG 3.03Å; E283-L287 PolarHBondContact O-N 2.81Å; E283-S505 WeakPolarHBondContact CG-OG 3.29Å
284	A	75.7	Confident	78.1	Confident	19 Å²	19	49.9 Å²	49.9	16%	0.157	27%	0.273	C	S	.	.	H	α-helix	trans	-58.3	-41.6	171.2	0	0	0	0	0	111.7	I280 T281 Q286 L287 K288	I280-A284 HydrophobicContact CG1-CB 4.06Å; T281-A284 PolarHBondContact O-N 3.35Å; T281-A284 PolarHBondContact OG1-N 2.82Å; A284-Q286 PolarHBondContact O-N 3.02Å; A284-L287 PolarHBondContact O-N 2.98Å; A284-K288 WeakPolarHBondContact O-CB 3.49Å; A284-K288 PolarHBondContact O-N 3.18Å
285	M	81.6	Confident	78.8	Confident	5 Å²	5	49.6 Å²	49.6	3%	0.025	27%	0.271	C	S	.	.	H	α-helix	trans	-64.2	-38.4	174.5	-62.6	171.2	67	0	0	112.5	V266 V270 I280 T281 R282 E283 A289 M313 M314 L319	V266-M285 HydrophobicContact CG1-CB 4.04Å; V266-M285 HydrophobicContact CG1-CE 4.48Å; V266-M285 HydrophobicContact CG1-CG 4.44Å; V270-M285 HydrophobicContact CG2-CE 3.86Å; V270-M285 HydrophobicContact CG2-CG 3.85Å; V270-M285 HydrophobicContact CG2-SD 4.11Å; I280-M285 HydrophobicContact CD1-CG 3.92Å; I280-M285 HydrophobicContact CG1-CG 4.04Å; T281-M285 WeakPolarHBondContact O-CG 3.19Å; T281-M285 PolarHBondContact O-N 3.41Å; T281-M285 VanDerWaalsContact O-N 3.13Å; R282-M285 WeakPolarHBondContact O-CB 3.45Å; R282-M285 PolarHBondContact O-N 3.42Å; E283-M285 VanDerWaalsContact C-N 3.29Å; E283-M285 PolarHBondContact O-N 2.9Å; M285-A289 WeakPolarHBondContact O-CB 3.3Å; M285-A289 PolarHBondContact O-N 3Å; M285-M313 HydrophobicContact CE-CE 3.37Å; M285-M313 HydrophobicContact CE-SD 4.18Å; M285-M314 HydrophobicContact CE-CG 3.65Å; M285-M314 HydrophobicContact CE-SD 4.4Å; M285-M314 HydrophobicContact SD-CG 4.39Å; M285-M314 HydrophobicContact SD-SD 4.48Å; M285-L319 HydrophobicContact CE-CD1 4.36Å
286	Q	84.1	Confident	79.5	Confident	11 Å²	11	48.5 Å²	48.5	5%	0.051	25%	0.251	C	S	.	.	H	α-helix	trans	-67.5	-42.8	177.5	-71.9	169.2	-85.8	0	0	111.3	R282 E283 A284 A289 L290 A305 W309 C310 L509	R282-Q286 VanDerWaalsContact O-CG 3.28Å; R282-Q286 WeakPolarHBondContact O-CG 3.33Å; R282-Q286 PolarHBondContact O-N 3.33Å; R282-Q286 PolarHBondContact O-OE1 3.15Å; E283-Q286 WeakPolarHBondContact O-CB 3.38Å; E283-Q286 PolarHBondContact O-N 3.49Å; E283-Q286 VanDerWaalsContact O-N 3.1Å; A284-Q286 PolarHBondContact O-N 3.02Å; Q286-A289 WeakPolarHBondContact O-CB 3.41Å; Q286-A289 PolarHBondContact O-N 3.43Å; Q286-L290 WeakPolarHBondContact O-CG 3.34Å; Q286-L290 PolarHBondContact O-N 2.81Å; Q286-A305 HydrophobicContact CB-CB 4.02Å; Q286-A305 HydrophobicContact CG-CB 4.32Å; Q286-A305 VanDerWaalsContact CG-O 3.31Å; Q286-A305 WeakPolarHBondContact CG-O 3.44Å; Q286-A305 PolarHBondContact NE2-O 2.65Å; Q286-A305 WeakPolarHBondContact O-CB 3.45Å; Q286-W309 HydrophobicContact CG-CZ3 4.49Å; Q286-C310 HydrophobicContact CG-CB 4.29Å; Q286-L509 HydrophobicContact CB-CD2 3.91Å
287	L	79.1	Confident	80.3	Confident	28 Å²	28	49.5 Å²	49.5	15%	0.147	26%	0.262	C	S	.	.	H	α-helix	trans	-61.2	-49	175.5	-72.1	166.6	0	0	0	111.4	E283 A284 A289 L290 E291 L508 L509 L513	E283-L287 WeakPolarHBondContact O-CG 3.03Å; E283-L287 PolarHBondContact O-N 2.81Å; A284-L287 PolarHBondContact O-N 2.98Å; L287-A289 PolarHBondContact O-N 3.24Å; L287-L290 PolarHBondContact O-N 3.33Å; L287-E291 PolarHBondContact O-N 2.92Å; L287-L508 HydrophobicContact CD1-CB 4.07Å; L287-L508 HydrophobicContact CD1-CD1 4.17Å; L287-L508 HydrophobicContact CD2-CB 4.46Å; L287-L509 HydrophobicContact CD2-CD2 4.02Å; L287-L509 HydrophobicContact CG-CD2 4.15Å; L287-L513 HydrophobicContact CD1-CD1 3.44Å; L287-L513 VanDerWaalsContact CD1-CD1 3.44Å; L287-L513 HydrophobicContact CD2-CD1 3.78Å; L287-L513 HydrophobicContact CG-CD1 4.16Å
288	K	85.6	Confident	81.5	Confident	39 Å²	39	48.5 Å²	48.5	17%	0.17	25%	0.246	C	C	.	.	H	α-helix	trans	-59.2	-36.7	176.9	-170.4	56.3	173.3	-179.1	0	111.7	V266 Y269 A284 E291 I292	V266-K288 HydrophobicContact CG2-CB 4.5Å; V266-K288 HydrophobicContact CG2-CG 4.39Å; Y269-K288 HydrophobicContact CD1-CB 3.92Å; Y269-K288 HydrophobicContact CD1-CD 4.35Å; Y269-K288 HydrophobicContact CD1-CG 3.61Å; Y269-K288 HydrophobicContact CD2-CD 4.39Å; Y269-K288 HydrophobicContact CD2-CG 4.41Å; Y269-K288 HydrophobicContact CE1-CB 4.1Å; Y269-K288 HydrophobicContact CE1-CG 4.14Å; Y269-K288 HydrophobicContact CG-CD 4.21Å; Y269-K288 HydrophobicContact CG-CG 3.76Å; A284-K288 WeakPolarHBondContact O-CB 3.49Å; A284-K288 PolarHBondContact O-N 3.18Å; K288-E291 WeakPolarHBondContact CD-OE2 3.43Å; K288-E291 IonicContact NZ-OE1 2.95Å; K288-E291 PolarHBondContact NZ-OE1 2.88Å; K288-E291 IonicContact NZ-OE2 2.76Å; K288-E291 PolarHBondContact NZ-OE2 3.43Å; K288-E291 PolarHBondContact O-N 3.05Å; K288-I292 HydrophobicContact CD-CD1 4.26Å; K288-I292 HydrophobicContact CD-CG1 4.49Å; K288-I292 HydrophobicContact CG-CD1 3.83Å; K288-I292 WeakPolarHBondContact O-CB 3.49Å; K288-I292 VanDerWaalsContact O-CD1 3.29Å; K288-I292 WeakPolarHBondContact O-CD1 3.47Å; K288-I292 VanDerWaalsContact O-CG1 3.23Å; K288-I292 WeakPolarHBondContact O-CG1 3.42Å; K288-I292 PolarHBondContact O-N 2.89Å
289	A	89.4	Confident	82.7	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-66.1	-38	176.2	0	0	0	0	0	113.2	V262 V266 M285 Q286 L287 A293 F303 A305 W309	V262-A289 HydrophobicContact CG1-CB 3.97Å; V266-A289 HydrophobicContact CG2-CB 3.74Å; M285-A289 WeakPolarHBondContact O-CB 3.3Å; M285-A289 PolarHBondContact O-N 3Å; Q286-A289 WeakPolarHBondContact O-CB 3.41Å; Q286-A289 PolarHBondContact O-N 3.43Å; L287-A289 PolarHBondContact O-N 3.24Å; A289-A293 VanDerWaalsContact O-CB 3.25Å; A289-A293 WeakPolarHBondContact O-CB 3.28Å; A289-A293 PolarHBondContact O-N 3.32Å; A289-F303 HydrophobicContact CB-CE1 3.86Å; A289-F303 HydrophobicContact CB-CZ 3.92Å; A289-F303 WeakPolarHBondContact O-CE1 3.25Å; A289-A305 HydrophobicContact CB-CB 4.03Å; A289-W309 HydrophobicContact CB-CE3 4.47Å; A289-W309 HydrophobicContact CB-CH2 3.22Å; A289-W309 HydrophobicContact CB-CZ2 3.81Å; A289-W309 HydrophobicContact CB-CZ3 3.6Å
290	L	86.6	Confident	83.2	Confident	56 Å²	56	55.7 Å²	55.7	29%	0.293	28%	0.281	S	S	.	.	H	α-helix	trans	-68.6	-43.3	176.1	-68.4	173.5	0	0	0	111.1	Q286 L287 A293 Q294 F303 A305	Q286-L290 WeakPolarHBondContact O-CG 3.34Å; Q286-L290 PolarHBondContact O-N 2.81Å; L287-L290 PolarHBondContact O-N 3.33Å; L290-A293 PolarHBondContact O-N 3.36Å; L290-Q294 WeakPolarHBondContact O-CG 3.45Å; L290-Q294 PolarHBondContact O-N 3.26Å; L290-F303 HydrophobicContact CD2-CD1 4.44Å; L290-A305 HydrophobicContact CD1-CB 4.49Å; L290-A305 HydrophobicContact CD2-CB 3.86Å; L290-A305 HydrophobicContact CG-CB 3.81Å
291	E	85.6	Confident	83.6	Confident	79 Å²	79	64.7 Å²	64.7	37%	0.369	32%	0.319	S	S	.	.	H	α-helix	trans	-56.4	-52	173.8	-175.1	-165.4	155.6	0	0	111	L287 K288 A293 Q294 E295	L287-E291 PolarHBondContact O-N 2.92Å; K288-E291 WeakPolarHBondContact CD-OE2 3.43Å; K288-E291 IonicContact NZ-OE1 2.95Å; K288-E291 PolarHBondContact NZ-OE1 2.88Å; K288-E291 IonicContact NZ-OE2 2.76Å; K288-E291 PolarHBondContact NZ-OE2 3.43Å; K288-E291 PolarHBondContact O-N 3.05Å; E291-A293 VanDerWaalsContact C-N 3.28Å; E291-A293 PolarHBondContact O-N 3.27Å; E291-Q294 WeakPolarHBondContact O-CB 3.37Å; E291-Q294 PolarHBondContact O-N 2.75Å; E291-Q294 VanDerWaalsContact O-N 3.14Å; E291-E295 WeakPolarHBondContact O-CG 3Å; E291-E295 PolarHBondContact O-N 3Å
292	I	88.9	Confident	83.8	Confident	0 Å²	0	63.8 Å²	63.8	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-62.3	-37.4	177.5	-65.9	157.6	0	0	0	111.1	V262 R265 V266 K288 Q294 E295 M296	V262-I292 HydrophobicContact CB-CG2 4.44Å; V262-I292 HydrophobicContact CG1-CG2 4.45Å; V262-I292 HydrophobicContact CG2-CG2 4.15Å; R265-I292 HydrophobicContact CB-CD1 3.47Å; R265-I292 VanDerWaalsContact CB-CD1 3.47Å; R265-I292 HydrophobicContact CB-CG1 4.18Å; R265-I292 HydrophobicContact CB-CG2 4.21Å; V266-I292 HydrophobicContact CG2-CD1 3.59Å; K288-I292 HydrophobicContact CD-CD1 4.26Å; K288-I292 HydrophobicContact CD-CG1 4.49Å; K288-I292 HydrophobicContact CG-CD1 3.83Å; K288-I292 WeakPolarHBondContact O-CB 3.49Å; K288-I292 VanDerWaalsContact O-CD1 3.29Å; K288-I292 WeakPolarHBondContact O-CD1 3.47Å; K288-I292 VanDerWaalsContact O-CG1 3.23Å; K288-I292 WeakPolarHBondContact O-CG1 3.42Å; K288-I292 PolarHBondContact O-N 2.89Å; I292-Q294 VanDerWaalsContact C-N 3.34Å; I292-E295 PolarHBondContact O-N 3.25Å; I292-M296 HydrophobicContact CG2-CG 4.32Å; I292-M296 HydrophobicContact CG2-SD 3.97Å; I292-M296 WeakPolarHBondContact O-CB 3.29Å; I292-M296 WeakPolarHBondContact O-CG 3.36Å; I292-M296 PolarHBondContact O-N 3.13Å
293	A	89.6	Confident	84.4	Confident	6 Å²	6	60.7 Å²	60.7	5%	0.05	31%	0.307	C	S	.	.	H	α-helix	trans	-65.7	-37.4	177.5	0	0	0	0	0	112.3	A289 L290 E291 M296 N297 I298 F303	A289-A293 VanDerWaalsContact O-CB 3.25Å; A289-A293 WeakPolarHBondContact O-CB 3.28Å; A289-A293 PolarHBondContact O-N 3.32Å; L290-A293 PolarHBondContact O-N 3.36Å; E291-A293 VanDerWaalsContact C-N 3.28Å; E291-A293 PolarHBondContact O-N 3.27Å; A293-M296 CarbonylContact O-C 3.6Å; A293-M296 PolarHBondContact O-N 3.03Å; A293-N297 PolarHBondContact O-N 2.99Å; A293-I298 HydrophobicContact CB-CB 4.25Å; A293-I298 HydrophobicContact CB-CD1 4.19Å; A293-I298 WeakPolarHBondContact O-CB 3.4Å; A293-I298 PolarHBondContact O-N 3.18Å; A293-F303 HydrophobicContact CB-CD1 3.48Å; A293-F303 VanDerWaalsContact CB-CD1 3.48Å; A293-F303 HydrophobicContact CB-CE1 4.04Å; A293-F303 HydrophobicContact CB-CG 4.3Å
294	Q	87.8	Confident	84.9	Confident	127 Å²	127	66.2 Å²	66.2	59%	0.593	33%	0.33	S	S	*	.	H	α-helix	trans	-65.1	-47.9	173.1	-73	174.9	-16.2	0	0	111.4	L290 E291 I292 M296 N297	L290-Q294 WeakPolarHBondContact O-CG 3.45Å; L290-Q294 PolarHBondContact O-N 3.26Å; E291-Q294 WeakPolarHBondContact O-CB 3.37Å; E291-Q294 PolarHBondContact O-N 2.75Å; E291-Q294 VanDerWaalsContact O-N 3.14Å; I292-Q294 VanDerWaalsContact C-N 3.34Å; Q294-M296 PolarHBondContact O-N 3.41Å; Q294-N297 PolarHBondContact O-N 2.98Å
295	E	90.1	Very high	85.3	Confident	95 Å²	95	65.7 Å²	65.7	44%	0.444	33%	0.325	S	S	.	.	H	α-helix	trans	-56.3	-35.7	174.7	-70.2	175.5	-162.7	0	0	112.3	R265 E291 I292 N297	R265-E295 IonicContact CZ-OE2 2.59Å; R265-E295 IonicContact NH1-OE2 2.89Å; R265-E295 PolarHBondContact NH1-OE2 3.02Å; R265-E295 IonicContact NH2-OE1 3.21Å; R265-E295 IonicContact NH2-OE2 2.77Å; R265-E295 PolarHBondContact NH2-OE2 3.08Å; E291-E295 WeakPolarHBondContact O-CG 3Å; E291-E295 PolarHBondContact O-N 3Å; I292-E295 PolarHBondContact O-N 3.25Å; E295-N297 PolarHBondContact O-N 3.38Å
296	M	88.7	Confident	85.3	Confident	70 Å²	70	67.2 Å²	67.2	35%	0.345	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.2	4.7	178.2	-70	-173.5	65.5	0	0	114	L261 V262 I292 A293 Q294 I298	L261-M296 HydrophobicContact CB-CE 3.92Å; L261-M296 HydrophobicContact CB-SD 4.1Å; L261-M296 HydrophobicContact CD2-CE 3.57Å; L261-M296 HydrophobicContact CD2-SD 3.88Å; L261-M296 HydrophobicContact CG-CE 4.18Å; L261-M296 HydrophobicContact CG-SD 4.1Å; V262-M296 HydrophobicContact CG2-SD 3.83Å; I292-M296 HydrophobicContact CG2-CG 4.32Å; I292-M296 HydrophobicContact CG2-SD 3.97Å; I292-M296 WeakPolarHBondContact O-CB 3.29Å; I292-M296 WeakPolarHBondContact O-CG 3.36Å; I292-M296 PolarHBondContact O-N 3.13Å; A293-M296 CarbonylContact O-C 3.6Å; A293-M296 PolarHBondContact O-N 3.03Å; Q294-M296 PolarHBondContact O-N 3.41Å; M296-I298 HydrophobicContact CB-CD1 4Å; M296-I298 HydrophobicContact CB-CG1 3.92Å; M296-I298 HydrophobicContact CE-CD1 4.44Å; M296-I298 PolarHBondContact O-N 2.59Å; M296-I298 HydrophobicContact SD-CD1 4.4Å
297	N	89.5	Confident	84.8	Confident	146 Å²	146	70.5 Å²	70.5	78%	0.781	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.1	33.7	-175.9	-63.3	-70.7	0	0	0	113.6	A293 Q294 E295	A293-N297 PolarHBondContact O-N 2.99Å; Q294-N297 PolarHBondContact O-N 2.98Å; E295-N297 PolarHBondContact O-N 3.38Å
298	I	87.6	Confident	84.5	Confident	28 Å²	28	70.4 Å²	70.4	14%	0.144	36%	0.36	C	S	.	.			trans	-78.7	125.2	175	-59.1	171.4	0	0	0	108	F259 V262 A293 M296 E300 F303	F259-I298 HydrophobicContact CD1-CD1 3.62Å; F259-I298 HydrophobicContact CD1-CG2 4.49Å; F259-I298 HydrophobicContact CE1-CD1 3.97Å; F259-I298 HydrophobicContact CE1-CG1 4.46Å; F259-I298 HydrophobicContact CE1-CG2 3.8Å; F259-I298 HydrophobicContact CG-CD1 4.44Å; F259-I298 HydrophobicContact CZ-CG2 4.18Å; V262-I298 HydrophobicContact CG2-CD1 3.84Å; A293-I298 HydrophobicContact CB-CB 4.25Å; A293-I298 HydrophobicContact CB-CD1 4.19Å; A293-I298 WeakPolarHBondContact O-CB 3.4Å; A293-I298 PolarHBondContact O-N 3.18Å; M296-I298 HydrophobicContact CB-CD1 4Å; M296-I298 HydrophobicContact CB-CG1 3.92Å; M296-I298 HydrophobicContact CE-CD1 4.44Å; M296-I298 PolarHBondContact O-N 2.59Å; M296-I298 HydrophobicContact SD-CD1 4.4Å; I298-E300 PolarHBondContact O-N 2.81Å; I298-F303 HydrophobicContact CG2-CB 3.7Å
299	P	84.2	Confident	84.6	Confident	92 Å²	92	69.3 Å²	69.3	60%	0.597	36%	0.355	S	S	*	.			trans	-57.5	141.6	178.4	-24	32.9	0	0	0	111.6	K301 G302 F303	P299-K301 PolarHBondContact O-N 2.77Å; P299-K301 VanDerWaalsContact O-N 3.14Å; P299-G302 VanDerWaalsContact O-CA 3.29Å; P299-G302 WeakPolarHBondContact O-CA 3.41Å; P299-G302 PolarHBondContact O-N 3.31Å; P299-F303 PolarHBondContact O-N 2.89Å
300	E	75.8	Confident	84.2	Confident	166 Å²	166	69.3 Å²	69.3	78%	0.776	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-33.8	-180	-66.3	-175.5	164.7	0	0	113	I298 G302	I298-E300 PolarHBondContact O-N 2.81Å; E300-G302 VanDerWaalsContact C-N 3.25Å; E300-G302 PolarHBondContact O-N 3.45Å
301	K	80.8	Confident	83.9	Confident	218 Å²	218	72.9 Å²	72.9	95%	0.948	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.7	-18.4	174.2	-64.3	-176.3	-179.6	178.4	0	113.2	P299	P299-K301 PolarHBondContact O-N 2.77Å; P299-K301 VanDerWaalsContact O-N 3.14Å
302	G	79.6	Confident	83.6	Confident	25 Å²	25	74.8 Å²	74.8	26%	0.258	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.1	-31.7	-176.4	0	0	0	0	0	113.9	F259 P299 E300	F259-G302 WeakPolarHBondContact CE2-O 3.48Å; F259-G302 WeakPolarHBondContact CZ-O 3.43Å; P299-G302 VanDerWaalsContact O-CA 3.29Å; P299-G302 WeakPolarHBondContact O-CA 3.41Å; P299-G302 PolarHBondContact O-N 3.31Å; E300-G302 VanDerWaalsContact C-N 3.25Å; E300-G302 PolarHBondContact O-N 3.45Å
303	F	86.4	Confident	83.5	Confident	10 Å²	10	74.8 Å²	74.8	4%	0.044	37%	0.368	C	S	.	.			trans	-131.3	125.4	179	176.3	-111.7	0	0	0	112	F259 V262 A289 L290 A293 I298 P299 A305 W309	F259-F303 HydrophobicContact CB-CD2 4.45Å; F259-F303 HydrophobicContact CD2-CB 4.29Å; F259-F303 AromaticContact CD2-CD2 3.29Å; F259-F303 HydrophobicContact CD2-CD2 3.29Å; F259-F303 AromaticContact CD2-CE2 3.94Å; F259-F303 HydrophobicContact CD2-CE2 3.94Å; F259-F303 HydrophobicContact CD2-CG 4.15Å; F259-F303 HydrophobicContact CE2-CB 3.88Å; F259-F303 AromaticContact CE2-CD2 3.6Å; F259-F303 HydrophobicContact CE2-CD2 3.6Å; F259-F303 HydrophobicContact CE2-CG 4.2Å; F259-F303 AromaticContact CG-CD2 3.96Å; F259-F303 HydrophobicContact CG-CD2 3.96Å; F259-F303 HydrophobicContact CG-CE2 4.48Å; F259-F303 HydrophobicContact CZ-CB 4.01Å; F259-F303 HydrophobicContact CZ-CD2 4.49Å; V262-F303 HydrophobicContact CG1-CE1 4.04Å; V262-F303 HydrophobicContact CG1-CE2 4.44Å; V262-F303 HydrophobicContact CG1-CZ 3.77Å; A289-F303 HydrophobicContact CB-CE1 3.86Å; A289-F303 HydrophobicContact CB-CZ 3.92Å; A289-F303 WeakPolarHBondContact O-CE1 3.25Å; L290-F303 HydrophobicContact CD2-CD1 4.44Å; A293-F303 HydrophobicContact CB-CD1 3.48Å; A293-F303 VanDerWaalsContact CB-CD1 3.48Å; A293-F303 HydrophobicContact CB-CE1 4.04Å; A293-F303 HydrophobicContact CB-CG 4.3Å; I298-F303 HydrophobicContact CG2-CB 3.7Å; P299-F303 PolarHBondContact O-N 2.89Å; F303-A305 HydrophobicContact CE1-CB 3.95Å; F303-A305 HydrophobicContact CZ-CB 4.18Å; F303-W309 AromaticContact CE2-CD1 3.81Å; F303-W309 HydrophobicContact CE2-CD2 4.24Å; F303-W309 AromaticContact CE2-CE2 3.96Å; F303-W309 HydrophobicContact CE2-CG 4.19Å; F303-W309 AromaticContact CE2-NE1 3.66Å; F303-W309 HydrophobicContact CZ-CD2 4.02Å; F303-W309 AromaticContact CZ-CE2 3.73Å; F303-W309 HydrophobicContact CZ-CG 4.43Å; F303-W309 HydrophobicContact CZ-CZ2 4.07Å; F303-W309 AromaticContact CZ-NE1 3.92Å
304	K	85.4	Confident	83.2	Confident	171 Å²	171	75.3 Å²	75.3	74%	0.743	37%	0.37	S	S	*	.			trans	-117	113.6	172.1	-170.4	172.2	-175.7	171.9	0	109.3	S306	K304-S306 PolarHBondContact O-N 2.99Å
305	A	85.9	Confident	82.8	Confident	7 Å²	7	77.8 Å²	77.8	6%	0.058	37%	0.374	C	S	.	.			trans	-70.2	63.2	169.7	0	0	0	0	0	110.5	Q286 A289 L290 F303 W309	Q286-A305 HydrophobicContact CB-CB 4.02Å; Q286-A305 HydrophobicContact CG-CB 4.32Å; Q286-A305 VanDerWaalsContact CG-O 3.31Å; Q286-A305 WeakPolarHBondContact CG-O 3.44Å; Q286-A305 PolarHBondContact NE2-O 2.65Å; Q286-A305 WeakPolarHBondContact O-CB 3.45Å; A289-A305 HydrophobicContact CB-CB 4.03Å; L290-A305 HydrophobicContact CD1-CB 4.49Å; L290-A305 HydrophobicContact CD2-CB 3.86Å; L290-A305 HydrophobicContact CG-CB 3.81Å; F303-A305 HydrophobicContact CE1-CB 3.95Å; F303-A305 HydrophobicContact CZ-CB 4.18Å; A305-W309 HydrophobicContact CB-CE3 4.16Å; A305-W309 HydrophobicContact CB-CZ3 4.35Å
306	S	80	Confident	82.5	Confident	37 Å²	37	76.4 Å²	76.4	26%	0.259	36%	0.364	S	S	.	.			trans	-76.8	159.6	179.9	59.5	0	0	0	0	111.9	K304 G308 W309 C310	K304-S306 PolarHBondContact O-N 2.99Å; S306-G308 PolarHBondContact O-N 3.47Å; S306-W309 WeakPolarHBondContact O-CA 3.39Å; S306-W309 WeakPolarHBondContact O-CB 3.44Å; S306-W309 PolarHBondContact O-N 2.82Å; S306-W309 PolarHBondContact OG-N 3.02Å; S306-W309 VanDerWaalsContact OG-N 3.1Å; S306-C310 PolarHBondContact O-N 3.33Å
307	L	73.8	Confident	82.2	Confident	80 Å²	80	75.7 Å²	75.7	42%	0.419	36%	0.358	S	S	.	.	H	α-helix	trans	-53.1	-37.4	169	-71.3	174.3	0	0	0	112.1	C310 R311	L307-C310 PolarHBondContact O-N 3.06Å; L307-R311 WeakPolarHBondContact O-CB 3.46Å; L307-R311 WeakPolarHBondContact O-CG 3.4Å; L307-R311 PolarHBondContact O-N 3.45Å
308	G	73.7	Confident	81.7	Confident	26 Å²	26	76.1 Å²	76.1	27%	0.268	36%	0.36	S	S	.	.	H	α-helix	trans	-65.1	-37.8	174.7	0	0	0	0	0	113.2	S306 R312	S306-G308 PolarHBondContact O-N 3.47Å; G308-R312 VanDerWaalsContact C-CZ 3.46Å; G308-R312 WeakPolarHBondContact O-CB 3.5Å; G308-R312 VanDerWaalsContact O-CG 3.25Å; G308-R312 WeakPolarHBondContact O-CG 3.24Å; G308-R312 PolarHBondContact O-N 2.96Å; G308-R312 PolarHBondContact O-NE 3.14Å; G308-R312 PolarHBondContact O-NH1 3Å
309	W	88	Confident	81.3	Confident	16 Å²	16	76 Å²	76	6%	0.061	36%	0.36	C	S	.	.	H	α-helix	trans	-64.8	-50.5	171.7	165.7	83.8	0	0	0	110.7	V262 D263 V266 Q286 A289 F303 A305 S306 R311 R312 M313	V262-W309 HydrophobicContact CG1-CZ2 4.3Å; D263-W309 PolarHBondContact OD1-NE1 3Å; V266-W309 HydrophobicContact CB-CH2 4.44Å; V266-W309 HydrophobicContact CG1-CH2 4.27Å; V266-W309 HydrophobicContact CG2-CH2 4.12Å; Q286-W309 HydrophobicContact CG-CZ3 4.49Å; A289-W309 HydrophobicContact CB-CE3 4.47Å; A289-W309 HydrophobicContact CB-CH2 3.22Å; A289-W309 HydrophobicContact CB-CZ2 3.81Å; A289-W309 HydrophobicContact CB-CZ3 3.6Å; F303-W309 AromaticContact CE2-CD1 3.81Å; F303-W309 HydrophobicContact CE2-CD2 4.24Å; F303-W309 AromaticContact CE2-CE2 3.96Å; F303-W309 HydrophobicContact CE2-CG 4.19Å; F303-W309 AromaticContact CE2-NE1 3.66Å; F303-W309 HydrophobicContact CZ-CD2 4.02Å; F303-W309 AromaticContact CZ-CE2 3.73Å; F303-W309 HydrophobicContact CZ-CG 4.43Å; F303-W309 HydrophobicContact CZ-CZ2 4.07Å; F303-W309 AromaticContact CZ-NE1 3.92Å; A305-W309 HydrophobicContact CB-CE3 4.16Å; A305-W309 HydrophobicContact CB-CZ3 4.35Å; S306-W309 WeakPolarHBondContact O-CA 3.39Å; S306-W309 WeakPolarHBondContact O-CB 3.44Å; S306-W309 PolarHBondContact O-N 2.82Å; S306-W309 PolarHBondContact OG-N 3.02Å; S306-W309 VanDerWaalsContact OG-N 3.1Å; W309-R311 PolarHBondContact O-N 3.22Å; W309-R312 PolarHBondContact O-N 3.42Å; W309-R312 VanDerWaalsContact O-N 3.08Å; W309-M313 HydrophobicContact CH2-CE 3.62Å; W309-M313 HydrophobicContact CZ2-CB 4.24Å; W309-M313 HydrophobicContact CZ2-CE 3.97Å; W309-M313 HydrophobicContact CZ2-CG 4.17Å; W309-M313 HydrophobicContact CZ3-CE 4.39Å; W309-M313 WeakPolarHBondContact O-CB 3.47Å; W309-M313 PolarHBondContact O-N 3.48Å
310	C	81.2	Confident	80.7	Confident	0 Å²	0	75 Å²	75	0%	0	36%	0.356	C	S	.	.	H	α-helix	trans	-57.1	-50.3	-178.2	-175.2	0	0	0	0	111.4	Q286 S306 L307 R312 M313 M314	Q286-C310 HydrophobicContact CG-CB 4.29Å; S306-C310 PolarHBondContact O-N 3.33Å; L307-C310 PolarHBondContact O-N 3.06Å; C310-R312 VanDerWaalsContact C-N 3.31Å; C310-R312 PolarHBondContact O-N 3.45Å; C310-M313 PolarHBondContact O-N 3.35Å; C310-M314 WeakPolarHBondContact O-CB 3.3Å; C310-M314 VanDerWaalsContact O-CG 3.31Å; C310-M314 WeakPolarHBondContact O-CG 3.42Å; C310-M314 PolarHBondContact O-N 3.09Å
311	R	78.8	Confident	80.2	Confident	131 Å²	131	71.2 Å²	71.2	49%	0.494	34%	0.34	S	S	.	.	H	α-helix	trans	-57.8	-39.9	175.2	-71.8	179.4	-168.4	171.6	4	113.3	L307 W309 R315	L307-R311 WeakPolarHBondContact O-CB 3.46Å; L307-R311 WeakPolarHBondContact O-CG 3.4Å; L307-R311 PolarHBondContact O-N 3.45Å; W309-R311 PolarHBondContact O-N 3.22Å; R311-R315 PolarHBondContact O-N 2.8Å
312	R	79.3	Confident	79	Confident	120 Å²	120	71.2 Å²	71.2	45%	0.453	33%	0.334	S	S	.	.	H	α-helix	trans	-73.5	-37.2	179.9	-74.4	-173.8	-62.3	-95.6	0.8	111.7	G308 W309 C310 R316	G308-R312 VanDerWaalsContact C-CZ 3.46Å; G308-R312 WeakPolarHBondContact O-CB 3.5Å; G308-R312 VanDerWaalsContact O-CG 3.25Å; G308-R312 WeakPolarHBondContact O-CG 3.24Å; G308-R312 PolarHBondContact O-N 2.96Å; G308-R312 PolarHBondContact O-NE 3.14Å; G308-R312 PolarHBondContact O-NH1 3Å; W309-R312 PolarHBondContact O-N 3.42Å; W309-R312 VanDerWaalsContact O-N 3.08Å; C310-R312 VanDerWaalsContact C-N 3.31Å; C310-R312 PolarHBondContact O-N 3.45Å; R312-R316 WeakPolarHBondContact O-CG 3.32Å; R312-R316 PolarHBondContact O-N 3.33Å; R312-R316 PolarHBondContact O-NH1 3.37Å
313	M	86.6	Confident	77.4	Confident	0 Å²	0	77.3 Å²	77.3	0%	0	36%	0.356	C	S	.	.	H	α-helix	trans	-67.6	-48.8	176.4	-178.9	-85.2	-84.4	0	0	110.5	D263 V266 M285 W309 C310 R315 R316 Y317 L319	D263-M313 HydrophobicContact CB-CG 3.76Å; V266-M313 HydrophobicContact CB-CE 3.76Å; V266-M313 HydrophobicContact CG1-CE 3.34Å; M285-M313 HydrophobicContact CE-CE 3.37Å; M285-M313 HydrophobicContact CE-SD 4.18Å; W309-M313 HydrophobicContact CH2-CE 3.62Å; W309-M313 HydrophobicContact CZ2-CB 4.24Å; W309-M313 HydrophobicContact CZ2-CE 3.97Å; W309-M313 HydrophobicContact CZ2-CG 4.17Å; W309-M313 HydrophobicContact CZ3-CE 4.39Å; W309-M313 WeakPolarHBondContact O-CB 3.47Å; W309-M313 PolarHBondContact O-N 3.48Å; C310-M313 PolarHBondContact O-N 3.35Å; M313-R315 VanDerWaalsContact C-N 3.27Å; M313-R315 PolarHBondContact O-N 3.4Å; M313-R316 WeakPolarHBondContact O-CA 3.45Å; M313-R316 WeakPolarHBondContact O-CB 3.45Å; M313-R316 PolarHBondContact O-N 2.92Å; M313-Y317 HydrophobicContact CG-CD2 4.13Å; M313-Y317 HydrophobicContact CG-CE2 4.39Å; M313-Y317 WeakPolarHBondContact O-CD2 3.39Å; M313-Y317 PolarHBondContact O-N 2.87Å; M313-Y317 VanDerWaalsContact O-N 3.11Å; M313-Y317 HydrophobicContact SD-CD2 4.18Å; M313-L319 HydrophobicContact SD-CD1 4.42Å
314	M	83.8	Confident	75.4	Confident	17 Å²	17	83.9 Å²	83.9	8%	0.084	38%	0.384	C	S	.	.	H	α-helix	trans	-50.3	-47.2	173.4	-75.3	167.2	42.3	0	0	112.1	M285 C310 R316 Y317 D318 L319 L321	M285-M314 HydrophobicContact CE-CG 3.65Å; M285-M314 HydrophobicContact CE-SD 4.4Å; M285-M314 HydrophobicContact SD-CG 4.39Å; M285-M314 HydrophobicContact SD-SD 4.48Å; C310-M314 WeakPolarHBondContact O-CB 3.3Å; C310-M314 VanDerWaalsContact O-CG 3.31Å; C310-M314 WeakPolarHBondContact O-CG 3.42Å; C310-M314 PolarHBondContact O-N 3.09Å; M314-R316 VanDerWaalsContact C-N 3.29Å; M314-R316 PolarHBondContact O-N 3.41Å; M314-Y317 CarbonylContact O-C 3.56Å; M314-Y317 PolarHBondContact O-N 3.42Å; M314-D318 PolarHBondContact O-N 3.37Å; M314-L319 HydrophobicContact CB-CB 4.13Å; M314-L319 HydrophobicContact CG-CB 4.2Å; M314-L319 PolarHBondContact O-N 3.02Å; M314-L321 HydrophobicContact CE-CG 4.23Å
315	R	80.4	Confident	73.2	Confident	179 Å²	179	81.6 Å²	81.6	68%	0.675	38%	0.384	S	S	*	.	H	α-helix	trans	-63.3	-28.1	176	-84.5	-171.2	-87.5	110.9	-11.4	114.7	R311 M313	R311-R315 PolarHBondContact O-N 2.8Å; M313-R315 VanDerWaalsContact C-N 3.27Å; M313-R315 PolarHBondContact O-N 3.4Å
316	R	82.8	Confident	71.3	Confident	65 Å²	65	86.1 Å²	86.1	25%	0.245	41%	0.413	C	S	.	.	H	α-helix	trans	-76.7	-30.4	176.8	-76.4	-173.6	-71	-82.2	1.4	112.3	K255 D263 R312 M313 M314	K255-R316 WeakPolarHBondContact O-CD 3.45Å; D263-R316 IonicContact OD1-NH2 3.18Å; D263-R316 PolarHBondContact OD1-NH2 2.87Å; D263-R316 IonicContact OD2-CZ 2.9Å; D263-R316 IonicContact OD2-NE 3.2Å; D263-R316 PolarHBondContact OD2-NE 3.2Å; D263-R316 IonicContact OD2-NH2 3.24Å; D263-R316 PolarHBondContact OD2-NH2 2.87Å; R312-R316 WeakPolarHBondContact O-CG 3.32Å; R312-R316 PolarHBondContact O-N 3.33Å; R312-R316 PolarHBondContact O-NH1 3.37Å; M313-R316 WeakPolarHBondContact O-CA 3.45Å; M313-R316 WeakPolarHBondContact O-CB 3.45Å; M313-R316 PolarHBondContact O-N 2.92Å; M314-R316 VanDerWaalsContact C-N 3.29Å; M314-R316 PolarHBondContact O-N 3.41Å
317	Y	82.8	Confident	69.3	Low	55 Å²	55	90.6 Å²	90.6	22%	0.216	44%	0.438	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.7	12.2	-175.1	-74.2	-98.2	0	0	0	113.5	D263 Q264 A267 M313 M314 L319	D263-Y317 HydrophobicContact CB-CE2 3.67Å; Q264-Y317 VanDerWaalsContact CA-OH 3.3Å; Q264-Y317 WeakPolarHBondContact CA-OH 3.47Å; Q264-Y317 PolarHBondContact N-OH 3.17Å; A267-Y317 HydrophobicContact CB-CD1 3.24Å; A267-Y317 HydrophobicContact CB-CD2 4.33Å; A267-Y317 HydrophobicContact CB-CE1 3.67Å; A267-Y317 HydrophobicContact CB-CG 3.62Å; M313-Y317 HydrophobicContact CG-CD2 4.13Å; M313-Y317 HydrophobicContact CG-CE2 4.39Å; M313-Y317 WeakPolarHBondContact O-CD2 3.39Å; M313-Y317 PolarHBondContact O-N 2.87Å; M313-Y317 VanDerWaalsContact O-N 3.11Å; M313-Y317 HydrophobicContact SD-CD2 4.18Å; M314-Y317 CarbonylContact O-C 3.56Å; M314-Y317 PolarHBondContact O-N 3.42Å; Y317-L319 VanDerWaalsContact C-N 3.26Å; Y317-L319 PolarHBondContact O-N 3.4Å
318	D	78.3	Confident	67.6	Low	155 Å²	155	91.7 Å²	91.7	83%	0.829	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.8	37.6	-179.5	-157.4	36.3	0	0	0	114	M314	M314-D318 PolarHBondContact O-N 3.37Å
319	L	79.5	Confident	66.3	Low	27 Å²	27	99 Å²	99	14%	0.141	48%	0.477	C	S	.	.			trans	-94.9	132.2	177.1	-59	171.6	0	0	0	109.7	V270 M285 M313 M314 Y317	V270-L319 HydrophobicContact CB-CD1 4.25Å; V270-L319 HydrophobicContact CG1-CD1 3.94Å; V270-L319 HydrophobicContact CG1-CD2 3.91Å; V270-L319 HydrophobicContact CG2-CD1 4.23Å; M285-L319 HydrophobicContact CE-CD1 4.36Å; M313-L319 HydrophobicContact SD-CD1 4.42Å; M314-L319 HydrophobicContact CB-CB 4.13Å; M314-L319 HydrophobicContact CG-CB 4.2Å; M314-L319 PolarHBondContact O-N 3.02Å; Y317-L319 VanDerWaalsContact C-N 3.26Å; Y317-L319 PolarHBondContact O-N 3.4Å
320	S	71.2	Confident	64.3	Low	71 Å²	71	107.2 Å²	107.2	50%	0.497	52%	0.516	S	S	.	.			trans	-122.7	146.1	173.3	53.1	0	0	0	0	110.2	R322	S320-R322 PolarHBondContact O-N 3.36Å
321	L	65.8	Low	63	Low	86 Å²	86	112.2 Å²	112.2	45%	0.45	54%	0.542	S	S	.	.			trans	-76.2	123.7	166.6	-67.9	-172.6	0	0	0	107.8	R282 M314	R282-L321 HydrophobicContact CG-CD1 4.13Å; R282-L321 HydrophobicContact CG-CD2 4.35Å; R282-L321 VanDerWaalsContact NH2-CD1 3.3Å; M314-L321 HydrophobicContact CE-CG 4.23Å
322	R	55.3	Low	62	Low	218 Å²	218	108.3 Å²	108.3	82%	0.823	53%	0.534	S	S	*	.			trans	-111.8	129.9	168.6	-61.3	-167.4	-170.2	-156.1	6.3	108.4	S320	S320-R322 PolarHBondContact O-N 3.36Å
323	H	46.7	Very low	61.2	Low	153 Å²	153	112.6 Å²	112.6	71%	0.708	56%	0.559	S	S	*	*	P	Polyproline II helix	trans	-71.3	128.3	160	-80.8	-108.2	0	0	0	106.6	V325 R375	H323-V325 PolarHBondContact O-N 3.18Å; H323-V325 VanDerWaalsContact O-N 3.12Å; H323-R375 PolarHBondContact ND1-NH2 2.9Å
324	K	45.3	Very low	60.5	Low	148 Å²	148	115.5 Å²	115.5	64%	0.643	58%	0.575	S	S	*	*	P	Polyproline II helix	trans	-56.3	120.5	158.8	-76.2	-173	177.8	-176.7	0	105.5	P326 R375	K324-P326 WeakPolarHBondContact O-CD 3.39Å; K324-R375 PolarHBondContact O-NH1 3.01Å
325	V	38.3	Very low	59.9	Low	122 Å²	122	116 Å²	116	74%	0.739	58%	0.578	S	S	*	*	P	Polyproline II helix	trans	-72	119.1	172.7	-177.3	0	0	0	0	104.6	H323 V327	H323-V325 PolarHBondContact O-N 3.18Å; H323-V325 VanDerWaalsContact O-N 3.12Å; V325-V327 PolarHBondContact O-N 3.32Å
326	P	44.9	Very low	59.6	Low	102 Å²	102	110.8 Å²	110.8	66%	0.662	57%	0.566	S	S	*	*	P	Polyproline II helix	trans	-54.8	133.6	168.3	-17.7	30.8	0	0	0	107.2	K324 P328	K324-P326 WeakPolarHBondContact O-CD 3.39Å; P326-P328 WeakPolarHBondContact O-CD 3.25Å; P326-P328 VanDerWaalsContact O-N 3.1Å
327	V	38.9	Very low	59.5	Low	131 Å²	131	113.6 Å²	113.6	79%	0.794	58%	0.582	S	S	*	*	P	Polyproline II helix	trans	-52.4	122.2	170.3	177.9	0	0	0	0	106.2	V325 Q329	V325-V327 PolarHBondContact O-N 3.32Å; V327-Q329 PolarHBondContact O-N 3.36Å
328	P	37.1	Very low	59.4	Low	104 Å²	104	114.1 Å²	114.1	68%	0.675	59%	0.585	S	S	*	*	P	Polyproline II helix	trans	-57.5	117.1	177.7	-19.2	29.9	0	0	0	107.5	P326 H330	P326-P328 WeakPolarHBondContact O-CD 3.25Å; P326-P328 VanDerWaalsContact O-N 3.1Å; P328-H330 PolarHBondContact O-N 2.99Å
329	Q	47.4	Very low	59.5	Low	179 Å²	179	108.2 Å²	108.2	84%	0.836	55%	0.553	S	S	*	*	P	Polyproline II helix	trans	-60.4	122.9	160.6	-74.2	178.2	-11	0	0	105.4	V327 L331	V327-Q329 PolarHBondContact O-N 3.36Å; Q329-L331 PolarHBondContact O-N 2.94Å; Q329-L331 VanDerWaalsContact O-N 3.13Å
330	H	46.8	Very low	59.6	Low	188 Å²	188	107 Å²	107	87%	0.87	55%	0.547	S	S	*	.	P	Polyproline II helix	trans	-54.3	123.2	171.9	-105.3	-76.7	0	0	0	107.4	P328	P328-H330 PolarHBondContact O-N 2.99Å
331	L	52.8	Low	60.1	Low	106 Å²	106	107.4 Å²	107.4	56%	0.555	55%	0.546	S	S	*	.	P	Polyproline II helix	trans	-61.4	130.7	172.5	-71.7	164.4	0	0	0	107.2	Q329 L335	Q329-L331 PolarHBondContact O-N 2.94Å; Q329-L331 VanDerWaalsContact O-N 3.13Å; L331-L335 HydrophobicContact CB-CD2 4.19Å; L331-L335 HydrophobicContact CD1-CD2 4.08Å; L331-L335 HydrophobicContact CD2-CD1 3.88Å; L331-L335 HydrophobicContact CD2-CD2 3.89Å; L331-L335 HydrophobicContact CG-CD2 4.27Å
332	P	58.2	Low	61.2	Low	49 Å²	49	103.5 Å²	103.5	32%	0.318	53%	0.526	S	S	.	.	P	Polyproline II helix	trans	-52.7	143.4	176.6	-27.7	35.2	0	0	0	111.5	D334 L335	P332-D334 WeakPolarHBondContact CB-OD1 3.26Å; P332-D334 PolarHBondContact O-N 3.28Å; P332-D334 VanDerWaalsContact O-N 3.13Å; P332-L335 VanDerWaalsContact O-CB 3.29Å; P332-L335 WeakPolarHBondContact O-CB 3.43Å; P332-L335 PolarHBondContact O-N 2.77Å; P332-L335 VanDerWaalsContact O-N 3.08Å
333	E	62.9	Low	62.6	Low	209 Å²	209	93.7 Å²	93.7	98%	0.977	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-23.6	177.8	-67.1	179.9	170.3	0	0	112.3
334	D	71.4	Confident	64.4	Low	61 Å²	61	91.9 Å²	91.9	33%	0.326	48%	0.476	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.1	13.5	178.8	70.2	-13.9	0	0	0	114.2	P332 T336 E337 K338	P332-D334 WeakPolarHBondContact CB-OD1 3.26Å; P332-D334 PolarHBondContact O-N 3.28Å; P332-D334 VanDerWaalsContact O-N 3.13Å; D334-T336 VanDerWaalsContact C-N 3.31Å; D334-T336 PolarHBondContact O-N 2.89Å; D334-E337 PolarHBondContact O-N 2.6Å; D334-K338 PolarHBondContact O-N 3.16Å; D334-K338 IonicContact OD1-NZ 3.71Å; D334-K338 PolarHBondContact OD1-NZ 3.42Å; D334-K338 WeakPolarHBondContact OD2-CE 3.22Å; D334-K338 IonicContact OD2-NZ 3.88Å; D334-K338 PolarHBondContact OD2-NZ 2.97Å
335	L	70.7	Confident	66.4	Low	28 Å²	28	87.3 Å²	87.3	15%	0.147	46%	0.463	C	S	.	.	H	α-helix	trans	-54.2	-46.4	-177.1	-170.8	82.6	0	0	0	112.6	L331 P332 K338 L339 L481	L331-L335 HydrophobicContact CB-CD2 4.19Å; L331-L335 HydrophobicContact CD1-CD2 4.08Å; L331-L335 HydrophobicContact CD2-CD1 3.88Å; L331-L335 HydrophobicContact CD2-CD2 3.89Å; L331-L335 HydrophobicContact CG-CD2 4.27Å; P332-L335 VanDerWaalsContact O-CB 3.29Å; P332-L335 WeakPolarHBondContact O-CB 3.43Å; P332-L335 PolarHBondContact O-N 2.77Å; P332-L335 VanDerWaalsContact O-N 3.08Å; L335-K338 PolarHBondContact O-N 2.84Å; L335-L339 WeakPolarHBondContact O-CB 3.42Å; L335-L339 PolarHBondContact O-N 3.19Å; L335-L481 HydrophobicContact CD1-CD2 3.28Å; L335-L481 HydrophobicContact CD1-CG 4.21Å; L335-L481 HydrophobicContact CG-CD2 3.92Å
336	T	74.2	Confident	68.8	Low	70 Å²	70	81.6 Å²	81.6	43%	0.429	43%	0.428	S	S	.	.	H	α-helix	trans	-63.9	-42.3	-178.7	-52.2	0	0	0	0	110.9	D334 L339 V340 I568 L572	D334-T336 VanDerWaalsContact C-N 3.31Å; D334-T336 PolarHBondContact O-N 2.89Å; T336-L339 PolarHBondContact O-N 3.33Å; T336-V340 HydrophobicContact CG2-CG2 4.48Å; T336-V340 WeakPolarHBondContact O-CB 3.35Å; T336-V340 VanDerWaalsContact O-CG2 3.28Å; T336-V340 WeakPolarHBondContact O-CG2 3.2Å; T336-V340 PolarHBondContact O-N 3.43Å; T336-I568 HydrophobicContact CG2-CG2 4Å; T336-L572 HydrophobicContact CG2-CD2 4.19Å
337	E	81	Confident	70.8	Confident	123 Å²	123	77.1 Å²	77.1	58%	0.575	40%	0.399	S	S	*	.	H	α-helix	trans	-65.3	-44	178.5	-173.6	179.4	179.7	0	0	111.6	D334 L339 V340 T341	D334-E337 PolarHBondContact O-N 2.6Å; E337-L339 VanDerWaalsContact C-N 3.33Å; E337-L339 PolarHBondContact O-N 2.95Å; E337-V340 PolarHBondContact O-N 2.87Å; E337-T341 VanDerWaalsContact O-CB 3.27Å; E337-T341 WeakPolarHBondContact O-CB 3.17Å; E337-T341 PolarHBondContact O-N 2.95Å; E337-T341 PolarHBondContact O-OG1 2.67Å
338	K	81.1	Confident	73.1	Confident	66 Å²	66	73.7 Å²	73.7	29%	0.287	38%	0.384	S	S	.	.	H	α-helix	trans	-61.6	-41.1	174.9	-76.3	173	172.3	148.7	0	112.1	D334 L335 Y342 P478 L481	D334-K338 PolarHBondContact O-N 3.16Å; D334-K338 IonicContact OD1-NZ 3.71Å; D334-K338 PolarHBondContact OD1-NZ 3.42Å; D334-K338 WeakPolarHBondContact OD2-CE 3.22Å; D334-K338 IonicContact OD2-NZ 3.88Å; D334-K338 PolarHBondContact OD2-NZ 2.97Å; L335-K338 PolarHBondContact O-N 2.84Å; K338-Y342 WeakPolarHBondContact O-CB 3.45Å; K338-Y342 PolarHBondContact O-N 3.3Å; K338-P478 HydrophobicContact CB-CB 4.28Å; K338-L481 HydrophobicContact CB-CD1 3.83Å
339	L	80.6	Confident	75.7	Confident	31 Å²	31	70.7 Å²	70.7	16%	0.162	36%	0.362	C	S	.	.	H	α-helix	trans	-64.2	-50.6	178.3	-173.7	75.1	0	0	0	111.1	L335 T336 E337 T341 Y342 Q343 L481 L485	L335-L339 WeakPolarHBondContact O-CB 3.42Å; L335-L339 PolarHBondContact O-N 3.19Å; T336-L339 PolarHBondContact O-N 3.33Å; E337-L339 VanDerWaalsContact C-N 3.33Å; E337-L339 PolarHBondContact O-N 2.95Å; L339-T341 VanDerWaalsContact C-N 3.34Å; L339-T341 PolarHBondContact O-N 2.76Å; L339-Y342 WeakPolarHBondContact O-CB 3.4Å; L339-Y342 PolarHBondContact O-N 3.41Å; L339-Q343 WeakPolarHBondContact O-CG 3.31Å; L339-Q343 PolarHBondContact O-N 3.41Å; L339-L481 HydrophobicContact CB-CD1 4.4Å; L339-L481 HydrophobicContact CD1-CD1 4.48Å; L339-L481 HydrophobicContact CD1-CD2 4.5Å; L339-L485 HydrophobicContact CD1-CD1 4.13Å; L339-L485 HydrophobicContact CD1-CD2 3.78Å; L339-L485 HydrophobicContact CD1-CG 4.13Å
340	V	80.1	Confident	77.7	Confident	3 Å²	3	63.8 Å²	63.8	2%	0.018	33%	0.329	C	S	.	.	H	α-helix	trans	-61.8	-43.7	178.6	171.4	0	0	0	0	110.7	T336 E337 Y342 Q343 R344 L565 I568	T336-V340 HydrophobicContact CG2-CG2 4.48Å; T336-V340 WeakPolarHBondContact O-CB 3.35Å; T336-V340 VanDerWaalsContact O-CG2 3.28Å; T336-V340 WeakPolarHBondContact O-CG2 3.2Å; T336-V340 PolarHBondContact O-N 3.43Å; E337-V340 PolarHBondContact O-N 2.87Å; V340-Y342 VanDerWaalsContact C-N 3.33Å; V340-Y342 PolarHBondContact O-N 3.43Å; V340-Q343 PolarHBondContact O-N 2.87Å; V340-R344 HydrophobicContact CG1-CG 4.31Å; V340-R344 WeakPolarHBondContact O-CB 3.47Å; V340-R344 WeakPolarHBondContact O-CG 3.4Å; V340-R344 PolarHBondContact O-N 2.75Å; V340-L565 HydrophobicContact CG1-CD1 4.42Å; V340-L565 HydrophobicContact CG1-CG 4.5Å; V340-I568 HydrophobicContact CG2-CB 4.47Å; V340-I568 HydrophobicContact CG2-CG2 3.5Å; V340-I568 VanDerWaalsContact CG2-CG2 3.5Å
341	T	83.7	Confident	79.6	Confident	78 Å²	78	61.1 Å²	61.1	48%	0.479	31%	0.311	S	S	.	.	H	α-helix	trans	-60.9	-43.8	177.7	-59.7	0	0	0	0	111.5	E337 L339 S345	E337-T341 VanDerWaalsContact O-CB 3.27Å; E337-T341 WeakPolarHBondContact O-CB 3.17Å; E337-T341 PolarHBondContact O-N 2.95Å; E337-T341 PolarHBondContact O-OG1 2.67Å; L339-T341 VanDerWaalsContact C-N 3.34Å; L339-T341 PolarHBondContact O-N 2.76Å; T341-S345 PolarHBondContact O-N 3.37Å; T341-S345 PolarHBondContact O-OG 2.99Å
342	Y	87.3	Confident	81.4	Confident	4 Å²	4	59.3 Å²	59.3	2%	0.016	31%	0.312	C	S	.	.	H	α-helix	trans	-61.1	-52.3	174.8	175	-94	0	0	0	111.3	K338 L339 V340 R344 S345 V346 I451 V475 I477 P478 L485	K338-Y342 WeakPolarHBondContact O-CB 3.45Å; K338-Y342 PolarHBondContact O-N 3.3Å; L339-Y342 WeakPolarHBondContact O-CB 3.4Å; L339-Y342 PolarHBondContact O-N 3.41Å; V340-Y342 VanDerWaalsContact C-N 3.33Å; V340-Y342 PolarHBondContact O-N 3.43Å; Y342-R344 VanDerWaalsContact C-N 3.34Å; Y342-R344 PolarHBondContact O-N 3.17Å; Y342-S345 PolarHBondContact O-N 3.03Å; Y342-S345 PolarHBondContact O-OG 3.36Å; Y342-V346 HydrophobicContact CD1-CG2 4.24Å; Y342-V346 HydrophobicContact CD2-CG2 4.49Å; Y342-V346 HydrophobicContact CE1-CG2 3.79Å; Y342-V346 HydrophobicContact CE2-CG2 4.1Å; Y342-V346 PolarHBondContact O-N 3.34Å; Y342-I451 WeakPolarHBondContact OH-CG2 3.28Å; Y342-V475 HydrophobicContact CD2-CG1 4.3Å; Y342-V475 HydrophobicContact CE2-CG1 3.56Å; Y342-I477 HydrophobicContact CE2-CG1 4.18Å; Y342-P478 HydrophobicContact CD2-CG 4.3Å; Y342-L485 HydrophobicContact CD1-CD1 3.43Å; Y342-L485 VanDerWaalsContact CD1-CD1 3.43Å; Y342-L485 HydrophobicContact CD1-CD2 3.9Å; Y342-L485 HydrophobicContact CD1-CG 4.23Å; Y342-L485 HydrophobicContact CD2-CD1 4.18Å; Y342-L485 HydrophobicContact CE1-CB 4.36Å; Y342-L485 HydrophobicContact CE1-CD1 3.75Å; Y342-L485 HydrophobicContact CE1-CD2 3.81Å; Y342-L485 HydrophobicContact CE1-CG 4.19Å; Y342-L485 HydrophobicContact CE2-CD1 4.41Å; Y342-L485 HydrophobicContact CG-CD1 3.66Å
343	Q	85.1	Confident	82.9	Confident	13 Å²	13	60.7 Å²	60.7	6%	0.061	31%	0.313	C	S	.	.	H	α-helix	trans	-57	-45.8	180	-74.3	173.5	-28	0	0	111.8	L339 V340 S345 V346 L347 H553 L565	L339-Q343 WeakPolarHBondContact O-CG 3.31Å; L339-Q343 PolarHBondContact O-N 3.41Å; V340-Q343 PolarHBondContact O-N 2.87Å; Q343-S345 VanDerWaalsContact C-N 3.33Å; Q343-S345 PolarHBondContact O-N 2.98Å; Q343-V346 PolarHBondContact O-N 3.28Å; Q343-L347 WeakPolarHBondContact O-CB 3.25Å; Q343-L347 WeakPolarHBondContact O-CG 3.3Å; Q343-L347 PolarHBondContact O-N 2.85Å; Q343-H553 HydrophobicContact CG-CB 4.15Å; Q343-H553 PolarHBondContact NE2-CD2 2.95Å; Q343-H553 VanDerWaalsContact NE2-CD2 3.3Å; Q343-H553 VanDerWaalsContact NE2-CG 3.31Å; Q343-L565 HydrophobicContact CB-CD1 3.82Å
344	R	83.7	Confident	84.1	Confident	114 Å²	114	57.4 Å²	57.4	43%	0.43	30%	0.303	S	S	.	.	H	α-helix	trans	-57.7	-43.8	174.6	-75.9	179.9	176.9	165.5	-14.5	112.3	V340 Y342 L347 A348 L565 E569	V340-R344 HydrophobicContact CG1-CG 4.31Å; V340-R344 WeakPolarHBondContact O-CB 3.47Å; V340-R344 WeakPolarHBondContact O-CG 3.4Å; V340-R344 PolarHBondContact O-N 2.75Å; Y342-R344 VanDerWaalsContact C-N 3.34Å; Y342-R344 PolarHBondContact O-N 3.17Å; R344-L347 PolarHBondContact O-N 2.98Å; R344-A348 VanDerWaalsContact O-CB 3.24Å; R344-A348 WeakPolarHBondContact O-CB 3.46Å; R344-A348 PolarHBondContact O-N 3.48Å; R344-L565 HydrophobicContact CG-CD1 4.48Å; R344-L565 HydrophobicContact CG-CD2 3.51Å; R344-E569 IonicContact CZ-OE1 3.41Å; R344-E569 IonicContact NE-OE1 3.28Å; R344-E569 PolarHBondContact NE-OE1 3.22Å; R344-E569 IonicContact NH2-OE1 2.98Å; R344-E569 PolarHBondContact NH2-OE1 2.96Å; R344-E569 IonicContact NH2-OE2 3.64Å; R344-E569 PolarHBondContact NH2-OE2 3.14Å
345	S	87.6	Confident	84.9	Confident	53 Å²	53	55.4 Å²	55.4	37%	0.371	29%	0.291	S	S	.	.	H	α-helix	trans	-66.6	-41.2	-179.7	68.2	0	0	0	0	112.6	T341 Y342 Q343 L349	T341-S345 PolarHBondContact O-N 3.37Å; T341-S345 PolarHBondContact O-OG 2.99Å; Y342-S345 PolarHBondContact O-N 3.03Å; Y342-S345 PolarHBondContact O-OG 3.36Å; Q343-S345 VanDerWaalsContact C-N 3.33Å; Q343-S345 PolarHBondContact O-N 2.98Å; S345-L349 WeakPolarHBondContact O-CG 3.48Å; S345-L349 PolarHBondContact O-N 3.33Å; S345-L349 VanDerWaalsContact O-N 3.11Å
346	V	89.2	Confident	85.7	Confident	1 Å²	1	58.5 Å²	58.5	1%	0.006	31%	0.305	C	S	.	.	H	α-helix	trans	-64.5	-46.9	174.8	174.1	0	0	0	0	110.6	Y342 Q343 A348 L349 R350 M449 V475	Y342-V346 HydrophobicContact CD1-CG2 4.24Å; Y342-V346 HydrophobicContact CD2-CG2 4.49Å; Y342-V346 HydrophobicContact CE1-CG2 3.79Å; Y342-V346 HydrophobicContact CE2-CG2 4.1Å; Y342-V346 PolarHBondContact O-N 3.34Å; Q343-V346 PolarHBondContact O-N 3.28Å; V346-A348 PolarHBondContact O-N 3.43Å; V346-L349 PolarHBondContact O-N 2.9Å; V346-R350 HydrophobicContact CG1-CG 4.43Å; V346-R350 VanDerWaalsContact O-CG 3.29Å; V346-R350 WeakPolarHBondContact O-CG 3.29Å; V346-R350 PolarHBondContact O-N 2.89Å; V346-M449 HydrophobicContact CG1-SD 4.49Å; V346-V475 HydrophobicContact CG2-CG1 3.92Å
347	L	87.4	Confident	86.3	Confident	8 Å²	8	58.5 Å²	58.5	4%	0.042	30%	0.304	C	S	.	.	H	α-helix	trans	-59.9	-45.5	177.1	-80.1	171.1	0	0	0	112.4	Q343 R344 L349 R350 R351 L558 E561	Q343-L347 WeakPolarHBondContact O-CB 3.25Å; Q343-L347 WeakPolarHBondContact O-CG 3.3Å; Q343-L347 PolarHBondContact O-N 2.85Å; R344-L347 PolarHBondContact O-N 2.98Å; L347-L349 PolarHBondContact O-N 3.48Å; L347-R350 PolarHBondContact O-N 3.44Å; L347-R351 WeakPolarHBondContact O-CG 3.36Å; L347-R351 PolarHBondContact O-N 2.86Å; L347-L558 HydrophobicContact CD2-CD2 3.52Å; L347-E561 HydrophobicContact CD1-CB 4.27Å; L347-E561 HydrophobicContact CD2-CB 4.09Å; L347-E561 WeakPolarHBondContact CD2-OE2 3.29Å
348	A	87.1	Confident	86.6	Confident	59 Å²	59	53.4 Å²	53.4	49%	0.488	28%	0.283	S	S	.	.	H	α-helix	trans	-60.4	-45.2	178.7	0	0	0	0	0	111.5	R344 V346 R351 A352	R344-A348 VanDerWaalsContact O-CB 3.24Å; R344-A348 WeakPolarHBondContact O-CB 3.46Å; R344-A348 PolarHBondContact O-N 3.48Å; V346-A348 PolarHBondContact O-N 3.43Å; A348-R351 PolarHBondContact O-N 2.94Å; A348-A352 VanDerWaalsContact O-CB 3.3Å; A348-A352 WeakPolarHBondContact O-CB 3.37Å; A348-A352 PolarHBondContact O-N 3.08Å
349	L	91.3	Very high	87.1	Confident	41 Å²	41	50.3 Å²	50.3	22%	0.215	27%	0.27	C	S	.	.	H	α-helix	trans	-61.9	-46	174.9	-75	171.5	0	0	0	111.3	S345 V346 L347 R351 A352 H353 Y355 M449 D473 V475	S345-L349 WeakPolarHBondContact O-CG 3.48Å; S345-L349 PolarHBondContact O-N 3.33Å; S345-L349 VanDerWaalsContact O-N 3.11Å; V346-L349 PolarHBondContact O-N 2.9Å; L347-L349 PolarHBondContact O-N 3.48Å; L349-R351 VanDerWaalsContact C-N 3.32Å; L349-R351 PolarHBondContact O-N 3.09Å; L349-A352 PolarHBondContact O-N 2.9Å; L349-H353 PolarHBondContact O-N 3.12Å; L349-Y355 HydrophobicContact CB-CE2 4Å; L349-Y355 VanDerWaalsContact O-CE2 3.27Å; L349-Y355 WeakPolarHBondContact O-CE2 3.43Å; L349-M449 HydrophobicContact CB-CE 3.57Å; L349-M449 HydrophobicContact CD1-CE 4.08Å; L349-M449 HydrophobicContact CG-CE 4.48Å; L349-D473 HydrophobicContact CD2-CB 4.48Å; L349-V475 HydrophobicContact CD1-CG2 3.63Å
350	R	89.7	Confident	87.7	Confident	34 Å²	34	49 Å²	49	13%	0.128	26%	0.263	C	S	.	.	H	α-helix	trans	-59.2	-42.1	179.1	-73.3	176.2	71.2	-160.8	-0.3	112	V346 L347 D354 Y355 M449 I554 S556 L558 E561	V346-R350 HydrophobicContact CG1-CG 4.43Å; V346-R350 VanDerWaalsContact O-CG 3.29Å; V346-R350 WeakPolarHBondContact O-CG 3.29Å; V346-R350 PolarHBondContact O-N 2.89Å; L347-R350 PolarHBondContact O-N 3.44Å; R350-D354 WeakPolarHBondContact O-CA 3.44Å; R350-D354 PolarHBondContact O-N 2.76Å; R350-Y355 HydrophobicContact CG-CD2 4.28Å; R350-M449 HydrophobicContact CG-CE 4.1Å; R350-I554 VanDerWaalsContact CD-O 3.29Å; R350-I554 WeakPolarHBondContact CD-O 3.5Å; R350-I554 PolarHBondContact NE-O 3.12Å; R350-I554 PolarHBondContact NH1-O 3.35Å; R350-S556 PolarHBondContact NH1-O 2.73Å; R350-S556 PolarHBondContact NH2-O 3.41Å; R350-L558 HydrophobicContact CB-CD2 4.28Å; R350-E561 IonicContact NH1-OE1 3.71Å; R350-E561 IonicContact NH1-OE2 3.66Å; R350-E561 PolarHBondContact NH1-OE2 3.14Å
351	R	87.3	Confident	88.2	Confident	132 Å²	132	48.9 Å²	48.9	50%	0.498	26%	0.262	S	S	.	.	H	α-helix	trans	-67.1	-40.4	175.1	-72.1	178.4	-179.8	159.5	10.3	112.9	L347 A348 L349 D562	L347-R351 WeakPolarHBondContact O-CG 3.36Å; L347-R351 PolarHBondContact O-N 2.86Å; A348-R351 PolarHBondContact O-N 2.94Å; L349-R351 VanDerWaalsContact C-N 3.32Å; L349-R351 PolarHBondContact O-N 3.09Å; R351-D562 IonicContact CZ-OD1 3.07Å; R351-D562 IonicContact CZ-OD2 3.4Å; R351-D562 IonicContact NH1-OD1 2.84Å; R351-D562 IonicContact NH2-OD1 2.66Å; R351-D562 PolarHBondContact NH2-OD1 2.77Å; R351-D562 IonicContact NH2-OD2 3.68Å; R351-D562 PolarHBondContact NH2-OD2 2.94Å
352	A	90.1	Very high	88.8	Confident	69 Å²	69	45.2 Å²	45.2	57%	0.57	24%	0.24	S	C	*	.	H	α-helix	trans	-70.3	-32.8	-176.8	0	0	0	0	0	112.9	A348 L349	A348-A352 VanDerWaalsContact O-CB 3.3Å; A348-A352 WeakPolarHBondContact O-CB 3.37Å; A348-A352 PolarHBondContact O-N 3.08Å; L349-A352 PolarHBondContact O-N 2.9Å
353	H	89.5	Confident	89	Confident	77 Å²	77	45 Å²	45	36%	0.356	24%	0.239	S	C	.	.	H	α-helix	trans	-123.1	-7.5	-167.3	-62.5	-51.2	0	0	0	115.1	L349 Y355 D473	L349-H353 PolarHBondContact O-N 3.12Å; H353-Y355 VanDerWaalsContact C-N 3.33Å; H353-Y355 HydrophobicContact CB-CD1 4.34Å; H353-Y355 HydrophobicContact CB-CD2 4.22Å; H353-Y355 HydrophobicContact CB-CE1 3.86Å; H353-Y355 HydrophobicContact CB-CE2 3.7Å; H353-Y355 AromaticContact CD2-CZ 3.85Å; H353-Y355 PolarHBondContact CD2-OH 3.33Å; H353-Y355 AromaticContact CG-CZ 4Å; H353-Y355 PolarHBondContact O-N 3.3Å; H353-D473 IonicContact CD2-OD2 3.19Å
354	D	87.8	Confident	89.1	Confident	141 Å²	141	44.8 Å²	44.8	75%	0.754	24%	0.238	S	C	*	.			trans	44.8	55.4	176.7	-167	32.9	0	0	0	112.7	R350 E356	R350-D354 WeakPolarHBondContact O-CA 3.44Å; R350-D354 PolarHBondContact O-N 2.76Å; D354-E356 PolarHBondContact O-N 3.03Å
355	Y	89.3	Confident	89.1	Confident	18 Å²	18	40.2 Å²	40.2	7%	0.071	22%	0.222	C	C	.	.			trans	-61.7	131.4	-174.9	-56.6	-84.6	0	0	0	111.2	L349 R350 H353 V357 M360 R447 G448 M449 D473	L349-Y355 HydrophobicContact CB-CE2 4Å; L349-Y355 VanDerWaalsContact O-CE2 3.27Å; L349-Y355 WeakPolarHBondContact O-CE2 3.43Å; R350-Y355 HydrophobicContact CG-CD2 4.28Å; H353-Y355 VanDerWaalsContact C-N 3.33Å; H353-Y355 HydrophobicContact CB-CD1 4.34Å; H353-Y355 HydrophobicContact CB-CD2 4.22Å; H353-Y355 HydrophobicContact CB-CE1 3.86Å; H353-Y355 HydrophobicContact CB-CE2 3.7Å; H353-Y355 AromaticContact CD2-CZ 3.85Å; H353-Y355 PolarHBondContact CD2-OH 3.33Å; H353-Y355 AromaticContact CG-CZ 4Å; H353-Y355 PolarHBondContact O-N 3.3Å; Y355-V357 PolarHBondContact O-N 3.37Å; Y355-M360 HydrophobicContact CG-CG 4.4Å; Y355-R447 HydrophobicContact CD1-CB 4.48Å; Y355-R447 WeakPolarHBondContact CD1-O 3.25Å; Y355-R447 HydrophobicContact CE1-CB 4.19Å; Y355-R447 HydrophobicContact CE1-CG 3.89Å; Y355-G448 WeakPolarHBondContact CE1-O 3.48Å; Y355-M449 HydrophobicContact CD1-CB 4.2Å; Y355-M449 HydrophobicContact CD2-CE 3.68Å; Y355-M449 HydrophobicContact CE1-CB 4.03Å; Y355-M449 HydrophobicContact CE2-CB 4.37Å; Y355-M449 HydrophobicContact CE2-CE 3.2Å; Y355-M449 HydrophobicContact CG-CB 4.43Å; Y355-D473 WeakPolarHBondContact OH-CB 3.32Å; Y355-D473 VanDerWaalsContact OH-CG 3.23Å; Y355-D473 PolarHBondContact OH-OD2 2.79Å
356	E	87.6	Confident	88.6	Confident	94 Å²	94	38.3 Å²	38.3	44%	0.439	21%	0.208	S	C	.	.			trans	-60.6	139	162.1	-72.6	-171.2	-171.6	0	0	109.8	D354 A358 Q359 Q446	D354-E356 PolarHBondContact O-N 3.03Å; E356-A358 PolarHBondContact O-N 3.24Å; E356-Q359 HydrophobicContact CB-CG 4.11Å; E356-Q359 PolarHBondContact O-N 3.23Å; E356-Q446 VanDerWaalsContact CD-NE2 3.31Å; E356-Q446 PolarHBondContact OE1-NE2 3.49Å; E356-Q446 PolarHBondContact OE2-OE1 2.98Å
357	V	86.9	Confident	87.8	Confident	70 Å²	70	41.9 Å²	41.9	42%	0.424	23%	0.231	S	C	.	.	G	3₁₀ helix	trans	-54.6	-32.5	178.7	-176.5	0	0	0	0	111.7	Y355 Q359 M360 A388 D389	Y355-V357 PolarHBondContact O-N 3.37Å; V357-Q359 PolarHBondContact O-N 3.1Å; V357-M360 HydrophobicContact CB-CE 4.39Å; V357-M360 HydrophobicContact CG1-CE 4.46Å; V357-M360 HydrophobicContact CG2-CE 4.29Å; V357-M360 PolarHBondContact O-N 3.1Å; V357-A388 HydrophobicContact CG1-CB 3.62Å; V357-A388 WeakPolarHBondContact O-CB 3.08Å; V357-D389 HydrophobicContact CG1-CB 4Å
358	A	87.4	Confident	86.9	Confident	16 Å²	16	42 Å²	42	13%	0.132	23%	0.232	C	C	.	.	G	3₁₀ helix	trans	-65.3	-18.9	174.7	0	0	0	0	0	115.2	E356 D389	E356-A358 PolarHBondContact O-N 3.24Å; A358-D389 WeakPolarHBondContact CA-OD2 3.48Å
359	Q	90.6	Very high	85.8	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-102.2	-2.2	-178.4	-54.1	-53.7	-36.3	0	0	113.1	E356 V357 G441 Q446 G448 M449	E356-Q359 HydrophobicContact CB-CG 4.11Å; E356-Q359 PolarHBondContact O-N 3.23Å; V357-Q359 PolarHBondContact O-N 3.1Å; Q359-G441 PolarHBondContact NE2-O 3.12Å; Q359-Q446 HydrophobicContact CG-CB 4.35Å; Q359-G448 WeakPolarHBondContact O-CA 3.19Å; Q359-M449 PolarHBondContact O-N 2.96Å
360	M	92.6	Very high	84.4	Confident	4 Å²	4	40.5 Å²	40.5	2%	0.02	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	122.8	174.7	-60.2	-167.9	-72.8	0	0	109.8	Y355 V357 L387 A388 M449	Y355-M360 HydrophobicContact CG-CG 4.4Å; V357-M360 HydrophobicContact CB-CE 4.39Å; V357-M360 HydrophobicContact CG1-CE 4.46Å; V357-M360 HydrophobicContact CG2-CE 4.29Å; V357-M360 PolarHBondContact O-N 3.1Å; M360-L387 CarbonylContact O-C 3.44Å; M360-L387 WeakPolarHBondContact O-CA 3.43Å; M360-A388 HydrophobicContact CB-CB 3.88Å; M360-A388 HydrophobicContact CE-CB 4.11Å; M360-A388 PolarHBondContact O-N 2.86Å; M360-M449 CarbonylContact C-O 3.59Å; M360-M449 WeakPolarHBondContact CA-O 3.18Å; M360-M449 HydrophobicContact CG-CB 4.19Å
361	G	92.3	Very high	82.8	Confident	1 Å²	1	42.6 Å²	42.6	1%	0.01	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	156.7	-177.2	0	0	0	0	0	112.8	V386 M449 L450 I451	G361-V386 CarbonylContact C-O 3.57Å; G361-V386 VanDerWaalsContact CA-O 3.31Å; G361-V386 WeakPolarHBondContact CA-O 3.3Å; G361-M449 PolarHBondContact N-O 2.99Å; G361-L450 WeakPolarHBondContact O-CA 3.44Å; G361-I451 WeakPolarHBondContact O-CD1 3.13Å; G361-I451 PolarHBondContact O-N 3.11Å
362	N	94.8	Very high	81	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	133.1	173.7	179.7	-105.4	0	0	0	108.9	P385 V386 I451 Q486 V487 L488 F549	N362-P385 WeakPolarHBondContact O-CA 3.39Å; N362-V386 HydrophobicContact CB-CG2 4.12Å; N362-V386 PolarHBondContact N-O 3.26Å; N362-V386 PolarHBondContact O-N 3.32Å; N362-I451 WeakPolarHBondContact CA-O 3.37Å; N362-I451 PolarHBondContact ND2-O 3.05Å; N362-Q486 PolarHBondContact ND2-OE1 2.92Å; N362-Q486 PolarHBondContact OD1-OE1 3.11Å; N362-V487 HydrophobicContact CB-CB 4.2Å; N362-V487 HydrophobicContact CB-CG2 4.15Å; N362-V487 WeakPolarHBondContact OD1-CB 3.29Å; N362-V487 PolarHBondContact OD1-N 2.67Å; N362-L488 WeakPolarHBondContact OD1-CG 3.33Å; N362-L488 PolarHBondContact OD1-N 3.03Å; N362-F549 HydrophobicContact CB-CE1 3.9Å; N362-F549 HydrophobicContact CB-CE2 4.42Å; N362-F549 HydrophobicContact CB-CZ 3.56Å
363	A	91.9	Very high	78.8	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	21%	0.21	C	C	.	.			trans	-142.2	151.6	180	0	0	0	0	0	111.7	E383 P385 W431 L450 I451 L452	A363-E383 HydrophobicContact CB-CG 4.37Å; A363-E383 WeakPolarHBondContact CB-OE1 3.22Å; A363-P385 HydrophobicContact CB-CB 3.97Å; A363-W431 HydrophobicContact CB-CH2 3.84Å; A363-W431 HydrophobicContact CB-CZ2 3.82Å; A363-L450 HydrophobicContact CB-CD1 4.41Å; A363-I451 PolarHBondContact N-O 3.05Å; A363-I451 VanDerWaalsContact N-O 3.1Å; A363-L452 HydrophobicContact CB-CD2 3.77Å
364	D	87	Confident	76.1	Confident	9 Å²	9	37.4 Å²	37.4	5%	0.048	21%	0.214	C	C	.	.			trans	-167.6	154.2	-179	-158.4	-1.9	0	0	0	109.1	E383 K384 N453 Q486 L488 Y493	D364-E383 WeakPolarHBondContact O-CA 3.34Å; D364-E383 WeakPolarHBondContact O-CG 3.37Å; D364-K384 PolarHBondContact O-N 2.97Å; D364-N453 PolarHBondContact OD1-ND2 3.29Å; D364-Q486 HydrophobicContact CB-CG 4.3Å; D364-Q486 VanDerWaalsContact CB-NE2 3.28Å; D364-Q486 WeakPolarHBondContact OD2-CG 3.36Å; D364-Q486 PolarHBondContact OD2-NE2 3.25Å; D364-L488 HydrophobicContact CB-CD1 3.64Å; D364-L488 VanDerWaalsContact N-CD1 3.33Å; D364-Y493 WeakPolarHBondContact CB-OH 3.37Å; D364-Y493 PolarHBondContact O-OH 3.22Å
365	E	83.6	Confident	73.6	Confident	17 Å²	17	37.2 Å²	37.2	8%	0.079	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	134.4	174.9	-57.2	76.6	-149.3	0	0	111.9	Q381 G382 E383 M423 H458	E365-Q381 HydrophobicContact CB-CG 3.62Å; E365-Q381 HydrophobicContact CG-CG 4.1Å; E365-G382 WeakPolarHBondContact CA-O 3.37Å; E365-E383 HydrophobicContact CG-CB 4.27Å; E365-E383 HydrophobicContact CG-CG 4.21Å; E365-M423 HydrophobicContact CG-CB 4.05Å; E365-M423 HydrophobicContact CG-CG 4.19Å; E365-H458 VanDerWaalsContact CD-CE1 3.49Å; E365-H458 VanDerWaalsContact CD-NE2 3.35Å; E365-H458 IonicContact OE1-CE1 3.93Å; E365-H458 PolarHBondContact OE1-CE1 2.93Å; E365-H458 IonicContact OE1-NE2 2.72Å; E365-H458 PolarHBondContact OE1-NE2 3.31Å; E365-H458 IonicContact OE2-CE1 2.76Å; E365-H458 PolarHBondContact OE2-CE1 3.1Å; E365-H458 IonicContact OE2-NE2 3.08Å; E365-H458 PolarHBondContact OE2-NE2 2.9Å
366	T	76.5	Confident	71.1	Confident	13 Å²	13	42.4 Å²	42.4	8%	0.08	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	136.6	167.4	-179.2	0	0	0	0	110.5	I368 G382 K384 Y493	T366-I368 HydrophobicContact CG2-CD1 4.16Å; T366-I368 HydrophobicContact CG2-CG1 3.93Å; T366-G382 PolarHBondContact N-O 3.33Å; T366-G382 PolarHBondContact O-N 2.69Å; T366-K384 HydrophobicContact CG2-CD 4.44Å; T366-Y493 VanDerWaalsContact CB-CE1 3.48Å; T366-Y493 HydrophobicContact CG2-CD1 3.65Å; T366-Y493 HydrophobicContact CG2-CE1 3.19Å; T366-Y493 PolarHBondContact N-OH 3.22Å
367	P	72.5	Confident	68.3	Low	77 Å²	77	42.6 Å²	42.6	50%	0.5	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	138.1	163	30.3	-34.1	0	0	0	109.6	D379	P367-D379 HydrophobicContact CB-CB 3.41Å; P367-D379 VanDerWaalsContact CB-CB 3.41Å; P367-D379 VanDerWaalsContact CB-OD2 3.29Å; P367-D379 WeakPolarHBondContact CB-OD2 3.46Å
368	I	68.4	Low	65.7	Low	11 Å²	11	43.1 Å²	43.1	6%	0.056	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	110	177.8	-52.9	177.7	0	0	0	110	T366 D379 N380 F529 V533	T366-I368 HydrophobicContact CG2-CD1 4.16Å; T366-I368 HydrophobicContact CG2-CG1 3.93Å; I368-D379 VanDerWaalsContact C-CG 3.45Å; I368-D379 PolarHBondContact N-OD2 3.11Å; I368-D379 VanDerWaalsContact N-OD2 3.16Å; I368-N380 PolarHBondContact N-O 3.5Å; I368-F529 HydrophobicContact CG2-CE1 3.93Å; I368-F529 HydrophobicContact CG2-CZ 3.63Å; I368-V533 HydrophobicContact CD1-CG1 4.36Å; I368-V533 HydrophobicContact CG2-CG2 4.27Å
369	C	65.4	Low	63.6	Low	32 Å²	32	43.7 Å²	43.7	22%	0.216	25%	0.247	C	C	.	.			trans	-80.5	135.6	-176	-17.4	0	0	0	0	114.4	E371 V372 D379 F529	C369-E371 VanDerWaalsContact C-N 3.28Å; C369-E371 WeakPolarHBondContact CB-O 3.39Å; C369-V372 HydrophobicContact CB-CG2 3.6Å; C369-D379 WeakPolarHBondContact CA-OD1 3.36Å; C369-D379 WeakPolarHBondContact CB-OD1 3.41Å; C369-D379 VanDerWaalsContact N-CG 3.33Å; C369-D379 PolarHBondContact N-OD1 3.31Å; C369-D379 PolarHBondContact N-OD2 3.43Å; C369-D379 VanDerWaalsContact N-OD2 3.11Å; C369-D379 PolarHBondContact SG-OD1 3.5Å; C369-D379 PolarHBondContact SG-OD2 3.04Å; C369-F529 WeakPolarHBondContact O-CE2 3.48Å; C369-F529 WeakPolarHBondContact O-CZ 3.28Å
370	L	60.6	Low	61.7	Low	35 Å²	35	44.8 Å²	44.8	18%	0.183	25%	0.253	C	S	.	.	S	Bend	trans	-74	-17.1	170.7	-74.3	166.9	0	0	0	113.6	N380 K523 P524 L526 F529	L370-N380 WeakPolarHBondContact CD1-ND2 3.18Å; L370-K523 HydrophobicContact CB-CD 4.27Å; L370-P524 WeakPolarHBondContact O-CD 3.37Å; L370-L526 HydrophobicContact CD2-CD1 4.33Å; L370-F529 HydrophobicContact CD2-CB 3.66Å; L370-F529 HydrophobicContact CD2-CD1 3.26Å; L370-F529 HydrophobicContact CD2-CD2 3.7Å; L370-F529 HydrophobicContact CD2-CE1 3.62Å; L370-F529 HydrophobicContact CD2-CE2 4.03Å; L370-F529 HydrophobicContact CD2-CG 3.25Å; L370-F529 HydrophobicContact CD2-CZ 3.95Å; L370-F529 HydrophobicContact CG-CD1 4.26Å; L370-F529 HydrophobicContact CG-CE1 4.16Å; L370-F529 HydrophobicContact CG-CG 4.5Å; L370-F529 HydrophobicContact CG-CZ 4.33Å
371	E	56	Low	60	Low	79 Å²	79	45.5 Å²	45.5	37%	0.369	26%	0.257	S	S	.	.	S	Bend	trans	-124.4	116.8	177.6	-64	177.8	169.5	0	0	107.4	C369 K523	C369-E371 VanDerWaalsContact C-N 3.28Å; C369-E371 WeakPolarHBondContact CB-O 3.39Å; E371-K523 HydrophobicContact CG-CD 4.17Å; E371-K523 HydrophobicContact CG-CG 3.7Å; E371-K523 WeakPolarHBondContact OE1-CE 3.35Å; E371-K523 WeakPolarHBondContact OE1-CG 3.17Å; E371-K523 IonicContact OE1-NZ 3.08Å
372	V	50.2	Low	58.4	Low	43 Å²	43	45.5 Å²	45.5	26%	0.261	26%	0.256	S	S	.	.			trans	-138.1	108.9	166.1	-166.7	0	0	0	0	110.3	C369 Y504	C369-V372 HydrophobicContact CB-CG2 3.6Å; V372-Y504 WeakPolarHBondContact O-CD1 3.22Å; V372-Y504 WeakPolarHBondContact O-CE1 3.29Å
373	P	43.3	Very low	57.1	Low	64 Å²	64	45.5 Å²	45.5	42%	0.416	26%	0.256	S	S	.	.	S	Bend		-136.9	85.2	105.6	35.6	-20.5	0	0	0	113.5	T281	T281-P373 HydrophobicContact CG2-CB 3.66Å
374	S	33.7	Very low	56.4	Low	61 Å²	61	45.5 Å²	45.5	43%	0.427	26%	0.256	S	S	.	.	S	Bend	trans	-164.7	164.6	152	-172	0	0	0	0	110.5	P279	P279-S374 WeakPolarHBondContact CG-OG 3.24Å
375	R	35.8	Very low	56.3	Low	138 Å²	138	45.1 Å²	45.1	52%	0.521	25%	0.254	S	S	.	.	S	Bend	trans	-89.3	7.7	-168	-84.2	-169.8	-177.8	-171.8	5.3	116.1	H323 K324	H323-R375 PolarHBondContact ND1-NH2 2.9Å; K324-R375 PolarHBondContact O-NH1 3.01Å
376	V	35.1	Very low	56.4	Low	126 Å²	126	44.3 Å²	44.3	76%	0.764	25%	0.251	S	S	*	.			trans	-151.7	129.3	169.6	-173.5	0	0	0	0	108.7
377	T	30.2	Very low	57	Low	99 Å²	99	43.7 Å²	43.7	61%	0.607	25%	0.247	S	C	*	.			trans	-178.8	162.9	148.1	28.4	0	0	0	0	111.9
378	V	32.2	Very low	57.6	Low	81 Å²	81	40 Å²	40	49%	0.491	22%	0.223	S	C	.	.			trans	-74.4	138.9	-169.8	179.9	0	0	0	0	114	W44	W44-V378 HydrophobicContact CH2-CG1 4.22Å; W44-V378 HydrophobicContact CZ3-CG1 4.19Å; W44-V378 HydrophobicContact CZ3-CG2 4Å
379	D	42.9	Very low	58.6	Low	27 Å²	27	42 Å²	42	14%	0.144	23%	0.234	C	C	.	.			trans	-130.1	172.2	-153.5	-87.4	-8.4	0	0	0	116.4	P367 I368 C369	P367-D379 HydrophobicContact CB-CB 3.41Å; P367-D379 VanDerWaalsContact CB-CB 3.41Å; P367-D379 VanDerWaalsContact CB-OD2 3.29Å; P367-D379 WeakPolarHBondContact CB-OD2 3.46Å; I368-D379 VanDerWaalsContact C-CG 3.45Å; I368-D379 PolarHBondContact N-OD2 3.11Å; I368-D379 VanDerWaalsContact N-OD2 3.16Å; C369-D379 WeakPolarHBondContact CA-OD1 3.36Å; C369-D379 WeakPolarHBondContact CB-OD1 3.41Å; C369-D379 VanDerWaalsContact N-CG 3.33Å; C369-D379 PolarHBondContact N-OD1 3.31Å; C369-D379 PolarHBondContact N-OD2 3.43Å; C369-D379 VanDerWaalsContact N-OD2 3.11Å; C369-D379 PolarHBondContact SG-OD1 3.5Å; C369-D379 PolarHBondContact SG-OD2 3.04Å
380	N	50.7	Low	59.6	Low	23 Å²	23	40.5 Å²	40.5	12%	0.123	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	127.7	157	-66.5	-36.2	0	0	0	108.1	I368 L370 R400	I368-N380 PolarHBondContact N-O 3.5Å; L370-N380 WeakPolarHBondContact CD1-ND2 3.18Å; N380-R400 PolarHBondContact OD1-N 3.03Å; N380-R400 VanDerWaalsContact OD1-N 3.1Å
381	Q	56.6	Low	61.1	Low	20 Å²	20	42.1 Å²	42.1	9%	0.093	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	142.5	-179.7	-167.3	168.6	15.5	0	0	109.8	E365 I398 G421 W422	E365-Q381 HydrophobicContact CB-CG 3.62Å; E365-Q381 HydrophobicContact CG-CG 4.1Å; Q381-I398 HydrophobicContact CB-CB 4.41Å; Q381-I398 PolarHBondContact N-O 3.37Å; Q381-I398 WeakPolarHBondContact O-CA 3.39Å; Q381-I398 PolarHBondContact O-N 3.4Å; Q381-G421 WeakPolarHBondContact CB-O 3.36Å; Q381-G421 PolarHBondContact OE1-O 3.32Å; Q381-G421 VanDerWaalsContact OE1-O 3.12Å; Q381-W422 VanDerWaalsContact OE1-C 3.27Å
382	G	59.3	Low	62.9	Low	0 Å²	0	41 Å²	41	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	131	175	0	0	0	0	0	111.9	E365 T366 Y396	E365-G382 WeakPolarHBondContact CA-O 3.37Å; T366-G382 PolarHBondContact N-O 3.33Å; T366-G382 PolarHBondContact O-N 2.69Å; G382-Y396 CarbonylContact C-O 3.37Å; G382-Y396 WeakPolarHBondContact CA-O 3.44Å
383	E	66.8	Low	64.9	Low	0 Å²	0	39.1 Å²	39.1	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	132.8	172	-153.6	-174.8	154.5	0	0	109.9	A363 D364 E365 P385 Y396 M423 W431	A363-E383 HydrophobicContact CB-CG 4.37Å; A363-E383 WeakPolarHBondContact CB-OE1 3.22Å; D364-E383 WeakPolarHBondContact O-CA 3.34Å; D364-E383 WeakPolarHBondContact O-CG 3.37Å; E365-E383 HydrophobicContact CG-CB 4.27Å; E365-E383 HydrophobicContact CG-CG 4.21Å; E383-P385 VanDerWaalsContact C-CD 3.42Å; E383-P385 WeakPolarHBondContact O-CD 3.45Å; E383-Y396 PolarHBondContact N-O 3.27Å; E383-Y396 PolarHBondContact O-N 3.09Å; E383-M423 WeakPolarHBondContact OE2-CE 3.25Å; E383-W431 VanDerWaalsContact CD-CE2 3.5Å; E383-W431 VanDerWaalsContact OE1-CZ2 3.31Å; E383-W431 WeakPolarHBondContact OE1-CZ2 3.37Å; E383-W431 PolarHBondContact OE2-NE1 3.16Å
384	K	77.1	Confident	67.2	Low	0 Å²	0	38.3 Å²	38.3	0%	0	20%	0.204	C	C	.	.			trans	-128.1	72.2	-170.9	-74.3	-173.1	179.6	177	0	113.2	D364 T366 L488 Y493 L496 W537	D364-K384 PolarHBondContact O-N 2.97Å; T366-K384 HydrophobicContact CG2-CD 4.44Å; K384-L488 HydrophobicContact CB-CD1 4.45Å; K384-L488 WeakPolarHBondContact O-CD1 3.25Å; K384-L488 WeakPolarHBondContact O-CD2 3.43Å; K384-Y493 HydrophobicContact CB-CE1 4.36Å; K384-Y493 HydrophobicContact CD-CE1 4.33Å; K384-L496 HydrophobicContact CD-CD1 4.3Å; K384-L496 HydrophobicContact CD-CD2 3.9Å; K384-W537 HydrophobicContact CB-CE3 4.38Å; K384-W537 HydrophobicContact CB-CH2 3.8Å; K384-W537 HydrophobicContact CB-CZ3 3.65Å; K384-W537 HydrophobicContact CD-CE3 4Å; K384-W537 HydrophobicContact CD-CZ3 4.03Å; K384-W537 HydrophobicContact CG-CE3 4.37Å; K384-W537 HydrophobicContact CG-CZ3 4.13Å; K384-W537 WeakPolarHBondContact O-CH2 3.35Å
385	P	84.5	Confident	70	Confident	2 Å²	2	35.4 Å²	35.4	1%	0.013	18%	0.184	C	C	.	.			trans	-71.3	143.5	-175.1	23.1	-34.2	0	0	0	116	N362 A363 E383 L393 W431 V435 W537	N362-P385 WeakPolarHBondContact O-CA 3.39Å; A363-P385 HydrophobicContact CB-CB 3.97Å; E383-P385 VanDerWaalsContact C-CD 3.42Å; E383-P385 WeakPolarHBondContact O-CD 3.45Å; P385-L393 HydrophobicContact CB-CB 4.21Å; P385-L393 HydrophobicContact CB-CD1 4Å; P385-L393 HydrophobicContact CB-CG 4.25Å; P385-L393 HydrophobicContact CG-CB 3.84Å; P385-L393 HydrophobicContact CG-CD1 4.29Å; P385-L393 HydrophobicContact CG-CG 4.41Å; P385-L393 PolarHBondContact O-N 3.17Å; P385-W431 HydrophobicContact CB-CZ2 3.75Å; P385-W431 HydrophobicContact CG-CZ2 3.8Å; P385-V435 HydrophobicContact CG-CG1 3.75Å; P385-W537 WeakPolarHBondContact O-CZ2 3.17Å
386	V	86.1	Confident	72.7	Confident	0 Å²	0	28.9 Å²	28.9	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	152.7	176.3	-65.1	0	0	0	0	111.3	G361 N362 K392 V487 L488 V492 W537 I545 F549	G361-V386 CarbonylContact C-O 3.57Å; G361-V386 VanDerWaalsContact CA-O 3.31Å; G361-V386 WeakPolarHBondContact CA-O 3.3Å; N362-V386 HydrophobicContact CB-CG2 4.12Å; N362-V386 PolarHBondContact N-O 3.26Å; N362-V386 PolarHBondContact O-N 3.32Å; V386-K392 HydrophobicContact CG1-CG 4.36Å; V386-V487 HydrophobicContact CG2-CG1 4.27Å; V386-L488 HydrophobicContact CB-CD2 4.46Å; V386-L488 HydrophobicContact CG1-CD2 3.91Å; V386-L488 HydrophobicContact CG2-CD2 3.74Å; V386-V492 HydrophobicContact CG1-CG2 4.39Å; V386-W537 HydrophobicContact CG1-CH2 3.65Å; V386-W537 HydrophobicContact CG1-CZ2 4.37Å; V386-W537 HydrophobicContact CG1-CZ3 4.44Å; V386-I545 HydrophobicContact CB-CD1 4.33Å; V386-I545 HydrophobicContact CB-CG2 3.76Å; V386-I545 HydrophobicContact CG1-CD1 3.72Å; V386-I545 HydrophobicContact CG1-CG1 4.21Å; V386-I545 HydrophobicContact CG1-CG2 4.25Å; V386-I545 HydrophobicContact CG2-CG2 4.04Å; V386-F549 HydrophobicContact CB-CE2 4.32Å; V386-F549 HydrophobicContact CG2-CE2 3.63Å; V386-F549 HydrophobicContact CG2-CZ 3.99Å
387	L	89.3	Confident	75.4	Confident	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	154	174.1	-60.1	-178.4	0	0	0	110.9	M360 D389 G390 R391 L393 W436 I545 F549	M360-L387 CarbonylContact O-C 3.44Å; M360-L387 WeakPolarHBondContact O-CA 3.43Å; L387-D389 WeakPolarHBondContact CB-OD1 3.29Å; L387-D389 PolarHBondContact O-N 2.91Å; L387-D389 VanDerWaalsContact O-N 3.15Å; L387-G390 PolarHBondContact O-N 2.95Å; L387-R391 HydrophobicContact CB-CB 4.29Å; L387-R391 HydrophobicContact CD1-CB 4.11Å; L387-R391 HydrophobicContact CG-CB 4.49Å; L387-R391 PolarHBondContact N-O 3.2Å; L387-L393 HydrophobicContact CD1-CD2 3.86Å; L387-L393 HydrophobicContact CD2-CD1 4.3Å; L387-L393 HydrophobicContact CD2-CD2 4.32Å; L387-L393 HydrophobicContact CD2-CG 4.48Å; L387-L393 HydrophobicContact CG-CD2 3.91Å; L387-L393 HydrophobicContact CG-CG 4.34Å; L387-W436 HydrophobicContact CD2-CH2 4.4Å; L387-W436 HydrophobicContact CD2-CZ3 3.88Å; L387-I545 WeakPolarHBondContact O-CG2 3.09Å; L387-F549 VanDerWaalsContact C-CE2 3.42Å; L387-F549 WeakPolarHBondContact O-CE2 3.5Å
388	A	86.4	Confident	78.2	Confident	0 Å²	0	18.4 Å²	18.4	0%	0	10%	0.095	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66	-18.1	-175.6	0	0	0	0	0	114.1	V357 M360 G390 F549	V357-A388 HydrophobicContact CG1-CB 3.62Å; V357-A388 WeakPolarHBondContact O-CB 3.08Å; M360-A388 HydrophobicContact CB-CB 3.88Å; M360-A388 HydrophobicContact CE-CB 4.11Å; M360-A388 PolarHBondContact O-N 2.86Å; A388-G390 PolarHBondContact O-N 3.12Å; A388-F549 HydrophobicContact CB-CB 4.28Å; A388-F549 HydrophobicContact CB-CD1 3.49Å; A388-F549 VanDerWaalsContact CB-CD1 3.49Å; A388-F549 HydrophobicContact CB-CD2 4.15Å; A388-F549 HydrophobicContact CB-CE1 3.71Å; A388-F549 HydrophobicContact CB-CE2 4.32Å; A388-F549 HydrophobicContact CB-CG 3.73Å; A388-F549 HydrophobicContact CB-CZ 4.11Å
389	D	87.6	Confident	80.9	Confident	52 Å²	52	14.8 Å²	14.8	28%	0.278	7%	0.073	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.8	5.2	173.5	66.3	7.5	0	0	0	113.2	V357 A358 L387 R391 V546	V357-D389 HydrophobicContact CG1-CB 4Å; A358-D389 WeakPolarHBondContact CA-OD2 3.48Å; L387-D389 WeakPolarHBondContact CB-OD1 3.29Å; L387-D389 PolarHBondContact O-N 2.91Å; L387-D389 VanDerWaalsContact O-N 3.15Å; D389-R391 VanDerWaalsContact CG-NE 3.33Å; D389-R391 VanDerWaalsContact OD1-CB 3.32Å; D389-R391 WeakPolarHBondContact OD1-CB 3.28Å; D389-R391 WeakPolarHBondContact OD1-CG 3.04Å; D389-R391 PolarHBondContact OD1-N 2.83Å; D389-R391 IonicContact OD1-NE 3.37Å; D389-R391 PolarHBondContact OD1-NE 3.07Å; D389-R391 IonicContact OD2-CZ 3.49Å; D389-R391 IonicContact OD2-NE 3.16Å; D389-R391 PolarHBondContact OD2-NE 2.66Å; D389-R391 IonicContact OD2-NH2 2.66Å; D389-R391 PolarHBondContact OD2-NH2 3.49Å; D389-V546 VanDerWaalsContact C-CG2 3.43Å
390	G	87.9	Confident	82.8	Confident	0 Å²	0	19 Å²	19	0%	0	9%	0.087	C	C	.	.	S	Bend	trans	88.7	1.1	177.3	0	0	0	0	0	114.5	L387 A388 S542	L387-G390 PolarHBondContact O-N 2.95Å; A388-G390 PolarHBondContact O-N 3.12Å; G390-S542 WeakPolarHBondContact CA-O 3.45Å; G390-S542 WeakPolarHBondContact O-CA 3.48Å; G390-S542 WeakPolarHBondContact O-CB 3.47Å; G390-S542 PolarHBondContact O-OG 3.16Å
391	R	91.4	Very high	84.3	Confident	70 Å²	70	19.1 Å²	19.1	26%	0.264	9%	0.093	S	C	.	.	P	Polyproline II helix	trans	-71.3	143.6	173.5	-71.6	-177.3	-70.5	158.2	4.7	110.8	L387 D389 T440	L387-R391 HydrophobicContact CB-CB 4.29Å; L387-R391 HydrophobicContact CD1-CB 4.11Å; L387-R391 HydrophobicContact CG-CB 4.49Å; L387-R391 PolarHBondContact N-O 3.2Å; D389-R391 VanDerWaalsContact CG-NE 3.33Å; D389-R391 VanDerWaalsContact OD1-CB 3.32Å; D389-R391 WeakPolarHBondContact OD1-CB 3.28Å; D389-R391 WeakPolarHBondContact OD1-CG 3.04Å; D389-R391 PolarHBondContact OD1-N 2.83Å; D389-R391 IonicContact OD1-NE 3.37Å; D389-R391 PolarHBondContact OD1-NE 3.07Å; D389-R391 IonicContact OD2-CZ 3.49Å; D389-R391 IonicContact OD2-NE 3.16Å; D389-R391 PolarHBondContact OD2-NE 2.66Å; D389-R391 IonicContact OD2-NH2 2.66Å; D389-R391 PolarHBondContact OD2-NH2 3.49Å; R391-T440 PolarHBondContact NH1-O 3.17Å
392	K	93.1	Very high	85.5	Confident	54 Å²	54	23.1 Å²	23.1	24%	0.235	12%	0.119	C	C	.	.	B	Isolated β-bridge	trans	-102.3	131.5	176.6	-71	177.2	-64.1	-164.7	0	108.1	V386 W537 N538 I540 I545	V386-K392 HydrophobicContact CG1-CG 4.36Å; K392-W537 HydrophobicContact CB-CH2 4.44Å; K392-W537 HydrophobicContact CB-CZ2 3.54Å; K392-W537 HydrophobicContact CD-CD2 4.15Å; K392-W537 HydrophobicContact CD-CZ2 4.08Å; K392-W537 WeakPolarHBondContact CD-O 3.42Å; K392-W537 HydrophobicContact CG-CH2 4.23Å; K392-W537 HydrophobicContact CG-CZ2 3.76Å; K392-W537 PolarHBondContact NZ-O 3.42Å; K392-N538 PolarHBondContact NZ-O 3.32Å; K392-I540 PolarHBondContact NZ-O 2.89Å; K392-I545 HydrophobicContact CD-CD1 4.01Å; K392-I545 HydrophobicContact CG-CD1 3.53Å
393	L	92.6	Very high	86.8	Confident	4 Å²	4	31.1 Å²	31.1	2%	0.021	15%	0.151	C	C	.	.	P	Polyproline II helix	trans	-87	165.5	169.8	-42.4	-179	0	0	0	109.4	P385 L387 V435 W436 R439 W537	P385-L393 HydrophobicContact CB-CB 4.21Å; P385-L393 HydrophobicContact CB-CD1 4Å; P385-L393 HydrophobicContact CB-CG 4.25Å; P385-L393 HydrophobicContact CG-CB 3.84Å; P385-L393 HydrophobicContact CG-CD1 4.29Å; P385-L393 HydrophobicContact CG-CG 4.41Å; P385-L393 PolarHBondContact O-N 3.17Å; L387-L393 HydrophobicContact CD1-CD2 3.86Å; L387-L393 HydrophobicContact CD2-CD1 4.3Å; L387-L393 HydrophobicContact CD2-CD2 4.32Å; L387-L393 HydrophobicContact CD2-CG 4.48Å; L387-L393 HydrophobicContact CG-CD2 3.91Å; L387-L393 HydrophobicContact CG-CG 4.34Å; L393-V435 HydrophobicContact CB-CG1 3.72Å; L393-V435 HydrophobicContact CD1-CG1 3.97Å; L393-W436 HydrophobicContact CD1-CE3 4.12Å; L393-W436 HydrophobicContact CD1-CZ3 4.43Å; L393-R439 HydrophobicContact CD1-CB 3.86Å; L393-R439 HydrophobicContact CD2-CB 3.66Å; L393-R439 HydrophobicContact CG-CB 4.43Å; L393-W537 WeakPolarHBondContact O-CZ2 3.48Å; L393-W537 PolarHBondContact O-NE1 3.25Å
394	P	91.8	Very high	87.7	Confident	48 Å²	48	34.5 Å²	34.5	31%	0.312	17%	0.168	S	C	.	.	P	Polyproline II helix	trans	-54.1	131.8	176.1	-27.7	36.5	0	0	0	111.3	Y396	P394-Y396 PolarHBondContact O-N 2.89Å
395	P	92.6	Very high	88.1	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	19%	0.185	C	C	.	.	P	Polyproline II helix	trans	-60.4	137.6	170.3	-22	33.9	0	0	0	110.1	I397 G412 M413 E414 M534 W537	P395-I397 HydrophobicContact CB-CD1 4.17Å; P395-G412 WeakPolarHBondContact CD-O 3.26Å; P395-M413 HydrophobicContact CB-CB 4.49Å; P395-M413 WeakPolarHBondContact O-CA 3.26Å; P395-M413 WeakPolarHBondContact O-CB 3.4Å; P395-E414 PolarHBondContact O-N 3.43Å; P395-M534 HydrophobicContact CG-SD 3.99Å; P395-W537 HydrophobicContact CG-CB 4.42Å; P395-W537 VanDerWaalsContact CG-CD1 3.42Å; P395-W537 HydrophobicContact CG-CD2 4.06Å; P395-W537 HydrophobicContact CG-CG 3.74Å
396	Y	93.5	Very high	88	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	110.4	176.2	-170.8	-91.7	0	0	0	109.1	G382 E383 P394 I398 E414 R416 L427 D430 W431 V434 V435	G382-Y396 CarbonylContact C-O 3.37Å; G382-Y396 WeakPolarHBondContact CA-O 3.44Å; E383-Y396 PolarHBondContact N-O 3.27Å; E383-Y396 PolarHBondContact O-N 3.09Å; P394-Y396 PolarHBondContact O-N 2.89Å; Y396-I398 HydrophobicContact CD1-CD1 4.41Å; Y396-I398 HydrophobicContact CD1-CG1 4Å; Y396-I398 HydrophobicContact CE1-CD1 4.22Å; Y396-I398 HydrophobicContact CE1-CG1 3.84Å; Y396-E414 CarbonylContact C-O 3.49Å; Y396-E414 WeakPolarHBondContact CA-O 3.36Å; Y396-E414 HydrophobicContact CD2-CB 3.57Å; Y396-E414 HydrophobicContact CD2-CG 4.41Å; Y396-E414 HydrophobicContact CE2-CB 4.21Å; Y396-E414 HydrophobicContact CG-CB 4.38Å; Y396-R416 HydrophobicContact CE1-CG 4.2Å; Y396-R416 HydrophobicContact CE2-CG 4.03Å; Y396-R416 VanDerWaalsContact OH-CG 3.25Å; Y396-R416 WeakPolarHBondContact OH-CG 3.37Å; Y396-L427 PolarHBondContact OH-O 2.84Å; Y396-D430 VanDerWaalsContact CE2-OD2 3.29Å; Y396-D430 WeakPolarHBondContact CE2-OD2 3.47Å; Y396-D430 PolarHBondContact OH-OD2 3.12Å; Y396-W431 HydrophobicContact CD2-CB 4.26Å; Y396-W431 AromaticContact CD2-CD1 3.72Å; Y396-W431 HydrophobicContact CD2-CG 4.41Å; Y396-W431 HydrophobicContact CE1-CB 4.38Å; Y396-W431 HydrophobicContact CE2-CB 4.1Å; Y396-W431 HydrophobicContact CG-CB 4.47Å; Y396-W431 AromaticContact CG-CD1 3.57Å; Y396-W431 HydrophobicContact CG-CG 4.42Å; Y396-V434 HydrophobicContact CD2-CG2 4.16Å; Y396-V434 HydrophobicContact CE2-CG2 3.85Å; Y396-V435 HydrophobicContact CD2-CG2 3.96Å
397	I	91.4	Very high	87.9	Confident	5 Å²	5	45.7 Å²	45.7	3%	0.026	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	121	-171.1	-54.4	-58.6	0	0	0	109.4	P395 L399 M413 E414 I415 R416 L530 V533	P395-I397 HydrophobicContact CB-CD1 4.17Å; I397-L399 HydrophobicContact CG2-CD2 3.8Å; I397-L399 HydrophobicContact CG2-CG 4.27Å; I397-M413 HydrophobicContact CG1-SD 4.11Å; I397-E414 PolarHBondContact N-O 3.21Å; I397-I415 CarbonylContact O-C 3.58Å; I397-I415 WeakPolarHBondContact O-CA 3.49Å; I397-R416 PolarHBondContact O-N 2.95Å; I397-L530 HydrophobicContact CG1-CD2 4.43Å; I397-L530 HydrophobicContact CG2-CD2 3.98Å; I397-V533 HydrophobicContact CD1-CG1 4.5Å
398	I	89.5	Confident	87.8	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	103.9	173.9	-53.7	166.6	0	0	0	107.5	Q381 Y396 H418 M423 L427	Q381-I398 HydrophobicContact CB-CB 4.41Å; Q381-I398 PolarHBondContact N-O 3.37Å; Q381-I398 WeakPolarHBondContact O-CA 3.39Å; Q381-I398 PolarHBondContact O-N 3.4Å; Y396-I398 HydrophobicContact CD1-CD1 4.41Å; Y396-I398 HydrophobicContact CD1-CG1 4Å; Y396-I398 HydrophobicContact CE1-CD1 4.22Å; Y396-I398 HydrophobicContact CE1-CG1 3.84Å; I398-H418 HydrophobicContact CG2-CB 3.71Å; I398-M423 HydrophobicContact CD1-CB 4.17Å; I398-M423 HydrophobicContact CD1-SD 3.62Å; I398-L427 HydrophobicContact CD1-CD1 4.08Å; I398-L427 HydrophobicContact CG1-CD1 4.45Å; I398-L427 HydrophobicContact CG2-CD1 4.17Å
399	L	88.3	Confident	88	Confident	5 Å²	5	58.2 Å²	58.2	3%	0.026	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	137.5	174	-59	176.2	0	0	0	109.7	I397 G401 I404 I415 R416 C417 H418 L526	I397-L399 HydrophobicContact CG2-CD2 3.8Å; I397-L399 HydrophobicContact CG2-CG 4.27Å; L399-G401 PolarHBondContact O-N 3.29Å; L399-I404 HydrophobicContact CD1-CG2 4.41Å; L399-I415 HydrophobicContact CD1-CG2 3.53Å; L399-I415 HydrophobicContact CG-CG2 3.89Å; L399-R416 PolarHBondContact N-O 2.9Å; L399-C417 VanDerWaalsContact O-CA 3.28Å; L399-C417 WeakPolarHBondContact O-CA 3.49Å; L399-H418 PolarHBondContact O-N 3.35Å; L399-L526 HydrophobicContact CD1-CD2 3.8Å; L399-L526 HydrophobicContact CD2-CD1 3.95Å; L399-L526 HydrophobicContact CD2-CD2 4.29Å
400	R	82.8	Confident	88.1	Confident	117 Å²	117	57.3 Å²	57.3	44%	0.442	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	120.4	171.8	-176.1	173.8	169.9	-174.4	-4.3	110.3	N380 H418 R419	N380-R400 PolarHBondContact OD1-N 3.03Å; N380-R400 VanDerWaalsContact OD1-N 3.1Å; R400-H418 WeakPolarHBondContact CA-O 3.42Å; R400-R419 WeakPolarHBondContact CG-O 3.36Å
401	G	81.8	Confident	88.3	Confident	24 Å²	24	62.7 Å²	62.7	25%	0.247	34%	0.339	C	S	.	.	S	Bend	trans	150.1	176.8	179.9	0	0	0	0	0	112.6	L399 H418 R419	L399-G401 PolarHBondContact O-N 3.29Å; G401-H418 PolarHBondContact N-O 2.96Å; G401-H418 CarbonylContact O-C 3.56Å; G401-H418 PolarHBondContact O-N 3.48Å; G401-H418 VanDerWaalsContact O-O 3.12Å; G401-R419 PolarHBondContact O-N 3.09Å
402	T	82.4	Confident	88.2	Confident	105 Å²	105	61.7 Å²	61.7	64%	0.644	35%	0.351	S	S	*	.	S	Bend	trans	-95.7	-12.6	177.7	49.4	0	0	0	0	113.4
403	Y	85.4	Confident	88.1	Confident	167 Å²	167	60 Å²	60	66%	0.655	34%	0.344	S	S	*	.	S	Bend	trans	-147.6	155.5	178.5	61.8	-86.8	0	0	0	110.7	P405 C417	Y403-P405 WeakPolarHBondContact O-CD 3.39Å; Y403-C417 PolarHBondContact O-SG 2.84Å
404	I	86.6	Confident	88.2	Confident	72 Å²	72	62.4 Å²	62.4	37%	0.369	36%	0.355	S	S	.	.	P	Polyproline II helix	trans	-77.6	121.5	173.6	-60.4	170.7	0	0	0	107.3	L399 F409 I415 C417	L399-I404 HydrophobicContact CD1-CG2 4.41Å; I404-F409 HydrophobicContact CG2-CD2 4.44Å; I404-F409 HydrophobicContact CG2-CE2 3.57Å; I404-F409 HydrophobicContact CG2-CZ 4Å; I404-I415 HydrophobicContact CD1-CB 4.43Å; I404-I415 HydrophobicContact CD1-CG2 4.07Å; I404-I415 HydrophobicContact CG1-CG2 4.28Å; I404-I415 HydrophobicContact CG2-CG2 4.39Å; I404-C417 VanDerWaalsContact CA-SG 3.52Å; I404-C417 HydrophobicContact CG1-CB 4.42Å; I404-C417 WeakPolarHBondContact CG1-SG 3.36Å; I404-C417 PolarHBondContact N-SG 3.38Å; I404-C417 VanDerWaalsContact N-SG 3.37Å
405	P	84.8	Confident	88.2	Confident	54 Å²	54	61.1 Å²	61.1	35%	0.351	35%	0.345	S	S	.	.	P	Polyproline II helix	trans	-58.9	144.5	178.6	-24.2	34.2	0	0	0	111.7	Y403 G407 F409 L526	Y403-P405 WeakPolarHBondContact O-CD 3.39Å; P405-G407 PolarHBondContact O-N 3.4Å; P405-F409 WeakPolarHBondContact O-CE2 3.34Å; P405-F409 VanDerWaalsContact O-CZ 3.24Å; P405-F409 WeakPolarHBondContact O-CZ 3.3Å; P405-L526 HydrophobicContact CG-CD2 4.23Å
406	P	83.8	Confident	88.2	Confident	128 Å²	128	64 Å²	64	83%	0.831	36%	0.356	S	S	*	.	S	Bend	trans	-62.9	130.1	175.1	26.7	-33.3	0	0	0	109.7
407	G	83.3	Confident	88	Confident	54 Å²	54	65.6 Å²	65.6	56%	0.557	37%	0.367	S	S	*	.	S	Bend	trans	177.7	168.1	-176.8	0	0	0	0	0	112.9	P405	P405-G407 PolarHBondContact O-N 3.4Å
408	K	87.6	Confident	87.8	Confident	202 Å²	202	67.6 Å²	67.6	88%	0.878	38%	0.376	S	S	*	.			trans	-89.1	122.7	168	-67.7	-176.1	179.7	-179.3	0	108.3
409	F	90	Very high	87.4	Confident	61 Å²	61	75.1 Å²	75.1	27%	0.268	41%	0.405	S	S	.	.			trans	-114.4	148.7	176.8	-56.9	-58.6	0	0	0	110.1	I404 P405 I415 L526 L530	I404-F409 HydrophobicContact CG2-CD2 4.44Å; I404-F409 HydrophobicContact CG2-CE2 3.57Å; I404-F409 HydrophobicContact CG2-CZ 4Å; P405-F409 WeakPolarHBondContact O-CE2 3.34Å; P405-F409 VanDerWaalsContact O-CZ 3.24Å; P405-F409 WeakPolarHBondContact O-CZ 3.3Å; F409-I415 HydrophobicContact CB-CD1 3.69Å; F409-I415 HydrophobicContact CD1-CD1 4.3Å; F409-I415 HydrophobicContact CD2-CD1 4.03Å; F409-I415 HydrophobicContact CG-CD1 3.74Å; F409-L526 HydrophobicContact CE1-CD2 3.91Å; F409-L526 HydrophobicContact CE1-CG 4.03Å; F409-L526 HydrophobicContact CZ-CD2 4.25Å; F409-L530 HydrophobicContact CD1-CD1 3.66Å; F409-L530 HydrophobicContact CE1-CD1 4.12Å; F409-L530 HydrophobicContact CG-CD1 4.39Å
410	P	90.4	Very high	86.8	Confident	34 Å²	34	80.5 Å²	80.5	22%	0.221	43%	0.426	C	S	.	.			trans	-62.5	145.6	176.3	28.2	-36.7	0	0	0	111.1	M413 L530 M534	P410-M413 HydrophobicContact CG-CE 3.47Å; P410-M413 VanDerWaalsContact CG-CE 3.47Å; P410-M413 HydrophobicContact CG-SD 4Å; P410-L530 HydrophobicContact CG-CB 3.97Å; P410-M534 HydrophobicContact CB-CG 4.06Å; P410-M534 HydrophobicContact CG-CG 3.9Å
411	S	90.8	Very high	86.4	Confident	112 Å²	112	75 Å²	75	78%	0.783	41%	0.405	S	S	*	.	S	Bend	trans	-76.4	158.4	172.7	55.9	0	0	0	0	111.4
412	G	89.3	Confident	86.1	Confident	49 Å²	49	80.5 Å²	80.5	51%	0.505	42%	0.419	S	S	.	.	S	Bend	trans	88	16.6	177.9	0	0	0	0	0	114.9	P395	P395-G412 WeakPolarHBondContact CD-O 3.26Å
413	M	92.5	Very high	86.1	Confident	18 Å²	18	75.8 Å²	75.8	9%	0.089	39%	0.39	C	S	.	.			trans	-130.3	155.5	167.4	64.7	174.3	57.2	0	0	110.2	P395 I397 P410 I415 L530 M534	P395-M413 HydrophobicContact CB-CB 4.49Å; P395-M413 WeakPolarHBondContact O-CA 3.26Å; P395-M413 WeakPolarHBondContact O-CB 3.4Å; I397-M413 HydrophobicContact CG1-SD 4.11Å; P410-M413 HydrophobicContact CG-CE 3.47Å; P410-M413 VanDerWaalsContact CG-CE 3.47Å; P410-M413 HydrophobicContact CG-SD 4Å; M413-I415 HydrophobicContact CG-CD1 4.15Å; M413-I415 HydrophobicContact CG-CG1 3.89Å; M413-I415 HydrophobicContact SD-CD1 3.68Å; M413-I415 HydrophobicContact SD-CG1 3.72Å; M413-L530 HydrophobicContact CE-CB 4.07Å; M413-L530 HydrophobicContact SD-CB 4.17Å; M413-L530 HydrophobicContact SD-CD1 4.14Å; M413-L530 HydrophobicContact SD-CD2 4.31Å; M413-L530 HydrophobicContact SD-CG 4.44Å; M413-M534 HydrophobicContact CB-SD 4.08Å; M413-M534 HydrophobicContact CE-CB 4.49Å; M413-M534 HydrophobicContact CE-CG 3.12Å; M413-M534 HydrophobicContact CE-SD 3.44Å; M413-M534 WeakPolarHBondContact CE-SD 3.46Å
414	E	93.7	Very high	86.2	Confident	56 Å²	56	69.7 Å²	69.7	26%	0.262	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	129.7	169.5	-70	-64.1	151.9	0	0	108.5	P395 Y396 I397 R416 V434 V435	P395-E414 PolarHBondContact O-N 3.43Å; Y396-E414 CarbonylContact C-O 3.49Å; Y396-E414 WeakPolarHBondContact CA-O 3.36Å; Y396-E414 HydrophobicContact CD2-CB 3.57Å; Y396-E414 HydrophobicContact CD2-CG 4.41Å; Y396-E414 HydrophobicContact CE2-CB 4.21Å; Y396-E414 HydrophobicContact CG-CB 4.38Å; I397-E414 PolarHBondContact N-O 3.21Å; E414-R416 IonicContact OE2-CZ 2.72Å; E414-R416 IonicContact OE2-NH1 3Å; E414-R416 PolarHBondContact OE2-NH1 3.46Å; E414-R416 IonicContact OE2-NH2 3.22Å; E414-R416 PolarHBondContact OE2-NH2 2.77Å; E414-V434 HydrophobicContact CB-CG2 4.5Å; E414-V434 HydrophobicContact CG-CG2 3.96Å; E414-V435 HydrophobicContact CG-CG2 4.21Å
415	I	92.1	Very high	86.3	Confident	20 Å²	20	69.6 Å²	69.6	10%	0.103	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	129.3	-179.7	-54.4	175.2	0	0	0	108.3	I397 L399 I404 F409 M413 L530	I397-I415 CarbonylContact O-C 3.58Å; I397-I415 WeakPolarHBondContact O-CA 3.49Å; L399-I415 HydrophobicContact CD1-CG2 3.53Å; L399-I415 HydrophobicContact CG-CG2 3.89Å; I404-I415 HydrophobicContact CD1-CB 4.43Å; I404-I415 HydrophobicContact CD1-CG2 4.07Å; I404-I415 HydrophobicContact CG1-CG2 4.28Å; I404-I415 HydrophobicContact CG2-CG2 4.39Å; F409-I415 HydrophobicContact CB-CD1 3.69Å; F409-I415 HydrophobicContact CD1-CD1 4.3Å; F409-I415 HydrophobicContact CD2-CD1 4.03Å; F409-I415 HydrophobicContact CG-CD1 3.74Å; M413-I415 HydrophobicContact CG-CD1 4.15Å; M413-I415 HydrophobicContact CG-CG1 3.89Å; M413-I415 HydrophobicContact SD-CD1 3.68Å; M413-I415 HydrophobicContact SD-CG1 3.72Å; I415-L530 HydrophobicContact CD1-CD1 3.86Å
416	R	93.1	Very high	86.6	Confident	60 Å²	60	72.9 Å²	72.9	23%	0.226	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	169	170.2	-61.4	-57.6	-178.7	-92.4	-5.6	110.2	Y396 I397 L399 E414 L427 D430	Y396-R416 HydrophobicContact CE1-CG 4.2Å; Y396-R416 HydrophobicContact CE2-CG 4.03Å; Y396-R416 VanDerWaalsContact OH-CG 3.25Å; Y396-R416 WeakPolarHBondContact OH-CG 3.37Å; I397-R416 PolarHBondContact O-N 2.95Å; L399-R416 PolarHBondContact N-O 2.9Å; E414-R416 IonicContact OE2-CZ 2.72Å; E414-R416 IonicContact OE2-NH1 3Å; E414-R416 PolarHBondContact OE2-NH1 3.46Å; E414-R416 IonicContact OE2-NH2 3.22Å; E414-R416 PolarHBondContact OE2-NH2 2.77Å; R416-L427 HydrophobicContact CB-CD2 4.05Å; R416-L427 HydrophobicContact CG-CD2 4.28Å; R416-D430 IonicContact CZ-OD2 2.62Å; R416-D430 IonicContact NE-OD1 3.15Å; R416-D430 IonicContact NE-OD2 2.71Å; R416-D430 PolarHBondContact NE-OD2 3.46Å; R416-D430 IonicContact NH2-OD1 2.9Å; R416-D430 PolarHBondContact NH2-OD1 2.95Å; R416-D430 IonicContact NH2-OD2 2.54Å; R416-D430 PolarHBondContact NH2-OD2 2.71Å
417	C	88.8	Confident	87	Confident	34 Å²	34	67.8 Å²	67.8	23%	0.23	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	142.8	172.6	-74.6	0	0	0	0	110.8	L399 Y403 I404	L399-C417 VanDerWaalsContact O-CA 3.28Å; L399-C417 WeakPolarHBondContact O-CA 3.49Å; Y403-C417 PolarHBondContact O-SG 2.84Å; I404-C417 VanDerWaalsContact CA-SG 3.52Å; I404-C417 HydrophobicContact CG1-CB 4.42Å; I404-C417 WeakPolarHBondContact CG1-SG 3.36Å; I404-C417 PolarHBondContact N-SG 3.38Å; I404-C417 VanDerWaalsContact N-SG 3.37Å
418	H	86.6	Confident	87.4	Confident	47 Å²	47	65.2 Å²	65.2	22%	0.218	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	140.1	169.4	-178	-125.8	0	0	0	109.5	I398 L399 R400 G401 Y420 G421 W422 L427	I398-H418 HydrophobicContact CG2-CB 3.71Å; L399-H418 PolarHBondContact O-N 3.35Å; R400-H418 WeakPolarHBondContact CA-O 3.42Å; G401-H418 PolarHBondContact N-O 2.96Å; G401-H418 CarbonylContact O-C 3.56Å; G401-H418 PolarHBondContact O-N 3.48Å; G401-H418 VanDerWaalsContact O-O 3.12Å; H418-Y420 AromaticContact CE1-CD2 4Å; H418-Y420 PolarHBondContact O-N 3Å; H418-G421 PolarHBondContact O-N 3.43Å; H418-W422 PolarHBondContact ND1-N 2.98Å; H418-W422 PolarHBondContact ND1-O 3.49Å; H418-L427 HydrophobicContact CB-CD1 3.94Å
419	R	80.8	Confident	87.7	Confident	158 Å²	158	58.1 Å²	58.1	60%	0.596	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.4	-38.4	-173.4	178.4	-179.5	-70.6	-170.1	0.2	112.5	R400 G401	R400-R419 WeakPolarHBondContact CG-O 3.36Å; G401-R419 PolarHBondContact O-N 3.09Å
420	Y	76.9	Confident	87.9	Confident	118 Å²	118	57.5 Å²	57.5	46%	0.463	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.8	-6.3	-177.4	-55.3	-64.2	0	0	0	113.6	H418 W422	H418-Y420 AromaticContact CE1-CD2 4Å; H418-Y420 PolarHBondContact O-N 3Å; Y420-W422 PolarHBondContact O-N 3.36Å
421	G	72.9	Confident	88.1	Confident	2 Å²	2	55.9 Å²	55.9	2%	0.021	28%	0.281	C	S	.	.			trans	75.5	7.3	-176.7	0	0	0	0	0	114.2	Q381 H418	Q381-G421 WeakPolarHBondContact CB-O 3.36Å; Q381-G421 PolarHBondContact OE1-O 3.32Å; Q381-G421 VanDerWaalsContact OE1-O 3.12Å; H418-G421 PolarHBondContact O-N 3.43Å
422	W	76.3	Confident	88.2	Confident	139 Å²	139	50.6 Å²	50.6	53%	0.527	24%	0.243	S	C	.	.			trans	-85.3	147.6	178.5	-64.1	109	0	0	0	113.4	Q381 H418 Y420 L427	Q381-W422 VanDerWaalsContact OE1-C 3.27Å; H418-W422 PolarHBondContact ND1-N 2.98Å; H418-W422 PolarHBondContact ND1-O 3.49Å; Y420-W422 PolarHBondContact O-N 3.36Å; W422-L427 WeakPolarHBondContact O-CD1 3.25Å
423	M	82.1	Confident	88.4	Confident	6 Å²	6	51.2 Å²	51.2	3%	0.03	23%	0.233	C	C	.	.			trans	-66.7	129.5	165.7	-169.6	59.6	152.9	0	0	110.1	E365 E383 I398 L427 M428 W431 F455	E365-M423 HydrophobicContact CG-CB 4.05Å; E365-M423 HydrophobicContact CG-CG 4.19Å; E383-M423 WeakPolarHBondContact OE2-CE 3.25Å; I398-M423 HydrophobicContact CD1-CB 4.17Å; I398-M423 HydrophobicContact CD1-SD 3.62Å; M423-L427 HydrophobicContact SD-CB 3.64Å; M423-M428 VanDerWaalsContact CE-CA 3.46Å; M423-M428 HydrophobicContact CE-CB 3.85Å; M423-M428 HydrophobicContact CE-CG 4.34Å; M423-M428 HydrophobicContact CE-SD 3.54Å; M423-M428 VanDerWaalsContact CE-SD 3.54Å; M423-W431 HydrophobicContact CE-CB 4.22Å; M423-F455 HydrophobicContact CB-CE1 4.32Å
424	T	87.4	Confident	88.5	Confident	39 Å²	39	51.2 Å²	51.2	24%	0.239	23%	0.234	C	C	.	.			trans	-122.5	167.9	178.3	63.5	0	0	0	0	109.6	D426 L427 M428	T424-D426 VanDerWaalsContact C-N 3.3Å; T424-D426 PolarHBondContact O-N 3.4Å; T424-L427 PolarHBondContact O-N 3.08Å; T424-L427 WeakPolarHBondContact OG1-CG 3.29Å; T424-L427 PolarHBondContact OG1-N 2.82Å; T424-M428 PolarHBondContact O-N 3.4Å
425	E	88.8	Confident	88.5	Confident	71 Å²	71	48.6 Å²	48.6	33%	0.332	22%	0.222	S	C	.	.	H	α-helix	trans	-54.3	-45.3	174.5	176.2	167.3	-153.9	0	0	112.4	L427 M428 Q429 T460 S462 V463	E425-L427 VanDerWaalsContact C-N 3.32Å; E425-L427 PolarHBondContact O-N 3.07Å; E425-M428 WeakPolarHBondContact O-CB 3.35Å; E425-M428 PolarHBondContact O-N 3.02Å; E425-Q429 WeakPolarHBondContact O-CG 3.5Å; E425-Q429 PolarHBondContact O-N 3.33Å; E425-T460 HydrophobicContact CB-CG2 4.42Å; E425-T460 HydrophobicContact CG-CG2 4.32Å; E425-T460 VanDerWaalsContact OE1-CB 3.24Å; E425-T460 WeakPolarHBondContact OE1-CB 3.41Å; E425-T460 PolarHBondContact OE1-OG1 2.97Å; E425-S462 WeakPolarHBondContact OE1-CB 3.28Å; E425-V463 HydrophobicContact CG-CG2 4.34Å
426	D	91.1	Very high	88.5	Confident	123 Å²	123	47.7 Å²	47.7	66%	0.658	22%	0.217	S	C	*	.	H	α-helix	trans	-62	-39.3	178.1	-62	-37.3	0	0	0	112.5	T424 Q429 D430	T424-D426 VanDerWaalsContact C-N 3.3Å; T424-D426 PolarHBondContact O-N 3.4Å; D426-Q429 PolarHBondContact O-N 3.45Å; D426-D430 PolarHBondContact O-N 3.3Å
427	L	91.9	Very high	88.4	Confident	20 Å²	20	49.9 Å²	49.9	11%	0.105	23%	0.225	C	C	.	.	H	α-helix	trans	-72.1	-35.1	177.5	-69.4	170.2	0	0	0	111.7	Y396 I398 R416 H418 W422 M423 T424 E425 Q429 D430 W431	Y396-L427 PolarHBondContact OH-O 2.84Å; I398-L427 HydrophobicContact CD1-CD1 4.08Å; I398-L427 HydrophobicContact CG1-CD1 4.45Å; I398-L427 HydrophobicContact CG2-CD1 4.17Å; R416-L427 HydrophobicContact CB-CD2 4.05Å; R416-L427 HydrophobicContact CG-CD2 4.28Å; H418-L427 HydrophobicContact CB-CD1 3.94Å; W422-L427 WeakPolarHBondContact O-CD1 3.25Å; M423-L427 HydrophobicContact SD-CB 3.64Å; T424-L427 PolarHBondContact O-N 3.08Å; T424-L427 WeakPolarHBondContact OG1-CG 3.29Å; T424-L427 PolarHBondContact OG1-N 2.82Å; E425-L427 VanDerWaalsContact C-N 3.32Å; E425-L427 PolarHBondContact O-N 3.07Å; L427-Q429 VanDerWaalsContact C-N 3.33Å; L427-D430 PolarHBondContact O-N 3.46Å; L427-W431 WeakPolarHBondContact O-CB 3.35Å; L427-W431 PolarHBondContact O-N 2.89Å
428	M	92.4	Very high	88.4	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-63.2	-41.2	172.7	-174.4	60.2	-169.3	0	0	111.3	M423 T424 E425 W431 L432 L452 V463 M467	M423-M428 VanDerWaalsContact CE-CA 3.46Å; M423-M428 HydrophobicContact CE-CB 3.85Å; M423-M428 HydrophobicContact CE-CG 4.34Å; M423-M428 HydrophobicContact CE-SD 3.54Å; M423-M428 VanDerWaalsContact CE-SD 3.54Å; T424-M428 PolarHBondContact O-N 3.4Å; E425-M428 WeakPolarHBondContact O-CB 3.35Å; E425-M428 PolarHBondContact O-N 3.02Å; M428-W431 HydrophobicContact CE-CE3 3.63Å; M428-W431 HydrophobicContact CE-CZ3 3.67Å; M428-W431 PolarHBondContact O-N 3.46Å; M428-W431 HydrophobicContact SD-CE3 3.93Å; M428-L432 HydrophobicContact CE-CD2 4.27Å; M428-L432 HydrophobicContact CE-CG 4.26Å; M428-L432 VanDerWaalsContact O-CG 3.31Å; M428-L432 WeakPolarHBondContact O-CG 3.31Å; M428-L432 PolarHBondContact O-N 3.37Å; M428-L452 HydrophobicContact CE-CD1 3.63Å; M428-L452 HydrophobicContact CE-CD2 4.35Å; M428-V463 HydrophobicContact CB-CG2 4.03Å; M428-V463 HydrophobicContact CE-CG1 4.35Å; M428-V463 HydrophobicContact CG-CG1 3.88Å; M428-V463 HydrophobicContact CG-CG2 3.71Å; M428-M467 HydrophobicContact CE-CE 3.86Å
429	Q	92.9	Very high	88.5	Confident	53 Å²	53	55.2 Å²	55.2	25%	0.248	24%	0.239	C	C	.	.	H	α-helix	trans	-64.6	-44.9	173.8	-70	-171.2	6.5	0	0	112.5	E425 D426 L427 W431 L432 E433 S462 V463	E425-Q429 WeakPolarHBondContact O-CG 3.5Å; E425-Q429 PolarHBondContact O-N 3.33Å; D426-Q429 PolarHBondContact O-N 3.45Å; L427-Q429 VanDerWaalsContact C-N 3.33Å; Q429-W431 VanDerWaalsContact C-N 3.33Å; Q429-W431 PolarHBondContact O-N 2.95Å; Q429-L432 WeakPolarHBondContact O-CB 3.13Å; Q429-L432 PolarHBondContact O-N 2.95Å; Q429-E433 WeakPolarHBondContact O-CG 3.31Å; Q429-E433 PolarHBondContact O-N 3.27Å; Q429-S462 PolarHBondContact NE2-OG 2.88Å; Q429-V463 HydrophobicContact CG-CG2 4.46Å
430	D	94.6	Very high	88.5	Confident	49 Å²	49	52.6 Å²	52.6	26%	0.262	24%	0.241	S	C	.	.	H	α-helix	trans	-60.1	-45.1	175.3	178.3	75.2	0	0	0	110.9	Y396 R416 D426 L427 L432 E433 V434	Y396-D430 VanDerWaalsContact CE2-OD2 3.29Å; Y396-D430 WeakPolarHBondContact CE2-OD2 3.47Å; Y396-D430 PolarHBondContact OH-OD2 3.12Å; R416-D430 IonicContact CZ-OD2 2.62Å; R416-D430 IonicContact NE-OD1 3.15Å; R416-D430 IonicContact NE-OD2 2.71Å; R416-D430 PolarHBondContact NE-OD2 3.46Å; R416-D430 IonicContact NH2-OD1 2.9Å; R416-D430 PolarHBondContact NH2-OD1 2.95Å; R416-D430 IonicContact NH2-OD2 2.54Å; R416-D430 PolarHBondContact NH2-OD2 2.71Å; D426-D430 PolarHBondContact O-N 3.3Å; L427-D430 PolarHBondContact O-N 3.46Å; D430-L432 VanDerWaalsContact C-N 3.32Å; D430-L432 PolarHBondContact O-N 2.86Å; D430-E433 PolarHBondContact O-N 3.46Å; D430-E433 VanDerWaalsContact O-N 3.09Å; D430-V434 VanDerWaalsContact O-CG2 3.28Å; D430-V434 WeakPolarHBondContact O-CG2 3.46Å; D430-V434 PolarHBondContact O-N 2.54Å
431	W	95.1	Very high	88.3	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-56.2	-45.4	175	176.2	85.2	0	0	0	112	A363 E383 P385 Y396 M423 L427 M428 Q429 E433 V434 V435 W436 L450	A363-W431 HydrophobicContact CB-CH2 3.84Å; A363-W431 HydrophobicContact CB-CZ2 3.82Å; E383-W431 VanDerWaalsContact CD-CE2 3.5Å; E383-W431 VanDerWaalsContact OE1-CZ2 3.31Å; E383-W431 WeakPolarHBondContact OE1-CZ2 3.37Å; E383-W431 PolarHBondContact OE2-NE1 3.16Å; P385-W431 HydrophobicContact CB-CZ2 3.75Å; P385-W431 HydrophobicContact CG-CZ2 3.8Å; Y396-W431 HydrophobicContact CD2-CB 4.26Å; Y396-W431 AromaticContact CD2-CD1 3.72Å; Y396-W431 HydrophobicContact CD2-CG 4.41Å; Y396-W431 HydrophobicContact CE1-CB 4.38Å; Y396-W431 HydrophobicContact CE2-CB 4.1Å; Y396-W431 HydrophobicContact CG-CB 4.47Å; Y396-W431 AromaticContact CG-CD1 3.57Å; Y396-W431 HydrophobicContact CG-CG 4.42Å; M423-W431 HydrophobicContact CE-CB 4.22Å; L427-W431 WeakPolarHBondContact O-CB 3.35Å; L427-W431 PolarHBondContact O-N 2.89Å; M428-W431 HydrophobicContact CE-CE3 3.63Å; M428-W431 HydrophobicContact CE-CZ3 3.67Å; M428-W431 PolarHBondContact O-N 3.46Å; M428-W431 HydrophobicContact SD-CE3 3.93Å; Q429-W431 VanDerWaalsContact C-N 3.33Å; Q429-W431 PolarHBondContact O-N 2.95Å; W431-E433 VanDerWaalsContact C-N 3.29Å; W431-E433 PolarHBondContact O-N 2.87Å; W431-V434 PolarHBondContact O-N 3.34Å; W431-V435 HydrophobicContact CD2-CB 4.44Å; W431-V435 HydrophobicContact CG-CB 4.33Å; W431-V435 HydrophobicContact CG-CG2 4.3Å; W431-V435 HydrophobicContact CZ2-CB 4.49Å; W431-V435 HydrophobicContact CZ2-CG1 4.29Å; W431-V435 WeakPolarHBondContact O-CA 3.27Å; W431-V435 VanDerWaalsContact O-CB 3.3Å; W431-V435 WeakPolarHBondContact O-CB 3.04Å; W431-V435 PolarHBondContact O-N 3.26Å; W431-W436 HydrophobicContact CH2-CB 4.05Å; W431-W436 HydrophobicContact CH2-CE3 4.36Å; W431-W436 HydrophobicContact CZ3-CB 4.02Å; W431-W436 PolarHBondContact O-N 3.06Å; W431-L450 HydrophobicContact CH2-CD1 4.07Å; W431-L450 HydrophobicContact CH2-CD2 3.8Å; W431-L450 HydrophobicContact CZ3-CD2 3.7Å
432	L	93.8	Very high	88.3	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	25%	0.251	C	S	.	.	I	π-helix	trans	-59.5	-41.3	176.1	-73.4	173.5	0	0	0	112.2	M428 Q429 D430 W436 R437 L450 V463 M467 M470	M428-L432 HydrophobicContact CE-CD2 4.27Å; M428-L432 HydrophobicContact CE-CG 4.26Å; M428-L432 VanDerWaalsContact O-CG 3.31Å; M428-L432 WeakPolarHBondContact O-CG 3.31Å; M428-L432 PolarHBondContact O-N 3.37Å; Q429-L432 WeakPolarHBondContact O-CB 3.13Å; Q429-L432 PolarHBondContact O-N 2.95Å; D430-L432 VanDerWaalsContact C-N 3.32Å; D430-L432 PolarHBondContact O-N 2.86Å; L432-W436 HydrophobicContact CD2-CB 3.86Å; L432-W436 HydrophobicContact CD2-CG 4.07Å; L432-W436 PolarHBondContact O-N 3.28Å; L432-R437 VanDerWaalsContact O-CB 3.26Å; L432-R437 WeakPolarHBondContact O-CB 3.48Å; L432-R437 PolarHBondContact O-N 3.14Å; L432-L450 HydrophobicContact CD2-CD2 4.47Å; L432-V463 HydrophobicContact CD1-CG1 4.1Å; L432-M467 HydrophobicContact CD1-CE 3.92Å; L432-M467 HydrophobicContact CD1-CG 4.42Å; L432-M467 HydrophobicContact CD1-SD 4.11Å; L432-M467 HydrophobicContact CD2-CE 3.44Å; L432-M467 VanDerWaalsContact CD2-CE 3.44Å; L432-M467 HydrophobicContact CD2-SD 3.47Å; L432-M467 WeakPolarHBondContact CD2-SD 3.3Å; L432-M467 HydrophobicContact CG-CE 4.22Å; L432-M467 HydrophobicContact CG-SD 4.46Å; L432-M470 HydrophobicContact CB-CE 3.58Å; L432-M470 HydrophobicContact CB-SD 4.3Å; L432-M470 HydrophobicContact CD1-CE 4.45Å
433	E	93.1	Very high	88.2	Confident	62 Å²	62	46.8 Å²	46.8	29%	0.29	24%	0.244	S	C	.	.	I	π-helix	trans	-72.5	-37.9	-178.8	-73.7	-61.9	155.1	0	0	113.7	Q429 D430 W431 R437 R438 M470	Q429-E433 WeakPolarHBondContact O-CG 3.31Å; Q429-E433 PolarHBondContact O-N 3.27Å; D430-E433 PolarHBondContact O-N 3.46Å; D430-E433 VanDerWaalsContact O-N 3.09Å; W431-E433 VanDerWaalsContact C-N 3.29Å; W431-E433 PolarHBondContact O-N 2.87Å; E433-R437 IonicContact OE1-CZ 3.04Å; E433-R437 IonicContact OE1-NE 2.9Å; E433-R437 IonicContact OE1-NH1 3.78Å; E433-R437 PolarHBondContact OE1-NH1 2.92Å; E433-R437 IonicContact OE1-NH2 3.65Å; E433-R437 PolarHBondContact OE1-NH2 3.47Å; E433-R437 VanDerWaalsContact OE2-CD 3.3Å; E433-R437 WeakPolarHBondContact OE2-CD 3.34Å; E433-R437 IonicContact OE2-CZ 3.99Å; E433-R437 IonicContact OE2-NE 4Å; E433-R437 PolarHBondContact OE2-NE 3.27Å; E433-R437 IonicContact OE2-NH1 3.71Å; E433-R437 PolarHBondContact OE2-NH1 3.45Å; E433-R438 WeakPolarHBondContact O-CG 3.45Å; E433-R438 PolarHBondContact O-NE 3.26Å; E433-R438 VanDerWaalsContact O-NE 3.12Å; E433-M470 WeakPolarHBondContact OE1-CE 3.38Å
434	V	93.8	Very high	87.5	Confident	18 Å²	18	51.9 Å²	51.9	11%	0.109	28%	0.277	C	S	.	.	I	π-helix	trans	-97.3	-27.9	-172.7	-53.4	0	0	0	0	113.4	Y396 E414 D430 W431	Y396-V434 HydrophobicContact CD2-CG2 4.16Å; Y396-V434 HydrophobicContact CE2-CG2 3.85Å; E414-V434 HydrophobicContact CB-CG2 4.5Å; E414-V434 HydrophobicContact CG-CG2 3.96Å; D430-V434 VanDerWaalsContact O-CG2 3.28Å; D430-V434 WeakPolarHBondContact O-CG2 3.46Å; D430-V434 PolarHBondContact O-N 2.54Å; W431-V434 PolarHBondContact O-N 3.34Å
435	V	93.2	Very high	86.7	Confident	1 Å²	1	59.6 Å²	59.6	1%	0.006	31%	0.308	C	S	.	.	I	π-helix	trans	-107.1	-61.2	-179.6	-172.6	0	0	0	0	111.2	P385 L393 Y396 E414 W431 R439	P385-V435 HydrophobicContact CG-CG1 3.75Å; L393-V435 HydrophobicContact CB-CG1 3.72Å; L393-V435 HydrophobicContact CD1-CG1 3.97Å; Y396-V435 HydrophobicContact CD2-CG2 3.96Å; E414-V435 HydrophobicContact CG-CG2 4.21Å; W431-V435 HydrophobicContact CD2-CB 4.44Å; W431-V435 HydrophobicContact CG-CB 4.33Å; W431-V435 HydrophobicContact CG-CG2 4.3Å; W431-V435 HydrophobicContact CZ2-CB 4.49Å; W431-V435 HydrophobicContact CZ2-CG1 4.29Å; W431-V435 WeakPolarHBondContact O-CA 3.27Å; W431-V435 VanDerWaalsContact O-CB 3.3Å; W431-V435 WeakPolarHBondContact O-CB 3.04Å; W431-V435 PolarHBondContact O-N 3.26Å; V435-R439 PolarHBondContact O-N 3.31Å
436	W	93.3	Very high	86.4	Confident	1 Å²	1	59 Å²	59	0%	0.004	31%	0.305	C	S	.	.	I	π-helix	trans	-68.2	-50.4	-170.9	-176.8	-115.1	0	0	0	112.8	L387 L393 W431 L432 R438 R439 L450 T472	L387-W436 HydrophobicContact CD2-CH2 4.4Å; L387-W436 HydrophobicContact CD2-CZ3 3.88Å; L393-W436 HydrophobicContact CD1-CE3 4.12Å; L393-W436 HydrophobicContact CD1-CZ3 4.43Å; W431-W436 HydrophobicContact CH2-CB 4.05Å; W431-W436 HydrophobicContact CH2-CE3 4.36Å; W431-W436 HydrophobicContact CZ3-CB 4.02Å; W431-W436 PolarHBondContact O-N 3.06Å; L432-W436 HydrophobicContact CD2-CB 3.86Å; L432-W436 HydrophobicContact CD2-CG 4.07Å; L432-W436 PolarHBondContact O-N 3.28Å; W436-R438 VanDerWaalsContact C-N 3.26Å; W436-R438 PolarHBondContact O-N 3.16Å; W436-R439 WeakPolarHBondContact O-CB 2.94Å; W436-R439 VanDerWaalsContact O-CD 3.31Å; W436-R439 WeakPolarHBondContact O-CD 3.4Å; W436-R439 WeakPolarHBondContact O-CG 2.95Å; W436-R439 PolarHBondContact O-N 2.66Å; W436-R439 PolarHBondContact O-NH1 3.41Å; W436-L450 HydrophobicContact CD2-CD1 4.29Å; W436-L450 HydrophobicContact CE3-CD1 3.82Å; W436-L450 HydrophobicContact CH2-CB 4.22Å; W436-L450 HydrophobicContact CH2-CD1 3.86Å; W436-L450 HydrophobicContact CZ2-CB 4Å; W436-L450 HydrophobicContact CZ2-CD1 4.32Å; W436-L450 HydrophobicContact CZ3-CD1 3.6Å; W436-T472 HydrophobicContact CZ2-CG2 3.77Å; W436-T472 PolarHBondContact NE1-OG1 3.13Å
437	R	90.5	Very high	86.4	Confident	106 Å²	106	57.4 Å²	57.4	40%	0.4	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-32.5	-179.5	-173.5	175.7	-79.8	-172.4	-6.1	112.4	L432 E433 S469 M470	L432-R437 VanDerWaalsContact O-CB 3.26Å; L432-R437 WeakPolarHBondContact O-CB 3.48Å; L432-R437 PolarHBondContact O-N 3.14Å; E433-R437 IonicContact OE1-CZ 3.04Å; E433-R437 IonicContact OE1-NE 2.9Å; E433-R437 IonicContact OE1-NH1 3.78Å; E433-R437 PolarHBondContact OE1-NH1 2.92Å; E433-R437 IonicContact OE1-NH2 3.65Å; E433-R437 PolarHBondContact OE1-NH2 3.47Å; E433-R437 VanDerWaalsContact OE2-CD 3.3Å; E433-R437 WeakPolarHBondContact OE2-CD 3.34Å; E433-R437 IonicContact OE2-CZ 3.99Å; E433-R437 IonicContact OE2-NE 4Å; E433-R437 PolarHBondContact OE2-NE 3.27Å; E433-R437 IonicContact OE2-NH1 3.71Å; E433-R437 PolarHBondContact OE2-NH1 3.45Å; R437-S469 PolarHBondContact NH2-OG 3.36Å; R437-M470 HydrophobicContact CB-SD 3.78Å; R437-M470 HydrophobicContact CG-SD 4.28Å
438	R	89.1	Confident	86.4	Confident	175 Å²	175	56.4 Å²	56.4	66%	0.66	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.1	7.6	-177.3	-58.6	180	-167.8	-173.1	-1.3	113.3	E433 W436 T440	E433-R438 WeakPolarHBondContact O-CG 3.45Å; E433-R438 PolarHBondContact O-NE 3.26Å; E433-R438 VanDerWaalsContact O-NE 3.12Å; W436-R438 VanDerWaalsContact C-N 3.26Å; W436-R438 PolarHBondContact O-N 3.16Å; R438-T440 PolarHBondContact O-N 3.48Å
439	R	89.5	Confident	86.5	Confident	18 Å²	18	56.4 Å²	56.4	7%	0.068	28%	0.284	C	S	.	.			trans	-53.4	140.6	-177.8	68.6	-172.9	179	-86.1	3.9	111.2	L393 V435 W436 G441 A442	L393-R439 HydrophobicContact CD1-CB 3.86Å; L393-R439 HydrophobicContact CD2-CB 3.66Å; L393-R439 HydrophobicContact CG-CB 4.43Å; V435-R439 PolarHBondContact O-N 3.31Å; W436-R439 WeakPolarHBondContact O-CB 2.94Å; W436-R439 VanDerWaalsContact O-CD 3.31Å; W436-R439 WeakPolarHBondContact O-CD 3.4Å; W436-R439 WeakPolarHBondContact O-CG 2.95Å; W436-R439 PolarHBondContact O-N 2.66Å; W436-R439 PolarHBondContact O-NH1 3.41Å; R439-G441 PolarHBondContact O-N 3.36Å; R439-A442 HydrophobicContact CG-CB 3.8Å; R439-A442 VanDerWaalsContact O-CB 3.29Å; R439-A442 WeakPolarHBondContact O-CB 3.34Å; R439-A442 PolarHBondContact O-N 2.96Å; R439-A442 VanDerWaalsContact O-N 3.08Å
440	T	79.8	Confident	86.5	Confident	104 Å²	104	53.9 Å²	53.9	64%	0.638	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	134.6	177.6	-50.6	0	0	0	0	109.5	R391 R438 A442	R391-T440 PolarHBondContact NH1-O 3.17Å; R438-T440 PolarHBondContact O-N 3.48Å; T440-A442 VanDerWaalsContact C-N 3.28Å; T440-A442 PolarHBondContact O-N 3.44Å
441	G	72.1	Confident	86.5	Confident	38 Å²	38	51.6 Å²	51.6	39%	0.392	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.6	13.2	-176.5	0	0	0	0	0	114.8	Q359 R439 V443	Q359-G441 PolarHBondContact NE2-O 3.12Å; R439-G441 PolarHBondContact O-N 3.36Å; G441-V443 PolarHBondContact O-N 3.08Å
442	A	74	Confident	86.2	Confident	37 Å²	37	51.6 Å²	51.6	31%	0.306	26%	0.26	S	S	.	.	P	Polyproline II helix	trans	-58.2	118	162	0	0	0	0	0	109.1	R439 T440	R439-A442 HydrophobicContact CG-CB 3.8Å; R439-A442 VanDerWaalsContact O-CB 3.29Å; R439-A442 WeakPolarHBondContact O-CB 3.34Å; R439-A442 PolarHBondContact O-N 2.96Å; R439-A442 VanDerWaalsContact O-N 3.08Å; T440-A442 VanDerWaalsContact C-N 3.28Å; T440-A442 PolarHBondContact O-N 3.44Å
443	V	72.9	Confident	85.9	Confident	62 Å²	62	52.8 Å²	52.8	38%	0.376	27%	0.267	S	S	.	.	P	Polyproline II helix	trans	-95.3	123	174.7	-175.7	0	0	0	0	107.8	G441 K445 Q446	G441-V443 PolarHBondContact O-N 3.08Å; V443-K445 PolarHBondContact O-N 3.32Å; V443-Q446 HydrophobicContact CB-CB 4.13Å; V443-Q446 HydrophobicContact CB-CG 3.86Å; V443-Q446 HydrophobicContact CG1-CG 3.93Å; V443-Q446 PolarHBondContact O-N 2.86Å
444	P	67.6	Low	85.3	Confident	113 Å²	113	52.2 Å²	52.2	73%	0.734	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.6	130.1	175.2	-24.1	33.2	0	0	0	110.3	Q446	P444-Q446 VanDerWaalsContact C-N 3.35Å; P444-Q446 PolarHBondContact O-N 3.27Å
445	K	71.3	Confident	84.5	Confident	201 Å²	201	55 Å²	55	87%	0.874	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.7	-3.7	179.7	-48.3	174	178.7	179.2	0	117	V443 N471	V443-K445 PolarHBondContact O-N 3.32Å; K445-N471 PolarHBondContact O-ND2 2.95Å
446	Q	82.2	Confident	83.6	Confident	58 Å²	58	66 Å²	66	27%	0.271	33%	0.33	S	S	.	.			trans	-77.4	146.1	168.8	-75.6	-170.3	-17.1	0	0	110.7	E356 Q359 V443 P444 N471	E356-Q446 VanDerWaalsContact CD-NE2 3.31Å; E356-Q446 PolarHBondContact OE1-NE2 3.49Å; E356-Q446 PolarHBondContact OE2-OE1 2.98Å; Q359-Q446 HydrophobicContact CG-CB 4.35Å; V443-Q446 HydrophobicContact CB-CB 4.13Å; V443-Q446 HydrophobicContact CB-CG 3.86Å; V443-Q446 HydrophobicContact CG1-CG 3.93Å; V443-Q446 PolarHBondContact O-N 2.86Å; P444-Q446 VanDerWaalsContact C-N 3.35Å; P444-Q446 PolarHBondContact O-N 3.27Å; Q446-N471 VanDerWaalsContact C-ND2 3.34Å; Q446-N471 PolarHBondContact O-ND2 3.19Å; Q446-N471 VanDerWaalsContact O-ND2 3.17Å
447	R	90.4	Very high	82.7	Confident	89 Å²	89	66.5 Å²	66.5	34%	0.336	34%	0.336	S	S	.	.			trans	-81.9	135.9	177.5	-162.1	167.3	-107.5	-101.4	-7	109	Y355 N471 D473	Y355-R447 HydrophobicContact CD1-CB 4.48Å; Y355-R447 WeakPolarHBondContact CD1-O 3.25Å; Y355-R447 HydrophobicContact CE1-CB 4.19Å; Y355-R447 HydrophobicContact CE1-CG 3.89Å; R447-N471 CarbonylContact C-O 3.44Å; R447-N471 VanDerWaalsContact CA-ND2 3.29Å; R447-N471 WeakPolarHBondContact CA-ND2 3.46Å; R447-N471 VanDerWaalsContact CA-O 3.28Å; R447-N471 WeakPolarHBondContact CA-O 3.49Å; R447-N471 WeakPolarHBondContact CG-O 3.48Å; R447-N471 PolarHBondContact N-ND2 2.72Å; R447-N471 PolarHBondContact NE-OD1 2.84Å; R447-N471 PolarHBondContact NH2-OD1 3.09Å; R447-D473 VanDerWaalsContact CD-OD2 3.25Å; R447-D473 WeakPolarHBondContact CD-OD2 3.27Å; R447-D473 WeakPolarHBondContact CG-OD2 3.35Å; R447-D473 IonicContact CZ-OD1 2.61Å; R447-D473 IonicContact CZ-OD2 3.16Å; R447-D473 IonicContact NE-OD2 2.67Å; R447-D473 IonicContact NH1-OD1 3.6Å; R447-D473 PolarHBondContact NH1-OD1 2.87Å; R447-D473 IonicContact NH1-OD2 2.99Å; R447-D473 PolarHBondContact NH1-OD2 2.91Å
448	G	92.6	Very high	82.2	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	161.4	176.6	0	0	0	0	0	112	Y355 Q359 N471 T472 D473	Y355-G448 WeakPolarHBondContact CE1-O 3.48Å; Q359-G448 WeakPolarHBondContact O-CA 3.19Å; G448-N471 PolarHBondContact N-O 3.37Å; G448-T472 CarbonylContact O-C 3.6Å; G448-T472 WeakPolarHBondContact O-CA 3.35Å; G448-D473 PolarHBondContact O-N 2.95Å
449	M	94.3	Very high	81.8	Confident	0 Å²	0	55 Å²	55	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	130.5	166.9	-176.6	-172.5	-67.7	0	0	108.1	V346 L349 R350 Y355 Q359 M360 G361 I451 D473 V475	V346-M449 HydrophobicContact CG1-SD 4.49Å; L349-M449 HydrophobicContact CB-CE 3.57Å; L349-M449 HydrophobicContact CD1-CE 4.08Å; L349-M449 HydrophobicContact CG-CE 4.48Å; R350-M449 HydrophobicContact CG-CE 4.1Å; Y355-M449 HydrophobicContact CD1-CB 4.2Å; Y355-M449 HydrophobicContact CD2-CE 3.68Å; Y355-M449 HydrophobicContact CE1-CB 4.03Å; Y355-M449 HydrophobicContact CE2-CB 4.37Å; Y355-M449 HydrophobicContact CE2-CE 3.2Å; Y355-M449 HydrophobicContact CG-CB 4.43Å; Q359-M449 PolarHBondContact O-N 2.96Å; M360-M449 CarbonylContact C-O 3.59Å; M360-M449 WeakPolarHBondContact CA-O 3.18Å; M360-M449 HydrophobicContact CG-CB 4.19Å; G361-M449 PolarHBondContact N-O 2.99Å; M449-I451 HydrophobicContact CG-CD1 4.03Å; M449-I451 HydrophobicContact SD-CD1 3.93Å; M449-I451 HydrophobicContact SD-CG1 4.49Å; M449-D473 CarbonylContact C-O 3.54Å; M449-D473 WeakPolarHBondContact CA-O 3.46Å; M449-V475 HydrophobicContact CG-CG2 3.83Å; M449-V475 HydrophobicContact SD-CG2 3.88Å
450	L	94.1	Very high	81.8	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	122.2	173.5	-175.1	72.9	0	0	0	110.5	G361 A363 W431 L432 W436 L452 M467 T472 D473 V475	G361-L450 WeakPolarHBondContact O-CA 3.44Å; A363-L450 HydrophobicContact CB-CD1 4.41Å; W431-L450 HydrophobicContact CH2-CD1 4.07Å; W431-L450 HydrophobicContact CH2-CD2 3.8Å; W431-L450 HydrophobicContact CZ3-CD2 3.7Å; L432-L450 HydrophobicContact CD2-CD2 4.47Å; W436-L450 HydrophobicContact CD2-CD1 4.29Å; W436-L450 HydrophobicContact CE3-CD1 3.82Å; W436-L450 HydrophobicContact CH2-CB 4.22Å; W436-L450 HydrophobicContact CH2-CD1 3.86Å; W436-L450 HydrophobicContact CZ2-CB 4Å; W436-L450 HydrophobicContact CZ2-CD1 4.32Å; W436-L450 HydrophobicContact CZ3-CD1 3.6Å; L450-L452 HydrophobicContact CD2-CD1 4Å; L450-L452 HydrophobicContact CD2-CD2 3.93Å; L450-L452 HydrophobicContact CD2-CG 4Å; L450-L452 HydrophobicContact CG-CD2 4.11Å; L450-L452 HydrophobicContact CG-CG 4.11Å; L450-M467 HydrophobicContact CD2-CE 3.42Å; L450-M467 VanDerWaalsContact CD2-CE 3.42Å; L450-M467 HydrophobicContact CD2-SD 4.01Å; L450-T472 HydrophobicContact CB-CG2 3.88Å; L450-D473 PolarHBondContact N-O 3.45Å; L450-V475 PolarHBondContact O-N 2.9Å
451	I	93.5	Very high	82.3	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	124.6	177.1	-58.8	84	0	0	0	108.9	Y342 G361 N362 A363 M449 V475 I477 I554	Y342-I451 WeakPolarHBondContact OH-CG2 3.28Å; G361-I451 WeakPolarHBondContact O-CD1 3.13Å; G361-I451 PolarHBondContact O-N 3.11Å; N362-I451 WeakPolarHBondContact CA-O 3.37Å; N362-I451 PolarHBondContact ND2-O 3.05Å; A363-I451 PolarHBondContact N-O 3.05Å; A363-I451 VanDerWaalsContact N-O 3.1Å; M449-I451 HydrophobicContact CG-CD1 4.03Å; M449-I451 HydrophobicContact SD-CD1 3.93Å; M449-I451 HydrophobicContact SD-CG1 4.49Å; I451-V475 WeakPolarHBondContact CA-O 3.45Å; I451-V475 HydrophobicContact CG1-CB 4.14Å; I451-V475 HydrophobicContact CG1-CG1 4.43Å; I451-I477 HydrophobicContact CG2-CD1 3.84Å; I451-I477 HydrophobicContact CG2-CG1 3.71Å; I451-I554 HydrophobicContact CD1-CD1 4.39Å; I451-I554 HydrophobicContact CD1-CG2 3.84Å; I451-I554 HydrophobicContact CG1-CD1 4.18Å; I451-I554 HydrophobicContact CG1-CG2 4.46Å
452	L	90.2	Very high	83.2	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	160	179.6	-62.4	175	0	0	0	111.1	A363 M428 L450 H458 M467 M474 V475 I476 I477	A363-L452 HydrophobicContact CB-CD2 3.77Å; M428-L452 HydrophobicContact CE-CD1 3.63Å; M428-L452 HydrophobicContact CE-CD2 4.35Å; L450-L452 HydrophobicContact CD2-CD1 4Å; L450-L452 HydrophobicContact CD2-CD2 3.93Å; L450-L452 HydrophobicContact CD2-CG 4Å; L450-L452 HydrophobicContact CG-CD2 4.11Å; L450-L452 HydrophobicContact CG-CG 4.11Å; L452-H458 HydrophobicContact CB-CB 4.49Å; L452-H458 HydrophobicContact CD1-CB 3.95Å; L452-M467 HydrophobicContact CD1-CE 3.95Å; L452-M474 HydrophobicContact CD1-CG 4.35Å; L452-M474 HydrophobicContact CD1-SD 4.25Å; L452-V475 PolarHBondContact N-O 3.3Å; L452-I476 HydrophobicContact CB-CD1 4.09Å; L452-I476 WeakPolarHBondContact O-CA 3.46Å; L452-I477 WeakPolarHBondContact O-CG1 3.44Å; L452-I477 PolarHBondContact O-N 2.98Å
453	N	86	Confident	84	Confident	25 Å²	25	54.7 Å²	54.7	13%	0.134	29%	0.287	C	S	.	.			trans	-70	171.5	168.9	73.9	12.1	0	0	0	111.3	D364 F455 H458	D364-N453 PolarHBondContact OD1-ND2 3.29Å; N453-F455 PolarHBondContact O-N 3.19Å; N453-F455 VanDerWaalsContact O-N 3.16Å; N453-F455 WeakPolarHBondContact OD1-CB 3.45Å; N453-F455 PolarHBondContact OD1-N 2.77Å; N453-H458 PolarHBondContact OD1-CE1 2.98Å; N453-H458 PolarHBondContact OD1-ND1 2.92Å
454	G	80.2	Confident	84.9	Confident	51 Å²	51	55.8 Å²	55.8	53%	0.526	29%	0.287	S	S	.	.	S	Bend	trans	-77.5	20.9	176.5	0	0	0	0	0	115.8	R456	G454-R456 PolarHBondContact O-N 3.4Å
455	F	78.1	Confident	86.1	Confident	77 Å²	77	55.1 Å²	55.1	34%	0.338	28%	0.277	S	S	.	.			trans	-63.5	132.4	178.1	179	-114.1	0	0	0	110.7	M423 N453 G457 H458	M423-F455 HydrophobicContact CB-CE1 4.32Å; N453-F455 PolarHBondContact O-N 3.19Å; N453-F455 VanDerWaalsContact O-N 3.16Å; N453-F455 WeakPolarHBondContact OD1-CB 3.45Å; N453-F455 PolarHBondContact OD1-N 2.77Å; F455-G457 PolarHBondContact O-N 3.21Å; F455-G457 VanDerWaalsContact O-N 3.13Å; F455-H458 AromaticContact CD1-CD2 3.7Å; F455-H458 AromaticContact CD1-NE2 3.55Å; F455-H458 WeakPolarHBondContact O-CB 3.48Å; F455-H458 PolarHBondContact O-N 3.19Å
456	R	74.4	Confident	87.1	Confident	231 Å²	231	46.5 Å²	46.5	87%	0.872	24%	0.242	S	C	*	.	G	3₁₀ helix	trans	-58	-32.7	-174.2	-70.7	-170.6	-179	-151.3	2.7	113	G454 H458 A459	G454-R456 PolarHBondContact O-N 3.4Å; R456-H458 PolarHBondContact O-N 2.66Å; R456-A459 PolarHBondContact O-N 2.97Å
457	G	73.3	Confident	87.6	Confident	12 Å²	12	43.9 Å²	43.9	12%	0.124	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-66	-18.8	177.5	0	0	0	0	0	114.5	F455	F455-G457 PolarHBondContact O-N 3.21Å; F455-G457 VanDerWaalsContact O-N 3.13Å
458	H	80.4	Confident	87.6	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	25%	0.246	C	C	.	.	G	3₁₀ helix	trans	-85.9	-23.5	178.6	-61.9	170.1	0	0	0	112.9	E365 L452 N453 F455 R456 V463	E365-H458 VanDerWaalsContact CD-CE1 3.49Å; E365-H458 VanDerWaalsContact CD-NE2 3.35Å; E365-H458 IonicContact OE1-CE1 3.93Å; E365-H458 PolarHBondContact OE1-CE1 2.93Å; E365-H458 IonicContact OE1-NE2 2.72Å; E365-H458 PolarHBondContact OE1-NE2 3.31Å; E365-H458 IonicContact OE2-CE1 2.76Å; E365-H458 PolarHBondContact OE2-CE1 3.1Å; E365-H458 IonicContact OE2-NE2 3.08Å; E365-H458 PolarHBondContact OE2-NE2 2.9Å; L452-H458 HydrophobicContact CB-CB 4.49Å; L452-H458 HydrophobicContact CD1-CB 3.95Å; N453-H458 PolarHBondContact OD1-CE1 2.98Å; N453-H458 PolarHBondContact OD1-ND1 2.92Å; F455-H458 AromaticContact CD1-CD2 3.7Å; F455-H458 AromaticContact CD1-NE2 3.55Å; F455-H458 WeakPolarHBondContact O-CB 3.48Å; F455-H458 PolarHBondContact O-N 3.19Å; R456-H458 PolarHBondContact O-N 2.66Å; H458-V463 WeakPolarHBondContact O-CG1 3.38Å
459	A	81.4	Confident	87.5	Confident	39 Å²	39	50.5 Å²	50.5	32%	0.322	27%	0.274	S	S	.	.	S	Bend	trans	-109.9	20.5	-170.2	0	0	0	0	0	113.3	R456 K464	R456-A459 PolarHBondContact O-N 2.97Å; A459-K464 WeakPolarHBondContact O-CE 3.34Å; A459-K464 PolarHBondContact O-NZ 3.34Å
460	T	88.7	Confident	87.3	Confident	32 Å²	32	51.6 Å²	51.6	20%	0.196	28%	0.279	C	S	.	.	S	Bend	trans	-70.1	156	172.2	75.4	0	0	0	0	110.8	E425 S462 V463 K464	E425-T460 HydrophobicContact CB-CG2 4.42Å; E425-T460 HydrophobicContact CG-CG2 4.32Å; E425-T460 VanDerWaalsContact OE1-CB 3.24Å; E425-T460 WeakPolarHBondContact OE1-CB 3.41Å; E425-T460 PolarHBondContact OE1-OG1 2.97Å; T460-S462 PolarHBondContact O-N 3.41Å; T460-V463 PolarHBondContact O-N 2.82Å; T460-V463 WeakPolarHBondContact OG1-CG2 3.24Å; T460-V463 PolarHBondContact OG1-N 3.41Å; T460-K464 WeakPolarHBondContact O-CG 3.25Å; T460-K464 PolarHBondContact O-N 2.95Å
461	D	90.6	Very high	87.2	Confident	108 Å²	108	54 Å²	54	58%	0.578	29%	0.292	S	S	*	.	H	α-helix	trans	-65.9	-31.4	-178.6	-63.3	-27.6	0	0	0	112	K464 N465	D461-K464 PolarHBondContact O-N 3.26Å; D461-K464 IonicContact OD1-NZ 2.72Å; D461-K464 PolarHBondContact OD1-NZ 3.23Å; D461-K464 VanDerWaalsContact OD1-NZ 3.09Å; D461-N465 WeakPolarHBondContact O-CB 3.4Å; D461-N465 PolarHBondContact O-N 3.24Å; D461-N465 PolarHBondContact O-ND2 3.4Å; D461-N465 VanDerWaalsContact O-ND2 3.12Å; D461-N465 PolarHBondContact O-OD1 3.37Å
462	S	92.1	Very high	87.2	Confident	51 Å²	51	54.3 Å²	54.3	36%	0.357	29%	0.294	S	S	.	.	H	α-helix	trans	-67.5	-38.3	176.4	-145.4	0	0	0	0	112.2	E425 Q429 T460 S466	E425-S462 WeakPolarHBondContact OE1-CB 3.28Å; Q429-S462 PolarHBondContact NE2-OG 2.88Å; T460-S462 PolarHBondContact O-N 3.41Å; S462-S466 WeakPolarHBondContact O-CB 3.35Å; S462-S466 PolarHBondContact O-N 3.17Å; S462-S466 PolarHBondContact O-OG 2.93Å
463	V	90.4	Very high	87.4	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-67.3	-44.6	173	174.8	0	0	0	0	110.8	E425 M428 Q429 L432 H458 T460 N465 S466 M467	E425-V463 HydrophobicContact CG-CG2 4.34Å; M428-V463 HydrophobicContact CB-CG2 4.03Å; M428-V463 HydrophobicContact CE-CG1 4.35Å; M428-V463 HydrophobicContact CG-CG1 3.88Å; M428-V463 HydrophobicContact CG-CG2 3.71Å; Q429-V463 HydrophobicContact CG-CG2 4.46Å; L432-V463 HydrophobicContact CD1-CG1 4.1Å; H458-V463 WeakPolarHBondContact O-CG1 3.38Å; T460-V463 PolarHBondContact O-N 2.82Å; T460-V463 WeakPolarHBondContact OG1-CG2 3.24Å; T460-V463 PolarHBondContact OG1-N 3.41Å; V463-N465 PolarHBondContact O-N 3.48Å; V463-S466 WeakPolarHBondContact O-CB 3.38Å; V463-S466 PolarHBondContact O-N 3.21Å; V463-S466 VanDerWaalsContact O-N 3.12Å; V463-M467 HydrophobicContact CG1-CE 4.13Å; V463-M467 WeakPolarHBondContact O-CG 3.35Å; V463-M467 PolarHBondContact O-N 3.02Å
464	K	91.4	Very high	87.7	Confident	85 Å²	85	56.9 Å²	56.9	37%	0.37	31%	0.307	S	S	.	.	H	α-helix	trans	-57.9	-47	175.5	-69	173.5	-164	151.9	0	112.3	A459 T460 D461 S466 M467 E468 M474	A459-K464 WeakPolarHBondContact O-CE 3.34Å; A459-K464 PolarHBondContact O-NZ 3.34Å; T460-K464 WeakPolarHBondContact O-CG 3.25Å; T460-K464 PolarHBondContact O-N 2.95Å; D461-K464 PolarHBondContact O-N 3.26Å; D461-K464 IonicContact OD1-NZ 2.72Å; D461-K464 PolarHBondContact OD1-NZ 3.23Å; D461-K464 VanDerWaalsContact OD1-NZ 3.09Å; K464-S466 VanDerWaalsContact C-N 3.25Å; K464-S466 PolarHBondContact O-N 2.92Å; K464-M467 WeakPolarHBondContact O-CB 3.49Å; K464-M467 PolarHBondContact O-N 3.41Å; K464-M467 VanDerWaalsContact O-N 3.17Å; K464-E468 PolarHBondContact O-N 3.29Å; K464-M474 HydrophobicContact CG-CE 3.83Å
465	N	92.9	Very high	88.2	Confident	98 Å²	98	54.8 Å²	54.8	52%	0.524	28%	0.284	S	S	.	.	H	α-helix	trans	-60.1	-38.4	176.7	-67.8	-22.5	0	0	0	111.4	D461 V463 E468 S469	D461-N465 WeakPolarHBondContact O-CB 3.4Å; D461-N465 PolarHBondContact O-N 3.24Å; D461-N465 PolarHBondContact O-ND2 3.4Å; D461-N465 VanDerWaalsContact O-ND2 3.12Å; D461-N465 PolarHBondContact O-OD1 3.37Å; V463-N465 PolarHBondContact O-N 3.48Å; N465-E468 PolarHBondContact O-N 3.45Å; N465-S469 WeakPolarHBondContact O-CB 3.42Å; N465-S469 PolarHBondContact O-N 2.93Å
466	S	92.8	Very high	88.8	Confident	20 Å²	20	54 Å²	54	14%	0.14	28%	0.283	C	S	.	.	H	α-helix	trans	-64.4	-44.4	175.8	-60.9	0	0	0	0	111.6	S462 V463 K464 S469 M470	S462-S466 WeakPolarHBondContact O-CB 3.35Å; S462-S466 PolarHBondContact O-N 3.17Å; S462-S466 PolarHBondContact O-OG 2.93Å; V463-S466 WeakPolarHBondContact O-CB 3.38Å; V463-S466 PolarHBondContact O-N 3.21Å; V463-S466 VanDerWaalsContact O-N 3.12Å; K464-S466 VanDerWaalsContact C-N 3.25Å; K464-S466 PolarHBondContact O-N 2.92Å; S466-S469 PolarHBondContact O-N 2.79Å; S466-S469 PolarHBondContact O-OG 2.95Å; S466-M470 VanDerWaalsContact O-CG 3.31Å; S466-M470 WeakPolarHBondContact O-CG 3.41Å; S466-M470 PolarHBondContact O-N 2.9Å
467	M	91.3	Very high	89.4	Confident	3 Å²	3	43.1 Å²	43.1	2%	0.015	24%	0.242	C	C	.	.	H	α-helix	trans	-61.3	-44.5	175.4	-64.1	-71.2	-170.2	0	0	112.3	M428 L432 L450 L452 V463 K464 S469 M470 N471 T472 M474	M428-M467 HydrophobicContact CE-CE 3.86Å; L432-M467 HydrophobicContact CD1-CE 3.92Å; L432-M467 HydrophobicContact CD1-CG 4.42Å; L432-M467 HydrophobicContact CD1-SD 4.11Å; L432-M467 HydrophobicContact CD2-CE 3.44Å; L432-M467 VanDerWaalsContact CD2-CE 3.44Å; L432-M467 HydrophobicContact CD2-SD 3.47Å; L432-M467 WeakPolarHBondContact CD2-SD 3.3Å; L432-M467 HydrophobicContact CG-CE 4.22Å; L432-M467 HydrophobicContact CG-SD 4.46Å; L450-M467 HydrophobicContact CD2-CE 3.42Å; L450-M467 VanDerWaalsContact CD2-CE 3.42Å; L450-M467 HydrophobicContact CD2-SD 4.01Å; L452-M467 HydrophobicContact CD1-CE 3.95Å; V463-M467 HydrophobicContact CG1-CE 4.13Å; V463-M467 WeakPolarHBondContact O-CG 3.35Å; V463-M467 PolarHBondContact O-N 3.02Å; K464-M467 WeakPolarHBondContact O-CB 3.49Å; K464-M467 PolarHBondContact O-N 3.41Å; K464-M467 VanDerWaalsContact O-N 3.17Å; M467-S469 VanDerWaalsContact C-N 3.34Å; M467-S469 PolarHBondContact O-N 2.99Å; M467-M470 CarbonylContact O-C 3.57Å; M467-M470 WeakPolarHBondContact O-CA 3.43Å; M467-M470 WeakPolarHBondContact O-CB 3.5Å; M467-M470 PolarHBondContact O-N 3.2Å; M467-N471 PolarHBondContact O-N 3.25Å; M467-T472 PolarHBondContact O-N 2.92Å; M467-T472 HydrophobicContact SD-CG2 4.19Å; M467-M474 HydrophobicContact CE-SD 4.48Å
468	E	91.5	Very high	89.9	Confident	146 Å²	146	44.1 Å²	44.1	68%	0.682	25%	0.246	S	C	*	.	H	α-helix	trans	-61.7	-43.6	178.5	-172.8	175.6	-167.6	0	0	111	K464 N465 M470 N471	K464-E468 PolarHBondContact O-N 3.29Å; N465-E468 PolarHBondContact O-N 3.45Å; E468-M470 PolarHBondContact O-N 3.43Å; E468-M470 VanDerWaalsContact O-N 3.15Å; E468-N471 PolarHBondContact O-N 3.23Å
469	S	90.8	Very high	89.8	Confident	82 Å²	82	46.8 Å²	46.8	57%	0.573	27%	0.274	S	S	*	.	H	α-helix	trans	-60.3	-25.3	174.4	82.9	0	0	0	0	113.2	R437 N465 S466 M467	R437-S469 PolarHBondContact NH2-OG 3.36Å; N465-S469 WeakPolarHBondContact O-CB 3.42Å; N465-S469 PolarHBondContact O-N 2.93Å; S466-S469 PolarHBondContact O-N 2.79Å; S466-S469 PolarHBondContact O-OG 2.95Å; M467-S469 VanDerWaalsContact C-N 3.34Å; M467-S469 PolarHBondContact O-N 2.99Å
470	M	89.8	Confident	89.5	Confident	23 Å²	23	47 Å²	47	11%	0.113	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.1	9.3	176.7	-62.8	-174.1	-143.6	0	0	112.9	L432 E433 R437 S466 M467 E468 T472	L432-M470 HydrophobicContact CB-CE 3.58Å; L432-M470 HydrophobicContact CB-SD 4.3Å; L432-M470 HydrophobicContact CD1-CE 4.45Å; E433-M470 WeakPolarHBondContact OE1-CE 3.38Å; R437-M470 HydrophobicContact CB-SD 3.78Å; R437-M470 HydrophobicContact CG-SD 4.28Å; S466-M470 VanDerWaalsContact O-CG 3.31Å; S466-M470 WeakPolarHBondContact O-CG 3.41Å; S466-M470 PolarHBondContact O-N 2.9Å; M467-M470 CarbonylContact O-C 3.57Å; M467-M470 WeakPolarHBondContact O-CA 3.43Å; M467-M470 WeakPolarHBondContact O-CB 3.5Å; M467-M470 PolarHBondContact O-N 3.2Å; E468-M470 PolarHBondContact O-N 3.43Å; E468-M470 VanDerWaalsContact O-N 3.15Å; M470-T472 VanDerWaalsContact C-N 3.26Å; M470-T472 PolarHBondContact O-N 3.44Å; M470-T472 PolarHBondContact O-OG1 2.91Å
471	N	91.5	Very high	89	Confident	50 Å²	50	45.5 Å²	45.5	27%	0.267	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	51	45.8	-176.2	-168.2	42.3	0	0	0	111.7	K445 Q446 R447 G448 M467 E468	K445-N471 PolarHBondContact O-ND2 2.95Å; Q446-N471 VanDerWaalsContact C-ND2 3.34Å; Q446-N471 PolarHBondContact O-ND2 3.19Å; Q446-N471 VanDerWaalsContact O-ND2 3.17Å; R447-N471 CarbonylContact C-O 3.44Å; R447-N471 VanDerWaalsContact CA-ND2 3.29Å; R447-N471 WeakPolarHBondContact CA-ND2 3.46Å; R447-N471 VanDerWaalsContact CA-O 3.28Å; R447-N471 WeakPolarHBondContact CA-O 3.49Å; R447-N471 WeakPolarHBondContact CG-O 3.48Å; R447-N471 PolarHBondContact N-ND2 2.72Å; R447-N471 PolarHBondContact NE-OD1 2.84Å; R447-N471 PolarHBondContact NH2-OD1 3.09Å; G448-N471 PolarHBondContact N-O 3.37Å; M467-N471 PolarHBondContact O-N 3.25Å; E468-N471 PolarHBondContact O-N 3.23Å
472	T	93.3	Very high	88.5	Confident	7 Å²	7	42.3 Å²	42.3	4%	0.043	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	128.3	-178	-59.6	0	0	0	0	110.3	W436 G448 L450 M467 M470	W436-T472 HydrophobicContact CZ2-CG2 3.77Å; W436-T472 PolarHBondContact NE1-OG1 3.13Å; G448-T472 CarbonylContact O-C 3.6Å; G448-T472 WeakPolarHBondContact O-CA 3.35Å; L450-T472 HydrophobicContact CB-CG2 3.88Å; M467-T472 PolarHBondContact O-N 2.92Å; M467-T472 HydrophobicContact SD-CG2 4.19Å; M470-T472 VanDerWaalsContact C-N 3.26Å; M470-T472 PolarHBondContact O-N 3.44Å; M470-T472 PolarHBondContact O-OG1 2.91Å
473	D	93.7	Very high	87.6	Confident	30 Å²	30	43.8 Å²	43.8	16%	0.16	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	130.9	170	-65.4	-61.7	0	0	0	110	L349 H353 Y355 R447 G448 M449 L450	L349-D473 HydrophobicContact CD2-CB 4.48Å; H353-D473 IonicContact CD2-OD2 3.19Å; Y355-D473 WeakPolarHBondContact OH-CB 3.32Å; Y355-D473 VanDerWaalsContact OH-CG 3.23Å; Y355-D473 PolarHBondContact OH-OD2 2.79Å; R447-D473 VanDerWaalsContact CD-OD2 3.25Å; R447-D473 WeakPolarHBondContact CD-OD2 3.27Å; R447-D473 WeakPolarHBondContact CG-OD2 3.35Å; R447-D473 IonicContact CZ-OD1 2.61Å; R447-D473 IonicContact CZ-OD2 3.16Å; R447-D473 IonicContact NE-OD2 2.67Å; R447-D473 IonicContact NH1-OD1 3.6Å; R447-D473 PolarHBondContact NH1-OD1 2.87Å; R447-D473 IonicContact NH1-OD2 2.99Å; R447-D473 PolarHBondContact NH1-OD2 2.91Å; G448-D473 PolarHBondContact O-N 2.95Å; M449-D473 CarbonylContact C-O 3.54Å; M449-D473 WeakPolarHBondContact CA-O 3.46Å; L450-D473 PolarHBondContact N-O 3.45Å
474	M	92.4	Very high	87	Confident	50 Å²	50	47.3 Å²	47.3	25%	0.246	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	129.8	178.7	-174.8	178.6	74	0	0	109.9	L452 K464 M467 I476	L452-M474 HydrophobicContact CD1-CG 4.35Å; L452-M474 HydrophobicContact CD1-SD 4.25Å; K464-M474 HydrophobicContact CG-CE 3.83Å; M467-M474 HydrophobicContact CE-SD 4.48Å; M474-I476 HydrophobicContact CE-CD1 3.94Å; M474-I476 HydrophobicContact CE-CG1 4.1Å; M474-I476 HydrophobicContact CG-CD1 3.99Å; M474-I476 HydrophobicContact SD-CD1 3.96Å
475	V	92.1	Very high	86.7	Confident	7 Å²	7	43.3 Å²	43.3	4%	0.042	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	125.5	175.7	178.9	0	0	0	0	108.6	Y342 V346 L349 M449 L450 I451 L452	Y342-V475 HydrophobicContact CD2-CG1 4.3Å; Y342-V475 HydrophobicContact CE2-CG1 3.56Å; V346-V475 HydrophobicContact CG2-CG1 3.92Å; L349-V475 HydrophobicContact CD1-CG2 3.63Å; M449-V475 HydrophobicContact CG-CG2 3.83Å; M449-V475 HydrophobicContact SD-CG2 3.88Å; L450-V475 PolarHBondContact O-N 2.9Å; I451-V475 WeakPolarHBondContact CA-O 3.45Å; I451-V475 HydrophobicContact CG1-CB 4.14Å; I451-V475 HydrophobicContact CG1-CG1 4.43Å; L452-V475 PolarHBondContact N-O 3.3Å
476	I	90.4	Very high	86.5	Confident	60 Å²	60	38.7 Å²	38.7	31%	0.308	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	127.4	179.7	-58.9	-58.2	0	0	0	109.8	L452 M474	L452-I476 HydrophobicContact CB-CD1 4.09Å; L452-I476 WeakPolarHBondContact O-CA 3.46Å; M474-I476 HydrophobicContact CE-CD1 3.94Å; M474-I476 HydrophobicContact CE-CG1 4.1Å; M474-I476 HydrophobicContact CG-CD1 3.99Å; M474-I476 HydrophobicContact SD-CD1 3.96Å
477	I	86.6	Confident	86.3	Confident	3 Å²	3	37.7 Å²	37.7	2%	0.015	23%	0.233	C	C	.	.	P	Polyproline II helix	trans	-69.9	128.9	173.4	-62.5	168.3	0	0	0	109	Y342 I451 L452 L481 L485 Q486	Y342-I477 HydrophobicContact CE2-CG1 4.18Å; I451-I477 HydrophobicContact CG2-CD1 3.84Å; I451-I477 HydrophobicContact CG2-CG1 3.71Å; L452-I477 WeakPolarHBondContact O-CG1 3.44Å; L452-I477 PolarHBondContact O-N 2.98Å; I477-L481 HydrophobicContact CG2-CB 4.17Å; I477-L485 HydrophobicContact CD1-CB 4.43Å; I477-L485 HydrophobicContact CG1-CB 4.35Å; I477-L485 HydrophobicContact CG2-CB 3.88Å; I477-L485 HydrophobicContact CG2-CD1 4.21Å; I477-Q486 HydrophobicContact CD1-CB 3.78Å; I477-Q486 HydrophobicContact CD1-CG 4.36Å
478	P	83.9	Confident	86.1	Confident	32 Å²	32	37.6 Å²	37.6	21%	0.208	23%	0.232	C	C	.	.	P	Polyproline II helix	trans	-62.3	147.5	177.4	-19.5	30.2	0	0	0	112.1	K338 Y342 G480 L481	K338-P478 HydrophobicContact CB-CB 4.28Å; Y342-P478 HydrophobicContact CD2-CG 4.3Å; P478-G480 PolarHBondContact O-N 3.22Å; P478-L481 HydrophobicContact CB-CD1 4Å; P478-L481 HydrophobicContact CG-CD1 4.01Å; P478-L481 WeakPolarHBondContact O-CB 3.18Å; P478-L481 PolarHBondContact O-N 3.37Å; P478-L481 VanDerWaalsContact O-N 3.16Å
479	G	79.1	Confident	85.7	Confident	57 Å²	57	33.7 Å²	33.7	59%	0.588	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.8	136.5	177.9	0	0	0	0	0	112.3	L481	G479-L481 VanDerWaalsContact C-N 3.32Å
480	G	73.8	Confident	85.3	Confident	43 Å²	43	31.5 Å²	31.5	44%	0.443	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	84.5	-5.5	-178.6	0	0	0	0	0	115.3	P478	P478-G480 PolarHBondContact O-N 3.22Å
481	L	77.7	Confident	85.1	Confident	0 Å²	0	31.8 Å²	31.8	0%	0	20%	0.202	C	C	.	.			trans	-105.1	1.6	-177.8	-69.7	178.2	0	0	0	115.3	L335 K338 L339 I477 P478 G479 S483 Q484 L485	L335-L481 HydrophobicContact CD1-CD2 3.28Å; L335-L481 HydrophobicContact CD1-CG 4.21Å; L335-L481 HydrophobicContact CG-CD2 3.92Å; K338-L481 HydrophobicContact CB-CD1 3.83Å; L339-L481 HydrophobicContact CB-CD1 4.4Å; L339-L481 HydrophobicContact CD1-CD1 4.48Å; L339-L481 HydrophobicContact CD1-CD2 4.5Å; I477-L481 HydrophobicContact CG2-CB 4.17Å; P478-L481 HydrophobicContact CB-CD1 4Å; P478-L481 HydrophobicContact CG-CD1 4.01Å; P478-L481 WeakPolarHBondContact O-CB 3.18Å; P478-L481 PolarHBondContact O-N 3.37Å; P478-L481 VanDerWaalsContact O-N 3.16Å; G479-L481 VanDerWaalsContact C-N 3.32Å; L481-S483 VanDerWaalsContact C-N 3.25Å; L481-S483 PolarHBondContact O-N 2.95Å; L481-Q484 PolarHBondContact O-N 2.89Å; L481-L485 HydrophobicContact CB-CD1 3.75Å; L481-L485 HydrophobicContact CB-CG 4.17Å; L481-L485 HydrophobicContact CD1-CD1 3.79Å; L481-L485 HydrophobicContact CG-CD1 4.35Å; L481-L485 PolarHBondContact O-N 3.28Å
482	T	80.4	Confident	84.9	Confident	42 Å²	42	29.4 Å²	29.4	26%	0.258	19%	0.189	S	C	.	.	H	α-helix	trans	-52.5	-42.9	-179.5	-39.6	0	0	0	0	111.8	Q484 L485 Q486 D489	T482-Q484 PolarHBondContact O-N 3.4Å; T482-L485 PolarHBondContact O-N 3.01Å; T482-Q486 HydrophobicContact CG2-CB 3.33Å; T482-Q486 HydrophobicContact CG2-CG 3.65Å; T482-Q486 WeakPolarHBondContact O-CA 3.45Å; T482-Q486 WeakPolarHBondContact O-CB 3.31Å; T482-Q486 PolarHBondContact O-N 2.93Å; T482-D489 WeakPolarHBondContact CG2-OD2 3.28Å
483	S	74.6	Confident	84.4	Confident	81 Å²	81	29.9 Å²	29.9	57%	0.566	19%	0.19	S	C	*	.	H	α-helix	trans	-61.3	-16.5	178.4	67.4	0	0	0	0	115.8	L481	L481-S483 VanDerWaalsContact C-N 3.25Å; L481-S483 PolarHBondContact O-N 2.95Å
484	Q	78	Confident	83.7	Confident	75 Å²	75	35.6 Å²	35.6	35%	0.35	21%	0.214	S	C	.	.	H	α-helix	trans	-112	-35.5	-179.4	-61.4	-172.7	49.7	0	0	112.7	L481 T482 C552	L481-Q484 PolarHBondContact O-N 2.89Å; T482-Q484 PolarHBondContact O-N 3.4Å; Q484-C552 PolarHBondContact O-SG 2.98Å
485	L	84.5	Confident	83.4	Confident	1 Å²	1	35.9 Å²	35.9	1%	0.005	22%	0.219	C	C	.	.	H	α-helix	trans	-109.5	-18.7	-170.2	-62.8	-179.5	0	0	0	114	L339 Y342 I477 L481 T482 V487 C552	L339-L485 HydrophobicContact CD1-CD1 4.13Å; L339-L485 HydrophobicContact CD1-CD2 3.78Å; L339-L485 HydrophobicContact CD1-CG 4.13Å; Y342-L485 HydrophobicContact CD1-CD1 3.43Å; Y342-L485 VanDerWaalsContact CD1-CD1 3.43Å; Y342-L485 HydrophobicContact CD1-CD2 3.9Å; Y342-L485 HydrophobicContact CD1-CG 4.23Å; Y342-L485 HydrophobicContact CD2-CD1 4.18Å; Y342-L485 HydrophobicContact CE1-CB 4.36Å; Y342-L485 HydrophobicContact CE1-CD1 3.75Å; Y342-L485 HydrophobicContact CE1-CD2 3.81Å; Y342-L485 HydrophobicContact CE1-CG 4.19Å; Y342-L485 HydrophobicContact CE2-CD1 4.41Å; Y342-L485 HydrophobicContact CG-CD1 3.66Å; I477-L485 HydrophobicContact CD1-CB 4.43Å; I477-L485 HydrophobicContact CG1-CB 4.35Å; I477-L485 HydrophobicContact CG2-CB 3.88Å; I477-L485 HydrophobicContact CG2-CD1 4.21Å; L481-L485 HydrophobicContact CB-CD1 3.75Å; L481-L485 HydrophobicContact CB-CG 4.17Å; L481-L485 HydrophobicContact CD1-CD1 3.79Å; L481-L485 HydrophobicContact CG-CD1 4.35Å; L481-L485 PolarHBondContact O-N 3.28Å; T482-L485 PolarHBondContact O-N 3.01Å; L485-V487 PolarHBondContact O-N 3.46Å; L485-C552 WeakPolarHBondContact O-CB 3.35Å; L485-C552 PolarHBondContact O-SG 3.03Å
486	Q	87.8	Confident	83.1	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	22%	0.217	C	C	.	.			trans	-84.3	109.1	178.5	-175.9	65.8	-73.3	0	0	110.2	N362 D364 I477 T482 L488 D489 V490	N362-Q486 PolarHBondContact ND2-OE1 2.92Å; N362-Q486 PolarHBondContact OD1-OE1 3.11Å; D364-Q486 HydrophobicContact CB-CG 4.3Å; D364-Q486 VanDerWaalsContact CB-NE2 3.28Å; D364-Q486 WeakPolarHBondContact OD2-CG 3.36Å; D364-Q486 PolarHBondContact OD2-NE2 3.25Å; I477-Q486 HydrophobicContact CD1-CB 3.78Å; I477-Q486 HydrophobicContact CD1-CG 4.36Å; T482-Q486 HydrophobicContact CG2-CB 3.33Å; T482-Q486 HydrophobicContact CG2-CG 3.65Å; T482-Q486 WeakPolarHBondContact O-CA 3.45Å; T482-Q486 WeakPolarHBondContact O-CB 3.31Å; T482-Q486 PolarHBondContact O-N 2.93Å; Q486-L488 HydrophobicContact CG-CB 4.37Å; Q486-L488 PolarHBondContact O-N 3.32Å; Q486-L488 VanDerWaalsContact O-N 3.15Å; Q486-D489 HydrophobicContact CB-CB 4.08Å; Q486-D489 HydrophobicContact CG-CB 4.23Å; Q486-D489 PolarHBondContact O-N 2.84Å; Q486-D489 VanDerWaalsContact O-N 3.09Å; Q486-V490 WeakPolarHBondContact O-CG2 3.31Å; Q486-V490 PolarHBondContact O-N 2.83Å; Q486-V490 VanDerWaalsContact O-N 3.09Å
487	V	88.9	Confident	82.6	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-56.7	-38.7	-175.9	-178.5	0	0	0	0	110.6	N362 V386 L485 D489 V490 V491 F549 C552 I554	N362-V487 HydrophobicContact CB-CB 4.2Å; N362-V487 HydrophobicContact CB-CG2 4.15Å; N362-V487 WeakPolarHBondContact OD1-CB 3.29Å; N362-V487 PolarHBondContact OD1-N 2.67Å; V386-V487 HydrophobicContact CG2-CG1 4.27Å; L485-V487 PolarHBondContact O-N 3.46Å; V487-D489 PolarHBondContact O-N 3.37Å; V487-V490 PolarHBondContact O-N 3.46Å; V487-V491 HydrophobicContact CG1-CG2 3.81Å; V487-V491 VanDerWaalsContact O-CG2 3.28Å; V487-V491 WeakPolarHBondContact O-CG2 3.16Å; V487-V491 PolarHBondContact O-N 3.31Å; V487-F549 HydrophobicContact CB-CD2 4.49Å; V487-F549 HydrophobicContact CB-CE2 4.46Å; V487-F549 HydrophobicContact CG1-CD2 3.82Å; V487-F549 HydrophobicContact CG1-CE2 3.97Å; V487-F549 HydrophobicContact CG1-CG 4.49Å; V487-F549 HydrophobicContact CG2-CD1 4.08Å; V487-F549 HydrophobicContact CG2-CD2 4.06Å; V487-F549 HydrophobicContact CG2-CE1 4.26Å; V487-F549 HydrophobicContact CG2-CE2 4.25Å; V487-F549 HydrophobicContact CG2-CG 3.98Å; V487-F549 HydrophobicContact CG2-CZ 4.35Å; V487-C552 HydrophobicContact CG2-CB 4.12Å; V487-I554 HydrophobicContact CG2-CD1 3.73Å
488	L	87.4	Confident	82.3	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	23%	0.23	C	C	.	.	I	π-helix	trans	-63.3	-40.8	179.7	-59.5	178.8	0	0	0	113.5	N362 D364 K384 V386 Q486 V492 Y493	N362-L488 WeakPolarHBondContact OD1-CG 3.33Å; N362-L488 PolarHBondContact OD1-N 3.03Å; D364-L488 HydrophobicContact CB-CD1 3.64Å; D364-L488 VanDerWaalsContact N-CD1 3.33Å; K384-L488 HydrophobicContact CB-CD1 4.45Å; K384-L488 WeakPolarHBondContact O-CD1 3.25Å; K384-L488 WeakPolarHBondContact O-CD2 3.43Å; V386-L488 HydrophobicContact CB-CD2 4.46Å; V386-L488 HydrophobicContact CG1-CD2 3.91Å; V386-L488 HydrophobicContact CG2-CD2 3.74Å; Q486-L488 HydrophobicContact CG-CB 4.37Å; Q486-L488 PolarHBondContact O-N 3.32Å; Q486-L488 VanDerWaalsContact O-N 3.15Å; L488-V492 HydrophobicContact CB-CB 4.34Å; L488-V492 HydrophobicContact CD2-CB 3.86Å; L488-V492 HydrophobicContact CD2-CG1 4.04Å; L488-V492 HydrophobicContact CD2-CG2 3.55Å; L488-V492 CarbonylContact O-C 3.57Å; L488-V492 WeakPolarHBondContact O-CA 3.47Å; L488-V492 WeakPolarHBondContact O-CB 3.47Å; L488-V492 PolarHBondContact O-N 3.37Å; L488-Y493 HydrophobicContact CB-CD2 4.21Å; L488-Y493 HydrophobicContact CB-CE1 4.16Å; L488-Y493 HydrophobicContact CB-CE2 3.74Å; L488-Y493 PolarHBondContact O-N 3.33Å
489	D	83.2	Confident	82.4	Confident	64 Å²	64	37.7 Å²	37.7	34%	0.342	23%	0.23	S	C	.	.	I	π-helix	trans	-65.5	-41.7	174.7	-84	2.5	0	0	0	111.6	T482 Q486 V487 Y493	T482-D489 WeakPolarHBondContact CG2-OD2 3.28Å; Q486-D489 HydrophobicContact CB-CB 4.08Å; Q486-D489 HydrophobicContact CG-CB 4.23Å; Q486-D489 PolarHBondContact O-N 2.84Å; Q486-D489 VanDerWaalsContact O-N 3.09Å; V487-D489 PolarHBondContact O-N 3.37Å; D489-Y493 WeakPolarHBondContact OD1-CD2 3.39Å; D489-Y493 WeakPolarHBondContact OD1-CE2 3.43Å
490	V	82.1	Confident	82.7	Confident	36 Å²	36	35.5 Å²	35.5	22%	0.218	21%	0.205	C	C	.	.	I	π-helix	trans	-72.1	-41	-173.2	179.1	0	0	0	0	111.8	Q486 V487 K551	Q486-V490 WeakPolarHBondContact O-CG2 3.31Å; Q486-V490 PolarHBondContact O-N 2.83Å; Q486-V490 VanDerWaalsContact O-N 3.09Å; V487-V490 PolarHBondContact O-N 3.46Å; V490-K551 HydrophobicContact CG1-CD 3.76Å; V490-K551 HydrophobicContact CG1-CG 4.41Å
491	V	86	Confident	82.9	Confident	30 Å²	30	38.4 Å²	38.4	18%	0.182	20%	0.203	C	C	.	.	I	π-helix	trans	-128.3	-16	-170.7	-58.2	0	0	0	0	116.4	V487 P495	V487-V491 HydrophobicContact CG1-CG2 3.81Å; V487-V491 VanDerWaalsContact O-CG2 3.28Å; V487-V491 WeakPolarHBondContact O-CG2 3.16Å; V487-V491 PolarHBondContact O-N 3.31Å; V491-P495 VanDerWaalsContact O-CG 3.24Å; V491-P495 WeakPolarHBondContact O-CG 3.45Å
492	V	86.7	Confident	83	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	22%	0.222	C	C	.	.	I	π-helix	trans	-104.1	-54.1	-171.1	174.6	0	0	0	0	113.2	V386 L488 K494 P495 L496 W537 I540	V386-V492 HydrophobicContact CG1-CG2 4.39Å; L488-V492 HydrophobicContact CB-CB 4.34Å; L488-V492 HydrophobicContact CD2-CB 3.86Å; L488-V492 HydrophobicContact CD2-CG1 4.04Å; L488-V492 HydrophobicContact CD2-CG2 3.55Å; L488-V492 CarbonylContact O-C 3.57Å; L488-V492 WeakPolarHBondContact O-CA 3.47Å; L488-V492 WeakPolarHBondContact O-CB 3.47Å; L488-V492 PolarHBondContact O-N 3.37Å; V492-K494 PolarHBondContact O-N 3.25Å; V492-P495 WeakPolarHBondContact O-CD 3.43Å; V492-P495 VanDerWaalsContact O-CG 3.27Å; V492-P495 WeakPolarHBondContact O-CG 3.39Å; V492-L496 WeakPolarHBondContact O-CB 3.48Å; V492-L496 PolarHBondContact O-N 3.07Å; V492-L496 VanDerWaalsContact O-N 3.12Å; V492-W537 HydrophobicContact CG1-CE3 4.28Å; V492-W537 HydrophobicContact CG1-CZ3 3.61Å; V492-I540 HydrophobicContact CB-CD1 4.3Å; V492-I540 HydrophobicContact CG1-CD1 3.54Å
493	Y	83.5	Confident	83.3	Confident	16 Å²	16	40.6 Å²	40.6	6%	0.063	22%	0.218	C	C	.	.	H	α-helix	trans	-68.3	-36	-165.1	-69.1	-36.4	0	0	0	113.9	D364 T366 K384 L488 D489 L496 N497	D364-Y493 WeakPolarHBondContact CB-OH 3.37Å; D364-Y493 PolarHBondContact O-OH 3.22Å; T366-Y493 VanDerWaalsContact CB-CE1 3.48Å; T366-Y493 HydrophobicContact CG2-CD1 3.65Å; T366-Y493 HydrophobicContact CG2-CE1 3.19Å; T366-Y493 PolarHBondContact N-OH 3.22Å; K384-Y493 HydrophobicContact CB-CE1 4.36Å; K384-Y493 HydrophobicContact CD-CE1 4.33Å; L488-Y493 HydrophobicContact CB-CD2 4.21Å; L488-Y493 HydrophobicContact CB-CE1 4.16Å; L488-Y493 HydrophobicContact CB-CE2 3.74Å; L488-Y493 PolarHBondContact O-N 3.33Å; D489-Y493 WeakPolarHBondContact OD1-CD2 3.39Å; D489-Y493 WeakPolarHBondContact OD1-CE2 3.43Å; Y493-L496 HydrophobicContact CD1-CD2 4.2Å; Y493-N497 WeakPolarHBondContact O-CB 3.34Å; Y493-N497 PolarHBondContact O-N 2.87Å; Y493-N497 PolarHBondContact O-ND2 3.08Å
494	K	79.4	Confident	83.6	Confident	150 Å²	150	37.2 Å²	37.2	65%	0.652	19%	0.193	S	C	*	.	H	α-helix	trans	-59.9	-59.8	176.2	179.6	171.7	-176	161.6	0	112.9	V492 L496 N497 D498	V492-K494 PolarHBondContact O-N 3.25Å; K494-L496 VanDerWaalsContact C-N 3.28Å; K494-L496 PolarHBondContact O-N 3.3Å; K494-N497 PolarHBondContact O-N 3.22Å; K494-D498 WeakPolarHBondContact O-CB 3.44Å; K494-D498 PolarHBondContact O-N 2.91Å
495	P	84.3	Confident	83.5	Confident	56 Å²	56	34.6 Å²	34.6	36%	0.364	18%	0.183	S	C	.	.	H	α-helix	trans	-62.7	-35.5	-179.7	22.4	-32.3	0	0	0	112.7	V491 V492 S499	V491-P495 VanDerWaalsContact O-CG 3.24Å; V491-P495 WeakPolarHBondContact O-CG 3.45Å; V492-P495 WeakPolarHBondContact O-CD 3.43Å; V492-P495 VanDerWaalsContact O-CG 3.27Å; V492-P495 WeakPolarHBondContact O-CG 3.39Å; P495-S499 WeakPolarHBondContact O-CB 3.27Å; P495-S499 PolarHBondContact O-N 3.13Å
496	L	85.8	Confident	83.4	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-57.5	-56.5	172.9	176	91.4	0	0	0	111.6	K384 V492 Y493 K494 D498 S499 V500 A536 W537 I540	K384-L496 HydrophobicContact CD-CD1 4.3Å; K384-L496 HydrophobicContact CD-CD2 3.9Å; V492-L496 WeakPolarHBondContact O-CB 3.48Å; V492-L496 PolarHBondContact O-N 3.07Å; V492-L496 VanDerWaalsContact O-N 3.12Å; Y493-L496 HydrophobicContact CD1-CD2 4.2Å; K494-L496 VanDerWaalsContact C-N 3.28Å; K494-L496 PolarHBondContact O-N 3.3Å; L496-D498 VanDerWaalsContact C-N 3.3Å; L496-D498 PolarHBondContact O-N 2.87Å; L496-S499 WeakPolarHBondContact O-CB 3.4Å; L496-S499 PolarHBondContact O-N 2.83Å; L496-S499 VanDerWaalsContact O-N 3.16Å; L496-V500 PolarHBondContact O-N 3.21Å; L496-A536 HydrophobicContact CD1-CB 3.77Å; L496-A536 HydrophobicContact CG-CB 4.39Å; L496-W537 HydrophobicContact CD1-CB 4.44Å; L496-I540 HydrophobicContact CB-CD1 4.13Å; L496-I540 HydrophobicContact CD1-CD1 4.38Å
497	N	80.9	Confident	83.1	Confident	43 Å²	43	41.2 Å²	41.2	23%	0.23	22%	0.216	C	C	.	.	H	α-helix	trans	-65.7	-35.8	-176.3	-72.6	-25.6	0	0	0	111.4	Y493 K494 S499 R501	Y493-N497 WeakPolarHBondContact O-CB 3.34Å; Y493-N497 PolarHBondContact O-N 2.87Å; Y493-N497 PolarHBondContact O-ND2 3.08Å; K494-N497 PolarHBondContact O-N 3.22Å; N497-S499 VanDerWaalsContact C-N 3.35Å; N497-R501 VanDerWaalsContact CB-NH2 3.31Å; N497-R501 VanDerWaalsContact O-CB 3.26Å; N497-R501 WeakPolarHBondContact O-CB 3.06Å; N497-R501 VanDerWaalsContact O-CG 3.26Å; N497-R501 WeakPolarHBondContact O-CG 3.43Å; N497-R501 PolarHBondContact O-N 3.29Å; N497-R501 PolarHBondContact O-NE 3.13Å
498	D	79.7	Confident	82.5	Confident	69 Å²	69	41.9 Å²	41.9	37%	0.369	22%	0.219	S	C	.	.	H	α-helix	trans	-63.3	-40.9	174	-69.9	-8.1	0	0	0	111.5	K494 L496 R501 A502	K494-D498 WeakPolarHBondContact O-CB 3.44Å; K494-D498 PolarHBondContact O-N 2.91Å; L496-D498 VanDerWaalsContact C-N 3.3Å; L496-D498 PolarHBondContact O-N 2.87Å; D498-R501 IonicContact OD1-CZ 3.96Å; D498-R501 VanDerWaalsContact OD1-CZ 3.28Å; D498-R501 IonicContact OD1-NH1 3.09Å; D498-R501 PolarHBondContact OD1-NH1 3.37Å; D498-R501 IonicContact OD1-NH2 2.81Å; D498-R501 PolarHBondContact OD1-NH2 3.34Å; D498-R501 VanDerWaalsContact OD1-NH2 3.07Å; D498-A502 WeakPolarHBondContact O-CB 3.46Å; D498-A502 PolarHBondContact O-N 3.19Å
499	S	87.6	Confident	81.7	Confident	29 Å²	29	44.5 Å²	44.5	20%	0.203	23%	0.233	C	C	.	.	H	α-helix	trans	-67.2	-47.2	177.1	-178.3	0	0	0	0	112.7	P495 L496 N497 R501 A502 Q503	P495-S499 WeakPolarHBondContact O-CB 3.27Å; P495-S499 PolarHBondContact O-N 3.13Å; L496-S499 WeakPolarHBondContact O-CB 3.4Å; L496-S499 PolarHBondContact O-N 2.83Å; L496-S499 VanDerWaalsContact O-N 3.16Å; N497-S499 VanDerWaalsContact C-N 3.35Å; S499-R501 VanDerWaalsContact C-N 3.34Å; S499-R501 PolarHBondContact O-N 2.94Å; S499-A502 PolarHBondContact O-N 3.48Å; S499-Q503 WeakPolarHBondContact O-CG 3.02Å; S499-Q503 PolarHBondContact O-N 3.26Å
500	V	83.8	Confident	81.5	Confident	10 Å²	10	45.1 Å²	45.1	6%	0.061	25%	0.247	C	C	.	.	H	α-helix	trans	-61.2	-44.2	176	175.7	0	0	0	0	110.6	L496 A502 Q503 Y504 F529 V533 A536	L496-V500 PolarHBondContact O-N 3.21Å; V500-A502 VanDerWaalsContact C-N 3.32Å; V500-A502 PolarHBondContact O-N 3.21Å; V500-Q503 PolarHBondContact O-N 3.1Å; V500-Y504 PolarHBondContact O-N 3.34Å; V500-F529 HydrophobicContact CG1-CE2 3.94Å; V500-F529 HydrophobicContact CG1-CZ 4.4Å; V500-V533 HydrophobicContact CG2-CG2 4.3Å; V500-A536 HydrophobicContact CG2-CB 3.76Å
501	R	78.2	Confident	80.7	Confident	105 Å²	105	46.4 Å²	46.4	40%	0.396	27%	0.268	S	S	.	.	H	α-helix	trans	-60.8	-40	175.8	-78	-173.1	-105.6	106.3	-1.2	112.1	N497 D498 S499 S505	N497-R501 VanDerWaalsContact CB-NH2 3.31Å; N497-R501 VanDerWaalsContact O-CB 3.26Å; N497-R501 WeakPolarHBondContact O-CB 3.06Å; N497-R501 VanDerWaalsContact O-CG 3.26Å; N497-R501 WeakPolarHBondContact O-CG 3.43Å; N497-R501 PolarHBondContact O-N 3.29Å; N497-R501 PolarHBondContact O-NE 3.13Å; D498-R501 IonicContact OD1-CZ 3.96Å; D498-R501 VanDerWaalsContact OD1-CZ 3.28Å; D498-R501 IonicContact OD1-NH1 3.09Å; D498-R501 PolarHBondContact OD1-NH1 3.37Å; D498-R501 IonicContact OD1-NH2 2.81Å; D498-R501 PolarHBondContact OD1-NH2 3.34Å; D498-R501 VanDerWaalsContact OD1-NH2 3.07Å; S499-R501 VanDerWaalsContact C-N 3.34Å; S499-R501 PolarHBondContact O-N 2.94Å; R501-S505 VanDerWaalsContact O-CB 3.27Å; R501-S505 WeakPolarHBondContact O-CB 2.95Å; R501-S505 PolarHBondContact O-N 3.43Å; R501-S505 PolarHBondContact O-OG 3.1Å
502	A	80.4	Confident	79.9	Confident	48 Å²	48	48.3 Å²	48.3	40%	0.397	28%	0.277	S	S	.	.	H	α-helix	trans	-64.8	-41.5	176.2	0	0	0	0	0	112.3	D498 S499 V500 S505 N506	D498-A502 WeakPolarHBondContact O-CB 3.46Å; D498-A502 PolarHBondContact O-N 3.19Å; S499-A502 PolarHBondContact O-N 3.48Å; V500-A502 VanDerWaalsContact C-N 3.32Å; V500-A502 PolarHBondContact O-N 3.21Å; A502-S505 WeakPolarHBondContact O-CB 3.28Å; A502-S505 PolarHBondContact O-N 3.33Å; A502-N506 VanDerWaalsContact O-CG 3.26Å; A502-N506 PolarHBondContact O-N 3.03Å; A502-N506 PolarHBondContact O-ND2 3.28Å
503	Q	86	Confident	78.7	Confident	39 Å²	39	52.2 Å²	52.2	18%	0.182	30%	0.297	C	S	.	.	H	α-helix	trans	-65.6	-45.8	177.1	-70.2	-174.1	79.4	0	0	111.9	S499 V500 S505 N506 W507 W532	S499-Q503 WeakPolarHBondContact O-CG 3.02Å; S499-Q503 PolarHBondContact O-N 3.26Å; V500-Q503 PolarHBondContact O-N 3.1Å; Q503-S505 VanDerWaalsContact C-N 3.32Å; Q503-S505 PolarHBondContact O-N 2.91Å; Q503-N506 PolarHBondContact O-N 2.9Å; Q503-W507 WeakPolarHBondContact O-CB 3.5Å; Q503-W507 PolarHBondContact O-N 2.93Å; Q503-W532 HydrophobicContact CB-CB 4.12Å; Q503-W532 HydrophobicContact CB-CD2 3.73Å; Q503-W532 HydrophobicContact CB-CE3 4.21Å; Q503-W532 HydrophobicContact CB-CG 3.69Å; Q503-W532 HydrophobicContact CG-CB 4.49Å; Q503-W532 HydrophobicContact CG-CG 4.28Å; Q503-W532 PolarHBondContact NE2-O 2.91Å; Q503-W532 VanDerWaalsContact NE2-O 3.09Å; Q503-W532 VanDerWaalsContact OE1-CG 3.32Å
504	Y	81.2	Confident	77.3	Confident	10 Å²	10	53.5 Å²	53.5	4%	0.039	31%	0.312	C	S	.	.	H	α-helix	trans	-57.7	-45.8	173.5	180	-109.6	0	0	0	111.7	V372 V500 N506 W507 L508 P524 W532	V372-Y504 WeakPolarHBondContact O-CD1 3.22Å; V372-Y504 WeakPolarHBondContact O-CE1 3.29Å; V500-Y504 PolarHBondContact O-N 3.34Å; Y504-N506 PolarHBondContact O-N 3.34Å; Y504-W507 HydrophobicContact CD2-CE3 4.26Å; Y504-W507 HydrophobicContact CE2-CE3 4.18Å; Y504-W507 HydrophobicContact CE2-CZ3 4.21Å; Y504-W507 WeakPolarHBondContact O-CB 3.33Å; Y504-W507 PolarHBondContact O-N 2.76Å; Y504-W507 VanDerWaalsContact O-N 3.16Å; Y504-L508 HydrophobicContact CD1-CD1 3.84Å; Y504-L508 HydrophobicContact CD1-CG 4.32Å; Y504-L508 HydrophobicContact CE1-CD1 3.35Å; Y504-L508 HydrophobicContact CE1-CD2 4.36Å; Y504-L508 HydrophobicContact CE1-CG 4Å; Y504-L508 HydrophobicContact CE2-CD1 4.47Å; Y504-L508 HydrophobicContact CE2-CD2 4.11Å; Y504-L508 HydrophobicContact CE2-CG 4.28Å; Y504-L508 WeakPolarHBondContact O-CG 3.23Å; Y504-L508 PolarHBondContact O-N 3.34Å; Y504-P524 HydrophobicContact CD2-CG 4.4Å; Y504-W532 HydrophobicContact CD2-CH2 4.31Å; Y504-W532 AromaticContact CD2-CZ3 3.9Å; Y504-W532 HydrophobicContact CD2-CZ3 3.9Å; Y504-W532 HydrophobicContact CG-CZ3 4.39Å
505	S	76.1	Confident	76.1	Confident	20 Å²	20	52.1 Å²	52.1	14%	0.14	31%	0.311	C	S	.	.	H	α-helix	trans	-59	-45.2	177.6	-61.9	0	0	0	0	112.5	E283 R501 A502 Q503 W507 L508 L509	E283-S505 WeakPolarHBondContact CG-OG 3.29Å; R501-S505 VanDerWaalsContact O-CB 3.27Å; R501-S505 WeakPolarHBondContact O-CB 2.95Å; R501-S505 PolarHBondContact O-N 3.43Å; R501-S505 PolarHBondContact O-OG 3.1Å; A502-S505 WeakPolarHBondContact O-CB 3.28Å; A502-S505 PolarHBondContact O-N 3.33Å; Q503-S505 VanDerWaalsContact C-N 3.32Å; Q503-S505 PolarHBondContact O-N 2.91Å; S505-W507 VanDerWaalsContact C-N 3.33Å; S505-L508 PolarHBondContact O-N 2.88Å; S505-L509 WeakPolarHBondContact O-CB 3.45Å; S505-L509 VanDerWaalsContact O-CG 3.27Å; S505-L509 WeakPolarHBondContact O-CG 3.44Å; S505-L509 PolarHBondContact O-N 3.16Å
506	N	82.2	Confident	74.6	Confident	107 Å²	107	51 Å²	51	57%	0.572	30%	0.304	S	S	*	.	H	α-helix	trans	-64	-40.4	176.4	-71.7	-28.4	0	0	0	111.8	A502 Q503 Y504 L509 A510	A502-N506 VanDerWaalsContact O-CG 3.26Å; A502-N506 PolarHBondContact O-N 3.03Å; A502-N506 PolarHBondContact O-ND2 3.28Å; Q503-N506 PolarHBondContact O-N 2.9Å; Y504-N506 PolarHBondContact O-N 3.34Å; N506-L509 PolarHBondContact O-N 3.41Å; N506-A510 PolarHBondContact O-N 3.02Å
507	W	82.6	Confident	72.3	Confident	34 Å²	34	57.9 Å²	57.9	13%	0.129	35%	0.349	C	S	.	.	H	α-helix	trans	-62.8	-42.3	176.8	179.3	81.6	0	0	0	112.2	Q503 Y504 S505 A510 N512 K522 P524 W532	Q503-W507 WeakPolarHBondContact O-CB 3.5Å; Q503-W507 PolarHBondContact O-N 2.93Å; Y504-W507 HydrophobicContact CD2-CE3 4.26Å; Y504-W507 HydrophobicContact CE2-CE3 4.18Å; Y504-W507 HydrophobicContact CE2-CZ3 4.21Å; Y504-W507 WeakPolarHBondContact O-CB 3.33Å; Y504-W507 PolarHBondContact O-N 2.76Å; Y504-W507 VanDerWaalsContact O-N 3.16Å; S505-W507 VanDerWaalsContact C-N 3.33Å; W507-A510 PolarHBondContact O-N 3.39Å; W507-N512 HydrophobicContact CD2-CB 3.86Å; W507-N512 VanDerWaalsContact CE2-CB 3.48Å; W507-N512 HydrophobicContact CE3-CB 4.26Å; W507-N512 HydrophobicContact CG-CB 4.44Å; W507-N512 HydrophobicContact CH2-CB 3.98Å; W507-N512 HydrophobicContact CZ2-CB 3.55Å; W507-N512 HydrophobicContact CZ3-CB 4.31Å; W507-N512 PolarHBondContact NE1-ND2 2.98Å; W507-N512 WeakPolarHBondContact O-CB 3.19Å; W507-N512 PolarHBondContact O-ND2 2.74Å; W507-K522 WeakPolarHBondContact CH2-O 3.41Å; W507-K522 WeakPolarHBondContact CZ3-O 3.41Å; W507-P524 HydrophobicContact CD2-CB 4.45Å; W507-P524 HydrophobicContact CE3-CB 4.5Å; W507-P524 HydrophobicContact CH2-CB 4.38Å; W507-P524 HydrophobicContact CZ2-CB 4.31Å; W507-P524 HydrophobicContact CZ3-CB 4.47Å; W507-W532 HydrophobicContact CB-CH2 3.47Å; W507-W532 VanDerWaalsContact CB-CH2 3.47Å; W507-W532 HydrophobicContact CB-CZ2 3.51Å; W507-W532 AromaticContact CD1-CZ2 3.86Å; W507-W532 AromaticContact CD2-CH2 3.96Å; W507-W532 HydrophobicContact CD2-CH2 3.96Å; W507-W532 HydrophobicContact CD2-CZ2 4.46Å; W507-W532 HydrophobicContact CE3-CH2 4.37Å; W507-W532 AromaticContact CG-CH2 3.56Å; W507-W532 HydrophobicContact CG-CH2 3.56Å; W507-W532 AromaticContact CG-CZ2 3.66Å; W507-W532 HydrophobicContact CG-CZ2 3.66Å
508	L	74.6	Confident	70.5	Confident	13 Å²	13	61.1 Å²	61.1	7%	0.068	37%	0.37	C	S	.	.	I	π-helix	trans	-63.2	-47.3	173.7	-65.9	177.2	0	0	0	111.5	L287 Y504 S505 A510 G511 L513	L287-L508 HydrophobicContact CD1-CB 4.07Å; L287-L508 HydrophobicContact CD1-CD1 4.17Å; L287-L508 HydrophobicContact CD2-CB 4.46Å; Y504-L508 HydrophobicContact CD1-CD1 3.84Å; Y504-L508 HydrophobicContact CD1-CG 4.32Å; Y504-L508 HydrophobicContact CE1-CD1 3.35Å; Y504-L508 HydrophobicContact CE1-CD2 4.36Å; Y504-L508 HydrophobicContact CE1-CG 4Å; Y504-L508 HydrophobicContact CE2-CD1 4.47Å; Y504-L508 HydrophobicContact CE2-CD2 4.11Å; Y504-L508 HydrophobicContact CE2-CG 4.28Å; Y504-L508 WeakPolarHBondContact O-CG 3.23Å; Y504-L508 PolarHBondContact O-N 3.34Å; S505-L508 PolarHBondContact O-N 2.88Å; L508-A510 PolarHBondContact O-N 3.39Å; L508-G511 PolarHBondContact O-N 2.91Å; L508-G511 VanDerWaalsContact O-N 3.07Å; L508-L513 HydrophobicContact CB-CD1 3.87Å; L508-L513 HydrophobicContact CD1-CD1 4.43Å; L508-L513 HydrophobicContact CD2-CD1 3.56Å; L508-L513 HydrophobicContact CG-CD1 4.14Å
509	L	70.9	Confident	68.8	Low	56 Å²	56	60 Å²	60	29%	0.293	38%	0.376	S	S	.	.	I	π-helix	trans	-65.1	-19.5	-179.4	-71.3	173.7	0	0	0	113.5	Q286 L287 S505 N506 G511	Q286-L509 HydrophobicContact CB-CD2 3.91Å; L287-L509 HydrophobicContact CD2-CD2 4.02Å; L287-L509 HydrophobicContact CG-CD2 4.15Å; S505-L509 WeakPolarHBondContact O-CB 3.45Å; S505-L509 VanDerWaalsContact O-CG 3.27Å; S505-L509 WeakPolarHBondContact O-CG 3.44Å; S505-L509 PolarHBondContact O-N 3.16Å; N506-L509 PolarHBondContact O-N 3.41Å; L509-G511 PolarHBondContact O-N 2.9Å
510	A	78.9	Confident	67.1	Low	76 Å²	76	63.4 Å²	63.4	63%	0.628	39%	0.391	S	S	*	.	I	π-helix	trans	-75.3	5.5	173.3	0	0	0	0	0	113.7	N506 W507 L508	N506-A510 PolarHBondContact O-N 3.02Å; W507-A510 PolarHBondContact O-N 3.39Å; L508-A510 PolarHBondContact O-N 3.39Å
511	G	66.9	Low	65.9	Low	64 Å²	64	65.1 Å²	65.1	66%	0.66	41%	0.407	S	S	*	.	I	π-helix	trans	88.6	12.6	177.5	0	0	0	0	0	114	L508 L509 L513	L508-G511 PolarHBondContact O-N 2.91Å; L508-G511 VanDerWaalsContact O-N 3.07Å; L509-G511 PolarHBondContact O-N 2.9Å; G511-L513 PolarHBondContact O-N 3.32Å; G511-L513 VanDerWaalsContact O-N 3.16Å
512	N	68.1	Low	65.1	Low	69 Å²	69	65.8 Å²	65.8	37%	0.369	41%	0.412	S	S	.	.	I	π-helix	trans	-79.3	14.2	176.4	-60.8	-59.6	0	0	0	113.4	W507 A514	W507-N512 HydrophobicContact CD2-CB 3.86Å; W507-N512 VanDerWaalsContact CE2-CB 3.48Å; W507-N512 HydrophobicContact CE3-CB 4.26Å; W507-N512 HydrophobicContact CG-CB 4.44Å; W507-N512 HydrophobicContact CH2-CB 3.98Å; W507-N512 HydrophobicContact CZ2-CB 3.55Å; W507-N512 HydrophobicContact CZ3-CB 4.31Å; W507-N512 PolarHBondContact NE1-ND2 2.98Å; W507-N512 WeakPolarHBondContact O-CB 3.19Å; W507-N512 PolarHBondContact O-ND2 2.74Å; N512-A514 PolarHBondContact O-N 3.36Å
513	L	62.2	Low	64.8	Low	82 Å²	82	68.7 Å²	68.7	43%	0.429	42%	0.416	S	S	.	.			trans	-74.8	70.5	174.3	-132.1	99.1	0	0	0	110.3	L287 L508 G511	L287-L513 HydrophobicContact CD1-CD1 3.44Å; L287-L513 VanDerWaalsContact CD1-CD1 3.44Å; L287-L513 HydrophobicContact CD2-CD1 3.78Å; L287-L513 HydrophobicContact CG-CD1 4.16Å; L508-L513 HydrophobicContact CB-CD1 3.87Å; L508-L513 HydrophobicContact CD1-CD1 4.43Å; L508-L513 HydrophobicContact CD2-CD1 3.56Å; L508-L513 HydrophobicContact CG-CD1 4.14Å; G511-L513 PolarHBondContact O-N 3.32Å; G511-L513 VanDerWaalsContact O-N 3.16Å
514	A	52.9	Low	64.5	Low	44 Å²	44	67 Å²	67	36%	0.364	41%	0.409	S	S	.	.	P	Polyproline II helix	trans	-83.9	128.9	160.4	0	0	0	0	0	107.5	N512 K522	N512-A514 PolarHBondContact O-N 3.36Å; A514-K522 HydrophobicContact CB-CB 4.23Å; A514-K522 HydrophobicContact CB-CD 3.8Å; A514-K522 WeakPolarHBondContact O-CB 3.47Å; A514-K522 PolarHBondContact O-N 3.34Å
515	L	55.8	Low	64.6	Low	120 Å²	120	70.3 Å²	70.3	63%	0.628	43%	0.431	S	S	*	.	B	Isolated β-bridge	trans	-70.8	138.1	159.3	-64	171.4	0	0	0	106.8	N520	L515-N520 CarbonylContact C-O 3.53Å; L515-N520 WeakPolarHBondContact CA-O 3.41Å
516	S	52.7	Low	65.1	Low	33 Å²	33	71.3 Å²	71.3	23%	0.231	44%	0.435	C	S	.	.	P	Polyproline II helix	trans	-57.5	161.5	165.2	65.3	0	0	0	0	108.9	T518 G519 N520	S516-T518 PolarHBondContact O-N 3.11Å; S516-T518 PolarHBondContact OG-N 3.16Å; S516-T518 PolarHBondContact OG-OG1 2.62Å; S516-G519 PolarHBondContact O-N 2.54Å; S516-G519 PolarHBondContact OG-N 2.97Å; S516-N520 PolarHBondContact N-O 3.32Å; S516-N520 PolarHBondContact OG-N 3.09Å; S516-N520 PolarHBondContact OG-O 3.46Å
517	P	37.5	Very low	65.4	Low	144 Å²	144	67.2 Å²	67.2	94%	0.935	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.6	-21.8	171.5	-26.2	35	0	0	0	113.6
518	T	41.7	Very low	65.7	Low	111 Å²	111	68 Å²	68	68%	0.681	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.2	2.7	177.9	54.1	0	0	0	0	114.8	S516	S516-T518 PolarHBondContact O-N 3.11Å; S516-T518 PolarHBondContact OG-N 3.16Å; S516-T518 PolarHBondContact OG-OG1 2.62Å
519	G	44.4	Very low	66.3	Low	47 Å²	47	67.6 Å²	67.6	49%	0.485	42%	0.422	S	S	.	.	S	Bend	trans	86.5	7.1	176.1	0	0	0	0	0	116.2	S516	S516-G519 PolarHBondContact O-N 2.54Å; S516-G519 PolarHBondContact OG-N 2.97Å
520	N	51.4	Low	67.2	Low	100 Å²	100	65 Å²	65	54%	0.535	41%	0.408	S	S	.	.	P	Polyproline II helix	trans	-88.4	151.3	176.8	-66.3	-29.3	0	0	0	111.3	L515 S516 K522	L515-N520 CarbonylContact C-O 3.53Å; L515-N520 WeakPolarHBondContact CA-O 3.41Å; S516-N520 PolarHBondContact N-O 3.32Å; S516-N520 PolarHBondContact OG-N 3.09Å; S516-N520 PolarHBondContact OG-O 3.46Å; N520-K522 PolarHBondContact O-N 3.2Å
521	A	58.9	Low	67.9	Low	46 Å²	46	66.4 Å²	66.4	38%	0.38	40%	0.402	S	S	.	.	B	Isolated β-bridge	trans	-60.8	129.2	173.1	0	0	0	0	0	110.2	K523	A521-K523 PolarHBondContact O-N 3.03Å
522	K	61.8	Low	69.1	Low	118 Å²	118	64.2 Å²	64.2	51%	0.513	37%	0.374	S	S	.	.	P	Polyproline II helix	trans	-62.2	124.5	176.8	-177.1	172.7	-178.2	179.1	0	110.3	W507 A514 N520	W507-K522 WeakPolarHBondContact CH2-O 3.41Å; W507-K522 WeakPolarHBondContact CZ3-O 3.41Å; A514-K522 HydrophobicContact CB-CB 4.23Å; A514-K522 HydrophobicContact CB-CD 3.8Å; A514-K522 WeakPolarHBondContact O-CB 3.47Å; A514-K522 PolarHBondContact O-N 3.34Å; N520-K522 PolarHBondContact O-N 3.2Å
523	K	73.4	Confident	70.2	Confident	109 Å²	109	61 Å²	61	47%	0.474	36%	0.356	S	S	.	.	P	Polyproline II helix	trans	-65.1	146.1	171.9	-65.3	-178.3	-177.9	-177.6	0	110.5	L370 E371 A521	L370-K523 HydrophobicContact CB-CD 4.27Å; E371-K523 HydrophobicContact CG-CD 4.17Å; E371-K523 HydrophobicContact CG-CG 3.7Å; E371-K523 WeakPolarHBondContact OE1-CE 3.35Å; E371-K523 WeakPolarHBondContact OE1-CG 3.17Å; E371-K523 IonicContact OE1-NZ 3.08Å; A521-K523 PolarHBondContact O-N 3.03Å
524	P	79.3	Confident	71.6	Confident	5 Å²	5	58 Å²	58	3%	0.032	34%	0.34	C	S	.	.	P	Polyproline II helix	trans	-62.7	148.7	169.2	29.5	-34.4	0	0	0	109.3	L370 Y504 W507 L526 F529 W532	L370-P524 WeakPolarHBondContact O-CD 3.37Å; Y504-P524 HydrophobicContact CD2-CG 4.4Å; W507-P524 HydrophobicContact CD2-CB 4.45Å; W507-P524 HydrophobicContact CE3-CB 4.5Å; W507-P524 HydrophobicContact CH2-CB 4.38Å; W507-P524 HydrophobicContact CZ2-CB 4.31Å; W507-P524 HydrophobicContact CZ3-CB 4.47Å; P524-L526 PolarHBondContact O-N 2.91Å; P524-F529 HydrophobicContact CG-CB 4.2Å; P524-F529 HydrophobicContact CG-CD2 4.07Å; P524-W532 HydrophobicContact CB-CH2 3.71Å; P524-W532 HydrophobicContact CB-CZ3 3.89Å; P524-W532 HydrophobicContact CG-CH2 4.17Å; P524-W532 HydrophobicContact CG-CZ3 3.84Å
525	P	84.6	Confident	73.5	Confident	79 Å²	79	59.2 Å²	59.2	51%	0.513	34%	0.343	S	S	.	.	P	Polyproline II helix	trans	-52.9	137.4	169.9	-24.6	34.1	0	0	0	110.7	G527 L528 F529	P525-G527 VanDerWaalsContact C-N 3.28Å; P525-G527 PolarHBondContact O-N 3.47Å; P525-L528 HydrophobicContact CB-CB 4.38Å; P525-L528 WeakPolarHBondContact O-CB 3.22Å; P525-L528 PolarHBondContact O-N 3.15Å; P525-F529 PolarHBondContact O-N 3.4Å
526	L	85.6	Confident	75.2	Confident	41 Å²	41	53.5 Å²	53.5	22%	0.215	31%	0.313	C	S	.	.	H	α-helix	trans	-54.9	-42.1	-174.2	179.5	62	0	0	0	112.8	L370 L399 P405 F409 P524 L528 F529 L530	L370-L526 HydrophobicContact CD2-CD1 4.33Å; L399-L526 HydrophobicContact CD1-CD2 3.8Å; L399-L526 HydrophobicContact CD2-CD1 3.95Å; L399-L526 HydrophobicContact CD2-CD2 4.29Å; P405-L526 HydrophobicContact CG-CD2 4.23Å; F409-L526 HydrophobicContact CE1-CD2 3.91Å; F409-L526 HydrophobicContact CE1-CG 4.03Å; F409-L526 HydrophobicContact CZ-CD2 4.25Å; P524-L526 PolarHBondContact O-N 2.91Å; L526-L528 VanDerWaalsContact C-N 3.33Å; L526-L528 PolarHBondContact O-N 3.41Å; L526-F529 WeakPolarHBondContact O-CB 3.31Å; L526-F529 PolarHBondContact O-N 2.94Å; L526-L530 HydrophobicContact CD1-CD1 4.26Å; L526-L530 HydrophobicContact CD1-CG 4.15Å; L526-L530 HydrophobicContact CG-CD1 4.15Å; L526-L530 HydrophobicContact CG-CG 4.42Å; L526-L530 WeakPolarHBondContact O-CG 3.39Å; L526-L530 PolarHBondContact O-N 3.17Å
527	G	88.2	Confident	77.1	Confident	20 Å²	20	52.2 Å²	52.2	21%	0.206	30%	0.303	C	S	.	.	H	α-helix	trans	-60.1	-40.5	176.9	0	0	0	0	0	113.4	P525 L530 E531	P525-G527 VanDerWaalsContact C-N 3.28Å; P525-G527 PolarHBondContact O-N 3.47Å; G527-L530 PolarHBondContact O-N 3.36Å; G527-E531 PolarHBondContact O-N 3.11Å
528	L	89.6	Confident	79.8	Confident	50 Å²	50	50.1 Å²	50.1	26%	0.262	28%	0.284	S	S	.	.	H	α-helix	trans	-67.6	-39.6	176.3	178.9	63.4	0	0	0	111.3	P525 L526 E531 W532	P525-L528 HydrophobicContact CB-CB 4.38Å; P525-L528 WeakPolarHBondContact O-CB 3.22Å; P525-L528 PolarHBondContact O-N 3.15Å; L526-L528 VanDerWaalsContact C-N 3.33Å; L526-L528 PolarHBondContact O-N 3.41Å; L528-E531 WeakPolarHBondContact O-CB 3.37Å; L528-E531 PolarHBondContact O-N 3.42Å; L528-W532 HydrophobicContact CD1-CZ2 4.27Å; L528-W532 HydrophobicContact CD2-CH2 4.33Å; L528-W532 HydrophobicContact CD2-CZ2 3.65Å; L528-W532 HydrophobicContact CG-CH2 4.49Å; L528-W532 HydrophobicContact CG-CZ2 3.68Å; L528-W532 VanDerWaalsContact O-CD1 3.31Å; L528-W532 PolarHBondContact O-N 3.25Å
529	F	88	Confident	82.3	Confident	5 Å²	5	48.4 Å²	48.4	2%	0.022	28%	0.277	C	S	.	.	H	α-helix	trans	-64	-45.2	176.6	-177.4	-104	0	0	0	112.4	I368 C369 L370 V500 P524 P525 L526 E531 W532 V533	I368-F529 HydrophobicContact CG2-CE1 3.93Å; I368-F529 HydrophobicContact CG2-CZ 3.63Å; C369-F529 WeakPolarHBondContact O-CE2 3.48Å; C369-F529 WeakPolarHBondContact O-CZ 3.28Å; L370-F529 HydrophobicContact CD2-CB 3.66Å; L370-F529 HydrophobicContact CD2-CD1 3.26Å; L370-F529 HydrophobicContact CD2-CD2 3.7Å; L370-F529 HydrophobicContact CD2-CE1 3.62Å; L370-F529 HydrophobicContact CD2-CE2 4.03Å; L370-F529 HydrophobicContact CD2-CG 3.25Å; L370-F529 HydrophobicContact CD2-CZ 3.95Å; L370-F529 HydrophobicContact CG-CD1 4.26Å; L370-F529 HydrophobicContact CG-CE1 4.16Å; L370-F529 HydrophobicContact CG-CG 4.5Å; L370-F529 HydrophobicContact CG-CZ 4.33Å; V500-F529 HydrophobicContact CG1-CE2 3.94Å; V500-F529 HydrophobicContact CG1-CZ 4.4Å; P524-F529 HydrophobicContact CG-CB 4.2Å; P524-F529 HydrophobicContact CG-CD2 4.07Å; P525-F529 PolarHBondContact O-N 3.4Å; L526-F529 WeakPolarHBondContact O-CB 3.31Å; L526-F529 PolarHBondContact O-N 2.94Å; F529-E531 VanDerWaalsContact C-N 3.26Å; F529-E531 PolarHBondContact O-N 3.26Å; F529-W532 AromaticContact CD2-CE3 3.94Å; F529-W532 HydrophobicContact CD2-CE3 3.94Å; F529-W532 HydrophobicContact CD2-CZ3 4.26Å; F529-W532 WeakPolarHBondContact O-CB 3.37Å; F529-W532 PolarHBondContact O-N 3.05Å; F529-W532 VanDerWaalsContact O-N 3.08Å; F529-V533 HydrophobicContact CD1-CG2 4.2Å; F529-V533 HydrophobicContact CE1-CG2 3.98Å; F529-V533 HydrophobicContact CZ-CG2 4.44Å; F529-V533 WeakPolarHBondContact O-CG2 3.41Å; F529-V533 PolarHBondContact O-N 2.9Å
530	L	89.9	Confident	84.6	Confident	3 Å²	3	46.6 Å²	46.6	2%	0.016	26%	0.256	C	S	.	.	H	α-helix	trans	-64.4	-33	176.8	-68.1	179.7	0	0	0	111.7	I397 F409 P410 M413 I415 L526 G527 V533 M534	I397-L530 HydrophobicContact CG1-CD2 4.43Å; I397-L530 HydrophobicContact CG2-CD2 3.98Å; F409-L530 HydrophobicContact CD1-CD1 3.66Å; F409-L530 HydrophobicContact CE1-CD1 4.12Å; F409-L530 HydrophobicContact CG-CD1 4.39Å; P410-L530 HydrophobicContact CG-CB 3.97Å; M413-L530 HydrophobicContact CE-CB 4.07Å; M413-L530 HydrophobicContact SD-CB 4.17Å; M413-L530 HydrophobicContact SD-CD1 4.14Å; M413-L530 HydrophobicContact SD-CD2 4.31Å; M413-L530 HydrophobicContact SD-CG 4.44Å; I415-L530 HydrophobicContact CD1-CD1 3.86Å; L526-L530 HydrophobicContact CD1-CD1 4.26Å; L526-L530 HydrophobicContact CD1-CG 4.15Å; L526-L530 HydrophobicContact CG-CD1 4.15Å; L526-L530 HydrophobicContact CG-CG 4.42Å; L526-L530 WeakPolarHBondContact O-CG 3.39Å; L526-L530 PolarHBondContact O-N 3.17Å; G527-L530 PolarHBondContact O-N 3.36Å; L530-V533 PolarHBondContact O-N 3.41Å; L530-M534 WeakPolarHBondContact O-CG 2.69Å; L530-M534 PolarHBondContact O-N 3.34Å
531	E	92.4	Very high	86.6	Confident	105 Å²	105	44.4 Å²	44.4	49%	0.491	25%	0.249	S	C	.	.	H	α-helix	trans	-60.7	-44.4	169.9	-173.8	-179.8	179.1	0	0	111.4	G527 L528 F529 V533 M534 V535	G527-E531 PolarHBondContact O-N 3.11Å; L528-E531 WeakPolarHBondContact O-CB 3.37Å; L528-E531 PolarHBondContact O-N 3.42Å; F529-E531 VanDerWaalsContact C-N 3.26Å; F529-E531 PolarHBondContact O-N 3.26Å; E531-V533 VanDerWaalsContact C-N 3.33Å; E531-V533 PolarHBondContact O-N 2.71Å; E531-M534 PolarHBondContact O-N 2.9Å; E531-M534 VanDerWaalsContact O-N 3.17Å; E531-V535 WeakPolarHBondContact O-CG2 3.34Å; E531-V535 PolarHBondContact O-N 3.19Å
532	W	92.2	Very high	88.2	Confident	18 Å²	18	45.1 Å²	45.1	7%	0.068	25%	0.251	C	S	.	.	H	α-helix	trans	-62.4	-40.3	175.6	-59.8	-15	0	0	0	112.6	Q503 Y504 W507 P524 L528 F529 M534 V535 A536	Q503-W532 HydrophobicContact CB-CB 4.12Å; Q503-W532 HydrophobicContact CB-CD2 3.73Å; Q503-W532 HydrophobicContact CB-CE3 4.21Å; Q503-W532 HydrophobicContact CB-CG 3.69Å; Q503-W532 HydrophobicContact CG-CB 4.49Å; Q503-W532 HydrophobicContact CG-CG 4.28Å; Q503-W532 PolarHBondContact NE2-O 2.91Å; Q503-W532 VanDerWaalsContact NE2-O 3.09Å; Q503-W532 VanDerWaalsContact OE1-CG 3.32Å; Y504-W532 HydrophobicContact CD2-CH2 4.31Å; Y504-W532 AromaticContact CD2-CZ3 3.9Å; Y504-W532 HydrophobicContact CD2-CZ3 3.9Å; Y504-W532 HydrophobicContact CG-CZ3 4.39Å; W507-W532 HydrophobicContact CB-CH2 3.47Å; W507-W532 VanDerWaalsContact CB-CH2 3.47Å; W507-W532 HydrophobicContact CB-CZ2 3.51Å; W507-W532 AromaticContact CD1-CZ2 3.86Å; W507-W532 AromaticContact CD2-CH2 3.96Å; W507-W532 HydrophobicContact CD2-CH2 3.96Å; W507-W532 HydrophobicContact CD2-CZ2 4.46Å; W507-W532 HydrophobicContact CE3-CH2 4.37Å; W507-W532 AromaticContact CG-CH2 3.56Å; W507-W532 HydrophobicContact CG-CH2 3.56Å; W507-W532 AromaticContact CG-CZ2 3.66Å; W507-W532 HydrophobicContact CG-CZ2 3.66Å; P524-W532 HydrophobicContact CB-CH2 3.71Å; P524-W532 HydrophobicContact CB-CZ3 3.89Å; P524-W532 HydrophobicContact CG-CH2 4.17Å; P524-W532 HydrophobicContact CG-CZ3 3.84Å; L528-W532 HydrophobicContact CD1-CZ2 4.27Å; L528-W532 HydrophobicContact CD2-CH2 4.33Å; L528-W532 HydrophobicContact CD2-CZ2 3.65Å; L528-W532 HydrophobicContact CG-CH2 4.49Å; L528-W532 HydrophobicContact CG-CZ2 3.68Å; L528-W532 VanDerWaalsContact O-CD1 3.31Å; L528-W532 PolarHBondContact O-N 3.25Å; F529-W532 AromaticContact CD2-CE3 3.94Å; F529-W532 HydrophobicContact CD2-CE3 3.94Å; F529-W532 HydrophobicContact CD2-CZ3 4.26Å; F529-W532 WeakPolarHBondContact O-CB 3.37Å; F529-W532 PolarHBondContact O-N 3.05Å; F529-W532 VanDerWaalsContact O-N 3.08Å; W532-M534 VanDerWaalsContact C-N 3.31Å; W532-M534 PolarHBondContact O-N 3.08Å; W532-V535 PolarHBondContact O-N 3.45Å; W532-A536 VanDerWaalsContact O-CB 3.3Å; W532-A536 WeakPolarHBondContact O-CB 3.02Å; W532-A536 PolarHBondContact O-N 3.16Å
533	V	90.6	Very high	89.7	Confident	1 Å²	1	45.1 Å²	45.1	1%	0.006	25%	0.252	C	S	.	.	H	α-helix	trans	-60.2	-42.7	174.4	174.4	0	0	0	0	110.5	I368 I397 V500 F529 L530 E531 A536 W537	I368-V533 HydrophobicContact CD1-CG1 4.36Å; I368-V533 HydrophobicContact CG2-CG2 4.27Å; I397-V533 HydrophobicContact CD1-CG1 4.5Å; V500-V533 HydrophobicContact CG2-CG2 4.3Å; F529-V533 HydrophobicContact CD1-CG2 4.2Å; F529-V533 HydrophobicContact CE1-CG2 3.98Å; F529-V533 HydrophobicContact CZ-CG2 4.44Å; F529-V533 WeakPolarHBondContact O-CG2 3.41Å; F529-V533 PolarHBondContact O-N 2.9Å; L530-V533 PolarHBondContact O-N 3.41Å; E531-V533 VanDerWaalsContact C-N 3.33Å; E531-V533 PolarHBondContact O-N 2.71Å; V533-A536 PolarHBondContact O-N 2.68Å; V533-W537 VanDerWaalsContact O-CB 3.31Å; V533-W537 WeakPolarHBondContact O-CB 3.41Å; V533-W537 PolarHBondContact O-N 2.82Å
534	M	92.6	Very high	90.5	Very high	19 Å²	19	42.4 Å²	42.4	9%	0.094	25%	0.248	C	C	.	.	H	α-helix	trans	-66.5	-43.7	175.7	-74.7	-59	-68.7	0	0	113.1	P395 P410 M413 L530 E531 W532 A536 W537 N538	P395-M534 HydrophobicContact CG-SD 3.99Å; P410-M534 HydrophobicContact CB-CG 4.06Å; P410-M534 HydrophobicContact CG-CG 3.9Å; M413-M534 HydrophobicContact CB-SD 4.08Å; M413-M534 HydrophobicContact CE-CB 4.49Å; M413-M534 HydrophobicContact CE-CG 3.12Å; M413-M534 HydrophobicContact CE-SD 3.44Å; M413-M534 WeakPolarHBondContact CE-SD 3.46Å; L530-M534 WeakPolarHBondContact O-CG 2.69Å; L530-M534 PolarHBondContact O-N 3.34Å; E531-M534 PolarHBondContact O-N 2.9Å; E531-M534 VanDerWaalsContact O-N 3.17Å; W532-M534 VanDerWaalsContact C-N 3.31Å; W532-M534 PolarHBondContact O-N 3.08Å; M534-A536 VanDerWaalsContact C-N 3.29Å; M534-A536 PolarHBondContact O-N 3.45Å; M534-W537 PolarHBondContact O-N 2.94Å; M534-N538 VanDerWaalsContact O-CB 3.25Å; M534-N538 WeakPolarHBondContact O-CB 3.38Å; M534-N538 PolarHBondContact O-N 3.48Å; M534-N538 PolarHBondContact O-ND2 2.96Å
535	V	93.2	Very high	91.1	Very high	69 Å²	69	42.2 Å²	42.2	42%	0.418	25%	0.246	S	C	.	.	H	α-helix	trans	-59.2	-45	175.6	169.3	0	0	0	0	110	E531 W532 N538 S539	E531-V535 WeakPolarHBondContact O-CG2 3.34Å; E531-V535 PolarHBondContact O-N 3.19Å; W532-V535 PolarHBondContact O-N 3.45Å; V535-N538 PolarHBondContact O-N 3.05Å; V535-S539 WeakPolarHBondContact O-CB 3.3Å; V535-S539 PolarHBondContact O-N 3.24Å
536	A	91.3	Very high	91.4	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-62	-48.7	176.3	0	0	0	0	0	111.4	L496 V500 W532 V533 M534 N538 S539	L496-A536 HydrophobicContact CD1-CB 3.77Å; L496-A536 HydrophobicContact CG-CB 4.39Å; V500-A536 HydrophobicContact CG2-CB 3.76Å; W532-A536 VanDerWaalsContact O-CB 3.3Å; W532-A536 WeakPolarHBondContact O-CB 3.02Å; W532-A536 PolarHBondContact O-N 3.16Å; V533-A536 PolarHBondContact O-N 2.68Å; M534-A536 VanDerWaalsContact C-N 3.29Å; M534-A536 PolarHBondContact O-N 3.45Å; A536-N538 VanDerWaalsContact C-N 3.34Å; A536-N538 PolarHBondContact O-N 3.29Å; A536-S539 PolarHBondContact O-N 3.39Å; A536-S539 PolarHBondContact O-OG 3.07Å
537	W	93.3	Very high	91.5	Very high	6 Å²	6	42.1 Å²	42.1	2%	0.023	24%	0.24	C	C	.	.	H	α-helix	trans	-58.1	-44.4	176.8	-178.3	-119.9	0	0	0	112.5	K384 P385 V386 K392 L393 P395 V492 L496 V533 M534 S539 I540	K384-W537 HydrophobicContact CB-CE3 4.38Å; K384-W537 HydrophobicContact CB-CH2 3.8Å; K384-W537 HydrophobicContact CB-CZ3 3.65Å; K384-W537 HydrophobicContact CD-CE3 4Å; K384-W537 HydrophobicContact CD-CZ3 4.03Å; K384-W537 HydrophobicContact CG-CE3 4.37Å; K384-W537 HydrophobicContact CG-CZ3 4.13Å; K384-W537 WeakPolarHBondContact O-CH2 3.35Å; P385-W537 WeakPolarHBondContact O-CZ2 3.17Å; V386-W537 HydrophobicContact CG1-CH2 3.65Å; V386-W537 HydrophobicContact CG1-CZ2 4.37Å; V386-W537 HydrophobicContact CG1-CZ3 4.44Å; K392-W537 HydrophobicContact CB-CH2 4.44Å; K392-W537 HydrophobicContact CB-CZ2 3.54Å; K392-W537 HydrophobicContact CD-CD2 4.15Å; K392-W537 HydrophobicContact CD-CZ2 4.08Å; K392-W537 WeakPolarHBondContact CD-O 3.42Å; K392-W537 HydrophobicContact CG-CH2 4.23Å; K392-W537 HydrophobicContact CG-CZ2 3.76Å; K392-W537 PolarHBondContact NZ-O 3.42Å; L393-W537 WeakPolarHBondContact O-CZ2 3.48Å; L393-W537 PolarHBondContact O-NE1 3.25Å; P395-W537 HydrophobicContact CG-CB 4.42Å; P395-W537 VanDerWaalsContact CG-CD1 3.42Å; P395-W537 HydrophobicContact CG-CD2 4.06Å; P395-W537 HydrophobicContact CG-CG 3.74Å; V492-W537 HydrophobicContact CG1-CE3 4.28Å; V492-W537 HydrophobicContact CG1-CZ3 3.61Å; L496-W537 HydrophobicContact CD1-CB 4.44Å; V533-W537 VanDerWaalsContact O-CB 3.31Å; V533-W537 WeakPolarHBondContact O-CB 3.41Å; V533-W537 PolarHBondContact O-N 2.82Å; M534-W537 PolarHBondContact O-N 2.94Å; W537-S539 VanDerWaalsContact C-N 3.29Å; W537-S539 PolarHBondContact O-N 3.02Å; W537-I540 HydrophobicContact CE3-CD1 3.95Å; W537-I540 HydrophobicContact CZ3-CD1 4.31Å; W537-I540 PolarHBondContact O-N 3.2Å
538	N	93.3	Very high	91.5	Very high	100 Å²	100	41.1 Å²	41.1	54%	0.535	23%	0.23	S	C	.	.	H	α-helix	trans	-68.1	-29	179.7	-72	-22.1	0	0	0	112.6	K392 M534 V535 A536 I540	K392-N538 PolarHBondContact NZ-O 3.32Å; M534-N538 VanDerWaalsContact O-CB 3.25Å; M534-N538 WeakPolarHBondContact O-CB 3.38Å; M534-N538 PolarHBondContact O-N 3.48Å; M534-N538 PolarHBondContact O-ND2 2.96Å; V535-N538 PolarHBondContact O-N 3.05Å; A536-N538 VanDerWaalsContact C-N 3.34Å; A536-N538 PolarHBondContact O-N 3.29Å; N538-I540 VanDerWaalsContact C-N 3.29Å; N538-I540 PolarHBondContact O-N 3.16Å
539	S	93.5	Very high	91.6	Very high	76 Å²	76	38.8 Å²	38.8	53%	0.531	22%	0.217	S	C	.	.	H	α-helix	trans	-71.8	-18.2	178.5	75.1	0	0	0	0	114.8	V535 A536 W537 S541	V535-S539 WeakPolarHBondContact O-CB 3.3Å; V535-S539 PolarHBondContact O-N 3.24Å; A536-S539 PolarHBondContact O-N 3.39Å; A536-S539 PolarHBondContact O-OG 3.07Å; W537-S539 VanDerWaalsContact C-N 3.29Å; W537-S539 PolarHBondContact O-N 3.02Å; S539-S541 PolarHBondContact O-N 3.42Å
540	I	92.5	Very high	91.6	Very high	8 Å²	8	42.8 Å²	42.8	4%	0.041	24%	0.235	C	C	.	.	S	Bend	trans	-72	123.5	178	-56.4	173.7	0	0	0	108.8	K392 V492 L496 W537 N538 I545	K392-I540 PolarHBondContact NZ-O 2.89Å; V492-I540 HydrophobicContact CB-CD1 4.3Å; V492-I540 HydrophobicContact CG1-CD1 3.54Å; L496-I540 HydrophobicContact CB-CD1 4.13Å; L496-I540 HydrophobicContact CD1-CD1 4.38Å; W537-I540 HydrophobicContact CE3-CD1 3.95Å; W537-I540 HydrophobicContact CZ3-CD1 4.31Å; W537-I540 PolarHBondContact O-N 3.2Å; N538-I540 VanDerWaalsContact C-N 3.29Å; N538-I540 PolarHBondContact O-N 3.16Å; I540-I545 HydrophobicContact CG2-CD1 4.23Å; I540-I545 HydrophobicContact CG2-CG1 4.19Å
541	S	93.6	Very high	91.5	Very high	55 Å²	55	49.5 Å²	49.5	39%	0.385	26%	0.264	S	S	.	.			trans	-76.9	143.9	-175.9	86.5	0	0	0	0	112	S539 E543 S544 I545	S539-S541 PolarHBondContact O-N 3.42Å; S541-E543 VanDerWaalsContact C-N 3.26Å; S541-E543 PolarHBondContact O-N 3.26Å; S541-S544 PolarHBondContact O-N 2.93Å; S541-S544 WeakPolarHBondContact OG-CB 3.5Å; S541-S544 PolarHBondContact OG-N 3.01Å; S541-S544 VanDerWaalsContact OG-N 3.07Å; S541-S544 PolarHBondContact OG-OG 3.37Å; S541-I545 PolarHBondContact O-N 3.22Å
542	S	93.4	Very high	91.1	Very high	60 Å²	60	44.5 Å²	44.5	42%	0.42	24%	0.24	S	C	.	.	H	α-helix	trans	-61.2	-35.9	174.3	-65.4	0	0	0	0	112.2	G390 S544 I545 V546	G390-S542 WeakPolarHBondContact CA-O 3.45Å; G390-S542 WeakPolarHBondContact O-CA 3.48Å; G390-S542 WeakPolarHBondContact O-CB 3.47Å; G390-S542 PolarHBondContact O-OG 3.16Å; S542-S544 PolarHBondContact O-N 2.94Å; S542-I545 WeakPolarHBondContact O-CB 3.23Å; S542-I545 PolarHBondContact O-N 2.9Å; S542-I545 VanDerWaalsContact O-N 3.16Å; S542-V546 WeakPolarHBondContact O-CG2 3.46Å; S542-V546 PolarHBondContact O-N 3.07Å
543	E	92.8	Very high	90.7	Very high	118 Å²	118	47 Å²	47	55%	0.551	25%	0.253	S	S	*	.	H	α-helix	trans	-59.4	-45.1	175.7	-172.7	62.9	-151	0	0	111.5	S541 I545 V546 Q547	S541-E543 VanDerWaalsContact C-N 3.26Å; S541-E543 PolarHBondContact O-N 3.26Å; E543-I545 VanDerWaalsContact C-N 3.25Å; E543-I545 PolarHBondContact O-N 3.49Å; E543-V546 PolarHBondContact O-N 3.26Å; E543-Q547 VanDerWaalsContact O-CG 3.28Å; E543-Q547 WeakPolarHBondContact O-CG 3.25Å; E543-Q547 PolarHBondContact O-N 3.05Å; E543-Q547 PolarHBondContact OE1-NE2 3.03Å
544	S	91.1	Very high	90.5	Very high	53 Å²	53	47 Å²	47	37%	0.371	25%	0.252	S	S	.	.	H	α-helix	trans	-60.9	-35.6	177.4	-58	0	0	0	0	112.5	S541 S542 G548	S541-S544 PolarHBondContact O-N 2.93Å; S541-S544 WeakPolarHBondContact OG-CB 3.5Å; S541-S544 PolarHBondContact OG-N 3.01Å; S541-S544 VanDerWaalsContact OG-N 3.07Å; S541-S544 PolarHBondContact OG-OG 3.37Å; S542-S544 PolarHBondContact O-N 2.94Å; S544-G548 PolarHBondContact O-N 2.95Å
545	I	92	Very high	90	Very high	0 Å²	0	47 Å²	47	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-68.1	-49.5	176.3	-66.4	167.1	0	0	0	110	V386 L387 K392 I540 S541 S542 E543 Q547 G548 F549	V386-I545 HydrophobicContact CB-CD1 4.33Å; V386-I545 HydrophobicContact CB-CG2 3.76Å; V386-I545 HydrophobicContact CG1-CD1 3.72Å; V386-I545 HydrophobicContact CG1-CG1 4.21Å; V386-I545 HydrophobicContact CG1-CG2 4.25Å; V386-I545 HydrophobicContact CG2-CG2 4.04Å; L387-I545 WeakPolarHBondContact O-CG2 3.09Å; K392-I545 HydrophobicContact CD-CD1 4.01Å; K392-I545 HydrophobicContact CG-CD1 3.53Å; I540-I545 HydrophobicContact CG2-CD1 4.23Å; I540-I545 HydrophobicContact CG2-CG1 4.19Å; S541-I545 PolarHBondContact O-N 3.22Å; S542-I545 WeakPolarHBondContact O-CB 3.23Å; S542-I545 PolarHBondContact O-N 2.9Å; S542-I545 VanDerWaalsContact O-N 3.16Å; E543-I545 VanDerWaalsContact C-N 3.25Å; E543-I545 PolarHBondContact O-N 3.49Å; I545-Q547 VanDerWaalsContact C-N 3.29Å; I545-Q547 PolarHBondContact O-N 3.37Å; I545-G548 WeakPolarHBondContact O-CA 3.47Å; I545-G548 PolarHBondContact O-N 3.38Å; I545-F549 HydrophobicContact CG2-CD2 3.93Å; I545-F549 HydrophobicContact CG2-CE2 3.76Å; I545-F549 WeakPolarHBondContact O-CD2 3.29Å; I545-F549 PolarHBondContact O-N 3.41Å
546	V	90.9	Very high	89.3	Confident	29 Å²	29	44.7 Å²	44.7	18%	0.176	24%	0.242	C	C	.	.	H	α-helix	trans	-55	-46.4	176.8	173.7	0	0	0	0	111	D389 S542 E543 G548 F549 K550	D389-V546 VanDerWaalsContact C-CG2 3.43Å; S542-V546 WeakPolarHBondContact O-CG2 3.46Å; S542-V546 PolarHBondContact O-N 3.07Å; E543-V546 PolarHBondContact O-N 3.26Å; V546-G548 VanDerWaalsContact C-N 3.28Å; V546-G548 PolarHBondContact O-N 3.36Å; V546-F549 PolarHBondContact O-N 3.01Å; V546-K550 PolarHBondContact O-N 3.45Å
547	Q	87.4	Confident	88.1	Confident	89 Å²	89	48.6 Å²	48.6	42%	0.416	26%	0.263	S	S	.	.	H	α-helix	trans	-65.4	-32.1	176.3	-62.8	-60.5	-29.5	0	0	112.3	E543 I545 K550 K551	E543-Q547 VanDerWaalsContact O-CG 3.28Å; E543-Q547 WeakPolarHBondContact O-CG 3.25Å; E543-Q547 PolarHBondContact O-N 3.05Å; E543-Q547 PolarHBondContact OE1-NE2 3.03Å; I545-Q547 VanDerWaalsContact C-N 3.29Å; I545-Q547 PolarHBondContact O-N 3.37Å; Q547-K550 PolarHBondContact O-N 2.97Å; Q547-K551 VanDerWaalsContact O-CB 3.3Å; Q547-K551 WeakPolarHBondContact O-CB 3.23Å; Q547-K551 PolarHBondContact O-N 3.32Å
548	G	88.8	Confident	86.7	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-61.6	-47.6	172.6	0	0	0	0	0	112.5	S544 I545 V546 K550 K551 C552	S544-G548 PolarHBondContact O-N 2.95Å; I545-G548 WeakPolarHBondContact O-CA 3.47Å; I545-G548 PolarHBondContact O-N 3.38Å; V546-G548 VanDerWaalsContact C-N 3.28Å; V546-G548 PolarHBondContact O-N 3.36Å; G548-K550 VanDerWaalsContact C-N 3.31Å; G548-K550 PolarHBondContact O-N 3.32Å; G548-K551 PolarHBondContact O-N 3.11Å; G548-C552 PolarHBondContact O-N 3.16Å; G548-C552 PolarHBondContact O-SG 3.24Å
549	F	91.8	Very high	84.9	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-61.9	-36.2	176.3	-83.8	-95.6	0	0	0	113.1	N362 V386 L387 A388 V487 I545 V546 H553 I554 S555	N362-F549 HydrophobicContact CB-CE1 3.9Å; N362-F549 HydrophobicContact CB-CE2 4.42Å; N362-F549 HydrophobicContact CB-CZ 3.56Å; V386-F549 HydrophobicContact CB-CE2 4.32Å; V386-F549 HydrophobicContact CG2-CE2 3.63Å; V386-F549 HydrophobicContact CG2-CZ 3.99Å; L387-F549 VanDerWaalsContact C-CE2 3.42Å; L387-F549 WeakPolarHBondContact O-CE2 3.5Å; A388-F549 HydrophobicContact CB-CB 4.28Å; A388-F549 HydrophobicContact CB-CD1 3.49Å; A388-F549 VanDerWaalsContact CB-CD1 3.49Å; A388-F549 HydrophobicContact CB-CD2 4.15Å; A388-F549 HydrophobicContact CB-CE1 3.71Å; A388-F549 HydrophobicContact CB-CE2 4.32Å; A388-F549 HydrophobicContact CB-CG 3.73Å; A388-F549 HydrophobicContact CB-CZ 4.11Å; V487-F549 HydrophobicContact CB-CD2 4.49Å; V487-F549 HydrophobicContact CB-CE2 4.46Å; V487-F549 HydrophobicContact CG1-CD2 3.82Å; V487-F549 HydrophobicContact CG1-CE2 3.97Å; V487-F549 HydrophobicContact CG1-CG 4.49Å; V487-F549 HydrophobicContact CG2-CD1 4.08Å; V487-F549 HydrophobicContact CG2-CD2 4.06Å; V487-F549 HydrophobicContact CG2-CE1 4.26Å; V487-F549 HydrophobicContact CG2-CE2 4.25Å; V487-F549 HydrophobicContact CG2-CG 3.98Å; V487-F549 HydrophobicContact CG2-CZ 4.35Å; I545-F549 HydrophobicContact CG2-CD2 3.93Å; I545-F549 HydrophobicContact CG2-CE2 3.76Å; I545-F549 WeakPolarHBondContact O-CD2 3.29Å; I545-F549 PolarHBondContact O-N 3.41Å; V546-F549 PolarHBondContact O-N 3.01Å; F549-H553 PolarHBondContact O-N 3.49Å; F549-I554 HydrophobicContact CD1-CB 3.98Å; F549-I554 HydrophobicContact CD1-CD1 4.09Å; F549-I554 HydrophobicContact CD1-CG2 3.76Å; F549-I554 HydrophobicContact CE1-CD1 4.47Å; F549-I554 HydrophobicContact CE1-CG2 4.29Å; F549-I554 PolarHBondContact O-N 2.78Å; F549-S555 VanDerWaalsContact CB-OG 3.26Å; F549-S555 WeakPolarHBondContact CB-OG 3.18Å; F549-S555 PolarHBondContact O-N 3.06Å
550	K	88	Confident	83.2	Confident	90 Å²	90	55.7 Å²	55.7	39%	0.391	29%	0.286	S	S	.	.	H	α-helix	trans	-66.9	-46	172.7	-67.2	178.6	179.8	-178	0	111.6	V546 Q547 G548 C552 H553 S555 S556	V546-K550 PolarHBondContact O-N 3.45Å; Q547-K550 PolarHBondContact O-N 2.97Å; G548-K550 VanDerWaalsContact C-N 3.31Å; G548-K550 PolarHBondContact O-N 3.32Å; K550-C552 PolarHBondContact O-N 2.96Å; K550-H553 PolarHBondContact O-N 2.95Å; K550-S555 PolarHBondContact N-OG 3.01Å; K550-S556 PolarHBondContact O-OG 3.39Å
551	K	86.3	Confident	81.5	Confident	143 Å²	143	56 Å²	56	62%	0.622	29%	0.287	S	S	*	.	H	α-helix	trans	-63.6	-29.3	179.6	-174.6	173.1	173.7	-169.6	0	112.9	V490 Q547 G548 H553	V490-K551 HydrophobicContact CG1-CD 3.76Å; V490-K551 HydrophobicContact CG1-CG 4.41Å; Q547-K551 VanDerWaalsContact O-CB 3.3Å; Q547-K551 WeakPolarHBondContact O-CB 3.23Å; Q547-K551 PolarHBondContact O-N 3.32Å; G548-K551 PolarHBondContact O-N 3.11Å; K551-H553 VanDerWaalsContact C-N 3.27Å
552	C	85.3	Confident	79.8	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85	6.6	174.1	-62.9	0	0	0	0	113.5	Q484 L485 V487 G548 K550 I554	Q484-C552 PolarHBondContact O-SG 2.98Å; L485-C552 WeakPolarHBondContact O-CB 3.35Å; L485-C552 PolarHBondContact O-SG 3.03Å; V487-C552 HydrophobicContact CG2-CB 4.12Å; G548-C552 PolarHBondContact O-N 3.16Å; G548-C552 PolarHBondContact O-SG 3.24Å; K550-C552 PolarHBondContact O-N 2.96Å; C552-I554 VanDerWaalsContact C-N 3.28Å; C552-I554 HydrophobicContact CB-CD1 3.8Å; C552-I554 HydrophobicContact CB-CG1 3.99Å; C552-I554 PolarHBondContact O-N 3.4Å
553	H	83.6	Confident	78.1	Confident	71 Å²	71	58 Å²	58	33%	0.329	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.4	35.7	-178.2	-56.3	-85.1	0	0	0	114	Q343 F549 K550 K551	Q343-H553 HydrophobicContact CG-CB 4.15Å; Q343-H553 PolarHBondContact NE2-CD2 2.95Å; Q343-H553 VanDerWaalsContact NE2-CD2 3.3Å; Q343-H553 VanDerWaalsContact NE2-CG 3.31Å; F549-H553 PolarHBondContact O-N 3.49Å; K550-H553 PolarHBondContact O-N 2.95Å; K551-H553 VanDerWaalsContact C-N 3.27Å
554	I	85.8	Confident	76.4	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	28%	0.283	C	S	.	.	S	Bend	trans	-100.6	-38.2	179.4	-57.7	169.7	0	0	0	110.8	R350 I451 V487 F549 C552	R350-I554 VanDerWaalsContact CD-O 3.29Å; R350-I554 WeakPolarHBondContact CD-O 3.5Å; R350-I554 PolarHBondContact NE-O 3.12Å; R350-I554 PolarHBondContact NH1-O 3.35Å; I451-I554 HydrophobicContact CD1-CD1 4.39Å; I451-I554 HydrophobicContact CD1-CG2 3.84Å; I451-I554 HydrophobicContact CG1-CD1 4.18Å; I451-I554 HydrophobicContact CG1-CG2 4.46Å; V487-I554 HydrophobicContact CG2-CD1 3.73Å; F549-I554 HydrophobicContact CD1-CB 3.98Å; F549-I554 HydrophobicContact CD1-CD1 4.09Å; F549-I554 HydrophobicContact CD1-CG2 3.76Å; F549-I554 HydrophobicContact CE1-CD1 4.47Å; F549-I554 HydrophobicContact CE1-CG2 4.29Å; F549-I554 PolarHBondContact O-N 2.78Å; C552-I554 VanDerWaalsContact C-N 3.28Å; C552-I554 HydrophobicContact CB-CD1 3.8Å; C552-I554 HydrophobicContact CB-CG1 3.99Å; C552-I554 PolarHBondContact O-N 3.4Å
555	S	82.9	Confident	74.8	Confident	19 Å²	19	53.9 Å²	53.9	13%	0.133	27%	0.268	C	S	.	.	S	Bend	trans	-126	14.3	-173.5	70.6	0	0	0	0	115.2	F549 K550	F549-S555 VanDerWaalsContact CB-OG 3.26Å; F549-S555 WeakPolarHBondContact CB-OG 3.18Å; F549-S555 PolarHBondContact O-N 3.06Å; K550-S555 PolarHBondContact N-OG 3.01Å
556	S	77.1	Confident	73.1	Confident	22 Å²	22	61.6 Å²	61.6	15%	0.154	30%	0.298	C	S	.	.	S	Bend	trans	-71.7	170.1	177.6	-12.4	0	0	0	0	111.8	R350 K550 L558 E561	R350-S556 PolarHBondContact NH1-O 2.73Å; R350-S556 PolarHBondContact NH2-O 3.41Å; K550-S556 PolarHBondContact O-OG 3.39Å; S556-L558 PolarHBondContact O-N 3.33Å; S556-E561 WeakPolarHBondContact CB-OE1 3.4Å; S556-E561 PolarHBondContact OG-OE1 3.49Å
557	N	65.7	Low	71.5	Confident	82 Å²	82	66.4 Å²	66.4	44%	0.439	32%	0.318	S	S	.	.			trans	-66.4	132.8	-179.2	-169.5	5.7	0	0	0	110.3	E559 E560 E561	N557-E559 VanDerWaalsContact C-N 3.26Å; N557-E559 PolarHBondContact O-N 3.19Å; N557-E560 HydrophobicContact CB-CB 4.47Å; N557-E560 HydrophobicContact CB-CG 4.35Å; N557-E560 PolarHBondContact O-N 2.91Å; N557-E561 WeakPolarHBondContact O-CG 3.39Å; N557-E561 PolarHBondContact O-N 3.36Å
558	L	64.5	Low	70.1	Confident	54 Å²	54	64.1 Å²	64.1	28%	0.283	31%	0.308	S	S	.	.	H	α-helix	trans	-65.1	-29.3	-174.7	-66.3	172.6	0	0	0	112.7	L347 R350 S556 D562	L347-L558 HydrophobicContact CD2-CD2 3.52Å; R350-L558 HydrophobicContact CB-CD2 4.28Å; S556-L558 PolarHBondContact O-N 3.33Å; L558-D562 PolarHBondContact O-N 2.86Å
559	E	56.6	Low	68.6	Low	147 Å²	147	66 Å²	66	69%	0.687	32%	0.317	S	S	*	.	H	α-helix	trans	-74.5	-41.8	179.7	-64.8	177.2	171.2	0	0	112.1	N557 E561 D562	N557-E559 VanDerWaalsContact C-N 3.26Å; N557-E559 PolarHBondContact O-N 3.19Å; E559-E561 VanDerWaalsContact C-N 3.31Å; E559-E561 PolarHBondContact O-N 2.73Å; E559-D562 PolarHBondContact O-N 3.28Å
560	E	57.1	Low	66.8	Low	129 Å²	129	70.4 Å²	70.4	60%	0.603	35%	0.348	S	S	*	.	H	α-helix	trans	-71	-28.4	177.6	-66.6	175.1	-179.4	0	0	112	N557 V564	N557-E560 HydrophobicContact CB-CB 4.47Å; N557-E560 HydrophobicContact CB-CG 4.35Å; N557-E560 PolarHBondContact O-N 2.91Å; E560-V564 WeakPolarHBondContact O-CG2 3.3Å; E560-V564 PolarHBondContact O-N 2.98Å
561	E	57.8	Low	65.3	Low	16 Å²	16	74 Å²	74	8%	0.075	37%	0.366	C	S	.	.	H	α-helix	trans	-73.2	-32.9	177.3	-76	178.1	163.1	0	0	112.2	L347 R350 S556 N557 E559 L565	L347-E561 HydrophobicContact CD1-CB 4.27Å; L347-E561 HydrophobicContact CD2-CB 4.09Å; L347-E561 WeakPolarHBondContact CD2-OE2 3.29Å; R350-E561 IonicContact NH1-OE1 3.71Å; R350-E561 IonicContact NH1-OE2 3.66Å; R350-E561 PolarHBondContact NH1-OE2 3.14Å; S556-E561 WeakPolarHBondContact CB-OE1 3.4Å; S556-E561 PolarHBondContact OG-OE1 3.49Å; N557-E561 WeakPolarHBondContact O-CG 3.39Å; N557-E561 PolarHBondContact O-N 3.36Å; E559-E561 VanDerWaalsContact C-N 3.31Å; E559-E561 PolarHBondContact O-N 2.73Å; E561-L565 VanDerWaalsContact O-CB 3.27Å; E561-L565 WeakPolarHBondContact O-CB 3.21Å; E561-L565 PolarHBondContact O-N 2.67Å
562	D	55.9	Low	63.8	Low	46 Å²	46	70 Å²	70	25%	0.246	35%	0.351	C	S	.	.	H	α-helix	trans	-63.9	-51.4	175	-87.3	-27.1	0	0	0	111.4	R351 L558 E559 V564 L565 W566	R351-D562 IonicContact CZ-OD1 3.07Å; R351-D562 IonicContact CZ-OD2 3.4Å; R351-D562 IonicContact NH1-OD1 2.84Å; R351-D562 IonicContact NH2-OD1 2.66Å; R351-D562 PolarHBondContact NH2-OD1 2.77Å; R351-D562 IonicContact NH2-OD2 3.68Å; R351-D562 PolarHBondContact NH2-OD2 2.94Å; L558-D562 PolarHBondContact O-N 2.86Å; E559-D562 PolarHBondContact O-N 3.28Å; D562-V564 VanDerWaalsContact C-N 3.27Å; D562-V564 PolarHBondContact O-N 3.43Å; D562-L565 PolarHBondContact O-N 2.75Å; D562-L565 VanDerWaalsContact O-N 3.1Å; D562-W566 WeakPolarHBondContact O-CB 3.48Å; D562-W566 PolarHBondContact O-N 2.87Å
563	D	57.9	Low	61.7	Low	111 Å²	111	76.6 Å²	76.6	59%	0.594	39%	0.394	S	S	*	.	H	α-helix	trans	-57.1	-42.7	-177.7	-70.8	-21.4	0	0	0	111.7	E567	D563-E567 WeakPolarHBondContact O-CG 3.44Å; D563-E567 PolarHBondContact O-N 2.94Å; D563-E567 VanDerWaalsContact O-N 3.09Å
564	V	57.3	Low	60.4	Low	69 Å²	69	77 Å²	77	42%	0.418	42%	0.417	S	S	.	.	H	α-helix	trans	-69.1	-39.8	177.8	175	0	0	0	0	111.8	E560 D562 E567 I568	E560-V564 WeakPolarHBondContact O-CG2 3.3Å; E560-V564 PolarHBondContact O-N 2.98Å; D562-V564 VanDerWaalsContact C-N 3.27Å; D562-V564 PolarHBondContact O-N 3.43Å; V564-E567 PolarHBondContact O-N 3.46Å; V564-I568 HydrophobicContact CG1-CD1 3.9Å; V564-I568 VanDerWaalsContact O-CG1 3.28Å; V564-I568 WeakPolarHBondContact O-CG1 3.44Å; V564-I568 PolarHBondContact O-N 3.31Å; V564-I568 VanDerWaalsContact O-N 3.07Å
565	L	58.7	Low	58.1	Low	14 Å²	14	80 Å²	80	7%	0.073	45%	0.448	C	S	.	.	H	α-helix	trans	-68.4	-38.6	179.7	-152.8	99	0	0	0	111.3	V340 Q343 R344 E561 D562 I568 E569	V340-L565 HydrophobicContact CG1-CD1 4.42Å; V340-L565 HydrophobicContact CG1-CG 4.5Å; Q343-L565 HydrophobicContact CB-CD1 3.82Å; R344-L565 HydrophobicContact CG-CD1 4.48Å; R344-L565 HydrophobicContact CG-CD2 3.51Å; E561-L565 VanDerWaalsContact O-CB 3.27Å; E561-L565 WeakPolarHBondContact O-CB 3.21Å; E561-L565 PolarHBondContact O-N 2.67Å; D562-L565 PolarHBondContact O-N 2.75Å; D562-L565 VanDerWaalsContact O-N 3.1Å; L565-I568 PolarHBondContact O-N 3.4Å; L565-E569 WeakPolarHBondContact CD2-OE1 3.27Å; L565-E569 WeakPolarHBondContact O-CB 3.42Å; L565-E569 WeakPolarHBondContact O-CG 3.34Å; L565-E569 PolarHBondContact O-N 2.93Å
566	W	56.1	Low	56.1	Low	163 Å²	163	82.5 Å²	82.5	62%	0.617	48%	0.477	S	S	*	.	H	α-helix	trans	-62.4	-41.4	173.4	-74.7	118.9	0	0	0	112.3	D562 E569 S570	D562-W566 WeakPolarHBondContact O-CB 3.48Å; D562-W566 PolarHBondContact O-N 2.87Å; W566-E569 PolarHBondContact O-N 3.39Å; W566-S570 PolarHBondContact O-N 3.21Å; W566-S570 VanDerWaalsContact O-N 3.1Å
567	E	57.2	Low	54.5	Low	130 Å²	130	90.5 Å²	90.5	61%	0.607	51%	0.512	S	S	*	.	H	α-helix	trans	-61.9	-46.3	174.6	-76.5	-179.7	175.1	0	0	111.4	D563 V564 E569 S570 E571	D563-E567 WeakPolarHBondContact O-CG 3.44Å; D563-E567 PolarHBondContact O-N 2.94Å; D563-E567 VanDerWaalsContact O-N 3.09Å; V564-E567 PolarHBondContact O-N 3.46Å; E567-E569 PolarHBondContact O-N 2.91Å; E567-S570 PolarHBondContact O-N 3.31Å; E567-S570 PolarHBondContact O-OG 3.46Å; E567-E571 PolarHBondContact O-N 3.24Å
568	I	58	Low	53.3	Low	40 Å²	40	91.8 Å²	91.8	21%	0.205	53%	0.525	C	S	.	.	H	α-helix	trans	-64.5	-39	178.8	-64.4	164.7	0	0	0	111.5	T336 V340 V564 L565 S570 E571 L572	T336-I568 HydrophobicContact CG2-CG2 4Å; V340-I568 HydrophobicContact CG2-CB 4.47Å; V340-I568 HydrophobicContact CG2-CG2 3.5Å; V340-I568 VanDerWaalsContact CG2-CG2 3.5Å; V564-I568 HydrophobicContact CG1-CD1 3.9Å; V564-I568 VanDerWaalsContact O-CG1 3.28Å; V564-I568 WeakPolarHBondContact O-CG1 3.44Å; V564-I568 PolarHBondContact O-N 3.31Å; V564-I568 VanDerWaalsContact O-N 3.07Å; L565-I568 PolarHBondContact O-N 3.4Å; I568-S570 VanDerWaalsContact C-N 3.32Å; I568-S570 PolarHBondContact O-N 3.48Å; I568-E571 PolarHBondContact O-N 3.37Å; I568-L572 PolarHBondContact O-N 3.37Å
569	E	56.3	Low	52.1	Low	41 Å²	41	95.2 Å²	95.2	19%	0.192	55%	0.55	C	S	.	*	H	α-helix	trans	-64.2	-35.5	176.2	-78.1	178.4	-158	0	0	113.1	R344 L565 W566 E567 E571 L572	R344-E569 IonicContact CZ-OE1 3.41Å; R344-E569 IonicContact NE-OE1 3.28Å; R344-E569 PolarHBondContact NE-OE1 3.22Å; R344-E569 IonicContact NH2-OE1 2.98Å; R344-E569 PolarHBondContact NH2-OE1 2.96Å; R344-E569 IonicContact NH2-OE2 3.64Å; R344-E569 PolarHBondContact NH2-OE2 3.14Å; L565-E569 WeakPolarHBondContact CD2-OE1 3.27Å; L565-E569 WeakPolarHBondContact O-CB 3.42Å; L565-E569 WeakPolarHBondContact O-CG 3.34Å; L565-E569 PolarHBondContact O-N 2.93Å; W566-E569 PolarHBondContact O-N 3.39Å; E567-E569 PolarHBondContact O-N 2.91Å; E569-E571 PolarHBondContact O-N 3.25Å; E569-L572 PolarHBondContact O-N 3.46Å
570	S	55.6	Low	51.2	Low	91 Å²	91	97.7 Å²	97.7	64%	0.636	56%	0.559	S	S	*	*	H	α-helix	trans	-67.6	-22.6	177.3	78.6	0	0	0	0	113.2	W566 E567 I568	W566-S570 PolarHBondContact O-N 3.21Å; W566-S570 VanDerWaalsContact O-N 3.1Å; E567-S570 PolarHBondContact O-N 3.31Å; E567-S570 PolarHBondContact O-OG 3.46Å; I568-S570 VanDerWaalsContact C-N 3.32Å; I568-S570 PolarHBondContact O-N 3.48Å
571	E	55	Low	50.1	Low	165 Å²	165	100.1 Å²	100.1	77%	0.771	57%	0.57	S	S	*	*	H	α-helix	trans	-89.6	-14.4	177.8	-65.3	-172.1	166.1	0	0	113.2	E567 I568 E569	E567-E571 PolarHBondContact O-N 3.24Å; I568-E571 PolarHBondContact O-N 3.37Å; E569-E571 PolarHBondContact O-N 3.25Å
572	L	55.5	Low	48.9	Very low	61 Å²	61	105 Å²	105	32%	0.319	61%	0.605	S	S	.	*	S	Bend	trans	-78.5	140.5	176.8	-70.5	173.2	0	0	0	111.2	T336 I568 E569 G574	T336-L572 HydrophobicContact CG2-CD2 4.19Å; I568-L572 PolarHBondContact O-N 3.37Å; E569-L572 PolarHBondContact O-N 3.46Å; L572-G574 PolarHBondContact O-N 3.39Å
573	P	41.4	Very low	47.8	Very low	138 Å²	138	110.5 Å²	110.5	90%	0.896	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.4	96.4	179.8	-10.8	24.7	0	0	0	110.8
574	G	55.1	Low	46.9	Very low	79 Å²	79	111.5 Å²	111.5	81%	0.814	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	138.2	3.6	174.9	0	0	0	0	0	117.6	L572 G576	L572-G574 PolarHBondContact O-N 3.39Å; G574-G576 PolarHBondContact O-N 2.78Å
575	G	38.4	Very low	45.9	Very low	63 Å²	63	117.1 Å²	117.1	65%	0.649	67%	0.666	S	S	*	*			trans	-65.1	95.4	176.3	0	0	0	0	0	113
576	G	41.7	Very low	44.6	Very low	72 Å²	72	122.3 Å²	122.3	74%	0.742	70%	0.704	S	S	*	*	P	Polyproline II helix	trans	-81.3	146.1	174.9	0	0	0	0	0	113	G574	G574-G576 PolarHBondContact O-N 2.78Å
577	E	41.9	Very low	43.8	Very low	189 Å²	189	123.9 Å²	123.9	88%	0.883	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-51.1	148.4	179.8	-79.6	-176.5	151.6	0	0	114.3
578	P	41.5	Very low	42.9	Very low	110 Å²	110	121.9 Å²	121.9	71%	0.714	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-68.8	153.5	-177.5	28.2	-34.1	0	0	0	112.8	K580	P578-K580 PolarHBondContact O-N 3.31Å
579	P	40.1	Very low	42.1	Very low	125 Å²	125	129.5 Å²	129.5	81%	0.812	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-67.3	126.8	173.6	-8.7	23.9	0	0	0	109.9	E581	P579-E581 PolarHBondContact O-N 3.32Å
580	K	36	Very low	41.3	Very low	200 Å²	200	131.1 Å²	131.1	87%	0.87	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-59.8	121.6	171.7	-73.1	-178.4	176.6	177.4	0	109.8	P578 C582	P578-K580 PolarHBondContact O-N 3.31Å; K580-C582 PolarHBondContact O-N 2.89Å
581	E	34.3	Very low	40.3	Very low	180 Å²	180	138.6 Å²	138.6	84%	0.841	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-55.3	128	166.5	-72.9	-177.9	147.1	0	0	109.4	P579 D583	P579-E581 PolarHBondContact O-N 3.32Å; E581-D583 PolarHBondContact O-N 3.31Å
582	C	33.3	Very low	39.5	Very low	119 Å²	119	137.3 Å²	137.3	80%	0.804	82%	0.823	S	S	*	*			trans	-78.8	107.4	168.1	-78.2	0	0	0	0	107.9	K580 T584	K580-C582 PolarHBondContact O-N 2.89Å; C582-T584 PolarHBondContact O-N 3.07Å; C582-T584 VanDerWaalsContact O-N 3.13Å
583	D	32.8	Very low	38.7	Very low	160 Å²	160	141.3 Å²	141.3	86%	0.856	85%	0.85	S	S	*	*			trans	-55.3	112.6	170	-67.3	-45.2	0	0	0	110.7	E581	E581-D583 PolarHBondContact O-N 3.31Å
584	T	39.8	Very low	38.5	Very low	132 Å²	132	141.4 Å²	141.4	81%	0.81	85%	0.847	S	S	*	*			trans	-106.2	91	160.5	49.4	0	0	0	0	108.9	C582	C582-T584 PolarHBondContact O-N 3.07Å; C582-T584 VanDerWaalsContact O-N 3.13Å
585	E	34.3	Very low	37.6	Very low	187 Å²	187	145.1 Å²	145.1	87%	0.874	85%	0.849	S	S	*	*			trans	-162	106.1	156.2	-114.3	175.3	-159.9	0	0	111.6
586	S	32.8	Very low	37.5	Very low	123 Å²	123	150.3 Å²	150.3	86%	0.86	86%	0.862	S	S	*	*			trans	165.2	86.9	133.3	49.3	0	0	0	0	111.2
587	M	39.1	Very low	37.2	Very low	197 Å²	197	155.5 Å²	155.5	97%	0.97	87%	0.87	S	S	*	*			trans	-99	107.6	146.6	-91.1	-161.6	166.3	0	0	107.4
588	A	38.9	Very low	36.9	Very low	87 Å²	87	153.1 Å²	153.1	72%	0.719	87%	0.869	S	S	*	*			trans	-178.2	140.3	142.5	0	0	0	0	0	111
589	E	39.7	Very low	36.5	Very low	201 Å²	201	156.4 Å²	156.4	94%	0.939	88%	0.881	S	S	*	*			trans	77.1	118.9	171	-50.6	-173.6	173.5	0	0	115.4
590	G	40.2	Very low	36.3	Very low	75 Å²	75	159 Å²	159	77%	0.773	89%	0.886	S	S	*	*			cis	143.4	94.8	10.3	0	0	0	0	0	109.1
591	N	33.8	Very low	36.3	Very low	247 Å²	247	155.3 Å²	155.3	100%	1.321	89%	0.888	S	S	*	*			trans	172.4	0	137.1	-118	-0.2	0	0	0	111.2

Retrieved 591 of 591 residues in 817.1 ms (Link to these results)

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