A0A2I3MY97_PAPAN Loading...

EH domain-containing protein 1

AlphaFold DB , UniProt , Accession A0A2I3MY97, Species PAPAN (Papio anubis, Olive baboon), Gene EHD1, Length 548 aa.

Structure Viewer

Loading PAE data...

(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	38.1	Very low	36.3	Very low	241 Å²	241	137.5 Å²	137.5	100%	1.187	85%	0.846	S	S	*	*				0	110.5	0	-101	164.8	159.4	0	0	107.3
2	E	35.4	Very low	36.5	Very low	187 Å²	187	135.8 Å²	135.8	87%	0.874	84%	0.844	S	S	*	*			trans	53.1	106.2	158.8	-67.4	176.1	152.4	0	0	121.3
3	Q	38.5	Very low	36	Very low	182 Å²	182	130.9 Å²	130.9	85%	0.85	84%	0.837	S	S	*	*				-77.3	157.6	127	-67.2	-173.2	-10.1	0	0	108.9
4	P	46.3	Very low	36.3	Very low	121 Å²	121	129.4 Å²	129.4	79%	0.786	83%	0.832	S	S	*	*				-141.6	158.5	87.3	33.7	-15.8	0	0	0	112.1
5	G	35.6	Very low	35.9	Very low	61 Å²	61	132.8 Å²	132.8	63%	0.629	84%	0.836	S	S	*	*			cis	93.9	85.2	21.5	0	0	0	0	0	111.5
6	T	33	Very low	35.7	Very low	154 Å²	154	136.2 Å²	136.2	95%	0.945	84%	0.835	S	S	*	*			trans	-155.7	137.8	148.6	36.4	0	0	0	0	112.3
7	A	34.6	Very low	35.4	Very low	102 Å²	102	134.1 Å²	134.1	84%	0.843	83%	0.827	S	S	*	*			trans	-105.6	158.1	-171.4	0	0	0	0	0	112.1
8	A	29.1	Very low	35.5	Very low	102 Å²	102	140.3 Å²	140.3	84%	0.843	83%	0.833	S	S	*	*			trans	-177.2	122.8	135.2	0	0	0	0	0	111.9
9	S	33.2	Very low	35.4	Very low	118 Å²	118	139.3 Å²	139.3	83%	0.825	83%	0.828	S	S	*	*			trans	-84.2	178.2	157.8	-41.1	0	0	0	0	109.3
10	P	45	Very low	35.3	Very low	116 Å²	116	135.8 Å²	135.8	75%	0.753	81%	0.811	S	S	*	*			cis	-130.4	-178	9.6	33.9	-9.6	0	0	0	112.1
11	V	30.3	Very low	35.1	Very low	128 Å²	128	139.3 Å²	139.3	78%	0.776	82%	0.815	S	S	*	*				-167.4	135.7	91.1	168.9	0	0	0	0	109.1
12	S	39.3	Very low	35.1	Very low	117 Å²	117	134.6 Å²	134.6	82%	0.818	80%	0.795	S	S	*	*			trans	-52.4	133.9	169.8	52.6	0	0	0	0	114.3
13	G	29.2	Very low	35.1	Very low	73 Å²	73	130.1 Å²	130.1	75%	0.753	79%	0.79	S	S	*	*			trans	-162.7	84.2	165.1	0	0	0	0	0	110.2	M15	G13-M15 PolarHBondContact O-N 2.97Å
14	S	39.8	Very low	34.9	Very low	110 Å²	110	133 Å²	133	77%	0.769	79%	0.793	S	S	*	*			trans	-58.4	122.2	171	119.7	0	0	0	0	109.2
15	M	30.4	Very low	34.5	Very low	180 Å²	180	138.4 Å²	138.4	89%	0.887	80%	0.798	S	S	*	*			trans	-140	98.3	158.8	-142.6	177.2	-68.1	0	0	108.2	G13 S17	G13-M15 PolarHBondContact O-N 2.97Å; M15-S17 PolarHBondContact O-N 3.28Å
16	F	33.7	Very low	34.6	Very low	187 Å²	187	145.1 Å²	145.1	82%	0.82	81%	0.81	S	S	*	*			trans	-56.7	116	169.9	-90.4	-94	0	0	0	109.3
17	S	29.4	Very low	35.2	Very low	101 Å²	101	145 Å²	145	71%	0.706	80%	0.796	S	S	*	*			trans	-107.1	91.4	167.2	172.3	0	0	0	0	108	M15 V19	M15-S17 PolarHBondContact O-N 3.28Å; S17-V19 PolarHBondContact O-N 3.13Å
18	W	37.7	Very low	35.4	Very low	246 Å²	246	148.4 Å²	148.4	93%	0.932	79%	0.794	S	S	*	*			trans	-72	94.7	161	-106.4	52.9	0	0	0	107.5
19	V	34.3	Very low	36.5	Very low	121 Å²	121	147.6 Å²	147.6	73%	0.733	78%	0.781	S	S	*	*			trans	-109.9	108.4	162.5	175.7	0	0	0	0	107.5	S17 K21	S17-V19 PolarHBondContact O-N 3.13Å; V19-K21 PolarHBondContact O-N 3.27Å
20	S	32.6	Very low	37.7	Very low	69 Å²	69	146.1 Å²	146.1	48%	0.483	76%	0.761	S	S	.	*			trans	-48.6	131.8	176.7	170.9	0	0	0	0	111.8	D22	S20-D22 PolarHBondContact O-N 3.43Å; S20-D22 VanDerWaalsContact O-N 3.16Å; S20-D22 WeakPolarHBondContact OG-CB 3.5Å; S20-D22 PolarHBondContact OG-N 3.01Å; S20-D22 VanDerWaalsContact OG-N 3.1Å; S20-D22 PolarHBondContact OG-OD2 3.38Å
21	K	31.8	Very low	38.3	Very low	209 Å²	209	148.4 Å²	148.4	91%	0.909	77%	0.766	S	S	*	*	G	3₁₀ helix	trans	-66.3	-1.4	171.1	-95.1	177.9	172.1	177.3	0	113.5	V19	V19-K21 PolarHBondContact O-N 3.27Å
22	D	38.6	Very low	40.2	Very low	142 Å²	142	144 Å²	144	76%	0.759	74%	0.736	S	S	*	*	G	3₁₀ helix	trans	-87.1	-11.3	-172.1	-67	-38.5	0	0	0	115.1	S20	S20-D22 PolarHBondContact O-N 3.43Å; S20-D22 VanDerWaalsContact O-N 3.16Å; S20-D22 WeakPolarHBondContact OG-CB 3.5Å; S20-D22 PolarHBondContact OG-N 3.01Å; S20-D22 VanDerWaalsContact OG-N 3.1Å; S20-D22 PolarHBondContact OG-OD2 3.38Å
23	A	34.4	Very low	41.7	Very low	93 Å²	93	146.6 Å²	146.6	77%	0.769	74%	0.735	S	S	*	*	G	3₁₀ helix	trans	-93.8	1.1	-172.7	0	0	0	0	0	115.7
24	R	33.6	Very low	44.3	Very low	242 Å²	242	146 Å²	146	91%	0.913	72%	0.718	S	S	*	*			trans	-115.9	9.1	-176.4	-81.9	-173.4	-176.3	177.2	2.1	116.3	K26	R24-K26 VanDerWaalsContact C-N 3.32Å; R24-K26 PolarHBondContact O-N 3.08Å
25	R	37.9	Very low	46.5	Very low	235 Å²	235	140.8 Å²	140.8	89%	0.887	68%	0.681	S	S	*	*			trans	-89.4	70.4	161.1	-90	-178.7	168.4	174	-4.5	109.7	K27	R25-K27 VanDerWaalsContact C-N 3.29Å; R25-K27 PolarHBondContact O-N 2.88Å; R25-K27 VanDerWaalsContact O-N 3.1Å
26	K	39.7	Very low	49.2	Very low	203 Å²	203	133.4 Å²	133.4	88%	0.883	65%	0.649	S	S	*	*			trans	-66.6	102.9	147.8	-91.3	-177.9	173.5	-179.4	0	104.5	R24 E28	R24-K26 VanDerWaalsContact C-N 3.32Å; R24-K26 PolarHBondContact O-N 3.08Å; K26-E28 PolarHBondContact O-N 2.89Å; K26-E28 VanDerWaalsContact O-N 3.1Å
27	K	44.7	Very low	51.9	Low	150 Å²	150	126.6 Å²	126.6	65%	0.652	62%	0.619	S	S	*	*	P	Polyproline II helix	trans	-47.2	117.3	178.3	-79.8	-175	168.2	-159.2	0	108.5	R25 E30	R25-K27 VanDerWaalsContact C-N 3.29Å; R25-K27 PolarHBondContact O-N 2.88Å; R25-K27 VanDerWaalsContact O-N 3.1Å; K27-E30 IonicContact NZ-OE1 2.56Å
28	E	39.6	Very low	54.8	Low	174 Å²	174	121.8 Å²	121.8	81%	0.813	59%	0.586	S	S	*	*	P	Polyproline II helix	trans	-50.8	144.4	158.7	-72.6	-179	153.5	0	0	108	K26 E30	K26-E28 PolarHBondContact O-N 2.89Å; K26-E28 VanDerWaalsContact O-N 3.1Å; E28-E30 PolarHBondContact O-N 3.26Å
29	P	50.8	Low	57.5	Low	86 Å²	86	110.1 Å²	110.1	56%	0.558	54%	0.542	S	S	*	.	P	Polyproline II helix	trans	-57.9	117.7	176.3	23.5	-30.4	0	0	0	108.4	L31	P29-L31 PolarHBondContact O-N 3.25Å
30	E	58.3	Low	60.3	Low	86 Å²	86	107.6 Å²	107.6	40%	0.402	52%	0.519	S	S	.	.			trans	-56.7	109.2	169	-77	168.2	-163	0	0	106.9	K27 E28 F32	K27-E30 IonicContact NZ-OE1 2.56Å; E28-E30 PolarHBondContact O-N 3.26Å; E30-F32 HydrophobicContact CB-CE1 4.19Å; E30-F32 HydrophobicContact CB-CZ 4.1Å; E30-F32 PolarHBondContact O-N 3.32Å
31	L	58.4	Low	63.2	Low	165 Å²	165	107 Å²	107	86%	0.864	51%	0.508	S	S	*	.			trans	-81.4	105.1	177.1	-88.3	138.6	0	0	0	107.7	P29	P29-L31 PolarHBondContact O-N 3.25Å
32	F	69.5	Low	66.2	Low	34 Å²	34	97.3 Å²	97.3	15%	0.149	47%	0.466	C	S	.	.			trans	-79.9	145.3	172.4	-50.4	-67.3	0	0	0	110.3	E30 Q41 L407 M410	E30-F32 HydrophobicContact CB-CE1 4.19Å; E30-F32 HydrophobicContact CB-CZ 4.1Å; E30-F32 PolarHBondContact O-N 3.32Å; F32-Q41 HydrophobicContact CE1-CB 4.32Å; F32-L407 HydrophobicContact CD2-CD2 4Å; F32-L407 HydrophobicContact CE2-CD2 4.26Å; F32-M410 HydrophobicContact CB-CE 3.82Å; F32-M410 HydrophobicContact CB-SD 4.39Å; F32-M410 HydrophobicContact CD2-SD 4.08Å
33	Q	71.9	Confident	69	Low	172 Å²	172	90.8 Å²	90.8	80%	0.804	43%	0.431	S	S	*	.	S	Bend	trans	-81.8	-33.2	176.3	-61.3	-175.4	-1.5	0	0	112.1	E37	Q33-E37 WeakPolarHBondContact CB-OE2 3.05Å; Q33-E37 PolarHBondContact N-OE2 3.23Å
34	T	83.8	Confident	71.9	Confident	62 Å²	62	88.8 Å²	88.8	38%	0.38	42%	0.415	S	S	.	.	S	Bend	trans	-139.7	160.6	176.1	68	0	0	0	0	111.7	A36 E37 G38 E414	T34-A36 VanDerWaalsContact C-N 3.31Å; T34-A36 PolarHBondContact O-N 2.83Å; T34-E37 PolarHBondContact O-N 2.78Å; T34-E37 PolarHBondContact OG1-N 3.29Å; T34-G38 PolarHBondContact O-N 3.23Å; T34-G38 VanDerWaalsContact O-N 3.09Å; T34-E414 WeakPolarHBondContact CA-OE1 3.2Å
35	V	85.4	Confident	74.9	Confident	0 Å²	0	82 Å²	82	0%	0	39%	0.393	C	S	.	.	H	α-helix	trans	-61.8	-39.8	174.1	174.2	0	0	0	0	111.3	E37 G38 L39 A304 M410 V411 E414	V35-E37 VanDerWaalsContact C-N 3.32Å; V35-E37 PolarHBondContact O-N 3.23Å; V35-G38 PolarHBondContact O-N 3.09Å; V35-L39 HydrophobicContact CG1-CD1 3.88Å; V35-L39 HydrophobicContact CG1-CG 4.07Å; V35-L39 WeakPolarHBondContact O-CB 3.15Å; V35-L39 WeakPolarHBondContact O-CG 3.23Å; V35-L39 PolarHBondContact O-N 3.02Å; V35-A304 HydrophobicContact CB-CB 4.18Å; V35-A304 HydrophobicContact CG1-CB 3.95Å; V35-M410 HydrophobicContact CG2-CB 3.84Å; V35-V411 HydrophobicContact CB-CG2 4.37Å; V35-V411 HydrophobicContact CG1-CG2 3.71Å; V35-V411 HydrophobicContact CG2-CB 4.46Å; V35-V411 HydrophobicContact CG2-CG2 3.77Å; V35-E414 WeakPolarHBondContact CB-OE2 3.37Å; V35-E414 VanDerWaalsContact CG2-CD 3.45Å; V35-E414 HydrophobicContact CG2-CG 4.28Å; V35-E414 VanDerWaalsContact CG2-OE2 3.3Å; V35-E414 WeakPolarHBondContact CG2-OE2 3.3Å; V35-E414 PolarHBondContact N-OE1 2.86Å
36	A	87	Confident	77.8	Confident	25 Å²	25	72 Å²	72	21%	0.207	36%	0.356	C	S	.	.	H	α-helix	trans	-59.8	-42.9	178.2	0	0	0	0	0	111.8	T34 L39 R40	T34-A36 VanDerWaalsContact C-N 3.31Å; T34-A36 PolarHBondContact O-N 2.83Å; A36-L39 PolarHBondContact O-N 3.05Å; A36-R40 WeakPolarHBondContact O-CB 3.28Å; A36-R40 PolarHBondContact O-N 2.98Å
37	E	90	Very high	80.6	Confident	44 Å²	44	62.3 Å²	62.3	21%	0.206	31%	0.314	C	S	.	.	H	α-helix	trans	-62.6	-45.8	174.8	-176.5	-176.7	-163.1	0	0	111.6	Q33 T34 V35 R40 Q41	Q33-E37 WeakPolarHBondContact CB-OE2 3.05Å; Q33-E37 PolarHBondContact N-OE2 3.23Å; T34-E37 PolarHBondContact O-N 2.78Å; T34-E37 PolarHBondContact OG1-N 3.29Å; V35-E37 VanDerWaalsContact C-N 3.32Å; V35-E37 PolarHBondContact O-N 3.23Å; E37-R40 PolarHBondContact O-N 2.86Å; E37-Q41 WeakPolarHBondContact O-CG 3.47Å; E37-Q41 PolarHBondContact O-N 3.23Å; E37-Q41 PolarHBondContact OE1-NE2 3.18Å
38	G	91.6	Very high	83.1	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-60.1	-46.1	177.8	0	0	0	0	0	112.7	T34 V35 R40 Q41 L42	T34-G38 PolarHBondContact O-N 3.23Å; T34-G38 VanDerWaalsContact O-N 3.09Å; V35-G38 PolarHBondContact O-N 3.09Å; G38-R40 PolarHBondContact O-N 3.28Å; G38-Q41 PolarHBondContact O-N 2.82Å; G38-L42 WeakPolarHBondContact O-CG 3.29Å; G38-L42 PolarHBondContact O-N 3.2Å
39	L	92.8	Very high	85.9	Confident	1 Å²	1	50.8 Å²	50.8	1%	0.005	27%	0.268	C	S	.	.	H	α-helix	trans	-59.5	-46	175.9	-72.5	173.7	0	0	0	112.1	V35 A36 Q41 L42 Y43 F69 K307 L308 L311 L407	V35-L39 HydrophobicContact CG1-CD1 3.88Å; V35-L39 HydrophobicContact CG1-CG 4.07Å; V35-L39 WeakPolarHBondContact O-CB 3.15Å; V35-L39 WeakPolarHBondContact O-CG 3.23Å; V35-L39 PolarHBondContact O-N 3.02Å; A36-L39 PolarHBondContact O-N 3.05Å; L39-Q41 PolarHBondContact O-N 3.37Å; L39-L42 PolarHBondContact O-N 3.08Å; L39-Y43 WeakPolarHBondContact O-CB 3.38Å; L39-Y43 PolarHBondContact O-N 3.14Å; L39-F69 HydrophobicContact CB-CD1 3.85Å; L39-F69 HydrophobicContact CB-CE1 4Å; L39-K307 HydrophobicContact CD1-CB 3.71Å; L39-L308 HydrophobicContact CD2-CB 4.09Å; L39-L308 HydrophobicContact CD2-CD1 3.47Å; L39-L308 VanDerWaalsContact CD2-CD1 3.47Å; L39-L308 HydrophobicContact CD2-CG 4.37Å; L39-L311 HydrophobicContact CD2-CD2 3.64Å; L39-L407 HydrophobicContact CD2-CD1 3.83Å; L39-L407 HydrophobicContact CG-CD1 4.23Å
40	R	93.4	Very high	88.2	Confident	68 Å²	68	46.8 Å²	46.8	26%	0.257	24%	0.242	S	C	.	.	H	α-helix	trans	-60.2	-46	178	179.8	179.3	59.4	-166.8	-3.2	111.6	A36 E37 G38 Y43 A44 D66 F69 D70	A36-R40 WeakPolarHBondContact O-CB 3.28Å; A36-R40 PolarHBondContact O-N 2.98Å; E37-R40 PolarHBondContact O-N 2.86Å; G38-R40 PolarHBondContact O-N 3.28Å; R40-Y43 PolarHBondContact O-N 3.17Å; R40-A44 WeakPolarHBondContact O-CB 3.48Å; R40-A44 PolarHBondContact O-N 3.39Å; R40-D66 VanDerWaalsContact CD-OD1 3.27Å; R40-D66 WeakPolarHBondContact CD-OD1 3.1Å; R40-D66 IonicContact NH1-OD2 2.67Å; R40-F69 HydrophobicContact CB-CB 4.33Å; R40-F69 HydrophobicContact CB-CD1 4.21Å; R40-F69 HydrophobicContact CB-CD2 3.91Å; R40-F69 HydrophobicContact CB-CE2 4.27Å; R40-F69 HydrophobicContact CB-CG 3.87Å; R40-F69 HydrophobicContact CG-CD2 4Å; R40-F69 HydrophobicContact CG-CE2 4.27Å; R40-F69 HydrophobicContact CG-CG 4.45Å; R40-D70 IonicContact NH1-OD2 3.89Å
41	Q	93.9	Very high	90.1	Very high	56 Å²	56	42.7 Å²	42.7	26%	0.262	22%	0.223	S	C	.	.	H	α-helix	trans	-65.7	-44	179.2	-71.1	-172.7	20.2	0	0	111.9	F32 E37 G38 L39 Y43 A44 Q45	F32-Q41 HydrophobicContact CE1-CB 4.32Å; E37-Q41 WeakPolarHBondContact O-CG 3.47Å; E37-Q41 PolarHBondContact O-N 3.23Å; E37-Q41 PolarHBondContact OE1-NE2 3.18Å; G38-Q41 PolarHBondContact O-N 2.82Å; L39-Q41 PolarHBondContact O-N 3.37Å; Q41-Y43 VanDerWaalsContact C-N 3.34Å; Q41-Y43 PolarHBondContact O-N 3.2Å; Q41-A44 PolarHBondContact O-N 3.27Å; Q41-Q45 VanDerWaalsContact O-CB 3.31Å; Q41-Q45 WeakPolarHBondContact O-CB 3.31Å; Q41-Q45 VanDerWaalsContact O-CG 3.3Å; Q41-Q45 WeakPolarHBondContact O-CG 3.39Å; Q41-Q45 PolarHBondContact O-N 3.04Å
42	L	95	Very high	92	Very high	5 Å²	5	40.7 Å²	40.7	3%	0.026	21%	0.209	C	C	.	.	H	α-helix	trans	-60.8	-43.9	175.5	-71.1	-175.2	0	0	0	111.7	G38 L39 K46 L47 M399 D403 L407	G38-L42 WeakPolarHBondContact O-CG 3.29Å; G38-L42 PolarHBondContact O-N 3.2Å; L39-L42 PolarHBondContact O-N 3.08Å; L42-K46 HydrophobicContact CD2-CD 4.27Å; L42-K46 WeakPolarHBondContact O-CA 3.33Å; L42-K46 WeakPolarHBondContact O-CB 3.45Å; L42-K46 PolarHBondContact O-N 3.27Å; L42-L47 PolarHBondContact O-N 3.17Å; L42-M399 HydrophobicContact CB-CG 4.36Å; L42-M399 HydrophobicContact CB-SD 4.07Å; L42-M399 HydrophobicContact CD1-CG 4.19Å; L42-M399 HydrophobicContact CD2-CG 4.36Å; L42-D403 HydrophobicContact CD1-CB 3.69Å; L42-D403 HydrophobicContact CD2-CB 3.73Å; L42-D403 HydrophobicContact CG-CB 4.38Å; L42-L407 HydrophobicContact CD1-CD1 3.4Å; L42-L407 HydrophobicContact CD1-CG 4.28Å; L42-L407 HydrophobicContact CG-CD1 4.42Å
43	Y	96.8	Very high	93.3	Very high	5 Å²	5	40.6 Å²	40.6	2%	0.02	21%	0.209	C	C	.	.	I	π-helix	trans	-57	-56.7	175.2	175.9	-109.1	0	0	0	111.2	L39 R40 Q41 Q45 L47 L48 E51 A63 L64 F69 L311	L39-Y43 WeakPolarHBondContact O-CB 3.38Å; L39-Y43 PolarHBondContact O-N 3.14Å; R40-Y43 PolarHBondContact O-N 3.17Å; Q41-Y43 VanDerWaalsContact C-N 3.34Å; Q41-Y43 PolarHBondContact O-N 3.2Å; Y43-Q45 VanDerWaalsContact C-N 3.34Å; Y43-Q45 PolarHBondContact O-N 3.3Å; Y43-L47 HydrophobicContact CD2-CB 4.01Å; Y43-L47 HydrophobicContact CD2-CD2 3.94Å; Y43-L47 HydrophobicContact CD2-CG 4.16Å; Y43-L47 HydrophobicContact CE2-CB 4.45Å; Y43-L47 HydrophobicContact CE2-CD2 4.17Å; Y43-L47 HydrophobicContact CE2-CG 4.24Å; Y43-L47 PolarHBondContact O-N 3.09Å; Y43-L47 VanDerWaalsContact O-N 3.11Å; Y43-L48 HydrophobicContact CE1-CB 4.15Å; Y43-L48 HydrophobicContact CE1-CD1 4.26Å; Y43-L48 HydrophobicContact CE1-CD2 4.48Å; Y43-L48 HydrophobicContact CE2-CB 4.46Å; Y43-L48 WeakPolarHBondContact O-CB 3.45Å; Y43-L48 PolarHBondContact O-N 3.37Å; Y43-L48 WeakPolarHBondContact OH-CD1 3.33Å; Y43-E51 WeakPolarHBondContact CE2-OE2 3.35Å; Y43-E51 PolarHBondContact OH-OE2 3.47Å; Y43-A63 WeakPolarHBondContact OH-CA 3.34Å; Y43-L64 HydrophobicContact CD1-CB 4.02Å; Y43-L64 HydrophobicContact CD2-CD1 4Å; Y43-L64 HydrophobicContact CE1-CB 3.57Å; Y43-L64 HydrophobicContact CE1-CG 4.22Å; Y43-L64 WeakPolarHBondContact CE1-O 3.22Å; Y43-L64 HydrophobicContact CE2-CB 4.37Å; Y43-L64 HydrophobicContact CE2-CD1 3.99Å; Y43-L64 HydrophobicContact CE2-CG 4.11Å; Y43-L64 HydrophobicContact CG-CD1 4.29Å; Y43-L64 PolarHBondContact OH-N 2.84Å; Y43-F69 HydrophobicContact CD1-CE2 4.14Å; Y43-F69 AromaticContact CD1-CZ 3.93Å; Y43-F69 HydrophobicContact CD1-CZ 3.93Å; Y43-F69 HydrophobicContact CG-CE2 4.5Å; Y43-F69 AromaticContact CG-CZ 3.83Å; Y43-F69 HydrophobicContact CG-CZ 3.83Å; Y43-L311 HydrophobicContact CD2-CD1 3.9Å; Y43-L311 HydrophobicContact CG-CD1 4.44Å
44	A	96.8	Very high	94.6	Very high	51 Å²	51	32.5 Å²	32.5	42%	0.421	17%	0.171	S	C	.	.	I	π-helix	trans	-62.8	-38.8	-174.7	0	0	0	0	0	113	R40 Q41	R40-A44 WeakPolarHBondContact O-CB 3.48Å; R40-A44 PolarHBondContact O-N 3.39Å; Q41-A44 PolarHBondContact O-N 3.27Å
45	Q	96.4	Very high	95.2	Very high	100 Å²	100	32.9 Å²	32.9	47%	0.467	17%	0.165	S	C	.	.	I	π-helix	trans	-89.8	-32.9	-173.4	-64.4	-178.5	19.6	0	0	113.8	Q41 Y43	Q41-Q45 VanDerWaalsContact O-CB 3.31Å; Q41-Q45 WeakPolarHBondContact O-CB 3.31Å; Q41-Q45 VanDerWaalsContact O-CG 3.3Å; Q41-Q45 WeakPolarHBondContact O-CG 3.39Å; Q41-Q45 PolarHBondContact O-N 3.04Å; Y43-Q45 VanDerWaalsContact C-N 3.34Å; Y43-Q45 PolarHBondContact O-N 3.3Å
46	K	97.4	Very high	95.7	Very high	25 Å²	25	32.9 Å²	32.9	11%	0.109	17%	0.165	C	C	.	.	I	π-helix	trans	-113.1	-39.9	-169.8	-61.6	-159.3	174.8	-167.5	0	113.5	L42 T395 V396 D398 M399 D403	L42-K46 HydrophobicContact CD2-CD 4.27Å; L42-K46 WeakPolarHBondContact O-CA 3.33Å; L42-K46 WeakPolarHBondContact O-CB 3.45Å; L42-K46 PolarHBondContact O-N 3.27Å; K46-T395 HydrophobicContact CB-CG2 3.83Å; K46-T395 HydrophobicContact CD-CG2 4.03Å; K46-T395 HydrophobicContact CG-CG2 3.76Å; K46-V396 VanDerWaalsContact O-CG2 3.28Å; K46-V396 WeakPolarHBondContact O-CG2 3.3Å; K46-D398 IonicContact NZ-OD2 3.05Å; K46-D398 PolarHBondContact NZ-OD2 2.89Å; K46-M399 HydrophobicContact CB-CB 4.25Å; K46-M399 HydrophobicContact CB-CG 4.33Å; K46-M399 HydrophobicContact CB-SD 3.84Å; K46-M399 HydrophobicContact CD-CB 3.72Å; K46-M399 HydrophobicContact CD-CG 4.09Å; K46-D403 VanDerWaalsContact CE-OD2 3.24Å; K46-D403 WeakPolarHBondContact CE-OD2 3.13Å; K46-D403 IonicContact NZ-OD1 3.08Å; K46-D403 IonicContact NZ-OD2 3.72Å; K46-D403 PolarHBondContact NZ-OD2 2.93Å
47	L	98.2	Very high	96	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	17%	0.168	C	C	.	.	I	π-helix	trans	-94	-48	-175.6	-176	55.4	0	0	0	113.5	L42 Y43 P49 L50 E51 L311 R314 A315 A318 V396 M399	L42-L47 PolarHBondContact O-N 3.17Å; Y43-L47 HydrophobicContact CD2-CB 4.01Å; Y43-L47 HydrophobicContact CD2-CD2 3.94Å; Y43-L47 HydrophobicContact CD2-CG 4.16Å; Y43-L47 HydrophobicContact CE2-CB 4.45Å; Y43-L47 HydrophobicContact CE2-CD2 4.17Å; Y43-L47 HydrophobicContact CE2-CG 4.24Å; Y43-L47 PolarHBondContact O-N 3.09Å; Y43-L47 VanDerWaalsContact O-N 3.11Å; L47-P49 VanDerWaalsContact C-CD 3.46Å; L47-P49 VanDerWaalsContact C-N 3.34Å; L47-L50 WeakPolarHBondContact O-CB 3.39Å; L47-L50 PolarHBondContact O-N 3.28Å; L47-E51 HydrophobicContact CD1-CG 4.31Å; L47-E51 WeakPolarHBondContact CD2-OE1 3.25Å; L47-E51 HydrophobicContact CG-CG 4.22Å; L47-E51 WeakPolarHBondContact CG-OE1 3.2Å; L47-E51 PolarHBondContact O-N 3.09Å; L47-E51 VanDerWaalsContact O-N 3.09Å; L47-L311 HydrophobicContact CD2-CD1 3.8Å; L47-R314 HydrophobicContact CD2-CG 4.21Å; L47-A315 HydrophobicContact CD1-CB 4.08Å; L47-A315 HydrophobicContact CD2-CB 3.97Å; L47-A318 HydrophobicContact CD1-CB 3.82Å; L47-V396 HydrophobicContact CD1-CG1 4.33Å; L47-V396 HydrophobicContact CD1-CG2 4.15Å; L47-M399 HydrophobicContact CB-CE 4.45Å; L47-M399 HydrophobicContact CB-SD 4.46Å
48	L	98.3	Very high	96.1	Very high	35 Å²	35	36.4 Å²	36.4	18%	0.183	18%	0.177	C	C	.	.	H	α-helix	trans	-53.6	-41.7	-177.8	178.6	64.9	0	0	0	113.2	Y43 L50 E51 E52 A63	Y43-L48 HydrophobicContact CE1-CB 4.15Å; Y43-L48 HydrophobicContact CE1-CD1 4.26Å; Y43-L48 HydrophobicContact CE1-CD2 4.48Å; Y43-L48 HydrophobicContact CE2-CB 4.46Å; Y43-L48 WeakPolarHBondContact O-CB 3.45Å; Y43-L48 PolarHBondContact O-N 3.37Å; Y43-L48 WeakPolarHBondContact OH-CD1 3.33Å; L48-L50 VanDerWaalsContact C-N 3.26Å; L48-L50 PolarHBondContact O-N 3.14Å; L48-E51 WeakPolarHBondContact O-CB 3.33Å; L48-E51 PolarHBondContact O-N 2.64Å; L48-E51 VanDerWaalsContact O-N 3.1Å; L48-E52 HydrophobicContact CD1-CG 3.87Å; L48-E52 HydrophobicContact CG-CG 4.2Å; L48-E52 WeakPolarHBondContact O-CG 3.4Å; L48-E52 PolarHBondContact O-N 2.96Å; L48-A63 HydrophobicContact CD1-CB 4.04Å
49	P	98.4	Very high	96.1	Very high	47 Å²	47	36.9 Å²	36.9	31%	0.305	18%	0.179	S	C	.	.	H	α-helix	trans	-61.5	-32.1	176.7	-25.2	36.2	0	0	0	113.9	L47 H53 L392	L47-P49 VanDerWaalsContact C-CD 3.46Å; L47-P49 VanDerWaalsContact C-N 3.34Å; P49-H53 WeakPolarHBondContact O-CB 3.45Å; P49-H53 PolarHBondContact O-N 2.93Å; P49-H53 VanDerWaalsContact O-N 3.16Å; P49-L392 HydrophobicContact CB-CD2 4.18Å
50	L	98.6	Very high	96	Very high	1 Å²	1	39 Å²	39	1%	0.005	19%	0.189	C	C	.	.	H	α-helix	trans	-70.6	-45.6	173.6	-176	74.9	0	0	0	110.3	L47 L48 H53 Y54 A318 K319 A322 L392 L393 V396	L47-L50 WeakPolarHBondContact O-CB 3.39Å; L47-L50 PolarHBondContact O-N 3.28Å; L48-L50 VanDerWaalsContact C-N 3.26Å; L48-L50 PolarHBondContact O-N 3.14Å; L50-H53 PolarHBondContact O-N 3.47Å; L50-Y54 HydrophobicContact CD1-CD2 3.65Å; L50-Y54 HydrophobicContact CD1-CE2 3.58Å; L50-Y54 HydrophobicContact CG-CD2 4.22Å; L50-Y54 WeakPolarHBondContact O-CD2 3.45Å; L50-Y54 PolarHBondContact O-N 3.48Å; L50-Y54 VanDerWaalsContact O-N 3.14Å; L50-A318 HydrophobicContact CD2-CB 4.21Å; L50-K319 HydrophobicContact CD2-CG 4.13Å; L50-A322 HydrophobicContact CD1-CB 4.1Å; L50-L392 HydrophobicContact CD1-CB 3.7Å; L50-L393 HydrophobicContact CD1-CD2 4.04Å; L50-L393 HydrophobicContact CD1-CG 4.41Å; L50-L393 HydrophobicContact CD2-CD2 4.26Å; L50-V396 HydrophobicContact CB-CG2 4.21Å; L50-V396 HydrophobicContact CD2-CB 4.48Å; L50-V396 HydrophobicContact CD2-CG2 3.82Å
51	E	98.3	Very high	95.7	Very high	1 Å²	1	36.1 Å²	36.1	1%	0.005	18%	0.179	C	C	.	.	H	α-helix	trans	-58.3	-49.3	179.2	-69.9	-176.2	178.9	0	0	111.6	Y43 L47 L48 R55 F56 H57 R314 A318	Y43-E51 WeakPolarHBondContact CE2-OE2 3.35Å; Y43-E51 PolarHBondContact OH-OE2 3.47Å; L47-E51 HydrophobicContact CD1-CG 4.31Å; L47-E51 WeakPolarHBondContact CD2-OE1 3.25Å; L47-E51 HydrophobicContact CG-CG 4.22Å; L47-E51 WeakPolarHBondContact CG-OE1 3.2Å; L47-E51 PolarHBondContact O-N 3.09Å; L47-E51 VanDerWaalsContact O-N 3.09Å; L48-E51 WeakPolarHBondContact O-CB 3.33Å; L48-E51 PolarHBondContact O-N 2.64Å; L48-E51 VanDerWaalsContact O-N 3.1Å; E51-R55 PolarHBondContact O-N 2.85Å; E51-F56 HydrophobicContact CB-CB 3.75Å; E51-F56 HydrophobicContact CB-CD1 4.36Å; E51-F56 HydrophobicContact CB-CG 4.2Å; E51-F56 HydrophobicContact CG-CB 4.03Å; E51-F56 HydrophobicContact CG-CD1 4.02Å; E51-F56 HydrophobicContact CG-CG 3.95Å; E51-F56 WeakPolarHBondContact O-CB 3.23Å; E51-F56 PolarHBondContact O-N 3.16Å; E51-H57 IonicContact OE2-CE1 3.27Å; E51-H57 PolarHBondContact OE2-CE1 3.37Å; E51-H57 IonicContact OE2-NE2 3.28Å; E51-R314 WeakPolarHBondContact OE1-CD 3.09Å; E51-R314 IonicContact OE1-CZ 3.01Å; E51-R314 IonicContact OE1-NE 3.4Å; E51-R314 PolarHBondContact OE1-NE 2.72Å; E51-R314 IonicContact OE1-NH2 3.37Å; E51-R314 IonicContact OE2-CZ 3.75Å; E51-R314 IonicContact OE2-NE 3.97Å; E51-R314 PolarHBondContact OE2-NE 3.46Å; E51-R314 IonicContact OE2-NH2 3.92Å; E51-R314 PolarHBondContact OE2-NH2 3.17Å; E51-A318 HydrophobicContact CG-CB 4.09Å
52	E	97.7	Very high	95.6	Very high	122 Å²	122	35.1 Å²	35.1	57%	0.57	18%	0.178	S	C	*	.	H	α-helix	trans	-64.6	-43.9	178.5	-69.4	-176.7	152	0	0	111.8	L48 Y54 R55	L48-E52 HydrophobicContact CD1-CG 3.87Å; L48-E52 HydrophobicContact CG-CG 4.2Å; L48-E52 WeakPolarHBondContact O-CG 3.4Å; L48-E52 PolarHBondContact O-N 2.96Å; E52-Y54 VanDerWaalsContact C-N 3.3Å; E52-Y54 PolarHBondContact O-N 3.26Å; E52-R55 PolarHBondContact O-N 2.83Å
53	H	98.1	Very high	95.4	Very high	33 Å²	33	36 Å²	36	15%	0.153	19%	0.186	C	C	.	.	H	α-helix	trans	-63.3	-36.9	-176.3	-169.6	54.7	0	0	0	112.7	P49 L50 Q386 K389 L392	P49-H53 WeakPolarHBondContact O-CB 3.45Å; P49-H53 PolarHBondContact O-N 2.93Å; P49-H53 VanDerWaalsContact O-N 3.16Å; L50-H53 PolarHBondContact O-N 3.47Å; H53-Q386 VanDerWaalsContact CE1-CG 3.48Å; H53-Q386 WeakPolarHBondContact CE1-CG 3.22Å; H53-Q386 WeakPolarHBondContact NE2-CB 3.38Å; H53-Q386 WeakPolarHBondContact O-CG 3.1Å; H53-K389 WeakPolarHBondContact CE1-CE 3.38Å; H53-K389 PolarHBondContact CE1-NZ 3.2Å; H53-K389 PolarHBondContact ND1-NZ 3.22Å; H53-K389 WeakPolarHBondContact NE2-CD 3.5Å; H53-K389 WeakPolarHBondContact NE2-CE 3.31Å; H53-K389 PolarHBondContact NE2-NZ 2.5Å; H53-L392 HydrophobicContact CB-CD1 3.77Å
54	Y	98	Very high	95.2	Very high	2 Å²	2	37.5 Å²	37.5	1%	0.008	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.4	13.9	178.9	-66.9	-71	0	0	0	114	L50 E52 F56 H321 A322 I325 S326 Q386 A387 L388 K389	L50-Y54 HydrophobicContact CD1-CD2 3.65Å; L50-Y54 HydrophobicContact CD1-CE2 3.58Å; L50-Y54 HydrophobicContact CG-CD2 4.22Å; L50-Y54 WeakPolarHBondContact O-CD2 3.45Å; L50-Y54 PolarHBondContact O-N 3.48Å; L50-Y54 VanDerWaalsContact O-N 3.14Å; E52-Y54 VanDerWaalsContact C-N 3.3Å; E52-Y54 PolarHBondContact O-N 3.26Å; Y54-F56 PolarHBondContact O-N 2.85Å; Y54-H321 PolarHBondContact O-CD2 2.76Å; Y54-H321 PolarHBondContact O-NE2 3.46Å; Y54-A322 HydrophobicContact CD1-CB 4.25Å; Y54-A322 HydrophobicContact CD2-CB 3.35Å; Y54-A322 HydrophobicContact CE2-CB 3.61Å; Y54-A322 HydrophobicContact CG-CB 3.7Å; Y54-I325 HydrophobicContact CD1-CB 4.2Å; Y54-I325 HydrophobicContact CD1-CG2 4.02Å; Y54-S326 WeakPolarHBondContact CE1-OG 3.34Å; Y54-Q386 HydrophobicContact CD1-CB 4.45Å; Y54-Q386 HydrophobicContact CE1-CB 4.13Å; Y54-A387 PolarHBondContact OH-O 3.11Å; Y54-L388 VanDerWaalsContact OH-CA 3.25Å; Y54-L388 WeakPolarHBondContact OH-CA 3.24Å; Y54-K389 PolarHBondContact OH-N 3.35Å
55	R	96.8	Very high	94.9	Very high	69 Å²	69	37 Å²	37	26%	0.26	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.5	36.7	176.4	-56.3	169.7	169.4	-119.5	-12.1	113.1	E51 E52 H57 E58 F59	E51-R55 PolarHBondContact O-N 2.85Å; E52-R55 PolarHBondContact O-N 2.83Å; R55-H57 PolarHBondContact O-N 2.96Å; R55-H57 VanDerWaalsContact O-N 3.11Å; R55-E58 HydrophobicContact CB-CB 4.44Å; R55-E58 HydrophobicContact CB-CG 4.19Å; R55-E58 IonicContact CZ-OE1 3.36Å; R55-E58 IonicContact NH1-OE1 3.05Å; R55-E58 PolarHBondContact NH1-OE1 3.36Å; R55-E58 IonicContact NH1-OE2 2.7Å; R55-E58 PolarHBondContact NH1-OE2 2.85Å; R55-E58 WeakPolarHBondContact O-CB 3.49Å; R55-E58 PolarHBondContact O-N 3.28Å; R55-F59 WeakPolarHBondContact O-CD2 3.46Å
56	F	96.8	Very high	94.5	Very high	1 Å²	1	36.8 Å²	36.8	0%	0.004	19%	0.185	C	C	.	.	G	3₁₀ helix	trans	-49.8	-40.8	-177.2	179.2	-92	0	0	0	112.7	E51 Y54 E58 F59 H60 R314 L317 A318 H321	E51-F56 HydrophobicContact CB-CB 3.75Å; E51-F56 HydrophobicContact CB-CD1 4.36Å; E51-F56 HydrophobicContact CB-CG 4.2Å; E51-F56 HydrophobicContact CG-CB 4.03Å; E51-F56 HydrophobicContact CG-CD1 4.02Å; E51-F56 HydrophobicContact CG-CG 3.95Å; E51-F56 WeakPolarHBondContact O-CB 3.23Å; E51-F56 PolarHBondContact O-N 3.16Å; Y54-F56 PolarHBondContact O-N 2.85Å; F56-E58 PolarHBondContact O-N 3.24Å; F56-F59 PolarHBondContact O-N 3.42Å; F56-F59 VanDerWaalsContact O-N 3.08Å; F56-H60 HydrophobicContact CD1-CB 4.28Å; F56-H60 HydrophobicContact CD2-CB 4.41Å; F56-H60 AromaticContact CD2-CD2 3.47Å; F56-H60 VanDerWaalsContact CD2-CD2 3.47Å; F56-H60 WeakPolarHBondContact CD2-CD2 3.45Å; F56-H60 HydrophobicContact CE1-CB 3.73Å; F56-H60 HydrophobicContact CE2-CB 3.89Å; F56-H60 AromaticContact CE2-CD2 3.39Å; F56-H60 WeakPolarHBondContact CE2-CD2 3.31Å; F56-H60 AromaticContact CE2-CG 3.8Å; F56-H60 HydrophobicContact CZ-CB 3.52Å; F56-H60 AromaticContact CZ-CD2 3.98Å; F56-H60 AromaticContact CZ-CG 3.94Å; F56-H60 PolarHBondContact O-N 3.49Å; F56-R314 HydrophobicContact CZ-CG 4.45Å; F56-L317 HydrophobicContact CE2-CB 4.47Å; F56-L317 HydrophobicContact CE2-CD2 4.24Å; F56-L317 HydrophobicContact CE2-CG 3.99Å; F56-L317 HydrophobicContact CZ-CD2 4.1Å; F56-L317 HydrophobicContact CZ-CG 4.32Å; F56-A318 HydrophobicContact CD2-CB 3.93Å; F56-A318 HydrophobicContact CE2-CB 3.92Å; F56-H321 HydrophobicContact CD2-CB 4.17Å
57	H	93.8	Very high	94.1	Very high	58 Å²	58	36 Å²	36	27%	0.269	18%	0.183	S	C	.	.	G	3₁₀ helix	trans	-67.7	-17.4	-177.8	-48.7	-51.5	0	0	0	114.9	E51 R55 F59 S61 P62 A63	E51-H57 IonicContact OE2-CE1 3.27Å; E51-H57 PolarHBondContact OE2-CE1 3.37Å; E51-H57 IonicContact OE2-NE2 3.28Å; R55-H57 PolarHBondContact O-N 2.96Å; R55-H57 VanDerWaalsContact O-N 3.11Å; H57-F59 VanDerWaalsContact C-N 3.27Å; H57-S61 WeakPolarHBondContact CA-O 3.11Å; H57-S61 PolarHBondContact ND1-O 3.27Å; H57-P62 VanDerWaalsContact ND1-C 3.3Å; H57-A63 WeakPolarHBondContact CE1-CA 3.43Å; H57-A63 PolarHBondContact CE1-N 2.86Å; H57-A63 VanDerWaalsContact CE1-N 3.29Å; H57-A63 PolarHBondContact ND1-N 3.49Å; H57-A63 VanDerWaalsContact ND1-N 3.13Å
58	E	91.6	Very high	93.6	Very high	85 Å²	85	37 Å²	37	40%	0.397	19%	0.188	S	C	.	.	G	3₁₀ helix	trans	-79.7	-12.4	174.9	-63.7	177.6	-165.5	0	0	112	R55 F56 Q380	R55-E58 HydrophobicContact CB-CB 4.44Å; R55-E58 HydrophobicContact CB-CG 4.19Å; R55-E58 IonicContact CZ-OE1 3.36Å; R55-E58 IonicContact NH1-OE1 3.05Å; R55-E58 PolarHBondContact NH1-OE1 3.36Å; R55-E58 IonicContact NH1-OE2 2.7Å; R55-E58 PolarHBondContact NH1-OE2 2.85Å; R55-E58 WeakPolarHBondContact O-CB 3.49Å; R55-E58 PolarHBondContact O-N 3.28Å; F56-E58 PolarHBondContact O-N 3.24Å; E58-Q380 PolarHBondContact OE2-OE1 3.24Å
59	F	91.9	Very high	93.2	Very high	9 Å²	9	35.9 Å²	35.9	4%	0.039	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-121.1	-40.8	-173.8	-67.5	-90.7	0	0	0	114	R55 F56 H57 H321 I325 M373 L376 L377 Q380 F385	R55-F59 WeakPolarHBondContact O-CD2 3.46Å; F56-F59 PolarHBondContact O-N 3.42Å; F56-F59 VanDerWaalsContact O-N 3.08Å; H57-F59 VanDerWaalsContact C-N 3.27Å; F59-H321 AromaticContact CD2-CE1 3.33Å; F59-H321 WeakPolarHBondContact CD2-CE1 3.34Å; F59-H321 AromaticContact CD2-NE2 3.76Å; F59-H321 AromaticContact CE2-CE1 3.87Å; F59-H321 AromaticContact CG-CE1 3.55Å; F59-I325 HydrophobicContact CE2-CD1 4.02Å; F59-I325 HydrophobicContact CZ-CD1 3.92Å; F59-M373 HydrophobicContact CB-CE 4.41Å; F59-M373 HydrophobicContact CB-SD 4.49Å; F59-M373 HydrophobicContact CD1-CE 3.2Å; F59-M373 HydrophobicContact CD1-SD 3.79Å; F59-M373 HydrophobicContact CE1-CE 3.43Å; F59-M373 VanDerWaalsContact CE1-CE 3.43Å; F59-M373 HydrophobicContact CE1-SD 4.45Å; F59-M373 HydrophobicContact CG-CE 3.86Å; F59-M373 HydrophobicContact CG-SD 4.45Å; F59-M373 HydrophobicContact CZ-CE 4.24Å; F59-L376 HydrophobicContact CB-CD1 4.44Å; F59-L376 HydrophobicContact CD1-CB 3.86Å; F59-L376 HydrophobicContact CD1-CD1 4.33Å; F59-L376 HydrophobicContact CE1-CB 4.23Å; F59-L376 VanDerWaalsContact O-CD1 3.25Å; F59-L376 WeakPolarHBondContact O-CD1 3.16Å; F59-L377 HydrophobicContact CE1-CD2 3.57Å; F59-L377 HydrophobicContact CE1-CG 3.97Å; F59-L377 HydrophobicContact CZ-CD2 3.88Å; F59-Q380 HydrophobicContact CE1-CG 3.85Å; F59-Q380 HydrophobicContact CE2-CG 4.49Å; F59-Q380 HydrophobicContact CZ-CB 4.27Å; F59-Q380 HydrophobicContact CZ-CG 3.61Å; F59-F385 HydrophobicContact CZ-CE1 4.24Å; F59-F385 HydrophobicContact CZ-CZ 4.06Å
60	H	90.3	Very high	92.6	Very high	47 Å²	47	38.3 Å²	38.3	22%	0.218	19%	0.193	C	C	.	.	S	Bend	trans	-111	-96.4	-170.7	-55.8	-65.7	0	0	0	109.9	F56 L317 H321	F56-H60 HydrophobicContact CD1-CB 4.28Å; F56-H60 HydrophobicContact CD2-CB 4.41Å; F56-H60 AromaticContact CD2-CD2 3.47Å; F56-H60 VanDerWaalsContact CD2-CD2 3.47Å; F56-H60 WeakPolarHBondContact CD2-CD2 3.45Å; F56-H60 HydrophobicContact CE1-CB 3.73Å; F56-H60 HydrophobicContact CE2-CB 3.89Å; F56-H60 AromaticContact CE2-CD2 3.39Å; F56-H60 WeakPolarHBondContact CE2-CD2 3.31Å; F56-H60 AromaticContact CE2-CG 3.8Å; F56-H60 HydrophobicContact CZ-CB 3.52Å; F56-H60 AromaticContact CZ-CD2 3.98Å; F56-H60 AromaticContact CZ-CG 3.94Å; F56-H60 PolarHBondContact O-N 3.49Å; H60-L317 HydrophobicContact CB-CD2 4.4Å; H60-H321 AromaticContact CD2-CG 3.83Å; H60-H321 AromaticContact CD2-ND1 3.66Å; H60-H321 AromaticContact NE2-CE1 3.73Å; H60-H321 AromaticContact NE2-CG 3.42Å; H60-H321 AromaticContact NE2-ND1 2.95Å; H60-H321 PolarHBondContact NE2-ND1 3.39Å
61	S	87.6	Confident	92.1	Very high	6 Å²	6	39.3 Å²	39.3	4%	0.042	20%	0.198	C	C	.	.			trans	-133	154.2	-177.4	48.6	0	0	0	0	113.4	H57 E194 R314	H57-S61 WeakPolarHBondContact CA-O 3.11Å; H57-S61 PolarHBondContact ND1-O 3.27Å; S61-E194 VanDerWaalsContact CB-OE1 3.25Å; S61-E194 WeakPolarHBondContact CB-OE1 3.33Å; S61-E194 WeakPolarHBondContact CB-OE2 3.39Å; S61-E194 PolarHBondContact OG-OE1 3.03Å; S61-R314 PolarHBondContact O-NH2 3.27Å; S61-R314 PolarHBondContact OG-NH1 3.32Å
62	P	90.4	Very high	91.7	Very high	35 Å²	35	42.8 Å²	42.8	23%	0.227	21%	0.213	C	C	.	.	P	Polyproline II helix	trans	-58.3	162.8	-179.8	-23.9	34.4	0	0	0	113.1	H57 K138 R314	H57-P62 VanDerWaalsContact ND1-C 3.3Å; P62-K138 HydrophobicContact CB-CB 4.26Å; P62-K138 HydrophobicContact CB-CD 3.82Å; P62-K138 HydrophobicContact CB-CG 3.86Å; P62-K138 HydrophobicContact CG-CB 4.14Å; P62-K138 HydrophobicContact CG-CG 4.29Å; P62-R314 PolarHBondContact O-NH2 3.41Å
63	A	92.4	Very high	91.5	Very high	24 Å²	24	37.4 Å²	37.4	20%	0.198	19%	0.189	C	C	.	.	P	Polyproline II helix	trans	-60.1	139.7	171.5	0	0	0	0	0	110.6	Y43 L48 H57 K138	Y43-A63 WeakPolarHBondContact OH-CA 3.34Å; L48-A63 HydrophobicContact CD1-CB 4.04Å; H57-A63 WeakPolarHBondContact CE1-CA 3.43Å; H57-A63 PolarHBondContact CE1-N 2.86Å; H57-A63 VanDerWaalsContact CE1-N 3.29Å; H57-A63 PolarHBondContact ND1-N 3.49Å; H57-A63 VanDerWaalsContact ND1-N 3.13Å; A63-K138 WeakPolarHBondContact O-CE 3.49Å
64	L	91.4	Very high	91.4	Very high	37 Å²	37	36 Å²	36	19%	0.194	18%	0.182	C	C	.	.	P	Polyproline II helix	trans	-71.4	142.3	174.7	-55.1	176.9	0	0	0	109.7	Y43 D68 F69	Y43-L64 HydrophobicContact CD1-CB 4.02Å; Y43-L64 HydrophobicContact CD2-CD1 4Å; Y43-L64 HydrophobicContact CE1-CB 3.57Å; Y43-L64 HydrophobicContact CE1-CG 4.22Å; Y43-L64 WeakPolarHBondContact CE1-O 3.22Å; Y43-L64 HydrophobicContact CE2-CB 4.37Å; Y43-L64 HydrophobicContact CE2-CD1 3.99Å; Y43-L64 HydrophobicContact CE2-CG 4.11Å; Y43-L64 HydrophobicContact CG-CD1 4.29Å; Y43-L64 PolarHBondContact OH-N 2.84Å; L64-D68 WeakPolarHBondContact CA-OD2 3.35Å; L64-D68 HydrophobicContact CB-CB 4.41Å; L64-D68 HydrophobicContact CD2-CB 4.36Å; L64-F69 HydrophobicContact CB-CE2 3.91Å; L64-F69 HydrophobicContact CB-CZ 4.08Å; L64-F69 HydrophobicContact CD1-CE1 4.44Å; L64-F69 HydrophobicContact CD1-CE2 4.43Å; L64-F69 HydrophobicContact CD1-CZ 3.79Å
65	E	90.1	Very high	91.4	Very high	41 Å²	41	36 Å²	36	19%	0.192	18%	0.182	C	C	.	.			trans	-110.2	165	175.4	-61.9	-176.5	-178.5	0	0	109.9	A67 D68 F69 R137 K138	E65-A67 PolarHBondContact O-N 3.29Å; E65-A67 VanDerWaalsContact O-N 3.1Å; E65-D68 PolarHBondContact N-OD2 3.23Å; E65-D68 WeakPolarHBondContact O-CB 3.27Å; E65-D68 PolarHBondContact O-N 3.14Å; E65-F69 WeakPolarHBondContact O-CD2 3.15Å; E65-R137 WeakPolarHBondContact OE2-CD 3.25Å; E65-R137 IonicContact OE2-NH1 3.86Å; E65-K138 WeakPolarHBondContact OE1-CE 3.44Å; E65-K138 IonicContact OE1-NZ 3.88Å; E65-K138 PolarHBondContact OE1-NZ 3.43Å
66	D	89	Confident	91.5	Very high	95 Å²	95	32.7 Å²	32.7	51%	0.508	17%	0.17	S	C	.	.	H	α-helix	trans	-53.1	-36.7	179.9	-66.5	-1.9	0	0	0	112.4	R40 D68 F69 D70	R40-D66 VanDerWaalsContact CD-OD1 3.27Å; R40-D66 WeakPolarHBondContact CD-OD1 3.1Å; R40-D66 IonicContact NH1-OD2 2.67Å; D66-D68 PolarHBondContact O-N 3.14Å; D66-F69 PolarHBondContact O-N 2.67Å; D66-D70 PolarHBondContact O-N 3.13Å; D66-D70 VanDerWaalsContact O-N 3.13Å
67	A	88.3	Confident	91.6	Very high	8 Å²	8	32.6 Å²	32.6	7%	0.066	17%	0.169	C	C	.	.	H	α-helix	trans	-61.4	-25.8	176.9	0	0	0	0	0	113.8	E65 F69 N71 P135	E65-A67 PolarHBondContact O-N 3.29Å; E65-A67 VanDerWaalsContact O-N 3.1Å; A67-F69 VanDerWaalsContact C-N 3.27Å; A67-F69 PolarHBondContact O-N 3.1Å; A67-N71 VanDerWaalsContact O-CB 3.28Å; A67-N71 WeakPolarHBondContact O-CB 3.48Å; A67-N71 PolarHBondContact O-N 3.33Å; A67-N71 VanDerWaalsContact O-N 3.12Å; A67-P135 HydrophobicContact CB-CB 4.38Å
68	D	88.6	Confident	91.7	Very high	21 Å²	21	29.9 Å²	29.9	11%	0.112	16%	0.157	C	C	.	.	H	α-helix	trans	-72.6	-21.6	175.7	-63.8	-61.6	0	0	0	112	L64 E65 D66 N71 R195	L64-D68 WeakPolarHBondContact CA-OD2 3.35Å; L64-D68 HydrophobicContact CB-CB 4.41Å; L64-D68 HydrophobicContact CD2-CB 4.36Å; E65-D68 PolarHBondContact N-OD2 3.23Å; E65-D68 WeakPolarHBondContact O-CB 3.27Å; E65-D68 PolarHBondContact O-N 3.14Å; D66-D68 PolarHBondContact O-N 3.14Å; D68-N71 PolarHBondContact O-OD1 2.83Å; D68-R195 IonicContact OD1-NE 3.16Å; D68-R195 PolarHBondContact OD1-NE 3.36Å
69	F	89.1	Confident	91.8	Very high	11 Å²	11	25.8 Å²	25.8	5%	0.048	14%	0.138	C	C	.	.	H	α-helix	trans	-93.5	-30.8	177.3	-60.7	-83.1	0	0	0	112.4	L39 R40 Y43 L64 E65 D66 A67 K307	L39-F69 HydrophobicContact CB-CD1 3.85Å; L39-F69 HydrophobicContact CB-CE1 4Å; R40-F69 HydrophobicContact CB-CB 4.33Å; R40-F69 HydrophobicContact CB-CD1 4.21Å; R40-F69 HydrophobicContact CB-CD2 3.91Å; R40-F69 HydrophobicContact CB-CE2 4.27Å; R40-F69 HydrophobicContact CB-CG 3.87Å; R40-F69 HydrophobicContact CG-CD2 4Å; R40-F69 HydrophobicContact CG-CE2 4.27Å; R40-F69 HydrophobicContact CG-CG 4.45Å; Y43-F69 HydrophobicContact CD1-CE2 4.14Å; Y43-F69 AromaticContact CD1-CZ 3.93Å; Y43-F69 HydrophobicContact CD1-CZ 3.93Å; Y43-F69 HydrophobicContact CG-CE2 4.5Å; Y43-F69 AromaticContact CG-CZ 3.83Å; Y43-F69 HydrophobicContact CG-CZ 3.83Å; L64-F69 HydrophobicContact CB-CE2 3.91Å; L64-F69 HydrophobicContact CB-CZ 4.08Å; L64-F69 HydrophobicContact CD1-CE1 4.44Å; L64-F69 HydrophobicContact CD1-CE2 4.43Å; L64-F69 HydrophobicContact CD1-CZ 3.79Å; E65-F69 WeakPolarHBondContact O-CD2 3.15Å; D66-F69 PolarHBondContact O-N 2.67Å; A67-F69 VanDerWaalsContact C-N 3.27Å; A67-F69 PolarHBondContact O-N 3.1Å; F69-K307 PolarHBondContact O-NZ 3.21Å
70	D	86.2	Confident	91.7	Very high	99 Å²	99	26.3 Å²	26.3	53%	0.529	14%	0.14	S	C	.	.	H	α-helix	trans	-95	-9.4	-175.4	-64.1	-26.6	0	0	0	113.5	R40 D66	R40-D70 IonicContact NH1-OD2 3.89Å; D66-D70 PolarHBondContact O-N 3.13Å; D66-D70 VanDerWaalsContact O-N 3.13Å
71	N	86.9	Confident	91.6	Very high	21 Å²	21	26.7 Å²	26.7	11%	0.112	14%	0.14	C	C	.	.	P	Polyproline II helix	trans	-62.7	147.3	-179.5	65.3	-19.2	0	0	0	113.2	A67 D68 M74 P135 K307	A67-N71 VanDerWaalsContact O-CB 3.28Å; A67-N71 WeakPolarHBondContact O-CB 3.48Å; A67-N71 PolarHBondContact O-N 3.33Å; A67-N71 VanDerWaalsContact O-N 3.12Å; D68-N71 PolarHBondContact O-OD1 2.83Å; N71-M74 WeakPolarHBondContact ND2-CE 3.42Å; N71-P135 HydrophobicContact CB-CB 4.41Å; N71-P135 HydrophobicContact CB-CG 4.11Å; N71-K307 PolarHBondContact O-NZ 3.05Å; N71-K307 WeakPolarHBondContact OD1-CE 3.39Å; N71-K307 PolarHBondContact OD1-NZ 3.32Å
72	K	91.1	Very high	91.7	Very high	75 Å²	75	28.8 Å²	28.8	33%	0.326	16%	0.155	S	C	.	.	P	Polyproline II helix	trans	-65.2	153.4	166.7	-59.7	-174.1	-169.5	-173.4	0	110	M74 L160 D161	K72-M74 PolarHBondContact O-N 3.46Å; K72-L160 PolarHBondContact NZ-O 3.41Å; K72-D161 WeakPolarHBondContact CD-O 3.44Å; K72-D161 VanDerWaalsContact CE-O 3.25Å; K72-D161 WeakPolarHBondContact CE-O 3.25Å; K72-D161 VanDerWaalsContact NZ-CA 3.3Å; K72-D161 PolarHBondContact NZ-O 3.44Å
73	P	94	Very high	91.8	Very high	9 Å²	9	27.4 Å²	27.4	6%	0.058	15%	0.146	C	C	.	.	P	Polyproline II helix	trans	-54.7	138.6	174.7	-20.3	27.3	0	0	0	112	I163 S164 D197 L299 P300 A303	P73-I163 HydrophobicContact CB-CG2 4.3Å; P73-I163 CarbonylContact O-C 3.55Å; P73-I163 WeakPolarHBondContact O-CA 3.45Å; P73-S164 PolarHBondContact O-N 3.48Å; P73-D197 WeakPolarHBondContact CA-OD2 3.42Å; P73-D197 HydrophobicContact CB-CB 4.24Å; P73-D197 WeakPolarHBondContact CB-OD2 3.38Å; P73-L299 HydrophobicContact CB-CB 3.98Å; P73-L299 HydrophobicContact CG-CB 4.42Å; P73-P300 HydrophobicContact CG-CB 4.28Å; P73-P300 HydrophobicContact CG-CG 4.28Å; P73-A303 HydrophobicContact CG-CB 3.89Å
74	M	96.2	Very high	91.8	Very high	2 Å²	2	26.9 Å²	26.9	1%	0.01	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	138.5	-178.8	-62.8	-175.5	-64.9	0	0	112	N71 K72 P135 F136 S164 R195 V196 D197 R198	N71-M74 WeakPolarHBondContact ND2-CE 3.42Å; K72-M74 PolarHBondContact O-N 3.46Å; M74-P135 HydrophobicContact SD-CG 4.42Å; M74-F136 HydrophobicContact SD-CE1 4.42Å; M74-S164 CarbonylContact C-O 3.46Å; M74-S164 VanDerWaalsContact CA-O 3.29Å; M74-S164 WeakPolarHBondContact CA-O 3.36Å; M74-R195 HydrophobicContact CE-CB 3.87Å; M74-R195 VanDerWaalsContact CE-O 3.28Å; M74-R195 WeakPolarHBondContact CE-O 3.22Å; M74-V196 HydrophobicContact CB-CB 4.17Å; M74-V196 HydrophobicContact CB-CG1 3.82Å; M74-V196 HydrophobicContact CE-CG1 4.29Å; M74-V196 WeakPolarHBondContact O-CB 3.32Å; M74-D197 PolarHBondContact N-OD2 3.42Å; M74-D197 PolarHBondContact O-N 3.3Å; M74-R198 PolarHBondContact O-N 2.97Å
75	V	97.9	Very high	92	Very high	2 Å²	2	25.6 Å²	25.6	1%	0.012	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	119.6	174.8	-178.2	0	0	0	0	109.2	I163 S164 I165 I166 R198 I200 L299	V75-I163 HydrophobicContact CG2-CD1 4.44Å; V75-S164 PolarHBondContact N-O 3.4Å; V75-I165 CarbonylContact O-C 3.6Å; V75-I165 WeakPolarHBondContact O-CA 3.29Å; V75-I166 PolarHBondContact O-N 3.09Å; V75-R198 WeakPolarHBondContact CA-O 3.46Å; V75-R198 HydrophobicContact CG2-CB 4.36Å; V75-I200 HydrophobicContact CG1-CD1 3.63Å; V75-I200 HydrophobicContact CG1-CG1 3.54Å; V75-L299 HydrophobicContact CG2-CD1 3.38Å
76	L	98.3	Very high	92.2	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	124.5	178.2	-177	65.9	0	0	0	110.6	V78 I166 T168 L189 F192 V196 R198 I199 I200	L76-V78 HydrophobicContact CD2-CG2 3.87Å; L76-V78 HydrophobicContact CG-CG2 3.78Å; L76-I166 HydrophobicContact CD1-CB 3.72Å; L76-I166 HydrophobicContact CD1-CG2 3.59Å; L76-T168 HydrophobicContact CD1-CG2 3.49Å; L76-T168 VanDerWaalsContact CD1-CG2 3.49Å; L76-T168 HydrophobicContact CG-CG2 4.34Å; L76-L189 HydrophobicContact CD1-CD2 4.29Å; L76-L189 HydrophobicContact CD2-CD2 4.12Å; L76-F192 HydrophobicContact CD1-CB 4.15Å; L76-F192 HydrophobicContact CD1-CG 4.32Å; L76-F192 HydrophobicContact CD2-CB 3.93Å; L76-V196 HydrophobicContact CB-CB 4.33Å; L76-V196 HydrophobicContact CB-CG1 4.02Å; L76-V196 HydrophobicContact CB-CG2 4.06Å; L76-R198 PolarHBondContact N-O 3.33Å; L76-I199 HydrophobicContact CB-CG1 4.44Å; L76-I199 HydrophobicContact CD2-CG1 4.37Å; L76-I199 HydrophobicContact CD2-CG2 4.39Å; L76-I199 CarbonylContact O-C 3.58Å; L76-I199 WeakPolarHBondContact O-CA 3.42Å; L76-I200 PolarHBondContact O-N 2.73Å
77	L	97.9	Very high	92.5	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	120.1	172.8	-60.1	-174.7	0	0	0	110.2	K85 F88 I89 I165 I166 T168 I200 L202	L77-K85 HydrophobicContact CB-CB 4.28Å; L77-K85 HydrophobicContact CB-CD 4.37Å; L77-K85 HydrophobicContact CB-CG 4.25Å; L77-K85 HydrophobicContact CD1-CB 4.2Å; L77-K85 WeakPolarHBondContact CD1-O 3.18Å; L77-F88 HydrophobicContact CD1-CD1 4.18Å; L77-F88 HydrophobicContact CD2-CD1 3.99Å; L77-F88 HydrophobicContact CD2-CE1 4.23Å; L77-I89 HydrophobicContact CD1-CD1 3.7Å; L77-I89 HydrophobicContact CD1-CG1 3.25Å; L77-I89 HydrophobicContact CG-CG1 4.46Å; L77-I165 HydrophobicContact CD1-CG2 4.33Å; L77-I165 HydrophobicContact CG-CG2 4.25Å; L77-I166 PolarHBondContact N-O 3.47Å; L77-T168 WeakPolarHBondContact O-CB 3.45Å; L77-T168 WeakPolarHBondContact O-CG2 3.49Å; L77-T168 PolarHBondContact O-OG1 2.84Å; L77-I200 HydrophobicContact CD2-CB 3.56Å; L77-I200 HydrophobicContact CD2-CD1 3.61Å; L77-I200 HydrophobicContact CD2-CG1 3.5Å; L77-I200 HydrophobicContact CD2-CG2 4.13Å; L77-L202 HydrophobicContact CB-CD1 4.35Å; L77-L202 HydrophobicContact CD2-CD1 3.97Å
78	V	96.3	Very high	92.8	Very high	0 Å²	0	21 Å²	21	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	139.6	177.5	-172.1	0	0	0	0	109.3	L76 T168 I171 L189 I199 I200 L201 L202 F214 V217	L76-V78 HydrophobicContact CD2-CG2 3.87Å; L76-V78 HydrophobicContact CG-CG2 3.78Å; V78-T168 HydrophobicContact CG2-CG2 4.49Å; V78-I171 HydrophobicContact CG1-CD1 3.75Å; V78-L189 HydrophobicContact CG1-CD1 3.98Å; V78-L189 HydrophobicContact CG2-CD1 4.49Å; V78-L189 HydrophobicContact CG2-CD2 4.05Å; V78-I199 HydrophobicContact CG2-CG2 4.13Å; V78-I200 PolarHBondContact N-O 3.48Å; V78-L201 HydrophobicContact CB-CD2 3.83Å; V78-L201 HydrophobicContact CG1-CD2 4.3Å; V78-L201 HydrophobicContact CG2-CD2 4.47Å; V78-L201 CarbonylContact O-C 3.46Å; V78-L201 WeakPolarHBondContact O-CA 3.48Å; V78-L202 PolarHBondContact O-N 3.02Å; V78-F214 HydrophobicContact CG1-CE2 3.98Å; V78-V217 HydrophobicContact CG1-CG1 3.97Å
79	G	94	Very high	93.2	Very high	0 Å²	0	20 Å²	20	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	171.7	164.6	176.3	0	0	0	0	0	112.8	K85 I171	G79-K85 PolarHBondContact O-NZ 2.8Å; G79-I171 PolarHBondContact O-N 2.83Å; G79-I171 VanDerWaalsContact O-N 3.08Å
80	Q	90.9	Very high	93.5	Very high	19 Å²	19	24.2 Å²	24.2	9%	0.089	12%	0.123	C	C	.	.	B	Isolated β-bridge	trans	-62.8	174.4	179	-62.9	-146.8	73.4	0	0	112.9	T83 K85 I171 D209 S211 F214	Q80-T83 HydrophobicContact CB-CG2 3.99Å; Q80-T83 WeakPolarHBondContact O-CG2 3.4Å; Q80-T83 PolarHBondContact O-N 2.96Å; Q80-T83 PolarHBondContact O-OG1 2.95Å; Q80-T83 VanDerWaalsContact O-OG1 3.06Å; Q80-K85 PolarHBondContact O-NZ 3.43Å; Q80-I171 CarbonylContact C-O 3.1Å; Q80-I171 VanDerWaalsContact CA-O 3.3Å; Q80-I171 WeakPolarHBondContact CA-O 3.45Å; Q80-I171 HydrophobicContact CG-CB 4.49Å; Q80-D209 PolarHBondContact NE2-O 3.48Å; Q80-S211 PolarHBondContact OE1-OG 3Å; Q80-F214 HydrophobicContact CG-CB 4.29Å; Q80-F214 HydrophobicContact CG-CD1 3.52Å; Q80-F214 HydrophobicContact CG-CE1 4.06Å; Q80-F214 HydrophobicContact CG-CG 4.13Å
81	Y	88	Confident	93.8	Very high	55 Å²	55	20.4 Å²	20.4	22%	0.216	10%	0.102	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57	140.1	176.3	-156.9	-95.3	0	0	0	112.3	T83 E105 P106 T107 I171 L172	Y81-T83 PolarHBondContact O-N 2.86Å; Y81-T83 VanDerWaalsContact O-N 3.11Å; Y81-E105 VanDerWaalsContact CE1-C 3.46Å; Y81-E105 VanDerWaalsContact CZ-C 3.46Å; Y81-E105 VanDerWaalsContact CZ-O 3.31Å; Y81-E105 PolarHBondContact OH-O 3.01Å; Y81-P106 HydrophobicContact CD1-CG 4.44Å; Y81-P106 HydrophobicContact CD2-CB 4.5Å; Y81-P106 HydrophobicContact CD2-CG 4.42Å; Y81-P106 HydrophobicContact CE1-CG 4.26Å; Y81-P106 HydrophobicContact CE2-CB 4.1Å; Y81-P106 HydrophobicContact CE2-CG 4.35Å; Y81-P106 VanDerWaalsContact CZ-N 3.3Å; Y81-P106 WeakPolarHBondContact OH-CA 3.19Å; Y81-T107 PolarHBondContact OH-N 3.13Å; Y81-T107 PolarHBondContact OH-OG1 3.23Å; Y81-I171 PolarHBondContact N-O 3.24Å; Y81-L172 HydrophobicContact CD2-CD2 4.32Å; Y81-L172 HydrophobicContact CG-CD2 4.46Å
82	S	88.4	Confident	94.1	Very high	51 Å²	51	19.5 Å²	19.5	36%	0.357	10%	0.097	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.4	11.3	176.8	-155.3	0	0	0	0	116.6	G84 K234	S82-G84 PolarHBondContact O-N 3.25Å; S82-G84 VanDerWaalsContact O-N 3.13Å; S82-K234 WeakPolarHBondContact O-CE 3.12Å; S82-K234 PolarHBondContact O-NZ 3.33Å
83	T	92.7	Very high	94.2	Very high	5 Å²	5	16 Å²	16	3%	0.031	8%	0.082	C	C	.	.	S	Bend	trans	-71.3	-5	177.6	59.5	0	0	0	0	114.6	Q80 Y81 D204 N233	Q80-T83 HydrophobicContact CB-CG2 3.99Å; Q80-T83 WeakPolarHBondContact O-CG2 3.4Å; Q80-T83 PolarHBondContact O-N 2.96Å; Q80-T83 PolarHBondContact O-OG1 2.95Å; Q80-T83 VanDerWaalsContact O-OG1 3.06Å; Y81-T83 PolarHBondContact O-N 2.86Å; Y81-T83 VanDerWaalsContact O-N 3.11Å; T83-D204 HydrophobicContact CG2-CB 4.29Å; T83-N233 PolarHBondContact O-ND2 3.11Å
84	G	93.4	Very high	94	Very high	13 Å²	13	21.6 Å²	21.6	13%	0.134	11%	0.107	C	C	.	.	S	Bend	trans	92.8	22.8	174.3	0	0	0	0	0	115.7	S82 T87 F88	S82-G84 PolarHBondContact O-N 3.25Å; S82-G84 VanDerWaalsContact O-N 3.13Å; G84-T87 PolarHBondContact O-N 3.27Å; G84-F88 VanDerWaalsContact O-CB 3.28Å; G84-F88 WeakPolarHBondContact O-CB 3.31Å; G84-F88 PolarHBondContact O-N 3.41Å
85	K	95	Very high	93.7	Very high	11 Å²	11	24.8 Å²	24.8	5%	0.048	12%	0.122	C	C	.	.	H	α-helix	trans	-53.8	-57.2	178.2	-63.9	178.8	-68.9	-66.3	0	113.1	L77 G79 Q80 T87 F88 I89 D167 T168 L202	L77-K85 HydrophobicContact CB-CB 4.28Å; L77-K85 HydrophobicContact CB-CD 4.37Å; L77-K85 HydrophobicContact CB-CG 4.25Å; L77-K85 HydrophobicContact CD1-CB 4.2Å; L77-K85 WeakPolarHBondContact CD1-O 3.18Å; G79-K85 PolarHBondContact O-NZ 2.8Å; Q80-K85 PolarHBondContact O-NZ 3.43Å; K85-T87 VanDerWaalsContact C-N 3.32Å; K85-T87 PolarHBondContact O-N 2.91Å; K85-F88 VanDerWaalsContact O-CB 3.3Å; K85-F88 WeakPolarHBondContact O-CB 3.5Å; K85-F88 PolarHBondContact O-N 2.87Å; K85-F88 VanDerWaalsContact O-N 3.1Å; K85-I89 PolarHBondContact O-N 3.47Å; K85-I89 VanDerWaalsContact O-N 3.07Å; K85-D167 WeakPolarHBondContact CB-OD1 3.4Å; K85-T168 WeakPolarHBondContact CE-O 3.06Å; K85-L202 HydrophobicContact CG-CD1 4.25Å; K85-L202 HydrophobicContact CG-CD2 4.31Å
86	T	94.8	Very high	93.5	Very high	12 Å²	12	28.5 Å²	28.5	7%	0.074	14%	0.142	C	C	.	.	H	α-helix	trans	-62.2	-39.1	-179.6	-49.2	0	0	0	0	111.9	I89 R90 F97 M100 I102 T108 D167	T86-I89 PolarHBondContact O-N 3.35Å; T86-R90 PolarHBondContact O-N 3.49Å; T86-R90 VanDerWaalsContact O-N 3.08Å; T86-F97 HydrophobicContact CG2-CE1 4.22Å; T86-F97 HydrophobicContact CG2-CZ 3.83Å; T86-M100 HydrophobicContact CG2-CB 3.93Å; T86-M100 HydrophobicContact CG2-CE 4.19Å; T86-I102 HydrophobicContact CG2-CD1 4.46Å; T86-I102 HydrophobicContact CG2-CG1 3.86Å; T86-T108 PolarHBondContact OG1-OG1 3.19Å; T86-D167 WeakPolarHBondContact CB-OD2 3.41Å; T86-D167 PolarHBondContact OG1-OD2 3Å
87	T	93.8	Very high	93.4	Very high	33 Å²	33	28.7 Å²	28.7	20%	0.202	14%	0.143	C	C	.	.	H	α-helix	trans	-65.6	-37.6	174.5	-49.3	0	0	0	0	111.9	G84 K85 R90 H91 W272	G84-T87 PolarHBondContact O-N 3.27Å; K85-T87 VanDerWaalsContact C-N 3.32Å; K85-T87 PolarHBondContact O-N 2.91Å; T87-R90 PolarHBondContact O-N 3.22Å; T87-H91 WeakPolarHBondContact O-CB 3.43Å; T87-H91 PolarHBondContact O-N 3.15Å; T87-W272 HydrophobicContact CG2-CB 3.9Å
88	F	96.1	Very high	93.2	Very high	3 Å²	3	29.4 Å²	29.4	1%	0.013	15%	0.147	C	C	.	.	H	α-helix	trans	-61.8	-42.6	175.4	-177.5	-78.5	0	0	0	111.1	L77 G84 K85 H91 L92 I200 L202 F271 L292 I296	L77-F88 HydrophobicContact CD1-CD1 4.18Å; L77-F88 HydrophobicContact CD2-CD1 3.99Å; L77-F88 HydrophobicContact CD2-CE1 4.23Å; G84-F88 VanDerWaalsContact O-CB 3.28Å; G84-F88 WeakPolarHBondContact O-CB 3.31Å; G84-F88 PolarHBondContact O-N 3.41Å; K85-F88 VanDerWaalsContact O-CB 3.3Å; K85-F88 WeakPolarHBondContact O-CB 3.5Å; K85-F88 PolarHBondContact O-N 2.87Å; K85-F88 VanDerWaalsContact O-N 3.1Å; F88-H91 PolarHBondContact O-N 3.32Å; F88-L92 HydrophobicContact CE1-CD2 4.44Å; F88-L92 WeakPolarHBondContact O-CB 3.21Å; F88-L92 PolarHBondContact O-N 3.35Å; F88-I200 HydrophobicContact CE1-CD1 3.78Å; F88-I200 HydrophobicContact CZ-CD1 3.94Å; F88-L202 HydrophobicContact CB-CD2 4.15Å; F88-L202 HydrophobicContact CD2-CD2 4.4Å; F88-L202 HydrophobicContact CG-CD2 4.42Å; F88-F271 HydrophobicContact CD2-CB 3.42Å; F88-F271 VanDerWaalsContact CD2-CB 3.42Å; F88-F271 HydrophobicContact CD2-CD1 4.05Å; F88-F271 HydrophobicContact CD2-CD2 4.22Å; F88-F271 AromaticContact CD2-CG 3.62Å; F88-F271 HydrophobicContact CD2-CG 3.62Å; F88-F271 HydrophobicContact CE2-CB 3.86Å; F88-F271 AromaticContact CE2-CD1 3.54Å; F88-F271 HydrophobicContact CE2-CD1 3.54Å; F88-F271 HydrophobicContact CE2-CD2 4.17Å; F88-F271 HydrophobicContact CE2-CE1 4.12Å; F88-F271 AromaticContact CE2-CG 3.56Å; F88-F271 HydrophobicContact CE2-CG 3.56Å; F88-F271 HydrophobicContact CG-CB 4.39Å; F88-F271 HydrophobicContact CZ-CD1 4.49Å; F88-L292 HydrophobicContact CE2-CD2 3.65Å; F88-L292 HydrophobicContact CZ-CD2 3.63Å; F88-L292 HydrophobicContact CZ-CG 4.49Å; F88-I296 HydrophobicContact CZ-CD1 4.48Å
89	I	96.4	Very high	92.8	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-60.7	-52.4	174.5	-58.1	-179.5	0	0	0	110.2	L77 K85 T86 H91 L92 I93 F97 V114 I165 D167	L77-I89 HydrophobicContact CD1-CD1 3.7Å; L77-I89 HydrophobicContact CD1-CG1 3.25Å; L77-I89 HydrophobicContact CG-CG1 4.46Å; K85-I89 PolarHBondContact O-N 3.47Å; K85-I89 VanDerWaalsContact O-N 3.07Å; T86-I89 PolarHBondContact O-N 3.35Å; I89-H91 PolarHBondContact O-N 3.23Å; I89-L92 WeakPolarHBondContact O-CB 3.33Å; I89-L92 PolarHBondContact O-N 3.46Å; I89-L92 VanDerWaalsContact O-N 3.1Å; I89-I93 HydrophobicContact CG2-CD1 4.24Å; I89-I93 WeakPolarHBondContact O-CG1 3.25Å; I89-I93 PolarHBondContact O-N 3.32Å; I89-F97 HydrophobicContact CB-CE1 3.79Å; I89-F97 HydrophobicContact CB-CZ 4.3Å; I89-F97 HydrophobicContact CD1-CE1 4.42Å; I89-F97 HydrophobicContact CD1-CZ 4.08Å; I89-F97 HydrophobicContact CG2-CD1 3.96Å; I89-F97 HydrophobicContact CG2-CE1 3.57Å; I89-F97 HydrophobicContact CG2-CZ 4.18Å; I89-V114 HydrophobicContact CD1-CG2 4.24Å; I89-V114 HydrophobicContact CG2-CG2 4.41Å; I89-I165 HydrophobicContact CD1-CG2 3.83Å; I89-I165 HydrophobicContact CG1-CG2 3.87Å; I89-I165 HydrophobicContact CG2-CD1 4.14Å; I89-D167 HydrophobicContact CD1-CB 3.49Å; I89-D167 VanDerWaalsContact CD1-CB 3.49Å
90	R	94.4	Very high	92.5	Very high	99 Å²	99	33 Å²	33	37%	0.374	18%	0.175	S	C	.	.	H	α-helix	trans	-55.2	-42.8	179.6	179.7	-166	167	141.8	-8.3	111.3	T86 T87 E94 Q95 D96 M100	T86-R90 PolarHBondContact O-N 3.49Å; T86-R90 VanDerWaalsContact O-N 3.08Å; T87-R90 PolarHBondContact O-N 3.22Å; R90-E94 VanDerWaalsContact O-CA 3.22Å; R90-E94 WeakPolarHBondContact O-CA 3.33Å; R90-E94 PolarHBondContact O-N 2.88Å; R90-Q95 PolarHBondContact O-N 3.46Å; R90-D96 WeakPolarHBondContact CD-OD1 3.26Å; R90-D96 WeakPolarHBondContact CG-OD1 3.29Å; R90-D96 IonicContact CZ-OD1 3.69Å; R90-D96 IonicContact CZ-OD2 3.7Å; R90-D96 IonicContact NE-OD1 2.84Å; R90-D96 PolarHBondContact NE-OD1 3.21Å; R90-D96 VanDerWaalsContact NE-OD1 3.16Å; R90-D96 IonicContact NH1-OD1 3.12Å; R90-D96 PolarHBondContact NH1-OD1 3.33Å; R90-D96 IonicContact NH1-OD2 2.73Å; R90-D96 PolarHBondContact NH1-OD2 3.25Å; R90-D96 IonicContact NH2-OD1 3.09Å; R90-M100 HydrophobicContact CB-CE 4.07Å; R90-M100 HydrophobicContact CG-CE 4.25Å
91	H	92.6	Very high	92.1	Very high	18 Å²	18	39.3 Å²	39.3	8%	0.083	20%	0.198	C	C	.	.	H	α-helix	trans	-61.4	-50.4	175.9	-175.5	66.2	0	0	0	110.9	T87 F88 I89 I93 E94 W272 E289 F293 A427	T87-H91 WeakPolarHBondContact O-CB 3.43Å; T87-H91 PolarHBondContact O-N 3.15Å; F88-H91 PolarHBondContact O-N 3.32Å; I89-H91 PolarHBondContact O-N 3.23Å; H91-I93 PolarHBondContact O-N 3.46Å; H91-E94 WeakPolarHBondContact O-CG 3.29Å; H91-E94 PolarHBondContact O-N 3.28Å; H91-W272 PolarHBondContact CE1-O 3.32Å; H91-W272 WeakPolarHBondContact ND1-CA 3.44Å; H91-W272 PolarHBondContact ND1-O 3.02Å; H91-E289 IonicContact CD2-OE1 2.85Å; H91-E289 IonicContact CE1-OE1 3.97Å; H91-E289 IonicContact NE2-OE1 3.16Å; H91-E289 PolarHBondContact NE2-OE1 3.18Å; H91-F293 AromaticContact CD2-CZ 3.99Å; H91-F293 AromaticContact NE2-CZ 3.99Å; H91-A427 WeakPolarHBondContact O-CB 3.42Å
92	L	93	Very high	91.7	Very high	2 Å²	2	40.9 Å²	40.9	1%	0.01	21%	0.209	C	C	.	.	H	α-helix	trans	-59.4	-43.3	-178.2	-163.1	71	0	0	0	113.1	F88 I89 I165 F293 I296 A427 F428	F88-L92 HydrophobicContact CE1-CD2 4.44Å; F88-L92 WeakPolarHBondContact O-CB 3.21Å; F88-L92 PolarHBondContact O-N 3.35Å; I89-L92 WeakPolarHBondContact O-CB 3.33Å; I89-L92 PolarHBondContact O-N 3.46Å; I89-L92 VanDerWaalsContact O-N 3.1Å; L92-I165 HydrophobicContact CD2-CD1 3.79Å; L92-F293 HydrophobicContact CD1-CD1 3.84Å; L92-F293 HydrophobicContact CD1-CE1 3.53Å; L92-F293 HydrophobicContact CD1-CZ 4.06Å; L92-I296 HydrophobicContact CD1-CD1 4.33Å; L92-I296 HydrophobicContact CD2-CD1 4.48Å; L92-A427 PolarHBondContact O-N 2.96Å; L92-A427 VanDerWaalsContact O-N 3.11Å; L92-F428 HydrophobicContact CD1-CE1 3.98Å; L92-F428 HydrophobicContact CD1-CE2 3.7Å; L92-F428 HydrophobicContact CD1-CZ 3.33Å; L92-F428 HydrophobicContact CD2-CE2 4.24Å; L92-F428 HydrophobicContact CD2-CZ 4.05Å; L92-F428 HydrophobicContact CG-CE2 3.65Å; L92-F428 HydrophobicContact CG-CZ 3.7Å
93	I	93.3	Very high	90.9	Very high	3 Å²	3	39.6 Å²	39.6	2%	0.015	20%	0.204	C	C	.	.	H	α-helix	trans	-91.2	-4	-178.1	74.4	178.9	0	0	0	113.4	I89 H91 Q95 F97 L155 N157 V159 L160 I165	I89-I93 HydrophobicContact CG2-CD1 4.24Å; I89-I93 WeakPolarHBondContact O-CG1 3.25Å; I89-I93 PolarHBondContact O-N 3.32Å; H91-I93 PolarHBondContact O-N 3.46Å; I93-Q95 HydrophobicContact CD1-CB 4.36Å; I93-Q95 WeakPolarHBondContact CD1-O 3.28Å; I93-Q95 HydrophobicContact CG1-CB 4.06Å; I93-Q95 VanDerWaalsContact CG1-O 3.28Å; I93-Q95 WeakPolarHBondContact CG1-O 3.31Å; I93-Q95 PolarHBondContact O-N 3.23Å; I93-Q95 VanDerWaalsContact O-N 3.14Å; I93-F97 HydrophobicContact CD1-CB 4.26Å; I93-F97 HydrophobicContact CD1-CD1 4.08Å; I93-L155 HydrophobicContact CD1-CD1 4.41Å; I93-N157 PolarHBondContact O-ND2 3.48Å; I93-V159 HydrophobicContact CG2-CB 4.17Å; I93-V159 HydrophobicContact CG2-CG1 4.11Å; I93-L160 HydrophobicContact CG2-CD2 4.32Å; I93-I165 HydrophobicContact CG2-CD1 4.06Å
94	E	90.8	Very high	89.3	Confident	126 Å²	126	45.1 Å²	45.1	59%	0.589	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	46.1	34.5	-172.7	-65.2	-175.6	158.4	0	0	114.6	R90 H91 A427	R90-E94 VanDerWaalsContact O-CA 3.22Å; R90-E94 WeakPolarHBondContact O-CA 3.33Å; R90-E94 PolarHBondContact O-N 2.88Å; H91-E94 WeakPolarHBondContact O-CG 3.29Å; H91-E94 PolarHBondContact O-N 3.28Å; E94-A427 HydrophobicContact CG-CB 4.32Å
95	Q	90.4	Very high	88	Confident	69 Å²	69	51.7 Å²	51.7	32%	0.322	27%	0.267	S	S	.	.	S	Bend	trans	-152.3	145.3	-173.5	-161.2	-177.2	-12	0	0	110.1	R90 I93 L155 N157	R90-Q95 PolarHBondContact O-N 3.46Å; I93-Q95 HydrophobicContact CD1-CB 4.36Å; I93-Q95 WeakPolarHBondContact CD1-O 3.28Å; I93-Q95 HydrophobicContact CG1-CB 4.06Å; I93-Q95 VanDerWaalsContact CG1-O 3.28Å; I93-Q95 WeakPolarHBondContact CG1-O 3.31Å; I93-Q95 PolarHBondContact O-N 3.23Å; I93-Q95 VanDerWaalsContact O-N 3.14Å; Q95-L155 HydrophobicContact CG-CD1 4.45Å; Q95-N157 PolarHBondContact OE1-ND2 3.08Å
96	D	93.8	Very high	86.5	Confident	79 Å²	79	55.8 Å²	55.8	42%	0.422	30%	0.295	S	S	.	.			trans	-71.3	149.8	165.6	-74.4	-27.3	0	0	0	110.1	R90 M100	R90-D96 WeakPolarHBondContact CD-OD1 3.26Å; R90-D96 WeakPolarHBondContact CG-OD1 3.29Å; R90-D96 IonicContact CZ-OD1 3.69Å; R90-D96 IonicContact CZ-OD2 3.7Å; R90-D96 IonicContact NE-OD1 2.84Å; R90-D96 PolarHBondContact NE-OD1 3.21Å; R90-D96 VanDerWaalsContact NE-OD1 3.16Å; R90-D96 IonicContact NH1-OD1 3.12Å; R90-D96 PolarHBondContact NH1-OD1 3.33Å; R90-D96 IonicContact NH1-OD2 2.73Å; R90-D96 PolarHBondContact NH1-OD2 3.25Å; R90-D96 IonicContact NH2-OD1 3.09Å; D96-M100 WeakPolarHBondContact CA-SD 3.24Å; D96-M100 HydrophobicContact CB-SD 3.47Å; D96-M100 WeakPolarHBondContact CB-SD 3.46Å; D96-M100 WeakPolarHBondContact OD1-CE 3.49Å
97	F	95.2	Very high	85.1	Confident	5 Å²	5	56.8 Å²	56.8	2%	0.022	30%	0.301	C	S	.	.			trans	-128.1	151.7	-180	62.6	-89.3	0	0	0	112.4	T86 I89 I93 G99 M100 I112 V114 A153 L155	T86-F97 HydrophobicContact CG2-CE1 4.22Å; T86-F97 HydrophobicContact CG2-CZ 3.83Å; I89-F97 HydrophobicContact CB-CE1 3.79Å; I89-F97 HydrophobicContact CB-CZ 4.3Å; I89-F97 HydrophobicContact CD1-CE1 4.42Å; I89-F97 HydrophobicContact CD1-CZ 4.08Å; I89-F97 HydrophobicContact CG2-CD1 3.96Å; I89-F97 HydrophobicContact CG2-CE1 3.57Å; I89-F97 HydrophobicContact CG2-CZ 4.18Å; I93-F97 HydrophobicContact CD1-CB 4.26Å; I93-F97 HydrophobicContact CD1-CD1 4.08Å; F97-G99 PolarHBondContact O-N 3.49Å; F97-M100 HydrophobicContact CD1-CB 4.16Å; F97-M100 HydrophobicContact CD1-SD 4.07Å; F97-M100 HydrophobicContact CD2-CB 3.87Å; F97-M100 HydrophobicContact CE1-CB 3.9Å; F97-M100 HydrophobicContact CE1-CE 4.28Å; F97-M100 HydrophobicContact CE1-SD 4.32Å; F97-M100 HydrophobicContact CE2-CB 3.59Å; F97-M100 HydrophobicContact CG-CB 4.16Å; F97-M100 HydrophobicContact CG-SD 4.46Å; F97-M100 HydrophobicContact CZ-CB 3.62Å; F97-M100 PolarHBondContact N-SD 3.2Å; F97-M100 VanDerWaalsContact O-CB 3.29Å; F97-M100 WeakPolarHBondContact O-CB 3.46Å; F97-M100 WeakPolarHBondContact O-CG 3.38Å; F97-M100 PolarHBondContact O-N 3.29Å; F97-I112 HydrophobicContact CE2-CD1 4.44Å; F97-I112 HydrophobicContact CE2-CG2 4.18Å; F97-V114 HydrophobicContact CB-CG1 4.33Å; F97-V114 HydrophobicContact CD2-CG1 4.42Å; F97-V114 HydrophobicContact CD2-CG2 3.71Å; F97-V114 HydrophobicContact CE2-CG2 3.61Å; F97-V114 HydrophobicContact CG-CG1 4.27Å; F97-V114 HydrophobicContact CG-CG2 4.26Å; F97-V114 HydrophobicContact CZ-CG2 4.09Å; F97-A153 HydrophobicContact CD2-CB 4.06Å; F97-L155 HydrophobicContact CB-CD1 4.01Å; F97-L155 HydrophobicContact CB-CD2 4.07Å
98	P	94.3	Very high	83.8	Confident	14 Å²	14	56 Å²	56	9%	0.091	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.5	137.4	-178	-29.2	36.6	0	0	0	113.7	M100 E120 V122 A153	P98-M100 PolarHBondContact O-N 3.18Å; P98-E120 HydrophobicContact CG-CG 3.25Å; P98-E120 WeakPolarHBondContact CG-OE1 3.46Å; P98-V122 HydrophobicContact CB-CG2 3.42Å; P98-V122 VanDerWaalsContact CB-CG2 3.42Å; P98-A153 HydrophobicContact CB-CB 4.3Å; P98-A153 WeakPolarHBondContact O-CB 3.32Å
99	G	87.3	Confident	83	Confident	39 Å²	39	60 Å²	60	40%	0.402	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.7	-2.4	178.4	0	0	0	0	0	114.6	F97	F97-G99 PolarHBondContact O-N 3.49Å
100	M	88.7	Confident	82.7	Confident	37 Å²	37	60.4 Å²	60.4	18%	0.182	32%	0.321	C	S	.	.			trans	-64.1	144.2	174	78.2	-176.8	-70	0	0	111.6	T86 R90 D96 F97 P98 I102	T86-M100 HydrophobicContact CG2-CB 3.93Å; T86-M100 HydrophobicContact CG2-CE 4.19Å; R90-M100 HydrophobicContact CB-CE 4.07Å; R90-M100 HydrophobicContact CG-CE 4.25Å; D96-M100 WeakPolarHBondContact CA-SD 3.24Å; D96-M100 HydrophobicContact CB-SD 3.47Å; D96-M100 WeakPolarHBondContact CB-SD 3.46Å; D96-M100 WeakPolarHBondContact OD1-CE 3.49Å; F97-M100 HydrophobicContact CD1-CB 4.16Å; F97-M100 HydrophobicContact CD1-SD 4.07Å; F97-M100 HydrophobicContact CD2-CB 3.87Å; F97-M100 HydrophobicContact CE1-CB 3.9Å; F97-M100 HydrophobicContact CE1-CE 4.28Å; F97-M100 HydrophobicContact CE1-SD 4.32Å; F97-M100 HydrophobicContact CE2-CB 3.59Å; F97-M100 HydrophobicContact CG-CB 4.16Å; F97-M100 HydrophobicContact CG-SD 4.46Å; F97-M100 HydrophobicContact CZ-CB 3.62Å; F97-M100 PolarHBondContact N-SD 3.2Å; F97-M100 VanDerWaalsContact O-CB 3.29Å; F97-M100 WeakPolarHBondContact O-CB 3.46Å; F97-M100 WeakPolarHBondContact O-CG 3.38Å; F97-M100 PolarHBondContact O-N 3.29Å; P98-M100 PolarHBondContact O-N 3.18Å; M100-I102 HydrophobicContact CE-CD1 3.38Å; M100-I102 HydrophobicContact CE-CG1 3.86Å
101	R	81.2	Confident	82.7	Confident	152 Å²	152	55.7 Å²	55.7	57%	0.574	30%	0.303	S	S	*	.			trans	-137.8	122.5	171.5	-61.6	-178.2	176.7	178.5	-0.1	108.6	T107 T108	R101-T107 WeakPolarHBondContact CD-O 3.44Å; R101-T107 PolarHBondContact O-OG1 3.42Å; R101-T108 PolarHBondContact O-OG1 3.28Å
102	I	79.5	Confident	82.9	Confident	87 Å²	87	55 Å²	55	45%	0.446	30%	0.3	S	S	.	.			trans	-116.6	121.2	175.6	-60.4	178.1	0	0	0	107.4	T86 M100	T86-I102 HydrophobicContact CG2-CD1 4.46Å; T86-I102 HydrophobicContact CG2-CG1 3.86Å; M100-I102 HydrophobicContact CE-CD1 3.38Å; M100-I102 HydrophobicContact CE-CG1 3.86Å
103	G	71.8	Confident	83.1	Confident	24 Å²	24	54.9 Å²	54.9	25%	0.247	30%	0.299	C	S	.	.			trans	-167.7	162.4	176	0	0	0	0	0	112.7	E105	G103-E105 VanDerWaalsContact C-N 3.31Å; G103-E105 PolarHBondContact O-N 3.1Å
104	P	60.8	Low	83.4	Confident	122 Å²	122	54.8 Å²	54.8	79%	0.792	30%	0.299	S	S	*	.	S	Bend	trans	-69.8	-26.2	-178.2	27.6	-33.9	0	0	0	113.3
105	E	65.7	Low	83.6	Confident	151 Å²	151	49.4 Å²	49.4	71%	0.706	27%	0.274	S	S	*	.	S	Bend	trans	-90.9	157.2	176.1	-63.4	-176	176.3	0	0	112	Y81 G103 T107	Y81-E105 VanDerWaalsContact CE1-C 3.46Å; Y81-E105 VanDerWaalsContact CZ-C 3.46Å; Y81-E105 VanDerWaalsContact CZ-O 3.31Å; Y81-E105 PolarHBondContact OH-O 3.01Å; G103-E105 VanDerWaalsContact C-N 3.31Å; G103-E105 PolarHBondContact O-N 3.1Å; E105-T107 WeakPolarHBondContact O-CG2 3.36Å; E105-T107 PolarHBondContact O-N 3.01Å
106	P	63.8	Low	83.9	Confident	96 Å²	96	48.7 Å²	48.7	62%	0.623	27%	0.27	S	S	*	.	S	Bend	trans	-37.8	91.7	169.5	-32.1	38.6	0	0	0	116	Y81	Y81-P106 HydrophobicContact CD1-CG 4.44Å; Y81-P106 HydrophobicContact CD2-CB 4.5Å; Y81-P106 HydrophobicContact CD2-CG 4.42Å; Y81-P106 HydrophobicContact CE1-CG 4.26Å; Y81-P106 HydrophobicContact CE2-CB 4.1Å; Y81-P106 HydrophobicContact CE2-CG 4.35Å; Y81-P106 VanDerWaalsContact CZ-N 3.3Å; Y81-P106 WeakPolarHBondContact OH-CA 3.19Å
107	T	64.3	Low	84	Confident	34 Å²	34	45 Å²	45	21%	0.209	25%	0.251	C	S	.	.			trans	-107.8	-49.7	-170.1	47.3	0	0	0	0	112.7	Y81 R101 E105	Y81-T107 PolarHBondContact OH-N 3.13Å; Y81-T107 PolarHBondContact OH-OG1 3.23Å; R101-T107 WeakPolarHBondContact CD-O 3.44Å; R101-T107 PolarHBondContact O-OG1 3.42Å; E105-T107 WeakPolarHBondContact O-CG2 3.36Å; E105-T107 PolarHBondContact O-N 3.01Å
108	T	67.6	Low	83.9	Confident	16 Å²	16	50 Å²	50	10%	0.098	28%	0.284	C	S	.	.			trans	-88.5	104.3	174.4	-52.3	0	0	0	0	110.3	T86 R101 S110 I112	T86-T108 PolarHBondContact OG1-OG1 3.19Å; R101-T108 PolarHBondContact O-OG1 3.28Å; T108-S110 WeakPolarHBondContact CG2-O 3.46Å; T108-I112 HydrophobicContact CG2-CD1 4.39Å
109	D	79.1	Confident	83.9	Confident	86 Å²	86	54 Å²	54	46%	0.46	31%	0.308	S	S	.	.			trans	-106.2	0.1	177.8	71	-16.3	0	0	0	113.4
110	S	89	Confident	84.3	Confident	9 Å²	9	58.3 Å²	58.3	6%	0.063	32%	0.318	C	S	.	.	S	Bend	trans	-126.8	150.8	-171.2	-61.9	0	0	0	0	111.7	T108 R149	T108-S110 WeakPolarHBondContact CG2-O 3.46Å; S110-R149 CarbonylContact C-O 3.49Å; S110-R149 WeakPolarHBondContact CA-O 3.15Å; S110-R149 VanDerWaalsContact CB-O 3.31Å; S110-R149 WeakPolarHBondContact CB-O 3.29Å
111	F	95.5	Very high	84.7	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	129	166.5	-74.4	-99.7	0	0	0	109.1	F146 R149 F150 M151 I166 D167 T168 P169 Y183 F185 V188 L189 F192	F111-F146 HydrophobicContact CD2-CD2 4.38Å; F111-F146 AromaticContact CD2-CE2 3.55Å; F111-F146 HydrophobicContact CD2-CE2 3.55Å; F111-F146 HydrophobicContact CD2-CZ 4.38Å; F111-F146 HydrophobicContact CE2-CD2 4.47Å; F111-F146 AromaticContact CE2-CE2 3.81Å; F111-F146 HydrophobicContact CE2-CE2 3.81Å; F111-F146 HydrophobicContact CG-CE2 4.1Å; F111-R149 PolarHBondContact N-O 2.92Å; F111-F150 HydrophobicContact CB-CD2 3.69Å; F111-F150 HydrophobicContact CB-CE2 4.41Å; F111-F150 WeakPolarHBondContact O-CA 3.48Å; F111-M151 PolarHBondContact O-N 3.26Å; F111-I166 HydrophobicContact CD1-CG2 4.48Å; F111-D167 WeakPolarHBondContact CA-O 3.49Å; F111-T168 HydrophobicContact CD1-CG2 3.92Å; F111-T168 HydrophobicContact CE1-CG2 3.7Å; F111-P169 VanDerWaalsContact CD2-CD 3.49Å; F111-P169 HydrophobicContact CD2-CG 3.77Å; F111-P169 HydrophobicContact CE2-CG 3.87Å; F111-P169 HydrophobicContact CG-CG 4.41Å; F111-Y183 AromaticContact CE2-CE2 3.86Å; F111-Y183 HydrophobicContact CE2-CE2 3.86Å; F111-F185 HydrophobicContact CE1-CE2 4.39Å; F111-F185 AromaticContact CE2-CD2 3.85Å; F111-F185 HydrophobicContact CE2-CD2 3.85Å; F111-F185 AromaticContact CE2-CE2 3.74Å; F111-F185 HydrophobicContact CE2-CE2 3.74Å; F111-F185 AromaticContact CZ-CD2 3.72Å; F111-F185 HydrophobicContact CZ-CD2 3.72Å; F111-F185 AromaticContact CZ-CE2 3.41Å; F111-F185 HydrophobicContact CZ-CE2 3.41Å; F111-F185 VanDerWaalsContact CZ-CE2 3.41Å; F111-F185 HydrophobicContact CZ-CZ 4.26Å; F111-V188 HydrophobicContact CD1-CG1 4.45Å; F111-V188 HydrophobicContact CE1-CG1 3.83Å; F111-V188 HydrophobicContact CE2-CG1 3.99Å; F111-V188 HydrophobicContact CZ-CB 4.3Å; F111-V188 HydrophobicContact CZ-CG1 3.56Å; F111-L189 HydrophobicContact CE1-CD2 3.84Å; F111-L189 HydrophobicContact CZ-CD2 4.29Å; F111-F192 HydrophobicContact CD1-CD2 4.43Å; F111-F192 AromaticContact CD1-CE2 3.87Å; F111-F192 HydrophobicContact CD1-CE2 3.87Å; F111-F192 HydrophobicContact CE1-CD2 4.31Å; F111-F192 HydrophobicContact CE1-CE2 4.13Å
112	I	96.9	Very high	85.4	Confident	4 Å²	4	53.9 Å²	53.9	2%	0.021	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	111.1	-178.5	-50.8	178.5	0	0	0	108.8	F97 T108 V114 M151 A153 I166 D167	F97-I112 HydrophobicContact CE2-CD1 4.44Å; F97-I112 HydrophobicContact CE2-CG2 4.18Å; T108-I112 HydrophobicContact CG2-CD1 4.39Å; I112-V114 HydrophobicContact CG2-CG2 3.97Å; I112-V114 PolarHBondContact O-N 3.37Å; I112-M151 WeakPolarHBondContact CA-O 3.25Å; I112-M151 HydrophobicContact CB-CG 4.39Å; I112-M151 HydrophobicContact CG1-CG 3.98Å; I112-M151 HydrophobicContact CG1-SD 4.28Å; I112-M151 HydrophobicContact CG2-CG 4.21Å; I112-A153 HydrophobicContact CG2-CB 3.73Å; I112-I166 WeakPolarHBondContact O-CA 3.36Å; I112-D167 HydrophobicContact CB-CB 4.13Å; I112-D167 PolarHBondContact N-O 3.43Å; I112-D167 PolarHBondContact O-N 2.98Å
113	A	97.4	Very high	86.2	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	98.8	169	0	0	0	0	0	109.5	M115 F136 F150 M151 C152 A153 I166	A113-M115 HydrophobicContact CB-CG 4.31Å; A113-M115 HydrophobicContact CB-SD 4.44Å; A113-M115 PolarHBondContact O-N 3.26Å; A113-F136 HydrophobicContact CB-CE2 4.05Å; A113-F136 HydrophobicContact CB-CZ 3.79Å; A113-F150 HydrophobicContact CB-CE2 4.19Å; A113-F150 HydrophobicContact CB-CZ 4.42Å; A113-M151 PolarHBondContact N-O 2.96Å; A113-C152 HydrophobicContact CB-CB 4.21Å; A113-C152 CarbonylContact O-C 3.54Å; A113-C152 WeakPolarHBondContact O-CA 3.27Å; A113-C152 PolarHBondContact O-SG 3.46Å; A113-A153 PolarHBondContact O-N 2.94Å; A113-I166 HydrophobicContact CB-CD1 3.67Å
114	V	97.9	Very high	87.4	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	111.3	175.6	-171.4	0	0	0	0	108.5	I89 F97 I112 A153 L155 L160 I165	I89-V114 HydrophobicContact CD1-CG2 4.24Å; I89-V114 HydrophobicContact CG2-CG2 4.41Å; F97-V114 HydrophobicContact CB-CG1 4.33Å; F97-V114 HydrophobicContact CD2-CG1 4.42Å; F97-V114 HydrophobicContact CD2-CG2 3.71Å; F97-V114 HydrophobicContact CE2-CG2 3.61Å; F97-V114 HydrophobicContact CG-CG1 4.27Å; F97-V114 HydrophobicContact CG-CG2 4.26Å; F97-V114 HydrophobicContact CZ-CG2 4.09Å; I112-V114 HydrophobicContact CG2-CG2 3.97Å; I112-V114 PolarHBondContact O-N 3.37Å; V114-A153 WeakPolarHBondContact CA-O 3.47Å; V114-A153 HydrophobicContact CG2-CB 4.44Å; V114-L155 HydrophobicContact CG1-CD2 4Å; V114-L160 HydrophobicContact CG1-CD1 3.84Å; V114-L160 HydrophobicContact CG1-CD2 4.15Å; V114-I165 HydrophobicContact CB-CB 4.43Å; V114-I165 PolarHBondContact N-O 3.39Å; V114-I165 PolarHBondContact O-N 3.24Å
115	M	96.6	Very high	89	Confident	13 Å²	13	48.5 Å²	48.5	6%	0.064	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	160.3	-172.4	-54.9	-171.3	86.8	0	0	111	A113 R134 F136 A153 Q154 L155 S164	A113-M115 HydrophobicContact CB-CG 4.31Å; A113-M115 HydrophobicContact CB-SD 4.44Å; A113-M115 PolarHBondContact O-N 3.26Å; M115-R134 PolarHBondContact SD-NH1 2.9Å; M115-F136 HydrophobicContact CE-CE2 4.37Å; M115-F136 HydrophobicContact CE-CZ 4.47Å; M115-F136 HydrophobicContact SD-CE2 3.65Å; M115-F136 HydrophobicContact SD-CZ 4.04Å; M115-A153 PolarHBondContact N-O 3.49Å; M115-Q154 VanDerWaalsContact O-CA 3.31Å; M115-Q154 WeakPolarHBondContact O-CA 3.41Å; M115-L155 PolarHBondContact O-N 2.91Å; M115-S164 WeakPolarHBondContact CE-OG 3.43Å
116	H	96.1	Very high	90.3	Very high	55 Å²	55	44.5 Å²	44.5	26%	0.255	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	139.9	170.9	176	93.7	0	0	0	111.1	L155 L160 D161	H116-L155 WeakPolarHBondContact CA-O 3.14Å; H116-L160 HydrophobicContact CB-CB 3.86Å; H116-L160 WeakPolarHBondContact CB-O 3.3Å; H116-D161 IonicContact CD2-OD1 3.84Å; H116-D161 IonicContact CE1-OD1 3.99Å; H116-D161 PolarHBondContact CE1-OD1 3.11Å; H116-D161 IonicContact CG-OD1 2.74Å; H116-D161 IonicContact ND1-OD1 3.41Å; H116-D161 PolarHBondContact ND1-OD1 2.97Å; H116-D161 IonicContact NE2-OD1 3.1Å
117	G	94.6	Very high	91.8	Very high	1 Å²	1	42.3 Å²	42.3	1%	0.01	25%	0.254	C	S	.	.			trans	-147.6	156	162.6	0	0	0	0	0	110.9	T119 L155 P156	G117-T119 PolarHBondContact O-N 3.27Å; G117-L155 PolarHBondContact N-O 3.35Å; G117-L155 VanDerWaalsContact N-O 3.11Å; G117-L155 CarbonylContact O-C 3.2Å; G117-P156 VanDerWaalsContact O-CA 3.28Å; G117-P156 WeakPolarHBondContact O-CA 3.39Å; G117-P156 WeakPolarHBondContact O-CD 3.27Å
118	P	93.9	Very high	93.1	Very high	110 Å²	110	40.8 Å²	40.8	71%	0.714	25%	0.245	S	C	*	.	S	Bend	trans	-66.7	-21.3	-179.5	28.8	-36	0	0	0	112.7
119	T	94.3	Very high	94.4	Very high	99 Å²	99	40.6 Å²	40.6	61%	0.607	24%	0.244	S	C	*	.	S	Bend	trans	-134.4	147.4	-179.5	54.5	0	0	0	0	109.7	G117	G117-T119 PolarHBondContact O-N 3.27Å
120	E	96.5	Very high	95	Very high	128 Å²	128	41.4 Å²	41.4	60%	0.598	25%	0.251	S	S	*	.			trans	-66.8	132.1	173.5	-169.6	176.2	167.2	0	0	111.1	P98 Q154 L155	P98-E120 HydrophobicContact CG-CG 3.25Å; P98-E120 WeakPolarHBondContact CG-OE1 3.46Å; E120-Q154 CarbonylContact C-O 3.23Å; E120-Q154 VanDerWaalsContact CA-O 3.24Å; E120-Q154 WeakPolarHBondContact CA-O 3.31Å; E120-L155 HydrophobicContact CG-CB 4.4Å
121	G	96.2	Very high	94.9	Very high	29 Å²	29	43.4 Å²	43.4	30%	0.299	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	177.8	173.7	178.2	0	0	0	0	0	114.7	Q154	G121-Q154 PolarHBondContact N-O 2.95Å; G121-Q154 PolarHBondContact O-N 2.88Å
122	V	96.4	Very high	94.5	Very high	67 Å²	67	47.3 Å²	47.3	41%	0.406	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	131.9	175.8	-179.2	0	0	0	0	109.7	P98 M151 C152	P98-V122 HydrophobicContact CB-CG2 3.42Å; P98-V122 VanDerWaalsContact CB-CG2 3.42Å; V122-M151 HydrophobicContact CG1-CB 3.9Å; V122-M151 HydrophobicContact CG1-CG 4.27Å; V122-M151 HydrophobicContact CG1-SD 3.85Å; V122-C152 CarbonylContact C-O 3.56Å; V122-C152 WeakPolarHBondContact CA-O 3.28Å
123	V	95.9	Very high	94	Very high	41 Å²	41	57.6 Å²	57.6	25%	0.248	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	117.2	170.9	-175.6	0	0	0	0	108.9	A127 L128 M151 C152	V123-A127 HydrophobicContact CG1-CB 4Å; V123-L128 HydrophobicContact CG1-CB 4.28Å; V123-L128 HydrophobicContact CG1-CD1 4.5Å; V123-M151 CarbonylContact O-C 3.56Å; V123-M151 WeakPolarHBondContact O-CA 3.48Å; V123-C152 HydrophobicContact CB-CB 4.35Å; V123-C152 PolarHBondContact N-O 3.12Å; V123-C152 PolarHBondContact O-N 3.49Å
124	P	96.1	Very high	93.6	Very high	80 Å²	80	60 Å²	60	52%	0.519	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.9	150	176.9	-22.7	33.5	0	0	0	112.8	N126 A127 L128	P124-N126 VanDerWaalsContact C-N 3.32Å; P124-N126 PolarHBondContact O-N 3.1Å; P124-A127 WeakPolarHBondContact O-CB 3.37Å; P124-A127 PolarHBondContact O-N 3.1Å; P124-L128 PolarHBondContact O-N 3.26Å
125	G	94.8	Very high	93.2	Very high	0 Å²	0	60.5 Å²	60.5	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-55	-41.5	-176	0	0	0	0	0	114	A127 L128 V129 F150	G125-A127 VanDerWaalsContact C-N 3.26Å; G125-A127 PolarHBondContact O-N 2.89Å; G125-L128 WeakPolarHBondContact O-CB 3.34Å; G125-L128 PolarHBondContact O-N 2.82Å; G125-V129 WeakPolarHBondContact O-CG1 3.5Å; G125-V129 PolarHBondContact O-N 3.09Å; G125-F150 WeakPolarHBondContact CA-O 3.15Å; G125-F150 PolarHBondContact N-O 3.38Å
126	N	93.7	Very high	93	Very high	67 Å²	67	59.9 Å²	59.9	36%	0.358	33%	0.334	S	S	.	.	H	α-helix	trans	-59.4	-34.8	176.8	-67.1	-41.6	0	0	0	113.2	P124 L147 N148	P124-N126 VanDerWaalsContact C-N 3.32Å; P124-N126 PolarHBondContact O-N 3.1Å; N126-L147 WeakPolarHBondContact OD1-CB 3.22Å; N126-L147 VanDerWaalsContact OD1-CD1 3.29Å; N126-L147 WeakPolarHBondContact OD1-CD1 3.28Å; N126-N148 PolarHBondContact ND2-OD1 2.79Å; N126-N148 VanDerWaalsContact ND2-OD1 3.13Å
127	A	94.3	Very high	92.8	Very high	50 Å²	50	62.1 Å²	62.1	41%	0.413	34%	0.341	S	S	.	.	H	α-helix	trans	-81.2	-30	175.4	0	0	0	0	0	111.8	V123 P124 G125 V130	V123-A127 HydrophobicContact CG1-CB 4Å; P124-A127 WeakPolarHBondContact O-CB 3.37Å; P124-A127 PolarHBondContact O-N 3.1Å; G125-A127 VanDerWaalsContact C-N 3.26Å; G125-A127 PolarHBondContact O-N 2.89Å; A127-V130 WeakPolarHBondContact O-CG2 3.45Å
128	L	92.8	Very high	92.7	Very high	2 Å²	2	64.9 Å²	64.9	1%	0.01	35%	0.353	C	S	.	.	H	α-helix	trans	-71.2	-36.9	-178.6	-171.2	59.5	0	0	0	112.7	V123 P124 G125 V130 D131 R134 F136 F150 C152	V123-L128 HydrophobicContact CG1-CB 4.28Å; V123-L128 HydrophobicContact CG1-CD1 4.5Å; P124-L128 PolarHBondContact O-N 3.26Å; G125-L128 WeakPolarHBondContact O-CB 3.34Å; G125-L128 PolarHBondContact O-N 2.82Å; L128-V130 PolarHBondContact O-N 2.98Å; L128-D131 PolarHBondContact O-N 3.11Å; L128-R134 HydrophobicContact CD1-CB 4.25Å; L128-R134 HydrophobicContact CD1-CG 4Å; L128-F136 HydrophobicContact CD1-CD2 3.86Å; L128-F136 HydrophobicContact CD1-CE2 4.4Å; L128-F136 HydrophobicContact CD2-CD2 3.61Å; L128-F136 HydrophobicContact CD2-CE2 4.08Å; L128-F136 HydrophobicContact CD2-CG 4.27Å; L128-F136 HydrophobicContact CG-CB 4.22Å; L128-F136 HydrophobicContact CG-CD2 3.62Å; L128-F136 HydrophobicContact CG-CE2 4.42Å; L128-F136 HydrophobicContact CG-CG 4.3Å; L128-F150 HydrophobicContact CD2-CD1 4.19Å; L128-F150 HydrophobicContact CD2-CE1 3.41Å; L128-F150 VanDerWaalsContact CD2-CE1 3.41Å; L128-F150 HydrophobicContact CD2-CE2 4.45Å; L128-F150 HydrophobicContact CD2-CZ 3.56Å; L128-F150 HydrophobicContact CG-CE1 4.21Å; L128-C152 HydrophobicContact CD1-CB 3.96Å; L128-C152 HydrophobicContact CD2-CB 3.49Å; L128-C152 VanDerWaalsContact CD2-CB 3.49Å; L128-C152 HydrophobicContact CG-CB 4.36Å
129	V	93.6	Very high	92.6	Very high	11 Å²	11	59.7 Å²	59.7	7%	0.067	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-2.9	-179.5	-59.1	0	0	0	0	114.4	G125 F136 R137 L139 N140 L147	G125-V129 WeakPolarHBondContact O-CG1 3.5Å; G125-V129 PolarHBondContact O-N 3.09Å; V129-F136 WeakPolarHBondContact CG1-O 3.4Å; V129-R137 WeakPolarHBondContact O-CA 3.44Å; V129-R137 VanDerWaalsContact O-CG 3.31Å; V129-R137 WeakPolarHBondContact O-CG 3.2Å; V129-L139 HydrophobicContact CG1-CB 4.09Å; V129-N140 HydrophobicContact CG2-CB 4.41Å; V129-L147 HydrophobicContact CG1-CD2 3.52Å; V129-L147 HydrophobicContact CG2-CD1 4.1Å; V129-L147 HydrophobicContact CG2-CD2 4.29Å
130	V	91.7	Very high	92.4	Very high	103 Å²	103	59.6 Å²	59.6	62%	0.624	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.6	-9.3	172.6	-60.6	0	0	0	0	113.1	A127 L128 P132	A127-V130 WeakPolarHBondContact O-CG2 3.45Å; L128-V130 PolarHBondContact O-N 2.98Å; V130-P132 WeakPolarHBondContact O-CD 3.49Å
131	D	88.7	Confident	92.1	Very high	52 Å²	52	57.8 Å²	57.8	28%	0.278	32%	0.321	S	S	.	.			trans	-80.5	113.7	179	-173.3	-9.2	0	0	0	110.9	L128 R133 R134 R137	L128-D131 PolarHBondContact O-N 3.11Å; D131-R133 PolarHBondContact O-N 3.16Å; D131-R133 WeakPolarHBondContact OD1-CB 3.2Å; D131-R133 PolarHBondContact OD1-N 2.89Å; D131-R134 HydrophobicContact CB-CB 4.24Å; D131-R134 HydrophobicContact CB-CG 3.96Å; D131-R134 PolarHBondContact O-N 3.34Å; D131-R134 VanDerWaalsContact OD2-CG 3.28Å; D131-R134 WeakPolarHBondContact OD2-CG 3.35Å; D131-R137 WeakPolarHBondContact O-CG 3.42Å
132	P	86.6	Confident	91.8	Very high	81 Å²	81	58.8 Å²	58.8	53%	0.526	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-13.7	178.4	30.8	-36.3	0	0	0	113.9	V130 R134	V130-P132 WeakPolarHBondContact O-CD 3.49Å; P132-R134 VanDerWaalsContact C-N 3.32Å
133	R	86.1	Confident	91.6	Very high	220 Å²	220	56.9 Å²	56.9	83%	0.83	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.3	-5.6	178.5	-58.1	176.7	179.6	166.6	-0.2	112.5	D131	D131-R133 PolarHBondContact O-N 3.16Å; D131-R133 WeakPolarHBondContact OD1-CB 3.2Å; D131-R133 PolarHBondContact OD1-N 2.89Å
134	R	88.3	Confident	91.4	Very high	51 Å²	51	60.1 Å²	60.1	19%	0.192	33%	0.328	C	S	.	.	S	Bend	trans	-112.9	139	-176.8	-62.3	-70.9	-176.1	174.6	-1.3	109.8	M115 L128 D131 P132 F136	M115-R134 PolarHBondContact SD-NH1 2.9Å; L128-R134 HydrophobicContact CD1-CB 4.25Å; L128-R134 HydrophobicContact CD1-CG 4Å; D131-R134 HydrophobicContact CB-CB 4.24Å; D131-R134 HydrophobicContact CB-CG 3.96Å; D131-R134 PolarHBondContact O-N 3.34Å; D131-R134 VanDerWaalsContact OD2-CG 3.28Å; D131-R134 WeakPolarHBondContact OD2-CG 3.35Å; P132-R134 VanDerWaalsContact C-N 3.32Å; R134-F136 HydrophobicContact CB-CD2 3.96Å; R134-F136 PolarHBondContact O-N 3.46Å
135	P	90	Very high	91.2	Very high	10 Å²	10	58.4 Å²	58.4	7%	0.065	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.9	30	-175.6	35.2	-38.2	0	0	0	112.7	A67 N71 M74 W191	A67-P135 HydrophobicContact CB-CB 4.38Å; N71-P135 HydrophobicContact CB-CB 4.41Å; N71-P135 HydrophobicContact CB-CG 4.11Å; M74-P135 HydrophobicContact SD-CG 4.42Å; P135-W191 VanDerWaalsContact O-CH2 3.25Å; P135-W191 WeakPolarHBondContact O-CH2 3.42Å
136	F	93.5	Very high	91.1	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-114.5	-5.2	-169.6	-60.1	-49.4	0	0	0	114	M74 A113 M115 L128 V129 R134 K138 L139 F150 I166 W191 F192	M74-F136 HydrophobicContact SD-CE1 4.42Å; A113-F136 HydrophobicContact CB-CE2 4.05Å; A113-F136 HydrophobicContact CB-CZ 3.79Å; M115-F136 HydrophobicContact CE-CE2 4.37Å; M115-F136 HydrophobicContact CE-CZ 4.47Å; M115-F136 HydrophobicContact SD-CE2 3.65Å; M115-F136 HydrophobicContact SD-CZ 4.04Å; L128-F136 HydrophobicContact CD1-CD2 3.86Å; L128-F136 HydrophobicContact CD1-CE2 4.4Å; L128-F136 HydrophobicContact CD2-CD2 3.61Å; L128-F136 HydrophobicContact CD2-CE2 4.08Å; L128-F136 HydrophobicContact CD2-CG 4.27Å; L128-F136 HydrophobicContact CG-CB 4.22Å; L128-F136 HydrophobicContact CG-CD2 3.62Å; L128-F136 HydrophobicContact CG-CE2 4.42Å; L128-F136 HydrophobicContact CG-CG 4.3Å; V129-F136 WeakPolarHBondContact CG1-O 3.4Å; R134-F136 HydrophobicContact CB-CD2 3.96Å; R134-F136 PolarHBondContact O-N 3.46Å; F136-K138 PolarHBondContact O-N 2.85Å; F136-K138 VanDerWaalsContact O-N 3.14Å; F136-L139 HydrophobicContact CB-CD1 4.05Å; F136-L139 HydrophobicContact CD1-CD1 3.92Å; F136-L139 HydrophobicContact CG-CD1 4.33Å; F136-L139 VanDerWaalsContact O-CB 3.22Å; F136-L139 WeakPolarHBondContact O-CB 3.47Å; F136-L139 PolarHBondContact O-N 2.89Å; F136-F150 HydrophobicContact CB-CE1 4.05Å; F136-F150 HydrophobicContact CB-CZ 4.29Å; F136-F150 HydrophobicContact CD1-CE1 4.39Å; F136-F150 AromaticContact CD1-CZ 3.82Å; F136-F150 HydrophobicContact CD1-CZ 3.82Å; F136-F150 HydrophobicContact CD2-CZ 4.15Å; F136-F150 HydrophobicContact CE1-CZ 4.17Å; F136-F150 HydrophobicContact CE2-CZ 4.44Å; F136-F150 HydrophobicContact CG-CE1 4.08Å; F136-F150 AromaticContact CG-CZ 3.82Å; F136-F150 HydrophobicContact CG-CZ 3.82Å; F136-F150 HydrophobicContact CZ-CZ 4.46Å; F136-I166 HydrophobicContact CE1-CD1 4.47Å; F136-I166 HydrophobicContact CZ-CD1 4.32Å; F136-W191 HydrophobicContact CD1-CH2 4.24Å; F136-W191 HydrophobicContact CD1-CZ3 4.49Å; F136-F192 HydrophobicContact CD1-CE1 4.5Å; F136-F192 HydrophobicContact CE1-CE1 4.07Å
137	R	91.8	Very high	91.1	Very high	102 Å²	102	55.3 Å²	55.3	39%	0.385	30%	0.304	S	S	.	.	G	3₁₀ helix	trans	-54.8	-38.5	-174.7	-64.1	-171	58	-169.9	5.9	113.9	E65 V129 D131 L139 N140	E65-R137 WeakPolarHBondContact OE2-CD 3.25Å; E65-R137 IonicContact OE2-NH1 3.86Å; V129-R137 WeakPolarHBondContact O-CA 3.44Å; V129-R137 VanDerWaalsContact O-CG 3.31Å; V129-R137 WeakPolarHBondContact O-CG 3.2Å; D131-R137 WeakPolarHBondContact O-CG 3.42Å; R137-L139 PolarHBondContact O-N 3.37Å; R137-N140 WeakPolarHBondContact O-CB 3.46Å; R137-N140 PolarHBondContact O-N 3.03Å
138	K	90.8	Very high	91.1	Very high	60 Å²	60	58.3 Å²	58.3	26%	0.261	31%	0.313	S	S	.	.	G	3₁₀ helix	trans	-68.6	-14.5	-179.6	-58.3	-55.2	-163.4	-155.6	0	113.8	P62 A63 E65 F136 N140 A141 W191	P62-K138 HydrophobicContact CB-CB 4.26Å; P62-K138 HydrophobicContact CB-CD 3.82Å; P62-K138 HydrophobicContact CB-CG 3.86Å; P62-K138 HydrophobicContact CG-CB 4.14Å; P62-K138 HydrophobicContact CG-CG 4.29Å; A63-K138 WeakPolarHBondContact O-CE 3.49Å; E65-K138 WeakPolarHBondContact OE1-CE 3.44Å; E65-K138 IonicContact OE1-NZ 3.88Å; E65-K138 PolarHBondContact OE1-NZ 3.43Å; F136-K138 PolarHBondContact O-N 2.85Å; F136-K138 VanDerWaalsContact O-N 3.14Å; K138-N140 PolarHBondContact O-N 2.72Å; K138-A141 WeakPolarHBondContact O-CB 3.39Å; K138-A141 PolarHBondContact O-N 3.41Å; K138-W191 HydrophobicContact CB-CZ2 4.14Å
139	L	92.1	Very high	91.1	Very high	0 Å²	0	61.6 Å²	61.6	0%	0	33%	0.325	C	S	.	.	G	3₁₀ helix	trans	-65.6	-14.9	173.4	-69.8	174.3	0	0	0	113.2	V129 F136 R137 A141 F142 F146 L147 F150 W191 F192	V129-L139 HydrophobicContact CG1-CB 4.09Å; F136-L139 HydrophobicContact CB-CD1 4.05Å; F136-L139 HydrophobicContact CD1-CD1 3.92Å; F136-L139 HydrophobicContact CG-CD1 4.33Å; F136-L139 VanDerWaalsContact O-CB 3.22Å; F136-L139 WeakPolarHBondContact O-CB 3.47Å; F136-L139 PolarHBondContact O-N 2.89Å; R137-L139 PolarHBondContact O-N 3.37Å; L139-A141 PolarHBondContact O-N 2.71Å; L139-A141 VanDerWaalsContact O-N 3.09Å; L139-F142 HydrophobicContact CD2-CD2 3.73Å; L139-F142 HydrophobicContact CD2-CE2 3.71Å; L139-F142 PolarHBondContact O-N 2.81Å; L139-F146 HydrophobicContact CB-CE1 3.93Å; L139-F146 HydrophobicContact CD1-CE1 4.07Å; L139-F146 HydrophobicContact CD1-CZ 4.36Å; L139-F146 HydrophobicContact CD2-CE1 3.96Å; L139-F146 HydrophobicContact CD2-CZ 4.24Å; L139-F146 HydrophobicContact CG-CE1 4.22Å; L139-L147 HydrophobicContact CB-CD2 4.47Å; L139-F150 HydrophobicContact CD1-CD1 3.96Å; L139-F150 HydrophobicContact CD1-CE1 3.37Å; L139-F150 HydrophobicContact CD1-CE2 4.28Å; L139-F150 HydrophobicContact CD1-CZ 3.57Å; L139-W191 HydrophobicContact CD1-CH2 4.05Å; L139-W191 HydrophobicContact CD1-CZ3 3.91Å; L139-W191 HydrophobicContact CD2-CD2 3.59Å; L139-W191 HydrophobicContact CD2-CE3 3.38Å; L139-W191 HydrophobicContact CD2-CG 4.3Å; L139-W191 HydrophobicContact CD2-CH2 3.95Å; L139-W191 HydrophobicContact CD2-CZ2 4.13Å; L139-W191 HydrophobicContact CD2-CZ3 3.59Å; L139-W191 HydrophobicContact CG-CD2 4.35Å; L139-W191 HydrophobicContact CG-CE3 4.08Å; L139-W191 HydrophobicContact CG-CH2 3.69Å; L139-W191 HydrophobicContact CG-CZ2 3.96Å; L139-W191 HydrophobicContact CG-CZ3 3.76Å; L139-F192 HydrophobicContact CD1-CZ 4.03Å
140	N	89.9	Confident	91.2	Very high	97 Å²	97	61.2 Å²	61.2	52%	0.519	32%	0.323	S	S	.	.	G	3₁₀ helix	trans	-56.1	-24.8	172.6	-168.5	39.5	0	0	0	112.9	V129 R137 K138 F142 G143	V129-N140 HydrophobicContact CG2-CB 4.41Å; R137-N140 WeakPolarHBondContact O-CB 3.46Å; R137-N140 PolarHBondContact O-N 3.03Å; K138-N140 PolarHBondContact O-N 2.72Å; N140-F142 PolarHBondContact O-N 2.76Å; N140-G143 PolarHBondContact O-N 3.38Å; N140-G143 VanDerWaalsContact O-N 3.09Å
141	A	90.1	Very high	91.4	Very high	90 Å²	90	58.3 Å²	58.3	74%	0.744	30%	0.303	S	S	*	.	G	3₁₀ helix	trans	-62.8	-24.5	176.3	0	0	0	0	0	113.9	K138 L139 G143	K138-A141 WeakPolarHBondContact O-CB 3.39Å; K138-A141 PolarHBondContact O-N 3.41Å; L139-A141 PolarHBondContact O-N 2.71Å; L139-A141 VanDerWaalsContact O-N 3.09Å; A141-G143 VanDerWaalsContact C-N 3.25Å; A141-G143 PolarHBondContact O-N 3.23Å
142	F	91.6	Very high	91.8	Very high	50 Å²	50	55.8 Å²	55.8	22%	0.219	29%	0.289	C	S	.	.	G	3₁₀ helix	trans	-81.8	-4.1	176.9	-63.4	-71.2	0	0	0	113.4	L139 N140 F146 A187 V188 W191	L139-F142 HydrophobicContact CD2-CD2 3.73Å; L139-F142 HydrophobicContact CD2-CE2 3.71Å; L139-F142 PolarHBondContact O-N 2.81Å; N140-F142 PolarHBondContact O-N 2.76Å; F142-F146 HydrophobicContact CB-CB 3.68Å; F142-F146 HydrophobicContact CB-CD1 3.75Å; F142-F146 HydrophobicContact CB-CG 3.78Å; F142-F146 HydrophobicContact CD2-CD1 4.46Å; F142-F146 HydrophobicContact CG-CD1 4.47Å; F142-A187 HydrophobicContact CE1-CB 3.87Å; F142-A187 HydrophobicContact CZ-CB 4.5Å; F142-V188 HydrophobicContact CB-CG2 4.38Å; F142-V188 HydrophobicContact CD1-CG2 3.57Å; F142-V188 HydrophobicContact CD2-CG2 3.88Å; F142-V188 HydrophobicContact CE1-CG2 3.68Å; F142-V188 HydrophobicContact CE2-CG2 3.99Å; F142-V188 HydrophobicContact CG-CG2 3.68Å; F142-V188 HydrophobicContact CZ-CB 4.42Å; F142-V188 HydrophobicContact CZ-CG2 3.89Å; F142-W191 HydrophobicContact CE2-CB 4.04Å; F142-W191 HydrophobicContact CE2-CG 4.01Å; F142-W191 HydrophobicContact CZ-CB 3.96Å; F142-W191 HydrophobicContact CZ-CG 4.34Å
143	G	91.3	Very high	92.3	Very high	28 Å²	28	52 Å²	52	29%	0.289	26%	0.264	S	S	.	.	H	α-helix	trans	73.7	176.5	172.1	0	0	0	0	0	115.3	N140 A141 A145 F146 L147	N140-G143 PolarHBondContact O-N 3.38Å; N140-G143 VanDerWaalsContact O-N 3.09Å; A141-G143 VanDerWaalsContact C-N 3.25Å; A141-G143 PolarHBondContact O-N 3.23Å; G143-A145 VanDerWaalsContact C-N 3.27Å; G143-A145 PolarHBondContact O-N 3.19Å; G143-F146 PolarHBondContact O-N 3.32Å; G143-F146 VanDerWaalsContact O-N 3.14Å; G143-L147 WeakPolarHBondContact O-CG 3.45Å; G143-L147 PolarHBondContact O-N 3.32Å; G143-L147 VanDerWaalsContact O-N 3.08Å
144	N	91.8	Very high	92.8	Very high	108 Å²	108	42.9 Å²	42.9	58%	0.578	23%	0.231	S	C	*	.	H	α-helix	trans	-61.2	-30.9	-171.3	-72	-29.8	0	0	0	114.2	F146 L147 N148	N144-F146 VanDerWaalsContact C-N 3.3Å; N144-F146 PolarHBondContact O-N 2.75Å; N144-L147 PolarHBondContact O-N 2.87Å; N144-N148 WeakPolarHBondContact O-CB 3.47Å; N144-N148 PolarHBondContact O-N 3.14Å; N144-N148 PolarHBondContact O-ND2 2.99Å
145	A	91.3	Very high	93.3	Very high	45 Å²	45	40.5 Å²	40.5	37%	0.372	22%	0.222	S	C	.	.	H	α-helix	trans	-61.4	-40.3	178.3	0	0	0	0	0	111.8	G143 G182	G143-A145 VanDerWaalsContact C-N 3.27Å; G143-A145 PolarHBondContact O-N 3.19Å; A145-G182 WeakPolarHBondContact CB-O 3.25Å
146	F	94.1	Very high	93.6	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-73.7	-48.1	173.1	171.6	-102.9	0	0	0	111.8	F111 L139 F142 G143 N144 N148 R149 F150 Y183 V188	F111-F146 HydrophobicContact CD2-CD2 4.38Å; F111-F146 AromaticContact CD2-CE2 3.55Å; F111-F146 HydrophobicContact CD2-CE2 3.55Å; F111-F146 HydrophobicContact CD2-CZ 4.38Å; F111-F146 HydrophobicContact CE2-CD2 4.47Å; F111-F146 AromaticContact CE2-CE2 3.81Å; F111-F146 HydrophobicContact CE2-CE2 3.81Å; F111-F146 HydrophobicContact CG-CE2 4.1Å; L139-F146 HydrophobicContact CB-CE1 3.93Å; L139-F146 HydrophobicContact CD1-CE1 4.07Å; L139-F146 HydrophobicContact CD1-CZ 4.36Å; L139-F146 HydrophobicContact CD2-CE1 3.96Å; L139-F146 HydrophobicContact CD2-CZ 4.24Å; L139-F146 HydrophobicContact CG-CE1 4.22Å; F142-F146 HydrophobicContact CB-CB 3.68Å; F142-F146 HydrophobicContact CB-CD1 3.75Å; F142-F146 HydrophobicContact CB-CG 3.78Å; F142-F146 HydrophobicContact CD2-CD1 4.46Å; F142-F146 HydrophobicContact CG-CD1 4.47Å; G143-F146 PolarHBondContact O-N 3.32Å; G143-F146 VanDerWaalsContact O-N 3.14Å; N144-F146 VanDerWaalsContact C-N 3.3Å; N144-F146 PolarHBondContact O-N 2.75Å; F146-N148 PolarHBondContact O-N 3.08Å; F146-R149 CarbonylContact O-C 3.59Å; F146-R149 VanDerWaalsContact O-C 3.23Å; F146-R149 WeakPolarHBondContact O-CA 3.48Å; F146-R149 PolarHBondContact O-N 2.72Å; F146-F150 HydrophobicContact CD1-CB 4.48Å; F146-F150 HydrophobicContact CE1-CB 3.87Å; F146-F150 HydrophobicContact CE1-CD1 4.16Å; F146-F150 HydrophobicContact CE1-CG 4.01Å; F146-F150 HydrophobicContact CE2-CB 4.42Å; F146-F150 HydrophobicContact CZ-CB 3.86Å; F146-F150 HydrophobicContact CZ-CD1 4.49Å; F146-F150 HydrophobicContact CZ-CD2 4.24Å; F146-F150 AromaticContact CZ-CG 3.96Å; F146-F150 HydrophobicContact CZ-CG 3.96Å; F146-F150 PolarHBondContact O-N 2.78Å; F146-F150 VanDerWaalsContact O-N 3.17Å; F146-Y183 HydrophobicContact CB-CD1 4.17Å; F146-Y183 HydrophobicContact CB-CD2 4.36Å; F146-Y183 HydrophobicContact CB-CG 3.9Å; F146-Y183 HydrophobicContact CD2-CD1 4.43Å; F146-Y183 AromaticContact CD2-CD2 3.8Å; F146-Y183 HydrophobicContact CD2-CD2 3.8Å; F146-Y183 HydrophobicContact CD2-CE1 4.47Å; F146-Y183 AromaticContact CD2-CE2 3.84Å; F146-Y183 HydrophobicContact CD2-CE2 3.84Å; F146-Y183 HydrophobicContact CD2-CG 4.12Å; F146-Y183 HydrophobicContact CE2-CE2 4.44Å; F146-Y183 HydrophobicContact CG-CG 4.5Å; F146-V188 HydrophobicContact CD2-CG1 4.34Å; F146-V188 HydrophobicContact CD2-CG2 3.86Å; F146-V188 HydrophobicContact CE2-CB 4.36Å; F146-V188 HydrophobicContact CE2-CG1 3.54Å; F146-V188 HydrophobicContact CE2-CG2 3.89Å; F146-V188 HydrophobicContact CG-CG2 4.39Å; F146-V188 HydrophobicContact CZ-CG1 3.84Å; F146-V188 HydrophobicContact CZ-CG2 4.45Å
147	L	94.2	Very high	93.7	Very high	2 Å²	2	43.5 Å²	43.5	1%	0.01	24%	0.241	C	C	.	.	H	α-helix	trans	-62.7	-28.7	-174.4	-63.5	178.7	0	0	0	113.7	N126 V129 L139 G143 N144 R149 F150	N126-L147 WeakPolarHBondContact OD1-CB 3.22Å; N126-L147 VanDerWaalsContact OD1-CD1 3.29Å; N126-L147 WeakPolarHBondContact OD1-CD1 3.28Å; V129-L147 HydrophobicContact CG1-CD2 3.52Å; V129-L147 HydrophobicContact CG2-CD1 4.1Å; V129-L147 HydrophobicContact CG2-CD2 4.29Å; L139-L147 HydrophobicContact CB-CD2 4.47Å; G143-L147 WeakPolarHBondContact O-CG 3.45Å; G143-L147 PolarHBondContact O-N 3.32Å; G143-L147 VanDerWaalsContact O-N 3.08Å; N144-L147 PolarHBondContact O-N 2.87Å; L147-R149 PolarHBondContact O-N 3.41Å; L147-F150 PolarHBondContact O-N 2.96Å
148	N	92.5	Very high	93.7	Very high	112 Å²	112	41.7 Å²	41.7	60%	0.599	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.7	-16.4	172.7	-71.3	-18.8	0	0	0	113.3	N126 N144 F146	N126-N148 PolarHBondContact ND2-OD1 2.79Å; N126-N148 VanDerWaalsContact ND2-OD1 3.13Å; N144-N148 WeakPolarHBondContact O-CB 3.47Å; N144-N148 PolarHBondContact O-N 3.14Å; N144-N148 PolarHBondContact O-ND2 2.99Å; F146-N148 PolarHBondContact O-N 3.08Å
149	R	92.9	Very high	93.9	Very high	72 Å²	72	38.8 Å²	38.8	27%	0.272	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-115.5	25.4	176.1	-64.1	-172.5	-176.6	156.6	7.2	111.9	S110 F111 F146 L147 S180 R181	S110-R149 CarbonylContact C-O 3.49Å; S110-R149 WeakPolarHBondContact CA-O 3.15Å; S110-R149 VanDerWaalsContact CB-O 3.31Å; S110-R149 WeakPolarHBondContact CB-O 3.29Å; F111-R149 PolarHBondContact N-O 2.92Å; F146-R149 CarbonylContact O-C 3.59Å; F146-R149 VanDerWaalsContact O-C 3.23Å; F146-R149 WeakPolarHBondContact O-CA 3.48Å; F146-R149 PolarHBondContact O-N 2.72Å; L147-R149 PolarHBondContact O-N 3.41Å; R149-S180 PolarHBondContact NH2-O 3.25Å; R149-R181 VanDerWaalsContact NH1-CA 3.26Å; R149-R181 PolarHBondContact NH1-O 3.04Å
150	F	96.1	Very high	94.1	Very high	3 Å²	3	38.8 Å²	38.8	1%	0.013	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	135.7	171.7	178.8	-129.6	0	0	0	108.2	F111 A113 G125 L128 F136 L139 F146 L147 F192	F111-F150 HydrophobicContact CB-CD2 3.69Å; F111-F150 HydrophobicContact CB-CE2 4.41Å; F111-F150 WeakPolarHBondContact O-CA 3.48Å; A113-F150 HydrophobicContact CB-CE2 4.19Å; A113-F150 HydrophobicContact CB-CZ 4.42Å; G125-F150 WeakPolarHBondContact CA-O 3.15Å; G125-F150 PolarHBondContact N-O 3.38Å; L128-F150 HydrophobicContact CD2-CD1 4.19Å; L128-F150 HydrophobicContact CD2-CE1 3.41Å; L128-F150 VanDerWaalsContact CD2-CE1 3.41Å; L128-F150 HydrophobicContact CD2-CE2 4.45Å; L128-F150 HydrophobicContact CD2-CZ 3.56Å; L128-F150 HydrophobicContact CG-CE1 4.21Å; F136-F150 HydrophobicContact CB-CE1 4.05Å; F136-F150 HydrophobicContact CB-CZ 4.29Å; F136-F150 HydrophobicContact CD1-CE1 4.39Å; F136-F150 AromaticContact CD1-CZ 3.82Å; F136-F150 HydrophobicContact CD1-CZ 3.82Å; F136-F150 HydrophobicContact CD2-CZ 4.15Å; F136-F150 HydrophobicContact CE1-CZ 4.17Å; F136-F150 HydrophobicContact CE2-CZ 4.44Å; F136-F150 HydrophobicContact CG-CE1 4.08Å; F136-F150 AromaticContact CG-CZ 3.82Å; F136-F150 HydrophobicContact CG-CZ 3.82Å; F136-F150 HydrophobicContact CZ-CZ 4.46Å; L139-F150 HydrophobicContact CD1-CD1 3.96Å; L139-F150 HydrophobicContact CD1-CE1 3.37Å; L139-F150 HydrophobicContact CD1-CE2 4.28Å; L139-F150 HydrophobicContact CD1-CZ 3.57Å; F146-F150 HydrophobicContact CD1-CB 4.48Å; F146-F150 HydrophobicContact CE1-CB 3.87Å; F146-F150 HydrophobicContact CE1-CD1 4.16Å; F146-F150 HydrophobicContact CE1-CG 4.01Å; F146-F150 HydrophobicContact CE2-CB 4.42Å; F146-F150 HydrophobicContact CZ-CB 3.86Å; F146-F150 HydrophobicContact CZ-CD1 4.49Å; F146-F150 HydrophobicContact CZ-CD2 4.24Å; F146-F150 AromaticContact CZ-CG 3.96Å; F146-F150 HydrophobicContact CZ-CG 3.96Å; F146-F150 PolarHBondContact O-N 2.78Å; F146-F150 VanDerWaalsContact O-N 3.17Å; L147-F150 PolarHBondContact O-N 2.96Å; F150-F192 HydrophobicContact CE2-CZ 4.1Å; F150-F192 HydrophobicContact CZ-CZ 4.47Å
151	M	96	Very high	94.2	Very high	41 Å²	41	37.9 Å²	37.9	20%	0.202	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	160.7	176.7	63.7	-178.2	72.1	0	0	110.6	F111 I112 A113 V122 V123	F111-M151 PolarHBondContact O-N 3.26Å; I112-M151 WeakPolarHBondContact CA-O 3.25Å; I112-M151 HydrophobicContact CB-CG 4.39Å; I112-M151 HydrophobicContact CG1-CG 3.98Å; I112-M151 HydrophobicContact CG1-SD 4.28Å; I112-M151 HydrophobicContact CG2-CG 4.21Å; A113-M151 PolarHBondContact N-O 2.96Å; V122-M151 HydrophobicContact CG1-CB 3.9Å; V122-M151 HydrophobicContact CG1-CG 4.27Å; V122-M151 HydrophobicContact CG1-SD 3.85Å; V123-M151 CarbonylContact O-C 3.56Å; V123-M151 WeakPolarHBondContact O-CA 3.48Å
152	C	97.2	Very high	94.3	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	120.7	168.8	175.3	0	0	0	0	109.4	A113 V122 V123 L128 Q154	A113-C152 HydrophobicContact CB-CB 4.21Å; A113-C152 CarbonylContact O-C 3.54Å; A113-C152 WeakPolarHBondContact O-CA 3.27Å; A113-C152 PolarHBondContact O-SG 3.46Å; V122-C152 CarbonylContact C-O 3.56Å; V122-C152 WeakPolarHBondContact CA-O 3.28Å; V123-C152 HydrophobicContact CB-CB 4.35Å; V123-C152 PolarHBondContact N-O 3.12Å; V123-C152 PolarHBondContact O-N 3.49Å; L128-C152 HydrophobicContact CD1-CB 3.96Å; L128-C152 HydrophobicContact CD2-CB 3.49Å; L128-C152 VanDerWaalsContact CD2-CB 3.49Å; L128-C152 HydrophobicContact CG-CB 4.36Å; C152-Q154 WeakPolarHBondContact SG-CG 3.19Å; C152-Q154 PolarHBondContact SG-NE2 3.19Å; C152-Q154 VanDerWaalsContact SG-NE2 3.36Å
153	A	97.6	Very high	94.5	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	123	169.1	0	0	0	0	0	107.9	F97 P98 I112 A113 V114 M115	F97-A153 HydrophobicContact CD2-CB 4.06Å; P98-A153 HydrophobicContact CB-CB 4.3Å; P98-A153 WeakPolarHBondContact O-CB 3.32Å; I112-A153 HydrophobicContact CG2-CB 3.73Å; A113-A153 PolarHBondContact O-N 2.94Å; V114-A153 WeakPolarHBondContact CA-O 3.47Å; V114-A153 HydrophobicContact CG2-CB 4.44Å; M115-A153 PolarHBondContact N-O 3.49Å
154	Q	96.6	Very high	94.8	Very high	30 Å²	30	31 Å²	31	14%	0.14	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	136.1	-179.7	-65.7	-178.4	5.8	0	0	109.8	M115 E120 G121 C152	M115-Q154 VanDerWaalsContact O-CA 3.31Å; M115-Q154 WeakPolarHBondContact O-CA 3.41Å; E120-Q154 CarbonylContact C-O 3.23Å; E120-Q154 VanDerWaalsContact CA-O 3.24Å; E120-Q154 WeakPolarHBondContact CA-O 3.31Å; G121-Q154 PolarHBondContact N-O 2.95Å; G121-Q154 PolarHBondContact O-N 2.88Å; C152-Q154 WeakPolarHBondContact SG-CG 3.19Å; C152-Q154 PolarHBondContact SG-NE2 3.19Å; C152-Q154 VanDerWaalsContact SG-NE2 3.36Å
155	L	97.6	Very high	95.1	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.1	152.4	176.7	65.2	169.1	0	0	0	110.7	I93 Q95 F97 V114 M115 H116 G117 E120 N157 L160	I93-L155 HydrophobicContact CD1-CD1 4.41Å; Q95-L155 HydrophobicContact CG-CD1 4.45Å; F97-L155 HydrophobicContact CB-CD1 4.01Å; F97-L155 HydrophobicContact CB-CD2 4.07Å; V114-L155 HydrophobicContact CG1-CD2 4Å; M115-L155 PolarHBondContact O-N 2.91Å; H116-L155 WeakPolarHBondContact CA-O 3.14Å; G117-L155 PolarHBondContact N-O 3.35Å; G117-L155 VanDerWaalsContact N-O 3.11Å; G117-L155 CarbonylContact O-C 3.2Å; E120-L155 HydrophobicContact CG-CB 4.4Å; L155-N157 HydrophobicContact CG-CB 4.35Å; L155-N157 PolarHBondContact O-N 3.48Å; L155-L160 HydrophobicContact CD2-CD1 3.32Å; L155-L160 HydrophobicContact CG-CD1 3.87Å
156	P	97.1	Very high	95.4	Very high	66 Å²	66	23.8 Å²	23.8	43%	0.429	13%	0.129	S	C	.	.			trans	-74.8	110.1	172.2	28.6	-32.2	0	0	0	108.8	G117	G117-P156 VanDerWaalsContact O-CA 3.28Å; G117-P156 WeakPolarHBondContact O-CA 3.39Å; G117-P156 WeakPolarHBondContact O-CD 3.27Å
157	N	95.8	Very high	95.5	Very high	7 Å²	7	23.8 Å²	23.8	4%	0.037	13%	0.129	C	C	.	.			trans	-148.7	132.8	176.9	-175.7	-73.2	0	0	0	110.4	I93 Q95 L155 V159 L160 D161	I93-N157 PolarHBondContact O-ND2 3.48Å; Q95-N157 PolarHBondContact OE1-ND2 3.08Å; L155-N157 HydrophobicContact CG-CB 4.35Å; L155-N157 PolarHBondContact O-N 3.48Å; N157-V159 VanDerWaalsContact C-N 3.29Å; N157-V159 PolarHBondContact O-N 2.92Å; N157-V159 VanDerWaalsContact OD1-CB 3.26Å; N157-V159 WeakPolarHBondContact OD1-CB 3.39Å; N157-V159 PolarHBondContact OD1-N 2.96Å; N157-L160 HydrophobicContact CB-CB 4.33Å; N157-L160 HydrophobicContact CB-CD1 3.94Å; N157-L160 HydrophobicContact CB-CG 4.03Å; N157-L160 PolarHBondContact O-N 2.94Å; N157-D161 PolarHBondContact O-N 3.39Å
158	P	92.4	Very high	95.6	Very high	64 Å²	64	23.7 Å²	23.7	42%	0.416	13%	0.128	S	C	.	.	H	α-helix	trans	-60.4	-30.5	-178	-26.3	35.9	0	0	0	115.1	L160 D161 K424	P158-L160 VanDerWaalsContact C-N 3.32Å; P158-D161 WeakPolarHBondContact O-CB 3.42Å; P158-D161 PolarHBondContact O-N 3.17Å; P158-K424 CarbonylContact C-O 3.52Å; P158-K424 VanDerWaalsContact CB-O 3.31Å; P158-K424 WeakPolarHBondContact CB-O 3.49Å
159	V	93.9	Very high	95.5	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-65.2	-42.7	175	176.8	0	0	0	0	109.9	I93 N157 D161 S162 I163 V423 K424 G425 F428	I93-V159 HydrophobicContact CG2-CB 4.17Å; I93-V159 HydrophobicContact CG2-CG1 4.11Å; N157-V159 VanDerWaalsContact C-N 3.29Å; N157-V159 PolarHBondContact O-N 2.92Å; N157-V159 VanDerWaalsContact OD1-CB 3.26Å; N157-V159 WeakPolarHBondContact OD1-CB 3.39Å; N157-V159 PolarHBondContact OD1-N 2.96Å; V159-D161 PolarHBondContact O-N 2.89Å; V159-S162 PolarHBondContact O-N 3.18Å; V159-S162 VanDerWaalsContact O-N 3.1Å; V159-I163 HydrophobicContact CG1-CD1 3.9Å; V159-I163 HydrophobicContact CG1-CG1 3.91Å; V159-I163 WeakPolarHBondContact O-CG1 3.42Å; V159-I163 PolarHBondContact O-N 3.18Å; V159-I163 VanDerWaalsContact O-N 3.1Å; V159-V423 HydrophobicContact CB-CG1 4.44Å; V159-V423 HydrophobicContact CG1-CG1 3.97Å; V159-K424 PolarHBondContact N-O 3.31Å; V159-G425 WeakPolarHBondContact CG2-O 3.47Å; V159-F428 HydrophobicContact CB-CE2 4.46Å; V159-F428 HydrophobicContact CG1-CD2 4.3Å; V159-F428 HydrophobicContact CG1-CE2 3.66Å; V159-F428 HydrophobicContact CG2-CD2 3.77Å; V159-F428 HydrophobicContact CG2-CE2 3.95Å
160	L	95.9	Very high	95.3	Very high	0 Å²	0	15.3 Å²	15.3	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-75	-12.8	-177.8	-55.8	178.9	0	0	0	112.9	K72 I93 V114 H116 L155 N157 P158 S162 I163 I165	K72-L160 PolarHBondContact NZ-O 3.41Å; I93-L160 HydrophobicContact CG2-CD2 4.32Å; V114-L160 HydrophobicContact CG1-CD1 3.84Å; V114-L160 HydrophobicContact CG1-CD2 4.15Å; H116-L160 HydrophobicContact CB-CB 3.86Å; H116-L160 WeakPolarHBondContact CB-O 3.3Å; L155-L160 HydrophobicContact CD2-CD1 3.32Å; L155-L160 HydrophobicContact CG-CD1 3.87Å; N157-L160 HydrophobicContact CB-CB 4.33Å; N157-L160 HydrophobicContact CB-CD1 3.94Å; N157-L160 HydrophobicContact CB-CG 4.03Å; N157-L160 PolarHBondContact O-N 2.94Å; P158-L160 VanDerWaalsContact C-N 3.32Å; L160-S162 PolarHBondContact O-N 3.42Å; L160-I163 CarbonylContact C-O 3.6Å; L160-I163 VanDerWaalsContact CA-O 3.28Å; L160-I163 WeakPolarHBondContact CA-O 3.3Å; L160-I163 VanDerWaalsContact O-O 3.08Å; L160-I165 HydrophobicContact CD2-CD1 4.26Å; L160-I165 HydrophobicContact CD2-CG1 4.48Å
161	D	92.8	Very high	94.8	Very high	78 Å²	78	15.2 Å²	15.2	42%	0.417	9%	0.09	S	C	.	.	H	α-helix	trans	-63.4	-30.1	167.7	-73.1	-30.4	0	0	0	111.6	K72 H116 N157 P158 V159	K72-D161 WeakPolarHBondContact CD-O 3.44Å; K72-D161 VanDerWaalsContact CE-O 3.25Å; K72-D161 WeakPolarHBondContact CE-O 3.25Å; K72-D161 VanDerWaalsContact NZ-CA 3.3Å; K72-D161 PolarHBondContact NZ-O 3.44Å; H116-D161 IonicContact CD2-OD1 3.84Å; H116-D161 IonicContact CE1-OD1 3.99Å; H116-D161 PolarHBondContact CE1-OD1 3.11Å; H116-D161 IonicContact CG-OD1 2.74Å; H116-D161 IonicContact ND1-OD1 3.41Å; H116-D161 PolarHBondContact ND1-OD1 2.97Å; H116-D161 IonicContact NE2-OD1 3.1Å; N157-D161 PolarHBondContact O-N 3.39Å; P158-D161 WeakPolarHBondContact O-CB 3.42Å; P158-D161 PolarHBondContact O-N 3.17Å; V159-D161 PolarHBondContact O-N 2.89Å
162	S	91.9	Very high	93.7	Very high	20 Å²	20	14.9 Å²	14.9	14%	0.14	9%	0.089	C	C	.	.	H	α-helix	trans	-107.6	-29.2	-173.5	-59.6	0	0	0	0	113.6	V159 L160 V422	V159-S162 PolarHBondContact O-N 3.18Å; V159-S162 VanDerWaalsContact O-N 3.1Å; L160-S162 PolarHBondContact O-N 3.42Å; S162-V422 PolarHBondContact OG-O 3.11Å
163	I	95.8	Very high	92.2	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	12%	0.115	C	C	.	.			trans	-136.7	171	179.9	60.7	170.9	0	0	0	112.1	P73 V75 V159 L160 I165 I296 L299 P300 V423	P73-I163 HydrophobicContact CB-CG2 4.3Å; P73-I163 CarbonylContact O-C 3.55Å; P73-I163 WeakPolarHBondContact O-CA 3.45Å; V75-I163 HydrophobicContact CG2-CD1 4.44Å; V159-I163 HydrophobicContact CG1-CD1 3.9Å; V159-I163 HydrophobicContact CG1-CG1 3.91Å; V159-I163 WeakPolarHBondContact O-CG1 3.42Å; V159-I163 PolarHBondContact O-N 3.18Å; V159-I163 VanDerWaalsContact O-N 3.1Å; L160-I163 CarbonylContact C-O 3.6Å; L160-I163 VanDerWaalsContact CA-O 3.28Å; L160-I163 WeakPolarHBondContact CA-O 3.3Å; L160-I163 VanDerWaalsContact O-O 3.08Å; I163-I165 HydrophobicContact CD1-CG1 4.36Å; I163-I296 HydrophobicContact CD1-CG2 3.74Å; I163-L299 HydrophobicContact CG2-CB 4.47Å; I163-P300 HydrophobicContact CG2-CG 4Å; I163-V423 HydrophobicContact CG2-CG2 4Å
164	S	97.1	Very high	90.4	Very high	2 Å²	2	20.8 Å²	20.8	1%	0.014	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	150	167	-66.1	0	0	0	0	109.6	P73 M74 V75 M115	P73-S164 PolarHBondContact O-N 3.48Å; M74-S164 CarbonylContact C-O 3.46Å; M74-S164 VanDerWaalsContact CA-O 3.29Å; M74-S164 WeakPolarHBondContact CA-O 3.36Å; V75-S164 PolarHBondContact N-O 3.4Å; M115-S164 WeakPolarHBondContact CE-OG 3.43Å
165	I	98.1	Very high	88.5	Confident	2 Å²	2	26.7 Å²	26.7	1%	0.01	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	133.6	-173.3	-51.9	166.1	0	0	0	108.6	V75 L77 I89 L92 I93 V114 L160 I163	V75-I165 CarbonylContact O-C 3.6Å; V75-I165 WeakPolarHBondContact O-CA 3.29Å; L77-I165 HydrophobicContact CD1-CG2 4.33Å; L77-I165 HydrophobicContact CG-CG2 4.25Å; I89-I165 HydrophobicContact CD1-CG2 3.83Å; I89-I165 HydrophobicContact CG1-CG2 3.87Å; I89-I165 HydrophobicContact CG2-CD1 4.14Å; L92-I165 HydrophobicContact CD2-CD1 3.79Å; I93-I165 HydrophobicContact CG2-CD1 4.06Å; V114-I165 HydrophobicContact CB-CB 4.43Å; V114-I165 PolarHBondContact N-O 3.39Å; V114-I165 PolarHBondContact O-N 3.24Å; L160-I165 HydrophobicContact CD2-CD1 4.26Å; L160-I165 HydrophobicContact CD2-CG1 4.48Å; I163-I165 HydrophobicContact CD1-CG1 4.36Å
166	I	97.9	Very high	86.5	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	108.8	176.9	-50.8	-57.8	0	0	0	107.9	V75 L76 L77 F111 I112 A113 F136 F192	V75-I166 PolarHBondContact O-N 3.09Å; L76-I166 HydrophobicContact CD1-CB 3.72Å; L76-I166 HydrophobicContact CD1-CG2 3.59Å; L77-I166 PolarHBondContact N-O 3.47Å; F111-I166 HydrophobicContact CD1-CG2 4.48Å; I112-I166 WeakPolarHBondContact O-CA 3.36Å; A113-I166 HydrophobicContact CB-CD1 3.67Å; F136-I166 HydrophobicContact CE1-CD1 4.47Å; F136-I166 HydrophobicContact CZ-CD1 4.32Å; I166-F192 HydrophobicContact CD1-CE1 4.12Å; I166-F192 HydrophobicContact CG1-CD1 4.21Å; I166-F192 HydrophobicContact CG1-CE1 4.09Å; I166-F192 HydrophobicContact CG2-CD1 4.3Å; I166-F192 HydrophobicContact CG2-CE1 4Å; I166-F192 HydrophobicContact CG2-CE2 4.5Å; I166-F192 HydrophobicContact CG2-CZ 4.12Å
167	D	96.9	Very high	84.5	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	133.9	167	-156.1	1.6	0	0	0	109	K85 T86 I89 F111 I112	K85-D167 WeakPolarHBondContact CB-OD1 3.4Å; T86-D167 WeakPolarHBondContact CB-OD2 3.41Å; T86-D167 PolarHBondContact OG1-OD2 3Å; I89-D167 HydrophobicContact CD1-CB 3.49Å; I89-D167 VanDerWaalsContact CD1-CB 3.49Å; F111-D167 WeakPolarHBondContact CA-O 3.49Å; I112-D167 HydrophobicContact CB-CB 4.13Å; I112-D167 PolarHBondContact N-O 3.43Å; I112-D167 PolarHBondContact O-N 2.98Å
168	T	95.1	Very high	82.7	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	21%	0.213	C	C	.	.			trans	-110.6	151.2	178	76.7	0	0	0	0	110.6	L76 L77 V78 K85 F111 L189	L76-T168 HydrophobicContact CD1-CG2 3.49Å; L76-T168 VanDerWaalsContact CD1-CG2 3.49Å; L76-T168 HydrophobicContact CG-CG2 4.34Å; L77-T168 WeakPolarHBondContact O-CB 3.45Å; L77-T168 WeakPolarHBondContact O-CG2 3.49Å; L77-T168 PolarHBondContact O-OG1 2.84Å; V78-T168 HydrophobicContact CG2-CG2 4.49Å; K85-T168 WeakPolarHBondContact CE-O 3.06Å; F111-T168 HydrophobicContact CD1-CG2 3.92Å; F111-T168 HydrophobicContact CE1-CG2 3.7Å; T168-L189 HydrophobicContact CG2-CD2 3.74Å
169	P	91.1	Very high	81	Confident	4 Å²	4	43.7 Å²	43.7	3%	0.026	23%	0.229	C	C	.	.	P	Polyproline II helix	trans	-50.5	146.1	167.2	-23.7	31.1	0	0	0	111.6	F111 I171 F185	F111-P169 VanDerWaalsContact CD2-CD 3.49Å; F111-P169 HydrophobicContact CD2-CG 3.77Å; F111-P169 HydrophobicContact CE2-CG 3.87Å; F111-P169 HydrophobicContact CG-CG 4.41Å; P169-I171 PolarHBondContact O-N 3.1Å; P169-F185 HydrophobicContact CB-CE2 4.18Å; P169-F185 HydrophobicContact CG-CE2 4.15Å
170	G	88.8	Confident	79.6	Confident	5 Å²	5	47.7 Å²	47.7	5%	0.052	26%	0.257	C	S	.	.	P	Polyproline II helix	trans	-63.1	130.4	173.7	0	0	0	0	0	111.4	L172	G170-L172 PolarHBondContact O-N 2.79Å
171	I	85.3	Confident	78.8	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	26%	0.26	C	S	.	.	B	Isolated β-bridge	trans	-69.2	129.4	172.7	-58.8	171.6	0	0	0	107.7	V78 G79 Q80 Y81 P169 F185 E213 F214 V217	V78-I171 HydrophobicContact CG1-CD1 3.75Å; G79-I171 PolarHBondContact O-N 2.83Å; G79-I171 VanDerWaalsContact O-N 3.08Å; Q80-I171 CarbonylContact C-O 3.1Å; Q80-I171 VanDerWaalsContact CA-O 3.3Å; Q80-I171 WeakPolarHBondContact CA-O 3.45Å; Q80-I171 HydrophobicContact CG-CB 4.49Å; Y81-I171 PolarHBondContact N-O 3.24Å; P169-I171 PolarHBondContact O-N 3.1Å; I171-F185 HydrophobicContact CD1-CE1 4.04Å; I171-F185 HydrophobicContact CG1-CE1 3.65Å; I171-F185 HydrophobicContact CG1-CZ 3.98Å; I171-E213 HydrophobicContact CG2-CB 4.01Å; I171-E213 HydrophobicContact CG2-CG 3.91Å; I171-F214 HydrophobicContact CD1-CB 4.32Å; I171-F214 HydrophobicContact CD1-CD2 3.32Å; I171-F214 HydrophobicContact CD1-CE2 3.8Å; I171-F214 HydrophobicContact CD1-CG 3.99Å; I171-F214 HydrophobicContact CG2-CB 4.06Å; I171-V217 HydrophobicContact CD1-CB 4.22Å; I171-V217 HydrophobicContact CD1-CG1 4.12Å; I171-V217 HydrophobicContact CD1-CG2 4.12Å
172	L	72.8	Confident	78.4	Confident	34 Å²	34	47.5 Å²	47.5	18%	0.178	27%	0.268	C	S	.	.	P	Polyproline II helix	trans	-97.3	154.9	-175.2	-71.9	167.3	0	0	0	109.7	Y81 G170 Q177	Y81-L172 HydrophobicContact CD2-CD2 4.32Å; Y81-L172 HydrophobicContact CG-CD2 4.46Å; G170-L172 PolarHBondContact O-N 2.79Å; L172-Q177 HydrophobicContact CB-CB 4.05Å; L172-Q177 HydrophobicContact CD1-CB 3.7Å; L172-Q177 HydrophobicContact CD1-CG 4.08Å; L172-Q177 HydrophobicContact CG-CB 4.46Å
173	S	65.6	Low	78.2	Confident	80 Å²	80	47.8 Å²	47.8	56%	0.559	27%	0.267	S	S	*	.	S	Bend	trans	-94.5	118.7	172.6	47.1	0	0	0	0	110
174	G	60.9	Low	77.8	Confident	44 Å²	44	52.5 Å²	52.5	45%	0.454	29%	0.292	S	S	.	.	S	Bend	trans	114.2	146.3	169.4	0	0	0	0	0	116.7	K176 Q177	G174-K176 PolarHBondContact O-N 2.92Å; G174-Q177 PolarHBondContact O-N 3.38Å
175	E	55.7	Low	77.4	Confident	155 Å²	155	52.9 Å²	52.9	72%	0.724	29%	0.293	S	S	*	.	H	α-helix	trans	-59.8	-33.6	-171.4	-69.4	-178.3	152.3	0	0	115.1	Q177 R178	E175-Q177 PolarHBondContact O-N 3.33Å; E175-R178 WeakPolarHBondContact O-CB 3.18Å; E175-R178 PolarHBondContact O-N 3.44Å
176	K	55	Low	77	Confident	189 Å²	189	54 Å²	54	82%	0.822	30%	0.303	S	S	*	.	H	α-helix	trans	-63	-28	-176.5	-71.6	-174.9	178.7	179	0	113	G174	G174-K176 PolarHBondContact O-N 2.92Å
177	Q	56.9	Low	76.5	Confident	82 Å²	82	55.2 Å²	55.2	38%	0.383	31%	0.313	S	S	.	.	H	α-helix	trans	-88.1	-23.1	-178.7	-71.5	-179	-27.4	0	0	112.7	L172 G174 E175 I179 S180	L172-Q177 HydrophobicContact CB-CB 4.05Å; L172-Q177 HydrophobicContact CD1-CB 3.7Å; L172-Q177 HydrophobicContact CD1-CG 4.08Å; L172-Q177 HydrophobicContact CG-CB 4.46Å; G174-Q177 PolarHBondContact O-N 3.38Å; E175-Q177 PolarHBondContact O-N 3.33Å; Q177-I179 VanDerWaalsContact C-N 3.33Å; Q177-I179 PolarHBondContact O-N 2.81Å; Q177-S180 PolarHBondContact O-N 2.51Å
178	R	57.7	Low	76.3	Confident	75 Å²	75	55.2 Å²	55.2	28%	0.283	31%	0.313	S	S	.	.	H	α-helix	trans	-57.6	-45.5	169.6	-68.4	-176.9	-176.7	-170.5	1.3	111.6	E175 S180 R181 E213 E216	E175-R178 WeakPolarHBondContact O-CB 3.18Å; E175-R178 PolarHBondContact O-N 3.44Å; R178-S180 VanDerWaalsContact C-N 3.28Å; R178-S180 PolarHBondContact O-N 3.47Å; R178-R181 PolarHBondContact O-N 3.41Å; R178-E213 HydrophobicContact CG-CG 4.32Å; R178-E213 WeakPolarHBondContact CG-OE2 3.26Å; R178-E213 IonicContact NE-OE2 2.95Å; R178-E216 IonicContact CZ-OE1 3.51Å; R178-E216 VanDerWaalsContact CZ-OE1 3.31Å; R178-E216 IonicContact CZ-OE2 2.89Å; R178-E216 VanDerWaalsContact NH1-CD 3.31Å; R178-E216 IonicContact NH1-OE1 2.71Å; R178-E216 PolarHBondContact NH1-OE1 3.32Å; R178-E216 IonicContact NH1-OE2 3.41Å; R178-E216 PolarHBondContact NH1-OE2 2.87Å; R178-E216 VanDerWaalsContact NH2-CD 3.32Å; R178-E216 IonicContact NH2-OE1 3.58Å; R178-E216 PolarHBondContact NH2-OE1 3Å; R178-E216 IonicContact NH2-OE2 3.63Å; R178-E216 PolarHBondContact NH2-OE2 3.02Å
179	I	56.5	Low	76.3	Confident	147 Å²	147	55.2 Å²	55.2	75%	0.754	31%	0.313	S	S	*	.	H	α-helix	trans	-68.6	-28.3	-177.9	-58	172.2	0	0	0	111.6	Q177 R181	Q177-I179 VanDerWaalsContact C-N 3.33Å; Q177-I179 PolarHBondContact O-N 2.81Å; I179-R181 VanDerWaalsContact C-N 3.25Å; I179-R181 PolarHBondContact O-N 2.85Å
180	S	64.9	Low	76.3	Confident	84 Å²	84	57.2 Å²	57.2	59%	0.587	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.3	-13	-176.6	-170.8	0	0	0	0	114.3	R149 Q177 R178	R149-S180 PolarHBondContact NH2-O 3.25Å; Q177-S180 PolarHBondContact O-N 2.51Å; R178-S180 VanDerWaalsContact C-N 3.28Å; R178-S180 PolarHBondContact O-N 3.47Å
181	R	77.7	Confident	76.4	Confident	17 Å²	17	57.8 Å²	57.8	6%	0.064	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-34.8	-173.2	-71.3	-168.9	-171.7	136	11.8	113.6	R149 R178 I179 Y183 F185 E213	R149-R181 VanDerWaalsContact NH1-CA 3.26Å; R149-R181 PolarHBondContact NH1-O 3.04Å; R178-R181 PolarHBondContact O-N 3.41Å; I179-R181 VanDerWaalsContact C-N 3.25Å; I179-R181 PolarHBondContact O-N 2.85Å; R181-Y183 VanDerWaalsContact C-N 3.26Å; R181-Y183 HydrophobicContact CB-CD1 4.2Å; R181-Y183 HydrophobicContact CB-CE1 3.93Å; R181-Y183 VanDerWaalsContact O-CD1 3.25Å; R181-Y183 WeakPolarHBondContact O-CD1 3.34Å; R181-Y183 PolarHBondContact O-N 2.65Å; R181-F185 VanDerWaalsContact NH1-CB 3.27Å; R181-F185 VanDerWaalsContact NH1-CD1 3.31Å; R181-E213 IonicContact CZ-OE1 2.57Å; R181-E213 IonicContact NH1-OE1 3.73Å; R181-E213 PolarHBondContact NH1-OE1 3.34Å; R181-E213 IonicContact NH2-OE1 2.76Å; R181-E213 PolarHBondContact NH2-OE1 3.43Å
182	G	84.2	Confident	76.9	Confident	57 Å²	57	57.8 Å²	57.8	59%	0.588	32%	0.323	S	S	*	.	S	Bend	trans	75.4	9.2	-178.5	0	0	0	0	0	114.9	A145	A145-G182 WeakPolarHBondContact CB-O 3.25Å
183	Y	88.3	Confident	77.8	Confident	26 Å²	26	56.1 Å²	56.1	10%	0.102	31%	0.314	C	S	.	.	S	Bend	trans	-150.4	159.8	172.9	63.4	-88.5	0	0	0	110	F111 F146 R181 F185 V188	F111-Y183 AromaticContact CE2-CE2 3.86Å; F111-Y183 HydrophobicContact CE2-CE2 3.86Å; F146-Y183 HydrophobicContact CB-CD1 4.17Å; F146-Y183 HydrophobicContact CB-CD2 4.36Å; F146-Y183 HydrophobicContact CB-CG 3.9Å; F146-Y183 HydrophobicContact CD2-CD1 4.43Å; F146-Y183 AromaticContact CD2-CD2 3.8Å; F146-Y183 HydrophobicContact CD2-CD2 3.8Å; F146-Y183 HydrophobicContact CD2-CE1 4.47Å; F146-Y183 AromaticContact CD2-CE2 3.84Å; F146-Y183 HydrophobicContact CD2-CE2 3.84Å; F146-Y183 HydrophobicContact CD2-CG 4.12Å; F146-Y183 HydrophobicContact CE2-CE2 4.44Å; F146-Y183 HydrophobicContact CG-CG 4.5Å; R181-Y183 VanDerWaalsContact C-N 3.26Å; R181-Y183 HydrophobicContact CB-CD1 4.2Å; R181-Y183 HydrophobicContact CB-CE1 3.93Å; R181-Y183 VanDerWaalsContact O-CD1 3.25Å; R181-Y183 WeakPolarHBondContact O-CD1 3.34Å; R181-Y183 PolarHBondContact O-N 2.65Å; Y183-F185 HydrophobicContact CE2-CB 4.19Å; Y183-F185 AromaticContact CE2-CD2 3.97Å; Y183-F185 HydrophobicContact CE2-CD2 3.97Å; Y183-F185 PolarHBondContact O-N 3Å; Y183-V188 HydrophobicContact CD2-CG2 3.98Å; Y183-V188 HydrophobicContact CE2-CG2 4.37Å
184	D	87.7	Confident	78.8	Confident	99 Å²	99	54.8 Å²	54.8	53%	0.529	30%	0.299	S	S	.	.			trans	-77.4	103.1	176.6	-173.2	-21.7	0	0	0	110.6	A186 A187 V188	D184-A186 PolarHBondContact OD1-N 3.18Å; D184-A186 VanDerWaalsContact OD1-N 3.1Å; D184-A187 HydrophobicContact CB-CB 3.89Å; D184-A187 VanDerWaalsContact CG-CB 3.41Å; D184-A187 PolarHBondContact OD1-N 2.9Å; D184-V188 VanDerWaalsContact O-CG2 3.31Å; D184-V188 WeakPolarHBondContact O-CG2 3.42Å; D184-V188 PolarHBondContact O-N 3.43Å
185	F	89.1	Confident	80.2	Confident	10 Å²	10	53.7 Å²	53.7	4%	0.044	28%	0.281	C	S	.	.	H	α-helix	trans	-68.4	-37.8	-177.4	-177.3	-99.3	0	0	0	113.2	F111 P169 I171 R181 Y183 V188 L189 V217	F111-F185 HydrophobicContact CE1-CE2 4.39Å; F111-F185 AromaticContact CE2-CD2 3.85Å; F111-F185 HydrophobicContact CE2-CD2 3.85Å; F111-F185 AromaticContact CE2-CE2 3.74Å; F111-F185 HydrophobicContact CE2-CE2 3.74Å; F111-F185 AromaticContact CZ-CD2 3.72Å; F111-F185 HydrophobicContact CZ-CD2 3.72Å; F111-F185 AromaticContact CZ-CE2 3.41Å; F111-F185 HydrophobicContact CZ-CE2 3.41Å; F111-F185 VanDerWaalsContact CZ-CE2 3.41Å; F111-F185 HydrophobicContact CZ-CZ 4.26Å; P169-F185 HydrophobicContact CB-CE2 4.18Å; P169-F185 HydrophobicContact CG-CE2 4.15Å; I171-F185 HydrophobicContact CD1-CE1 4.04Å; I171-F185 HydrophobicContact CG1-CE1 3.65Å; I171-F185 HydrophobicContact CG1-CZ 3.98Å; R181-F185 VanDerWaalsContact NH1-CB 3.27Å; R181-F185 VanDerWaalsContact NH1-CD1 3.31Å; Y183-F185 HydrophobicContact CE2-CB 4.19Å; Y183-F185 AromaticContact CE2-CD2 3.97Å; Y183-F185 HydrophobicContact CE2-CD2 3.97Å; Y183-F185 PolarHBondContact O-N 3Å; F185-V188 PolarHBondContact O-N 3.42Å; F185-L189 HydrophobicContact CD1-CD1 3.89Å; F185-L189 HydrophobicContact CD1-CG 4.46Å; F185-L189 HydrophobicContact CE1-CD1 3.26Å; F185-L189 HydrophobicContact CE1-CG 4.08Å; F185-L189 HydrophobicContact CZ-CD1 3.71Å; F185-L189 HydrophobicContact CZ-CG 4.23Å; F185-L189 PolarHBondContact O-N 3.47Å; F185-L189 VanDerWaalsContact O-N 3.09Å; F185-V217 HydrophobicContact CD1-CG2 3.93Å; F185-V217 HydrophobicContact CE1-CG2 3.98Å
186	A	88.6	Confident	82	Confident	27 Å²	27	46.3 Å²	46.3	22%	0.223	25%	0.247	C	C	.	.	H	α-helix	trans	-68.7	-41.6	-179.4	0	0	0	0	0	110.4	D184 V188 L189 E190	D184-A186 PolarHBondContact OD1-N 3.18Å; D184-A186 VanDerWaalsContact OD1-N 3.1Å; A186-V188 VanDerWaalsContact C-N 3.35Å; A186-V188 PolarHBondContact O-N 2.84Å; A186-L189 PolarHBondContact O-N 3.45Å; A186-E190 WeakPolarHBondContact O-CB 3.3Å; A186-E190 PolarHBondContact O-N 3.06Å
187	A	88.4	Confident	83.9	Confident	25 Å²	25	37.8 Å²	37.8	21%	0.207	21%	0.21	C	C	.	.	H	α-helix	trans	-64.3	-37	176.1	0	0	0	0	0	112.8	F142 D184 E190 W191	F142-A187 HydrophobicContact CE1-CB 3.87Å; F142-A187 HydrophobicContact CZ-CB 4.5Å; D184-A187 HydrophobicContact CB-CB 3.89Å; D184-A187 VanDerWaalsContact CG-CB 3.41Å; D184-A187 PolarHBondContact OD1-N 2.9Å; A187-E190 PolarHBondContact O-N 3.33Å; A187-W191 WeakPolarHBondContact O-CB 3.09Å; A187-W191 PolarHBondContact O-N 2.72Å
188	V	93.1	Very high	85.8	Confident	0 Å²	0	34 Å²	34	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-63.7	-44	173.5	171	0	0	0	0	111	F111 F142 F146 Y183 D184 F185 A186 W191 F192	F111-V188 HydrophobicContact CD1-CG1 4.45Å; F111-V188 HydrophobicContact CE1-CG1 3.83Å; F111-V188 HydrophobicContact CE2-CG1 3.99Å; F111-V188 HydrophobicContact CZ-CB 4.3Å; F111-V188 HydrophobicContact CZ-CG1 3.56Å; F142-V188 HydrophobicContact CB-CG2 4.38Å; F142-V188 HydrophobicContact CD1-CG2 3.57Å; F142-V188 HydrophobicContact CD2-CG2 3.88Å; F142-V188 HydrophobicContact CE1-CG2 3.68Å; F142-V188 HydrophobicContact CE2-CG2 3.99Å; F142-V188 HydrophobicContact CG-CG2 3.68Å; F142-V188 HydrophobicContact CZ-CB 4.42Å; F142-V188 HydrophobicContact CZ-CG2 3.89Å; F146-V188 HydrophobicContact CD2-CG1 4.34Å; F146-V188 HydrophobicContact CD2-CG2 3.86Å; F146-V188 HydrophobicContact CE2-CB 4.36Å; F146-V188 HydrophobicContact CE2-CG1 3.54Å; F146-V188 HydrophobicContact CE2-CG2 3.89Å; F146-V188 HydrophobicContact CG-CG2 4.39Å; F146-V188 HydrophobicContact CZ-CG1 3.84Å; F146-V188 HydrophobicContact CZ-CG2 4.45Å; Y183-V188 HydrophobicContact CD2-CG2 3.98Å; Y183-V188 HydrophobicContact CE2-CG2 4.37Å; D184-V188 VanDerWaalsContact O-CG2 3.31Å; D184-V188 WeakPolarHBondContact O-CG2 3.42Å; D184-V188 PolarHBondContact O-N 3.43Å; F185-V188 PolarHBondContact O-N 3.42Å; A186-V188 VanDerWaalsContact C-N 3.35Å; A186-V188 PolarHBondContact O-N 2.84Å; V188-W191 WeakPolarHBondContact O-CB 3.03Å; V188-W191 PolarHBondContact O-N 3.02Å; V188-F192 HydrophobicContact CG1-CD2 3.87Å; V188-F192 HydrophobicContact CG1-CE2 3.74Å; V188-F192 VanDerWaalsContact O-CD2 3.3Å; V188-F192 WeakPolarHBondContact O-CD2 3.43Å; V188-F192 PolarHBondContact O-N 3.01Å
189	L	93.6	Very high	87.6	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-66.7	-39.5	177.6	-74.3	-179.7	0	0	0	112.6	L76 V78 F111 T168 F185 A186 W191 F192 A193 V217	L76-L189 HydrophobicContact CD1-CD2 4.29Å; L76-L189 HydrophobicContact CD2-CD2 4.12Å; V78-L189 HydrophobicContact CG1-CD1 3.98Å; V78-L189 HydrophobicContact CG2-CD1 4.49Å; V78-L189 HydrophobicContact CG2-CD2 4.05Å; F111-L189 HydrophobicContact CE1-CD2 3.84Å; F111-L189 HydrophobicContact CZ-CD2 4.29Å; T168-L189 HydrophobicContact CG2-CD2 3.74Å; F185-L189 HydrophobicContact CD1-CD1 3.89Å; F185-L189 HydrophobicContact CD1-CG 4.46Å; F185-L189 HydrophobicContact CE1-CD1 3.26Å; F185-L189 HydrophobicContact CE1-CG 4.08Å; F185-L189 HydrophobicContact CZ-CD1 3.71Å; F185-L189 HydrophobicContact CZ-CG 4.23Å; F185-L189 PolarHBondContact O-N 3.47Å; F185-L189 VanDerWaalsContact O-N 3.09Å; A186-L189 PolarHBondContact O-N 3.45Å; L189-W191 VanDerWaalsContact C-N 3.29Å; L189-W191 PolarHBondContact O-N 2.82Å; L189-F192 PolarHBondContact O-N 3.28Å; L189-A193 WeakPolarHBondContact O-CB 3.47Å; L189-A193 PolarHBondContact O-N 3.06Å; L189-V217 HydrophobicContact CD1-CB 4.32Å; L189-V217 HydrophobicContact CD1-CG1 3.3Å; L189-V217 HydrophobicContact CD1-CG2 4.02Å
190	E	91.3	Very high	89.6	Confident	46 Å²	46	23.4 Å²	23.4	22%	0.215	14%	0.143	C	C	.	.	H	α-helix	trans	-57.5	-44.7	171.6	-170.5	179.1	-172.7	0	0	110.2	A186 A187 F192 A193 E194 K372	A186-E190 WeakPolarHBondContact O-CB 3.3Å; A186-E190 PolarHBondContact O-N 3.06Å; A187-E190 PolarHBondContact O-N 3.33Å; E190-F192 PolarHBondContact O-N 2.93Å; E190-A193 WeakPolarHBondContact O-CB 3.27Å; E190-A193 PolarHBondContact O-N 3.28Å; E190-A193 VanDerWaalsContact O-N 3.15Å; E190-E194 PolarHBondContact O-N 3.21Å; E190-E194 VanDerWaalsContact O-N 3.16Å; E190-K372 IonicContact OE1-NZ 3.6Å; E190-K372 PolarHBondContact OE1-NZ 3.47Å; E190-K372 IonicContact OE2-NZ 2.89Å; E190-K372 PolarHBondContact OE2-NZ 3.46Å
191	W	91.9	Very high	91.2	Very high	16 Å²	16	19.4 Å²	19.4	6%	0.061	12%	0.115	C	C	.	.	H	α-helix	trans	-60.6	-40.2	176.9	-177.9	95.6	0	0	0	113.3	P135 F136 K138 L139 F142 A187 V188 L189 R195	P135-W191 VanDerWaalsContact O-CH2 3.25Å; P135-W191 WeakPolarHBondContact O-CH2 3.42Å; F136-W191 HydrophobicContact CD1-CH2 4.24Å; F136-W191 HydrophobicContact CD1-CZ3 4.49Å; K138-W191 HydrophobicContact CB-CZ2 4.14Å; L139-W191 HydrophobicContact CD1-CH2 4.05Å; L139-W191 HydrophobicContact CD1-CZ3 3.91Å; L139-W191 HydrophobicContact CD2-CD2 3.59Å; L139-W191 HydrophobicContact CD2-CE3 3.38Å; L139-W191 HydrophobicContact CD2-CG 4.3Å; L139-W191 HydrophobicContact CD2-CH2 3.95Å; L139-W191 HydrophobicContact CD2-CZ2 4.13Å; L139-W191 HydrophobicContact CD2-CZ3 3.59Å; L139-W191 HydrophobicContact CG-CD2 4.35Å; L139-W191 HydrophobicContact CG-CE3 4.08Å; L139-W191 HydrophobicContact CG-CH2 3.69Å; L139-W191 HydrophobicContact CG-CZ2 3.96Å; L139-W191 HydrophobicContact CG-CZ3 3.76Å; F142-W191 HydrophobicContact CE2-CB 4.04Å; F142-W191 HydrophobicContact CE2-CG 4.01Å; F142-W191 HydrophobicContact CZ-CB 3.96Å; F142-W191 HydrophobicContact CZ-CG 4.34Å; A187-W191 WeakPolarHBondContact O-CB 3.09Å; A187-W191 PolarHBondContact O-N 2.72Å; V188-W191 WeakPolarHBondContact O-CB 3.03Å; V188-W191 PolarHBondContact O-N 3.02Å; L189-W191 VanDerWaalsContact C-N 3.29Å; L189-W191 PolarHBondContact O-N 2.82Å; W191-R195 PolarHBondContact O-NH1 3.37Å; W191-R195 VanDerWaalsContact O-NH1 3.14Å
192	F	94.3	Very high	92.1	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-69.3	-40.7	173.9	-82.7	-72.2	0	0	0	111.4	L76 F111 F136 L139 F150 I166 V188 L189 E190 E194 R195 V196	L76-F192 HydrophobicContact CD1-CB 4.15Å; L76-F192 HydrophobicContact CD1-CG 4.32Å; L76-F192 HydrophobicContact CD2-CB 3.93Å; F111-F192 HydrophobicContact CD1-CD2 4.43Å; F111-F192 AromaticContact CD1-CE2 3.87Å; F111-F192 HydrophobicContact CD1-CE2 3.87Å; F111-F192 HydrophobicContact CE1-CD2 4.31Å; F111-F192 HydrophobicContact CE1-CE2 4.13Å; F136-F192 HydrophobicContact CD1-CE1 4.5Å; F136-F192 HydrophobicContact CE1-CE1 4.07Å; L139-F192 HydrophobicContact CD1-CZ 4.03Å; F150-F192 HydrophobicContact CE2-CZ 4.1Å; F150-F192 HydrophobicContact CZ-CZ 4.47Å; I166-F192 HydrophobicContact CD1-CE1 4.12Å; I166-F192 HydrophobicContact CG1-CD1 4.21Å; I166-F192 HydrophobicContact CG1-CE1 4.09Å; I166-F192 HydrophobicContact CG2-CD1 4.3Å; I166-F192 HydrophobicContact CG2-CE1 4Å; I166-F192 HydrophobicContact CG2-CE2 4.5Å; I166-F192 HydrophobicContact CG2-CZ 4.12Å; V188-F192 HydrophobicContact CG1-CD2 3.87Å; V188-F192 HydrophobicContact CG1-CE2 3.74Å; V188-F192 VanDerWaalsContact O-CD2 3.3Å; V188-F192 WeakPolarHBondContact O-CD2 3.43Å; V188-F192 PolarHBondContact O-N 3.01Å; L189-F192 PolarHBondContact O-N 3.28Å; E190-F192 PolarHBondContact O-N 2.93Å; F192-E194 PolarHBondContact O-N 3.16Å; F192-R195 PolarHBondContact O-N 3.09Å; F192-V196 HydrophobicContact CB-CG1 4.31Å; F192-V196 HydrophobicContact CD1-CG1 4.49Å; F192-V196 WeakPolarHBondContact O-CG1 3.14Å; F192-V196 WeakPolarHBondContact O-CG2 3.19Å; F192-V196 PolarHBondContact O-N 3.34Å
193	A	92.1	Very high	92.7	Very high	0 Å²	0	16 Å²	16	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-57.1	-35.3	-179.7	0	0	0	0	0	113.1	L189 E190 R195 I199 L221 H224 K227	L189-A193 WeakPolarHBondContact O-CB 3.47Å; L189-A193 PolarHBondContact O-N 3.06Å; E190-A193 WeakPolarHBondContact O-CB 3.27Å; E190-A193 PolarHBondContact O-N 3.28Å; E190-A193 VanDerWaalsContact O-N 3.15Å; A193-R195 PolarHBondContact O-N 3.2Å; A193-I199 HydrophobicContact CB-CD1 3.87Å; A193-L221 HydrophobicContact CB-CD2 3.38Å; A193-H224 HydrophobicContact CB-CB 4.43Å; A193-K227 PolarHBondContact O-NZ 2.88Å
194	E	87.8	Confident	93	Very high	52 Å²	52	15.2 Å²	15.2	24%	0.243	8%	0.082	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-27.9	173.5	-68.6	-175.7	157.6	0	0	113.5	S61 E190 F192	S61-E194 VanDerWaalsContact CB-OE1 3.25Å; S61-E194 WeakPolarHBondContact CB-OE1 3.33Å; S61-E194 WeakPolarHBondContact CB-OE2 3.39Å; S61-E194 PolarHBondContact OG-OE1 3.03Å; E190-E194 PolarHBondContact O-N 3.21Å; E190-E194 VanDerWaalsContact O-N 3.16Å; F192-E194 PolarHBondContact O-N 3.16Å
195	R	89.9	Confident	93.3	Very high	20 Å²	20	10.6 Å²	10.6	8%	0.075	6%	0.057	C	C	.	.	T	Hydrogen-bonded Turn	trans	-113.5	-17.4	-168.7	-72.2	168.1	179.2	67.9	10.6	114.8	D68 M74 W191 F192 A193	D68-R195 IonicContact OD1-NE 3.16Å; D68-R195 PolarHBondContact OD1-NE 3.36Å; M74-R195 HydrophobicContact CE-CB 3.87Å; M74-R195 VanDerWaalsContact CE-O 3.28Å; M74-R195 WeakPolarHBondContact CE-O 3.22Å; W191-R195 PolarHBondContact O-NH1 3.37Å; W191-R195 VanDerWaalsContact O-NH1 3.14Å; F192-R195 PolarHBondContact O-N 3.09Å; A193-R195 PolarHBondContact O-N 3.2Å
196	V	93.9	Very high	93.3	Very high	0 Å²	0	14.7 Å²	14.7	0%	0	8%	0.077	C	C	.	.			trans	-85.7	155.8	179.5	-59.3	0	0	0	0	110.2	M74 L76 F192 I199 K227	M74-V196 HydrophobicContact CB-CB 4.17Å; M74-V196 HydrophobicContact CB-CG1 3.82Å; M74-V196 HydrophobicContact CE-CG1 4.29Å; M74-V196 WeakPolarHBondContact O-CB 3.32Å; L76-V196 HydrophobicContact CB-CB 4.33Å; L76-V196 HydrophobicContact CB-CG1 4.02Å; L76-V196 HydrophobicContact CB-CG2 4.06Å; F192-V196 HydrophobicContact CB-CG1 4.31Å; F192-V196 HydrophobicContact CD1-CG1 4.49Å; F192-V196 WeakPolarHBondContact O-CG1 3.14Å; F192-V196 WeakPolarHBondContact O-CG2 3.19Å; F192-V196 PolarHBondContact O-N 3.34Å; V196-I199 HydrophobicContact CG2-CD1 4.33Å; V196-I199 HydrophobicContact CG2-CG1 3.7Å; V196-K227 VanDerWaalsContact O-CD 3.31Å; V196-K227 WeakPolarHBondContact O-CD 3.2Å; V196-K227 WeakPolarHBondContact O-CE 3.48Å; V196-K227 PolarHBondContact O-NZ 2.88Å
197	D	94.5	Very high	93.2	Very high	10 Å²	10	20.7 Å²	20.7	5%	0.053	10%	0.097	C	C	.	.	S	Bend	trans	-90.4	-24	178.9	-64	-107.3	0	0	0	111.7	P73 M74 L299 R306	P73-D197 WeakPolarHBondContact CA-OD2 3.42Å; P73-D197 HydrophobicContact CB-CB 4.24Å; P73-D197 WeakPolarHBondContact CB-OD2 3.38Å; M74-D197 PolarHBondContact N-OD2 3.42Å; M74-D197 PolarHBondContact O-N 3.3Å; D197-L299 HydrophobicContact CB-CD2 4.17Å; D197-R306 IonicContact OD1-NH1 3.55Å
198	R	95.6	Very high	93.2	Very high	2 Å²	2	21.8 Å²	21.8	1%	0.008	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151	138.1	-173.7	-153.2	-88.8	-160.6	-170.3	3.7	110.9	M74 V75 L76 I200 D295 L299	M74-R198 PolarHBondContact O-N 2.97Å; V75-R198 WeakPolarHBondContact CA-O 3.46Å; V75-R198 HydrophobicContact CG2-CB 4.36Å; L76-R198 PolarHBondContact N-O 3.33Å; R198-I200 VanDerWaalsContact NH1-CA 3.34Å; R198-I200 VanDerWaalsContact NH1-CG2 3.28Å; R198-D295 IonicContact CZ-OD2 3.33Å; R198-D295 IonicContact NE-OD2 2.65Å; R198-D295 PolarHBondContact NE-OD2 2.73Å; R198-D295 VanDerWaalsContact NE-OD2 3.12Å; R198-D295 IonicContact NH2-OD2 2.74Å; R198-D295 PolarHBondContact NH2-OD2 2.92Å; R198-D295 VanDerWaalsContact NH2-OD2 3.08Å; R198-L299 HydrophobicContact CB-CD1 4.07Å; R198-L299 HydrophobicContact CB-CD2 4.09Å; R198-L299 HydrophobicContact CG-CD2 4.41Å
199	I	97.4	Very high	92.8	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	117.7	176.6	-55.1	170.8	0	0	0	107.9	L76 V78 A193 V196 L201 L221 H224 K227 I228 R229	L76-I199 HydrophobicContact CB-CG1 4.44Å; L76-I199 HydrophobicContact CD2-CG1 4.37Å; L76-I199 HydrophobicContact CD2-CG2 4.39Å; L76-I199 CarbonylContact O-C 3.58Å; L76-I199 WeakPolarHBondContact O-CA 3.42Å; V78-I199 HydrophobicContact CG2-CG2 4.13Å; A193-I199 HydrophobicContact CB-CD1 3.87Å; V196-I199 HydrophobicContact CG2-CD1 4.33Å; V196-I199 HydrophobicContact CG2-CG1 3.7Å; I199-L201 HydrophobicContact CG2-CD2 3.99Å; I199-L221 HydrophobicContact CD1-CD2 4.16Å; I199-L221 HydrophobicContact CG2-CD1 4.17Å; I199-H224 HydrophobicContact CD1-CB 4.23Å; I199-K227 HydrophobicContact CD1-CB 4.35Å; I199-K227 HydrophobicContact CG1-CB 4.31Å; I199-K227 PolarHBondContact N-O 2.73Å; I199-I228 HydrophobicContact CB-CG1 4.28Å; I199-I228 HydrophobicContact CD1-CG1 4.35Å; I199-I228 WeakPolarHBondContact O-CA 3.39Å; I199-R229 PolarHBondContact O-N 3.16Å
200	I	97.9	Very high	92.4	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	114.1	175.4	-38.8	-147.5	0	0	0	108.3	V75 L76 L77 V78 F88 R198 L202 R229 V231 I296	V75-I200 HydrophobicContact CG1-CD1 3.63Å; V75-I200 HydrophobicContact CG1-CG1 3.54Å; L76-I200 PolarHBondContact O-N 2.73Å; L77-I200 HydrophobicContact CD2-CB 3.56Å; L77-I200 HydrophobicContact CD2-CD1 3.61Å; L77-I200 HydrophobicContact CD2-CG1 3.5Å; L77-I200 HydrophobicContact CD2-CG2 4.13Å; V78-I200 PolarHBondContact N-O 3.48Å; F88-I200 HydrophobicContact CE1-CD1 3.78Å; F88-I200 HydrophobicContact CZ-CD1 3.94Å; R198-I200 VanDerWaalsContact NH1-CA 3.34Å; R198-I200 VanDerWaalsContact NH1-CG2 3.28Å; I200-L202 HydrophobicContact CB-CD1 3.95Å; I200-L202 HydrophobicContact CG2-CD1 3.42Å; I200-L202 VanDerWaalsContact CG2-CD1 3.42Å; I200-L202 HydrophobicContact CG2-CG 4.22Å; I200-R229 WeakPolarHBondContact CA-O 3.25Å; I200-V231 HydrophobicContact CG2-CB 4.15Å; I200-V231 HydrophobicContact CG2-CG2 3.47Å; I200-V231 VanDerWaalsContact CG2-CG2 3.47Å; I200-I296 HydrophobicContact CD1-CD1 4.19Å
201	L	97.2	Very high	92.2	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	109.6	170.7	-58.4	-175.8	0	0	0	109.3	V78 I199 F203 F214 I218 L221 I228 R229 V230 V231	V78-L201 HydrophobicContact CB-CD2 3.83Å; V78-L201 HydrophobicContact CG1-CD2 4.3Å; V78-L201 HydrophobicContact CG2-CD2 4.47Å; V78-L201 CarbonylContact O-C 3.46Å; V78-L201 WeakPolarHBondContact O-CA 3.48Å; I199-L201 HydrophobicContact CG2-CD2 3.99Å; L201-F203 HydrophobicContact CB-CE2 3.85Å; L201-F214 HydrophobicContact CD2-CE2 4.41Å; L201-I218 HydrophobicContact CD1-CG1 4.19Å; L201-L221 HydrophobicContact CD2-CD1 4.27Å; L201-I228 HydrophobicContact CD1-CG2 3.61Å; L201-I228 HydrophobicContact CG-CG2 3.92Å; L201-R229 PolarHBondContact N-O 2.87Å; L201-V230 HydrophobicContact CB-CG2 4.25Å; L201-V230 HydrophobicContact CD1-CG2 4.35Å; L201-V230 CarbonylContact O-C 3.51Å; L201-V230 WeakPolarHBondContact O-CA 3.39Å; L201-V231 PolarHBondContact O-N 3.37Å
202	L	97	Very high	91.9	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	128.1	-179.7	-77	86.9	0	0	0	111.7	L77 V78 K85 F88 I200 V231	L77-L202 HydrophobicContact CB-CD1 4.35Å; L77-L202 HydrophobicContact CD2-CD1 3.97Å; V78-L202 PolarHBondContact O-N 3.02Å; K85-L202 HydrophobicContact CG-CD1 4.25Å; K85-L202 HydrophobicContact CG-CD2 4.31Å; F88-L202 HydrophobicContact CB-CD2 4.15Å; F88-L202 HydrophobicContact CD2-CD2 4.4Å; F88-L202 HydrophobicContact CG-CD2 4.42Å; I200-L202 HydrophobicContact CB-CD1 3.95Å; I200-L202 HydrophobicContact CG2-CD1 3.42Å; I200-L202 VanDerWaalsContact CG2-CD1 3.42Å; I200-L202 HydrophobicContact CG2-CG 4.22Å; L202-V231 WeakPolarHBondContact CA-O 3.42Å; L202-V231 HydrophobicContact CG-CB 4.31Å
203	F	96.3	Very high	91.5	Very high	3 Å²	3	31.3 Å²	31.3	1%	0.013	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	148	171.6	-63.8	-92.6	0	0	0	110	L201 L208 I210 F214 I218 V230 V231 L232 N233 L250 L254	L201-F203 HydrophobicContact CB-CE2 3.85Å; F203-L208 HydrophobicContact CB-CD1 4.09Å; F203-L208 HydrophobicContact CD1-CD1 3.93Å; F203-L208 HydrophobicContact CG-CD1 4.32Å; F203-I210 HydrophobicContact CD1-CG1 4.41Å; F203-I210 HydrophobicContact CE1-CD1 3.68Å; F203-I210 HydrophobicContact CE1-CG1 3.8Å; F203-I210 HydrophobicContact CZ-CD1 4.26Å; F203-F214 AromaticContact CD1-CE1 3.99Å; F203-F214 HydrophobicContact CD1-CE1 3.99Å; F203-F214 AromaticContact CE1-CD1 3.98Å; F203-F214 HydrophobicContact CE1-CD1 3.98Å; F203-F214 AromaticContact CE1-CE1 3.29Å; F203-F214 HydrophobicContact CE1-CE1 3.29Å; F203-F214 HydrophobicContact CE1-CZ 4.07Å; F203-F214 HydrophobicContact CE2-CE1 4.31Å; F203-F214 HydrophobicContact CE2-CZ 4.32Å; F203-F214 HydrophobicContact CZ-CD1 4.4Å; F203-F214 AromaticContact CZ-CE1 3.48Å; F203-F214 HydrophobicContact CZ-CE1 3.48Å; F203-F214 VanDerWaalsContact CZ-CE1 3.48Å; F203-F214 AromaticContact CZ-CZ 3.77Å; F203-F214 HydrophobicContact CZ-CZ 3.77Å; F203-I218 HydrophobicContact CZ-CD1 4.39Å; F203-V230 HydrophobicContact CD2-CG1 3.69Å; F203-V230 HydrophobicContact CE2-CG1 3.78Å; F203-V231 PolarHBondContact N-O 3.3Å; F203-L232 HydrophobicContact CB-CD1 4.1Å; F203-N233 WeakPolarHBondContact O-CB 3.47Å; F203-N233 PolarHBondContact O-N 2.93Å; F203-L250 HydrophobicContact CD1-CD1 3.72Å; F203-L250 HydrophobicContact CD2-CD1 3.85Å; F203-L250 HydrophobicContact CD2-CD2 4.34Å; F203-L250 HydrophobicContact CE1-CD1 3.78Å; F203-L250 HydrophobicContact CE2-CD1 3.92Å; F203-L250 HydrophobicContact CG-CD1 3.76Å; F203-L250 HydrophobicContact CG-CD2 4.42Å; F203-L250 HydrophobicContact CZ-CD1 3.88Å; F203-L254 HydrophobicContact CE2-CD2 4.46Å; F203-L254 HydrophobicContact CZ-CD2 4.03Å
204	D	94.6	Very high	91.4	Very high	10 Å²	10	31.3 Å²	31.3	5%	0.053	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	122.1	174.8	-174	-41.6	0	0	0	108.8	T83 H206 K207 L208 K234	T83-D204 HydrophobicContact CG2-CB 4.29Å; D204-H206 VanDerWaalsContact C-N 3.28Å; D204-H206 PolarHBondContact O-N 3.41Å; D204-H206 WeakPolarHBondContact OD1-CA 3.44Å; D204-H206 WeakPolarHBondContact OD1-CB 3.36Å; D204-H206 PolarHBondContact OD1-N 2.91Å; D204-K207 CarbonylContact O-C 3.5Å; D204-K207 PolarHBondContact O-N 2.95Å; D204-K207 PolarHBondContact OD1-N 3.47Å; D204-K207 VanDerWaalsContact OD1-N 3.16Å; D204-L208 WeakPolarHBondContact O-CA 3.41Å; D204-L208 PolarHBondContact O-N 3.35Å; D204-L208 VanDerWaalsContact O-N 3.1Å; D204-K234 WeakPolarHBondContact OD2-CD 3.32Å; D204-K234 WeakPolarHBondContact OD2-CE 3.47Å; D204-K234 IonicContact OD2-NZ 2.83Å; D204-K234 PolarHBondContact OD2-NZ 2.98Å
205	A	94.2	Very high	91.4	Very high	1 Å²	1	29.6 Å²	29.6	1%	0.008	15%	0.147	C	C	.	.	S	Bend	trans	-66.7	-29.6	-178.2	0	0	0	0	0	113.2	L232 N233 A235 I238	A205-L232 HydrophobicContact CB-CD1 3.86Å; A205-L232 HydrophobicContact CB-CG 3.97Å; A205-N233 WeakPolarHBondContact CB-O 3.4Å; A205-N233 PolarHBondContact N-O 3.17Å; A205-A235 HydrophobicContact CB-CB 4.46Å; A205-I238 HydrophobicContact CB-CD1 3.8Å; A205-I238 HydrophobicContact CB-CG1 4.42Å
206	H	89.6	Confident	91.3	Very high	97 Å²	97	32.9 Å²	32.9	45%	0.449	16%	0.163	S	C	.	.	S	Bend	trans	-79.4	-33.6	178.5	-177.5	73.5	0	0	0	111.8	D204 Q237 I238	D204-H206 VanDerWaalsContact C-N 3.28Å; D204-H206 PolarHBondContact O-N 3.41Å; D204-H206 WeakPolarHBondContact OD1-CA 3.44Å; D204-H206 WeakPolarHBondContact OD1-CB 3.36Å; D204-H206 PolarHBondContact OD1-N 2.91Å; H206-Q237 HydrophobicContact CB-CB 4.44Å; H206-I238 HydrophobicContact CB-CG2 4.38Å
207	K	87.1	Confident	91.1	Very high	152 Å²	152	33 Å²	33	66%	0.661	16%	0.164	S	C	*	.	S	Bend	trans	-123.9	56.2	-178.6	-61.1	-177.1	-177.3	178.2	0	112	D204 D209	D204-K207 CarbonylContact O-C 3.5Å; D204-K207 PolarHBondContact O-N 2.95Å; D204-K207 PolarHBondContact OD1-N 3.47Å; D204-K207 VanDerWaalsContact OD1-N 3.16Å; K207-D209 PolarHBondContact O-N 3.49Å
208	L	87.5	Confident	91	Very high	48 Å²	48	32.6 Å²	32.6	25%	0.251	16%	0.162	S	C	.	.			trans	-65.3	109.8	178.4	-176.4	72.8	0	0	0	110.1	F203 D204 V246 A249 L250	F203-L208 HydrophobicContact CB-CD1 4.09Å; F203-L208 HydrophobicContact CD1-CD1 3.93Å; F203-L208 HydrophobicContact CG-CD1 4.32Å; D204-L208 WeakPolarHBondContact O-CA 3.41Å; D204-L208 PolarHBondContact O-N 3.35Å; D204-L208 VanDerWaalsContact O-N 3.1Å; L208-V246 HydrophobicContact CB-CG1 3.95Å; L208-V246 HydrophobicContact CD2-CG1 3.88Å; L208-V246 WeakPolarHBondContact CD2-O 3.38Å; L208-V246 HydrophobicContact CG-CG1 4.36Å; L208-A249 HydrophobicContact CD2-CB 3.91Å; L208-L250 HydrophobicContact CD1-CB 4.13Å; L208-L250 HydrophobicContact CD1-CD1 3.97Å; L208-L250 HydrophobicContact CD1-CG 4.49Å; L208-L250 HydrophobicContact CD2-CB 3.97Å
209	D	84.4	Confident	90.6	Very high	87 Å²	87	37.8 Å²	37.8	47%	0.465	19%	0.185	S	C	.	.			trans	-139.7	148.6	171	-175	22.3	0	0	0	108.3	Q80 K207	Q80-D209 PolarHBondContact NE2-O 3.48Å; K207-D209 PolarHBondContact O-N 3.49Å
210	I	87	Confident	90.1	Very high	28 Å²	28	39 Å²	39	14%	0.144	19%	0.194	C	C	.	.			trans	-129.2	93.9	170.8	-45.6	-164.7	0	0	0	107	F203 F214 S215 I218 L250 I257	F203-I210 HydrophobicContact CD1-CG1 4.41Å; F203-I210 HydrophobicContact CE1-CD1 3.68Å; F203-I210 HydrophobicContact CE1-CG1 3.8Å; F203-I210 HydrophobicContact CZ-CD1 4.26Å; I210-F214 HydrophobicContact CG2-CB 4.31Å; I210-F214 HydrophobicContact CG2-CD1 4.11Å; I210-F214 HydrophobicContact CG2-CG 4.42Å; I210-S215 WeakPolarHBondContact CG2-OG 3.48Å; I210-I218 HydrophobicContact CG2-CD1 4.41Å; I210-L250 HydrophobicContact CD1-CD1 4.23Å; I210-I257 HydrophobicContact CD1-CD1 4.45Å; I210-I257 HydrophobicContact CG2-CD1 3.91Å
211	S	86.9	Confident	89.6	Confident	10 Å²	10	39 Å²	39	7%	0.07	19%	0.194	C	C	.	.			trans	-62.9	160.8	178.8	67.5	0	0	0	0	112	Q80 E213 F214 S215	Q80-S211 PolarHBondContact OE1-OG 3Å; S211-E213 PolarHBondContact O-N 2.9Å; S211-F214 PolarHBondContact O-N 2.94Å; S211-F214 VanDerWaalsContact O-N 3.13Å; S211-F214 PolarHBondContact OG-N 3.05Å; S211-S215 PolarHBondContact O-N 2.9Å; S211-S215 PolarHBondContact O-OG 3.43Å; S211-S215 VanDerWaalsContact O-OG 3.08Å
212	D	84.8	Confident	88.9	Confident	126 Å²	126	43.9 Å²	43.9	67%	0.674	22%	0.216	S	C	*	.	H	α-helix	trans	-58.5	-36.8	175.4	-66.8	-35.1	0	0	0	111.7	S215 E216	D212-S215 WeakPolarHBondContact O-CB 3.24Å; D212-S215 PolarHBondContact O-N 2.73Å; D212-E216 WeakPolarHBondContact O-CG 3.41Å; D212-E216 PolarHBondContact O-N 3.44Å
213	E	85.2	Confident	88.1	Confident	11 Å²	11	48.7 Å²	48.7	5%	0.051	24%	0.241	C	C	.	.	H	α-helix	trans	-66.6	-42.2	176.6	-168.6	-177.8	144	0	0	111.4	I171 R178 R181 S211 S215 E216 V217	I171-E213 HydrophobicContact CG2-CB 4.01Å; I171-E213 HydrophobicContact CG2-CG 3.91Å; R178-E213 HydrophobicContact CG-CG 4.32Å; R178-E213 WeakPolarHBondContact CG-OE2 3.26Å; R178-E213 IonicContact NE-OE2 2.95Å; R181-E213 IonicContact CZ-OE1 2.57Å; R181-E213 IonicContact NH1-OE1 3.73Å; R181-E213 PolarHBondContact NH1-OE1 3.34Å; R181-E213 IonicContact NH2-OE1 2.76Å; R181-E213 PolarHBondContact NH2-OE1 3.43Å; S211-E213 PolarHBondContact O-N 2.9Å; E213-S215 VanDerWaalsContact C-N 3.3Å; E213-S215 PolarHBondContact O-N 3.18Å; E213-E216 PolarHBondContact O-N 3.34Å; E213-V217 WeakPolarHBondContact O-CG2 3.28Å; E213-V217 PolarHBondContact O-N 3.26Å
214	F	90.1	Very high	87.7	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-66.4	-38.4	176.4	-166	-166.3	0	0	0	111.2	V78 Q80 I171 L201 F203 I210 S211 E216 V217 I218	V78-F214 HydrophobicContact CG1-CE2 3.98Å; Q80-F214 HydrophobicContact CG-CB 4.29Å; Q80-F214 HydrophobicContact CG-CD1 3.52Å; Q80-F214 HydrophobicContact CG-CE1 4.06Å; Q80-F214 HydrophobicContact CG-CG 4.13Å; I171-F214 HydrophobicContact CD1-CB 4.32Å; I171-F214 HydrophobicContact CD1-CD2 3.32Å; I171-F214 HydrophobicContact CD1-CE2 3.8Å; I171-F214 HydrophobicContact CD1-CG 3.99Å; I171-F214 HydrophobicContact CG2-CB 4.06Å; L201-F214 HydrophobicContact CD2-CE2 4.41Å; F203-F214 AromaticContact CD1-CE1 3.99Å; F203-F214 HydrophobicContact CD1-CE1 3.99Å; F203-F214 AromaticContact CE1-CD1 3.98Å; F203-F214 HydrophobicContact CE1-CD1 3.98Å; F203-F214 AromaticContact CE1-CE1 3.29Å; F203-F214 HydrophobicContact CE1-CE1 3.29Å; F203-F214 HydrophobicContact CE1-CZ 4.07Å; F203-F214 HydrophobicContact CE2-CE1 4.31Å; F203-F214 HydrophobicContact CE2-CZ 4.32Å; F203-F214 HydrophobicContact CZ-CD1 4.4Å; F203-F214 AromaticContact CZ-CE1 3.48Å; F203-F214 HydrophobicContact CZ-CE1 3.48Å; F203-F214 VanDerWaalsContact CZ-CE1 3.48Å; F203-F214 AromaticContact CZ-CZ 3.77Å; F203-F214 HydrophobicContact CZ-CZ 3.77Å; I210-F214 HydrophobicContact CG2-CB 4.31Å; I210-F214 HydrophobicContact CG2-CD1 4.11Å; I210-F214 HydrophobicContact CG2-CG 4.42Å; S211-F214 PolarHBondContact O-N 2.94Å; S211-F214 VanDerWaalsContact O-N 3.13Å; S211-F214 PolarHBondContact OG-N 3.05Å; F214-E216 PolarHBondContact O-N 3.29Å; F214-V217 HydrophobicContact CD2-CB 4.49Å; F214-V217 WeakPolarHBondContact O-CB 3.46Å; F214-V217 PolarHBondContact O-N 3.44Å; F214-I218 HydrophobicContact CD1-CD1 4.48Å; F214-I218 HydrophobicContact CD2-CD1 3.95Å; F214-I218 HydrophobicContact CD2-CG1 3.93Å; F214-I218 HydrophobicContact CE1-CD1 4.49Å; F214-I218 HydrophobicContact CE2-CD1 3.94Å; F214-I218 HydrophobicContact CE2-CG1 3.87Å; F214-I218 HydrophobicContact CG-CD1 4.24Å; F214-I218 HydrophobicContact CZ-CD1 4.22Å; F214-I218 VanDerWaalsContact O-CG1 3.28Å; F214-I218 WeakPolarHBondContact O-CG1 3.29Å; F214-I218 PolarHBondContact O-N 2.96Å
215	S	89.3	Confident	87.3	Confident	16 Å²	16	52.1 Å²	52.1	11%	0.112	26%	0.257	C	S	.	.	H	α-helix	trans	-61.7	-41.3	174.1	-62.4	0	0	0	0	112.4	I210 S211 D212 E213 I218 K219 I257	I210-S215 WeakPolarHBondContact CG2-OG 3.48Å; S211-S215 PolarHBondContact O-N 2.9Å; S211-S215 PolarHBondContact O-OG 3.43Å; S211-S215 VanDerWaalsContact O-OG 3.08Å; D212-S215 WeakPolarHBondContact O-CB 3.24Å; D212-S215 PolarHBondContact O-N 2.73Å; E213-S215 VanDerWaalsContact C-N 3.3Å; E213-S215 PolarHBondContact O-N 3.18Å; S215-I218 PolarHBondContact O-N 3.08Å; S215-K219 WeakPolarHBondContact O-CB 3.28Å; S215-K219 VanDerWaalsContact O-CG 3.23Å; S215-K219 WeakPolarHBondContact O-CG 3.13Å; S215-K219 PolarHBondContact O-N 3.14Å; S215-I257 WeakPolarHBondContact OG-CD1 3.28Å
216	E	86.9	Confident	87	Confident	89 Å²	89	56 Å²	56	42%	0.416	28%	0.278	S	S	.	.	H	α-helix	trans	-62.1	-43.6	173.4	-76.8	168.1	-153	0	0	111.8	R178 D212 E213 F214 K219 A220	R178-E216 IonicContact CZ-OE1 3.51Å; R178-E216 VanDerWaalsContact CZ-OE1 3.31Å; R178-E216 IonicContact CZ-OE2 2.89Å; R178-E216 VanDerWaalsContact NH1-CD 3.31Å; R178-E216 IonicContact NH1-OE1 2.71Å; R178-E216 PolarHBondContact NH1-OE1 3.32Å; R178-E216 IonicContact NH1-OE2 3.41Å; R178-E216 PolarHBondContact NH1-OE2 2.87Å; R178-E216 VanDerWaalsContact NH2-CD 3.32Å; R178-E216 IonicContact NH2-OE1 3.58Å; R178-E216 PolarHBondContact NH2-OE1 3Å; R178-E216 IonicContact NH2-OE2 3.63Å; R178-E216 PolarHBondContact NH2-OE2 3.02Å; D212-E216 WeakPolarHBondContact O-CG 3.41Å; D212-E216 PolarHBondContact O-N 3.44Å; E213-E216 PolarHBondContact O-N 3.34Å; F214-E216 PolarHBondContact O-N 3.29Å; E216-K219 WeakPolarHBondContact O-CB 3.48Å; E216-K219 PolarHBondContact O-N 2.82Å; E216-A220 PolarHBondContact O-N 2.83Å
217	V	90.1	Very high	87.2	Confident	2 Å²	2	51.8 Å²	51.8	1%	0.012	26%	0.258	C	S	.	.	H	α-helix	trans	-60.9	-48.9	175.4	166	0	0	0	0	111	V78 I171 F185 L189 E213 F214 K219 A220 L221	V78-V217 HydrophobicContact CG1-CG1 3.97Å; I171-V217 HydrophobicContact CD1-CB 4.22Å; I171-V217 HydrophobicContact CD1-CG1 4.12Å; I171-V217 HydrophobicContact CD1-CG2 4.12Å; F185-V217 HydrophobicContact CD1-CG2 3.93Å; F185-V217 HydrophobicContact CE1-CG2 3.98Å; L189-V217 HydrophobicContact CD1-CB 4.32Å; L189-V217 HydrophobicContact CD1-CG1 3.3Å; L189-V217 HydrophobicContact CD1-CG2 4.02Å; E213-V217 WeakPolarHBondContact O-CG2 3.28Å; E213-V217 PolarHBondContact O-N 3.26Å; F214-V217 HydrophobicContact CD2-CB 4.49Å; F214-V217 WeakPolarHBondContact O-CB 3.46Å; F214-V217 PolarHBondContact O-N 3.44Å; V217-K219 VanDerWaalsContact C-N 3.26Å; V217-K219 PolarHBondContact O-N 3.14Å; V217-A220 WeakPolarHBondContact O-CB 3.4Å; V217-A220 PolarHBondContact O-N 3.22Å; V217-L221 HydrophobicContact CG1-CD1 4.33Å; V217-L221 WeakPolarHBondContact O-CG 3.4Å; V217-L221 PolarHBondContact O-N 2.83Å
218	I	91.7	Very high	87.5	Confident	2 Å²	2	44.7 Å²	44.7	1%	0.01	23%	0.227	C	C	.	.	H	α-helix	trans	-60.8	-38.8	178.7	-63.9	164.5	0	0	0	110.5	L201 F203 I210 F214 S215 A220 L221 K222 L254 I257 I258	L201-I218 HydrophobicContact CD1-CG1 4.19Å; F203-I218 HydrophobicContact CZ-CD1 4.39Å; I210-I218 HydrophobicContact CG2-CD1 4.41Å; F214-I218 HydrophobicContact CD1-CD1 4.48Å; F214-I218 HydrophobicContact CD2-CD1 3.95Å; F214-I218 HydrophobicContact CD2-CG1 3.93Å; F214-I218 HydrophobicContact CE1-CD1 4.49Å; F214-I218 HydrophobicContact CE2-CD1 3.94Å; F214-I218 HydrophobicContact CE2-CG1 3.87Å; F214-I218 HydrophobicContact CG-CD1 4.24Å; F214-I218 HydrophobicContact CZ-CD1 4.22Å; F214-I218 VanDerWaalsContact O-CG1 3.28Å; F214-I218 WeakPolarHBondContact O-CG1 3.29Å; F214-I218 PolarHBondContact O-N 2.96Å; S215-I218 PolarHBondContact O-N 3.08Å; I218-A220 VanDerWaalsContact C-N 3.33Å; I218-A220 PolarHBondContact O-N 3.12Å; I218-L221 WeakPolarHBondContact O-CB 3.5Å; I218-L221 PolarHBondContact O-N 3.17Å; I218-L221 VanDerWaalsContact O-N 3.09Å; I218-K222 PolarHBondContact O-N 2.9Å; I218-L254 HydrophobicContact CD1-CD2 4.32Å; I218-I257 HydrophobicContact CB-CG2 3.81Å; I218-I257 HydrophobicContact CG2-CG2 3.55Å; I218-I258 HydrophobicContact CG2-CD1 4.29Å; I218-I258 HydrophobicContact CG2-CG1 3.74Å
219	K	88.1	Confident	87.9	Confident	112 Å²	112	45.2 Å²	45.2	49%	0.487	23%	0.226	S	C	.	.	H	α-helix	trans	-64.4	-34.5	174.3	-73.4	168.1	-174.5	171.9	0	112.9	S215 E216 V217 L221 K222 I257	S215-K219 WeakPolarHBondContact O-CB 3.28Å; S215-K219 VanDerWaalsContact O-CG 3.23Å; S215-K219 WeakPolarHBondContact O-CG 3.13Å; S215-K219 PolarHBondContact O-N 3.14Å; E216-K219 WeakPolarHBondContact O-CB 3.48Å; E216-K219 PolarHBondContact O-N 2.82Å; V217-K219 VanDerWaalsContact C-N 3.26Å; V217-K219 PolarHBondContact O-N 3.14Å; K219-L221 PolarHBondContact O-N 3.27Å; K219-K222 WeakPolarHBondContact O-CB 3.3Å; K219-K222 WeakPolarHBondContact O-CD 3.28Å; K219-K222 VanDerWaalsContact O-CG 3.22Å; K219-K222 WeakPolarHBondContact O-CG 3.41Å; K219-K222 PolarHBondContact O-N 3.04Å; K219-I257 HydrophobicContact CG-CG2 4Å
220	A	86	Confident	88.5	Confident	24 Å²	24	41.1 Å²	41.1	20%	0.198	20%	0.204	C	C	.	.	H	α-helix	trans	-65.8	-27.5	173.8	0	0	0	0	0	111.8	E216 V217 I218	E216-A220 PolarHBondContact O-N 2.83Å; V217-A220 WeakPolarHBondContact O-CB 3.4Å; V217-A220 PolarHBondContact O-N 3.22Å; I218-A220 VanDerWaalsContact C-N 3.33Å; I218-A220 PolarHBondContact O-N 3.12Å
221	L	88.7	Confident	89.1	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.9	0.7	178.9	-58.2	176.6	0	0	0	114.3	A193 I199 L201 V217 I218 K219 N223 H224 I228	A193-L221 HydrophobicContact CB-CD2 3.38Å; I199-L221 HydrophobicContact CD1-CD2 4.16Å; I199-L221 HydrophobicContact CG2-CD1 4.17Å; L201-L221 HydrophobicContact CD2-CD1 4.27Å; V217-L221 HydrophobicContact CG1-CD1 4.33Å; V217-L221 WeakPolarHBondContact O-CG 3.4Å; V217-L221 PolarHBondContact O-N 2.83Å; I218-L221 WeakPolarHBondContact O-CB 3.5Å; I218-L221 PolarHBondContact O-N 3.17Å; I218-L221 VanDerWaalsContact O-N 3.09Å; K219-L221 PolarHBondContact O-N 3.27Å; L221-N223 PolarHBondContact O-N 2.96Å; L221-N223 VanDerWaalsContact O-N 3.08Å; L221-H224 WeakPolarHBondContact O-CA 3.49Å; L221-H224 PolarHBondContact O-N 2.88Å; L221-I228 HydrophobicContact CB-CD1 4.1Å
222	K	81.5	Confident	89.6	Confident	104 Å²	104	39.3 Å²	39.3	45%	0.452	19%	0.194	S	C	.	.	G	3₁₀ helix	trans	-56	-30.2	-172.2	71.7	-178.8	-174.6	167.7	0	114.9	I218 K219 H224	I218-K222 PolarHBondContact O-N 2.9Å; K219-K222 WeakPolarHBondContact O-CB 3.3Å; K219-K222 WeakPolarHBondContact O-CD 3.28Å; K219-K222 VanDerWaalsContact O-CG 3.22Å; K219-K222 WeakPolarHBondContact O-CG 3.41Å; K219-K222 PolarHBondContact O-N 3.04Å; K222-H224 PolarHBondContact O-N 2.87Å
223	N	80.9	Confident	90.2	Very high	101 Å²	101	33.4 Å²	33.4	54%	0.54	16%	0.162	S	C	.	.	G	3₁₀ helix	trans	-80.6	-0.2	-179.7	-64.6	-20	0	0	0	112.9	L221	L221-N223 PolarHBondContact O-N 2.96Å; L221-N223 VanDerWaalsContact O-N 3.08Å
224	H	87.1	Confident	90.7	Very high	22 Å²	22	34.1 Å²	34.1	10%	0.102	17%	0.165	C	C	.	.	G	3₁₀ helix	trans	-126.8	25.5	-176.3	-55.3	-70.5	0	0	0	111.3	A193 I199 L221 K222 D226 K227	A193-H224 HydrophobicContact CB-CB 4.43Å; I199-H224 HydrophobicContact CD1-CB 4.23Å; L221-H224 WeakPolarHBondContact O-CA 3.49Å; L221-H224 PolarHBondContact O-N 2.88Å; K222-H224 PolarHBondContact O-N 2.87Å; H224-D226 PolarHBondContact O-N 3.36Å; H224-K227 HydrophobicContact CB-CD 4.28Å; H224-K227 WeakPolarHBondContact O-CB 3.41Å; H224-K227 PolarHBondContact O-N 3.08Å
225	E	87.3	Confident	91	Very high	62 Å²	62	34.1 Å²	34.1	29%	0.29	17%	0.165	S	C	.	.	G	3₁₀ helix	trans	-59.4	-29.9	-177.3	62.2	-177.3	-162.2	0	0	113.7	K227 I228 I258 T260	E225-K227 PolarHBondContact O-N 2.8Å; E225-I228 WeakPolarHBondContact O-CB 3.36Å; E225-I228 PolarHBondContact O-N 3.24Å; E225-I258 HydrophobicContact CB-CG2 4.4Å; E225-T260 PolarHBondContact OE1-OG1 2.7Å; E225-T260 WeakPolarHBondContact OE2-CB 3.14Å; E225-T260 VanDerWaalsContact OE2-CG2 3.31Å; E225-T260 WeakPolarHBondContact OE2-CG2 3.38Å; E225-T260 PolarHBondContact OE2-OG1 3.16Å
226	D	87.7	Confident	91.1	Very high	84 Å²	84	33.4 Å²	33.4	45%	0.449	16%	0.16	S	C	.	.	G	3₁₀ helix	trans	-61.7	-27.3	174.5	58	-44.8	0	0	0	113	H224 R229 K313	H224-D226 PolarHBondContact O-N 3.36Å; D226-R229 PolarHBondContact O-NH1 3.32Å; D226-K313 VanDerWaalsContact CG-NZ 3.31Å; D226-K313 IonicContact OD1-NZ 3.56Å; D226-K313 PolarHBondContact OD1-NZ 3.38Å; D226-K313 VanDerWaalsContact OD1-NZ 3.09Å; D226-K313 IonicContact OD2-NZ 2.72Å; D226-K313 PolarHBondContact OD2-NZ 3.09Å
227	K	92	Very high	91.5	Very high	7 Å²	7	31.8 Å²	31.8	3%	0.03	15%	0.152	C	C	.	.	G	3₁₀ helix	trans	-86.4	-15.3	177	-51.4	-174.7	177.3	-170.6	0	112.5	A193 V196 I199 H224 E225 D310	A193-K227 PolarHBondContact O-NZ 2.88Å; V196-K227 VanDerWaalsContact O-CD 3.31Å; V196-K227 WeakPolarHBondContact O-CD 3.2Å; V196-K227 WeakPolarHBondContact O-CE 3.48Å; V196-K227 PolarHBondContact O-NZ 2.88Å; I199-K227 HydrophobicContact CD1-CB 4.35Å; I199-K227 HydrophobicContact CG1-CB 4.31Å; I199-K227 PolarHBondContact N-O 2.73Å; H224-K227 HydrophobicContact CB-CD 4.28Å; H224-K227 WeakPolarHBondContact O-CB 3.41Å; H224-K227 PolarHBondContact O-N 3.08Å; E225-K227 PolarHBondContact O-N 2.8Å; K227-D310 IonicContact NZ-OD1 2.79Å; K227-D310 PolarHBondContact NZ-OD1 3.34Å; K227-D310 IonicContact NZ-OD2 3.16Å; K227-D310 PolarHBondContact NZ-OD2 2.92Å
228	I	94.5	Very high	91.7	Very high	3 Å²	3	31.8 Å²	31.8	2%	0.015	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	140.4	-174.3	-64.6	177	0	0	0	110.6	I199 L201 L221 E225 V230 V264	I199-I228 HydrophobicContact CB-CG1 4.28Å; I199-I228 HydrophobicContact CD1-CG1 4.35Å; I199-I228 WeakPolarHBondContact O-CA 3.39Å; L201-I228 HydrophobicContact CD1-CG2 3.61Å; L201-I228 HydrophobicContact CG-CG2 3.92Å; L221-I228 HydrophobicContact CB-CD1 4.1Å; E225-I228 WeakPolarHBondContact O-CB 3.36Å; E225-I228 PolarHBondContact O-N 3.24Å; I228-V230 HydrophobicContact CG2-CG2 4.42Å; I228-V264 HydrophobicContact CG2-CG1 4.1Å
229	R	95.7	Very high	91.8	Very high	60 Å²	60	37.7 Å²	37.7	23%	0.226	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	136.7	171.3	-67.8	-66.4	-171	-74.1	-11.7	108.5	I199 I200 L201 D226 Y267 D295	I199-R229 PolarHBondContact O-N 3.16Å; I200-R229 WeakPolarHBondContact CA-O 3.25Å; L201-R229 PolarHBondContact N-O 2.87Å; D226-R229 PolarHBondContact O-NH1 3.32Å; R229-Y267 HydrophobicContact CB-CE2 3.96Å; R229-Y267 HydrophobicContact CG-CE2 4.16Å; R229-D295 IonicContact CZ-OD1 2.99Å; R229-D295 IonicContact NE-OD1 2.92Å; R229-D295 IonicContact NE-OD2 2.81Å; R229-D295 IonicContact NH2-OD1 3.74Å; R229-D295 PolarHBondContact NH2-OD1 3.39Å
230	V	97.4	Very high	92	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	137.7	-171.5	175	0	0	0	0	108.9	L201 F203 I228 L250 L254 V264 R265 V266 Y267	L201-V230 HydrophobicContact CB-CG2 4.25Å; L201-V230 HydrophobicContact CD1-CG2 4.35Å; L201-V230 CarbonylContact O-C 3.51Å; L201-V230 WeakPolarHBondContact O-CA 3.39Å; F203-V230 HydrophobicContact CD2-CG1 3.69Å; F203-V230 HydrophobicContact CE2-CG1 3.78Å; I228-V230 HydrophobicContact CG2-CG2 4.42Å; V230-L250 HydrophobicContact CG1-CD2 3.95Å; V230-L254 HydrophobicContact CB-CD1 4.47Å; V230-L254 HydrophobicContact CG1-CD1 4.1Å; V230-L254 HydrophobicContact CG2-CD1 3.75Å; V230-V264 HydrophobicContact CB-CG1 4.4Å; V230-V264 HydrophobicContact CG2-CB 4.5Å; V230-V264 HydrophobicContact CG2-CG1 3.6Å; V230-R265 PolarHBondContact N-O 3.4Å; V230-V266 HydrophobicContact CB-CB 4.41Å; V230-V266 HydrophobicContact CB-CG2 3.92Å; V230-V266 HydrophobicContact CG1-CB 4.42Å; V230-V266 HydrophobicContact CG1-CG1 4.13Å; V230-V266 HydrophobicContact CG1-CG2 3.9Å; V230-V266 CarbonylContact O-C 3.59Å; V230-V266 VanDerWaalsContact O-CA 3.3Å; V230-V266 WeakPolarHBondContact O-CA 3.33Å; V230-Y267 WeakPolarHBondContact O-CD2 3.35Å; V230-Y267 PolarHBondContact O-N 2.89Å
231	V	98.3	Very high	92.3	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	117.3	175.1	174.6	0	0	0	0	108.1	I200 L201 L202 F203 N233 Y267 F271 L292	I200-V231 HydrophobicContact CG2-CB 4.15Å; I200-V231 HydrophobicContact CG2-CG2 3.47Å; I200-V231 VanDerWaalsContact CG2-CG2 3.47Å; L201-V231 PolarHBondContact O-N 3.37Å; L202-V231 WeakPolarHBondContact CA-O 3.42Å; L202-V231 HydrophobicContact CG-CB 4.31Å; F203-V231 PolarHBondContact N-O 3.3Å; V231-N233 HydrophobicContact CG1-CB 4.24Å; V231-N233 PolarHBondContact O-N 3.41Å; V231-Y267 CarbonylContact C-O 3.3Å; V231-Y267 WeakPolarHBondContact CA-O 3.3Å; V231-Y267 HydrophobicContact CG2-CD2 4.45Å; V231-F271 HydrophobicContact CG1-CD2 3.61Å; V231-F271 HydrophobicContact CG1-CE2 3.3Å; V231-F271 HydrophobicContact CG1-CZ 4.08Å; V231-L292 HydrophobicContact CG2-CD2 3.91Å
232	L	97.8	Very high	92.6	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	91.5	169.7	-175.7	59.8	0	0	0	107.8	F203 A205 L243 V246 L250 V266 Y267 I268 G269	F203-L232 HydrophobicContact CB-CD1 4.1Å; A205-L232 HydrophobicContact CB-CD1 3.86Å; A205-L232 HydrophobicContact CB-CG 3.97Å; L232-L243 HydrophobicContact CD2-CD1 4.02Å; L232-V246 HydrophobicContact CD1-CG1 4.11Å; L232-V246 HydrophobicContact CD2-CG1 4.24Å; L232-L250 HydrophobicContact CB-CD2 4.37Å; L232-L250 HydrophobicContact CD1-CD2 4.17Å; L232-V266 HydrophobicContact CB-CG1 4Å; L232-Y267 PolarHBondContact N-O 3.35Å; L232-I268 HydrophobicContact CB-CG1 4.46Å; L232-G269 PolarHBondContact O-N 3.49Å; L232-G269 VanDerWaalsContact O-N 3.12Å
233	N	97.2	Very high	93.2	Very high	3 Å²	3	39.6 Å²	39.6	2%	0.016	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	162.2	-173.3	-161.9	15.6	0	0	0	111.7	T83 F203 A205 V231 A235 G269 F271	T83-N233 PolarHBondContact O-ND2 3.11Å; F203-N233 WeakPolarHBondContact O-CB 3.47Å; F203-N233 PolarHBondContact O-N 2.93Å; A205-N233 WeakPolarHBondContact CB-O 3.4Å; A205-N233 PolarHBondContact N-O 3.17Å; V231-N233 HydrophobicContact CG1-CB 4.24Å; V231-N233 PolarHBondContact O-N 3.41Å; N233-A235 PolarHBondContact O-N 2.86Å; N233-G269 CarbonylContact C-O 3.6Å; N233-G269 VanDerWaalsContact C-O 3.3Å; N233-G269 VanDerWaalsContact CA-O 3.26Å; N233-G269 WeakPolarHBondContact CA-O 3.43Å; N233-F271 PolarHBondContact OD1-N 3.03Å; N233-F271 VanDerWaalsContact OD1-N 3.11Å
234	K	95.7	Very high	93.9	Very high	26 Å²	26	39.2 Å²	39.2	11%	0.113	19%	0.188	C	C	.	.			trans	59.4	31.6	-179.7	-49.6	-172.8	-164.8	165.8	0	113.1	S82 D204 D236 Q237 G269 S270	S82-K234 WeakPolarHBondContact O-CE 3.12Å; S82-K234 PolarHBondContact O-NZ 3.33Å; D204-K234 WeakPolarHBondContact OD2-CD 3.32Å; D204-K234 WeakPolarHBondContact OD2-CE 3.47Å; D204-K234 IonicContact OD2-NZ 2.83Å; D204-K234 PolarHBondContact OD2-NZ 2.98Å; K234-D236 PolarHBondContact O-N 3.49Å; K234-Q237 HydrophobicContact CB-CG 4.04Å; K234-Q237 WeakPolarHBondContact O-CB 3.37Å; K234-Q237 WeakPolarHBondContact O-CG 3.36Å; K234-Q237 PolarHBondContact O-N 3.06Å; K234-G269 PolarHBondContact N-O 3.43Å; K234-S270 VanDerWaalsContact CA-OG 3.31Å; K234-S270 WeakPolarHBondContact CA-OG 3.31Å
235	A	96.3	Very high	94.3	Very high	0 Å²	0	47 Å²	47	0%	0	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-65	-22.7	-178.7	0	0	0	0	0	112.8	A205 N233 Q237 I238 L243 I268 G269 S270 F285	A205-A235 HydrophobicContact CB-CB 4.46Å; N233-A235 PolarHBondContact O-N 2.86Å; A235-Q237 PolarHBondContact O-N 3.17Å; A235-I238 WeakPolarHBondContact O-CG1 3.36Å; A235-L243 HydrophobicContact CB-CD1 3.88Å; A235-I268 HydrophobicContact CB-CG2 3.62Å; A235-G269 PolarHBondContact N-O 3.1Å; A235-S270 PolarHBondContact N-OG 3.3Å; A235-F285 HydrophobicContact CB-CD1 4.25Å; A235-F285 HydrophobicContact CB-CE1 3.49Å; A235-F285 VanDerWaalsContact CB-CE1 3.49Å; A235-F285 HydrophobicContact CB-CZ 3.72Å
236	D	93.3	Very high	94.7	Very high	0 Å²	0	45 Å²	45	0%	0	21%	0.208	C	C	.	.	G	3₁₀ helix	trans	-68.6	-9	175.2	76.9	-52.6	0	0	0	114.6	K234 S270 L276 L277 I278 F285	K234-D236 PolarHBondContact O-N 3.49Å; D236-S270 WeakPolarHBondContact CB-OG 3.3Å; D236-S270 PolarHBondContact N-OG 3.4Å; D236-S270 VanDerWaalsContact OD1-CB 3.32Å; D236-S270 WeakPolarHBondContact OD1-CB 3.35Å; D236-S270 PolarHBondContact OD1-OG 2.97Å; D236-L276 HydrophobicContact CB-CB 4.16Å; D236-L276 HydrophobicContact CB-CD2 3.75Å; D236-L276 WeakPolarHBondContact OD2-CA 3.4Å; D236-L277 PolarHBondContact OD2-N 3.18Å; D236-I278 VanDerWaalsContact O-CB 3.27Å; D236-I278 WeakPolarHBondContact O-CB 3.35Å; D236-I278 WeakPolarHBondContact O-CG1 3.03Å; D236-I278 PolarHBondContact O-N 3.46Å; D236-F285 HydrophobicContact CB-CE2 3.88Å
237	Q	93.8	Very high	95.1	Very high	55 Å²	55	44.6 Å²	44.6	26%	0.257	20%	0.201	S	C	.	.	G	3₁₀ helix	trans	-88.7	-3.7	-179	-54	-166.8	-4.4	0	0	113.8	H206 K234 A235 W272 L277	H206-Q237 HydrophobicContact CB-CB 4.44Å; K234-Q237 HydrophobicContact CB-CG 4.04Å; K234-Q237 WeakPolarHBondContact O-CB 3.37Å; K234-Q237 WeakPolarHBondContact O-CG 3.36Å; K234-Q237 PolarHBondContact O-N 3.06Å; A235-Q237 PolarHBondContact O-N 3.17Å; Q237-W272 VanDerWaalsContact NE2-CH2 3.34Å; Q237-L277 HydrophobicContact CG-CD1 3.98Å
238	I	94.9	Very high	95.2	Very high	2 Å²	2	46.1 Å²	46.1	1%	0.01	22%	0.218	C	C	.	.	S	Bend	trans	-133.7	150	-176.2	60.4	173.6	0	0	0	110.7	A205 H206 A235 Q242 L243 V246	A205-I238 HydrophobicContact CB-CD1 3.8Å; A205-I238 HydrophobicContact CB-CG1 4.42Å; H206-I238 HydrophobicContact CB-CG2 4.38Å; A235-I238 WeakPolarHBondContact O-CG1 3.36Å; I238-Q242 HydrophobicContact CB-CB 4.25Å; I238-Q242 HydrophobicContact CB-CG 4.15Å; I238-Q242 HydrophobicContact CD1-CG 4.26Å; I238-Q242 HydrophobicContact CG2-CG 4.37Å; I238-L243 HydrophobicContact CD1-CB 3.95Å; I238-L243 HydrophobicContact CD1-CD1 3.93Å; I238-L243 HydrophobicContact CG1-CB 4.17Å; I238-L243 HydrophobicContact CG1-CD1 4.4Å; I238-V246 HydrophobicContact CD1-CB 4.37Å; I238-V246 HydrophobicContact CD1-CG2 4.08Å
239	E	93.4	Very high	95.2	Very high	126 Å²	126	48.1 Å²	48.1	59%	0.589	24%	0.235	S	C	*	.			trans	-68.6	157	177.5	-64.1	175.6	-173.5	0	0	111.8	Q241 Q242 L243 I278	E239-Q241 VanDerWaalsContact C-N 3.29Å; E239-Q241 PolarHBondContact O-N 3.39Å; E239-Q241 VanDerWaalsContact O-N 3.16Å; E239-Q242 WeakPolarHBondContact O-CB 3.26Å; E239-Q242 PolarHBondContact O-N 3.37Å; E239-L243 PolarHBondContact O-N 3.36Å; E239-I278 HydrophobicContact CG-CD1 4.31Å
240	T	92	Very high	95.2	Very high	50 Å²	50	45.2 Å²	45.2	31%	0.307	23%	0.225	S	C	.	.	H	α-helix	trans	-52	-42.3	-177.6	-51.8	0	0	0	0	113.6	L243 M244 N281	T240-L243 WeakPolarHBondContact O-CB 3.36Å; T240-L243 PolarHBondContact O-N 3.35Å; T240-M244 WeakPolarHBondContact O-CG 3.37Å; T240-M244 PolarHBondContact O-N 3.32Å; T240-M244 VanDerWaalsContact O-N 3.12Å; T240-N281 WeakPolarHBondContact CG2-OD1 3.4Å; T240-N281 PolarHBondContact OG1-ND2 3.15Å; T240-N281 PolarHBondContact OG1-OD1 3.5Å
241	Q	92.5	Very high	95	Very high	144 Å²	144	47.3 Å²	47.3	67%	0.673	24%	0.235	S	C	*	.	H	α-helix	trans	-66.6	-40	178.6	-66.2	-170	7.8	0	0	112.4	E239 M244 R245	E239-Q241 VanDerWaalsContact C-N 3.29Å; E239-Q241 PolarHBondContact O-N 3.39Å; E239-Q241 VanDerWaalsContact O-N 3.16Å; Q241-M244 PolarHBondContact O-N 3.07Å; Q241-R245 WeakPolarHBondContact O-CG 3.35Å; Q241-R245 PolarHBondContact O-N 2.96Å
242	Q	94.6	Very high	94.6	Very high	86 Å²	86	55.8 Å²	55.8	40%	0.402	27%	0.267	S	S	.	.	H	α-helix	trans	-67.9	-39.7	176.6	-175.1	174.7	-0.7	0	0	110.5	I238 E239 M244 R245 V246	I238-Q242 HydrophobicContact CB-CB 4.25Å; I238-Q242 HydrophobicContact CB-CG 4.15Å; I238-Q242 HydrophobicContact CD1-CG 4.26Å; I238-Q242 HydrophobicContact CG2-CG 4.37Å; E239-Q242 WeakPolarHBondContact O-CB 3.26Å; E239-Q242 PolarHBondContact O-N 3.37Å; Q242-M244 VanDerWaalsContact C-N 3.33Å; Q242-M244 PolarHBondContact O-N 3.1Å; Q242-R245 WeakPolarHBondContact O-CB 3.36Å; Q242-R245 PolarHBondContact O-N 2.82Å; Q242-R245 VanDerWaalsContact O-N 3.11Å; Q242-V246 HydrophobicContact CG-CG2 4.28Å; Q242-V246 WeakPolarHBondContact O-CG2 3.3Å; Q242-V246 PolarHBondContact O-N 3.15Å
243	L	95.7	Very high	94.3	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-56.5	-45.3	175.5	-178.5	61.3	0	0	0	112	L232 A235 I238 E239 T240 R245 V246 Y247 I268 F285	L232-L243 HydrophobicContact CD2-CD1 4.02Å; A235-L243 HydrophobicContact CB-CD1 3.88Å; I238-L243 HydrophobicContact CD1-CB 3.95Å; I238-L243 HydrophobicContact CD1-CD1 3.93Å; I238-L243 HydrophobicContact CG1-CB 4.17Å; I238-L243 HydrophobicContact CG1-CD1 4.4Å; E239-L243 PolarHBondContact O-N 3.36Å; T240-L243 WeakPolarHBondContact O-CB 3.36Å; T240-L243 PolarHBondContact O-N 3.35Å; L243-R245 VanDerWaalsContact C-N 3.33Å; L243-R245 PolarHBondContact O-N 2.85Å; L243-V246 PolarHBondContact O-N 2.88Å; L243-Y247 VanDerWaalsContact O-CB 3.27Å; L243-Y247 WeakPolarHBondContact O-CB 3.43Å; L243-Y247 PolarHBondContact O-N 2.68Å; L243-I268 HydrophobicContact CD1-CG2 3.88Å; L243-I268 HydrophobicContact CD2-CG2 4.08Å; L243-I268 HydrophobicContact CG-CG2 4.43Å; L243-F285 HydrophobicContact CD2-CE1 4.04Å; L243-F285 HydrophobicContact CD2-CZ 4.44Å
244	M	94.6	Very high	94	Very high	94 Å²	94	57.9 Å²	57.9	46%	0.463	28%	0.281	S	S	.	.	H	α-helix	trans	-63.3	-36.7	176.5	-65.2	-59.1	98.1	0	0	112.9	T240 Q241 Q242 G248	T240-M244 WeakPolarHBondContact O-CG 3.37Å; T240-M244 PolarHBondContact O-N 3.32Å; T240-M244 VanDerWaalsContact O-N 3.12Å; Q241-M244 PolarHBondContact O-N 3.07Å; Q242-M244 VanDerWaalsContact C-N 3.33Å; Q242-M244 PolarHBondContact O-N 3.1Å; M244-G248 PolarHBondContact O-N 3.32Å
245	R	95.6	Very high	93.7	Very high	185 Å²	185	59 Å²	59	70%	0.698	30%	0.301	S	S	*	.	H	α-helix	trans	-67.4	-45	175.9	-68	176.3	-175.6	172.6	4.4	111.7	Q241 Q242 L243 G248 A249	Q241-R245 WeakPolarHBondContact O-CG 3.35Å; Q241-R245 PolarHBondContact O-N 2.96Å; Q242-R245 WeakPolarHBondContact O-CB 3.36Å; Q242-R245 PolarHBondContact O-N 2.82Å; Q242-R245 VanDerWaalsContact O-N 3.11Å; L243-R245 VanDerWaalsContact C-N 3.33Å; L243-R245 PolarHBondContact O-N 2.85Å; R245-G248 PolarHBondContact O-N 3.17Å; R245-A249 WeakPolarHBondContact O-CB 3.3Å; R245-A249 PolarHBondContact O-N 3.03Å
246	V	96.1	Very high	93.3	Very high	19 Å²	19	65.8 Å²	65.8	12%	0.115	33%	0.33	C	S	.	.	H	α-helix	trans	-63.7	-45.7	177.8	171.5	0	0	0	0	110.4	L208 L232 I238 Q242 L243 G248 A249 L250	L208-V246 HydrophobicContact CB-CG1 3.95Å; L208-V246 HydrophobicContact CD2-CG1 3.88Å; L208-V246 WeakPolarHBondContact CD2-O 3.38Å; L208-V246 HydrophobicContact CG-CG1 4.36Å; L232-V246 HydrophobicContact CD1-CG1 4.11Å; L232-V246 HydrophobicContact CD2-CG1 4.24Å; I238-V246 HydrophobicContact CD1-CB 4.37Å; I238-V246 HydrophobicContact CD1-CG2 4.08Å; Q242-V246 HydrophobicContact CG-CG2 4.28Å; Q242-V246 WeakPolarHBondContact O-CG2 3.3Å; Q242-V246 PolarHBondContact O-N 3.15Å; L243-V246 PolarHBondContact O-N 2.88Å; V246-G248 PolarHBondContact O-N 2.97Å; V246-A249 PolarHBondContact O-N 2.73Å; V246-L250 WeakPolarHBondContact O-CB 3.38Å; V246-L250 PolarHBondContact O-N 3.31Å
247	Y	95.3	Very high	93.1	Very high	76 Å²	76	67 Å²	67	30%	0.298	34%	0.336	S	S	.	.	H	α-helix	trans	-57.3	-49.6	175	178.5	-100	0	0	0	111.9	L243 A249 L250 M251 V266 I268	L243-Y247 VanDerWaalsContact O-CB 3.27Å; L243-Y247 WeakPolarHBondContact O-CB 3.43Å; L243-Y247 PolarHBondContact O-N 2.68Å; Y247-A249 VanDerWaalsContact C-N 3.34Å; Y247-A249 PolarHBondContact O-N 2.86Å; Y247-L250 PolarHBondContact O-N 2.92Å; Y247-M251 HydrophobicContact CD1-CG 4.39Å; Y247-M251 HydrophobicContact CE1-CG 4.01Å; Y247-M251 HydrophobicContact CE2-CG 4.2Å; Y247-M251 HydrophobicContact CE2-SD 4.45Å; Y247-M251 WeakPolarHBondContact O-CG 3.41Å; Y247-M251 PolarHBondContact O-N 3.12Å; Y247-V266 HydrophobicContact CD2-CG1 4.24Å; Y247-V266 HydrophobicContact CE2-CB 3.84Å; Y247-V266 HydrophobicContact CE2-CG1 3.95Å; Y247-V266 HydrophobicContact CE2-CG2 4.16Å; Y247-I268 HydrophobicContact CD2-CD1 3.72Å; Y247-I268 HydrophobicContact CD2-CG1 4.33Å; Y247-I268 HydrophobicContact CE2-CD1 4Å; Y247-I268 HydrophobicContact CG-CD1 4.44Å
248	G	94.8	Very high	92.7	Very high	39 Å²	39	65 Å²	65	40%	0.402	33%	0.327	S	S	.	.	H	α-helix	trans	-59.4	-42.1	176.5	0	0	0	0	0	113.1	M244 R245 V246 M251 W252	M244-G248 PolarHBondContact O-N 3.32Å; R245-G248 PolarHBondContact O-N 3.17Å; V246-G248 PolarHBondContact O-N 2.97Å; G248-M251 PolarHBondContact O-N 3.11Å; G248-W252 WeakPolarHBondContact O-CB 3.49Å; G248-W252 PolarHBondContact O-N 3.5Å
249	A	94.8	Very high	91.8	Very high	45 Å²	45	71.7 Å²	71.7	37%	0.372	36%	0.363	S	S	.	.	H	α-helix	trans	-65.5	-39.8	177	0	0	0	0	0	112.8	L208 R245 V246 Y247 S253	L208-A249 HydrophobicContact CD2-CB 3.91Å; R245-A249 WeakPolarHBondContact O-CB 3.3Å; R245-A249 PolarHBondContact O-N 3.03Å; V246-A249 PolarHBondContact O-N 2.73Å; Y247-A249 VanDerWaalsContact C-N 3.34Å; Y247-A249 PolarHBondContact O-N 2.86Å; A249-S253 WeakPolarHBondContact O-CB 3.48Å; A249-S253 PolarHBondContact O-N 2.98Å; A249-S253 PolarHBondContact O-OG 2.95Å; A249-S253 VanDerWaalsContact O-OG 3.06Å
250	L	94.8	Very high	91.2	Very high	0 Å²	0	67.3 Å²	67.3	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-62.5	-50.1	175.5	173.3	62.7	0	0	0	110.7	F203 L208 I210 V230 L232 V246 Y247 W252 S253 L254 V266	F203-L250 HydrophobicContact CD1-CD1 3.72Å; F203-L250 HydrophobicContact CD2-CD1 3.85Å; F203-L250 HydrophobicContact CD2-CD2 4.34Å; F203-L250 HydrophobicContact CE1-CD1 3.78Å; F203-L250 HydrophobicContact CE2-CD1 3.92Å; F203-L250 HydrophobicContact CG-CD1 3.76Å; F203-L250 HydrophobicContact CG-CD2 4.42Å; F203-L250 HydrophobicContact CZ-CD1 3.88Å; L208-L250 HydrophobicContact CD1-CB 4.13Å; L208-L250 HydrophobicContact CD1-CD1 3.97Å; L208-L250 HydrophobicContact CD1-CG 4.49Å; L208-L250 HydrophobicContact CD2-CB 3.97Å; I210-L250 HydrophobicContact CD1-CD1 4.23Å; V230-L250 HydrophobicContact CG1-CD2 3.95Å; L232-L250 HydrophobicContact CB-CD2 4.37Å; L232-L250 HydrophobicContact CD1-CD2 4.17Å; V246-L250 WeakPolarHBondContact O-CB 3.38Å; V246-L250 PolarHBondContact O-N 3.31Å; Y247-L250 PolarHBondContact O-N 2.92Å; L250-W252 VanDerWaalsContact C-N 3.32Å; L250-W252 PolarHBondContact O-N 3.08Å; L250-S253 PolarHBondContact O-N 3.25Å; L250-L254 HydrophobicContact CD1-CD1 3.81Å; L250-L254 HydrophobicContact CD1-CG 3.89Å; L250-L254 HydrophobicContact CG-CD1 3.95Å; L250-L254 HydrophobicContact CG-CG 4.38Å; L250-L254 WeakPolarHBondContact O-CB 3.42Å; L250-L254 WeakPolarHBondContact O-CG 3.36Å; L250-L254 PolarHBondContact O-N 3.35Å; L250-V266 HydrophobicContact CD2-CG1 4.31Å
251	M	92.8	Very high	90.8	Very high	44 Å²	44	71.1 Å²	71.1	22%	0.217	37%	0.37	C	S	.	.	H	α-helix	trans	-61	-41.9	179.9	-67.9	-55.8	-71.2	0	0	112	Y247 G248 S253 L254 G255 V263 V266	Y247-M251 HydrophobicContact CD1-CG 4.39Å; Y247-M251 HydrophobicContact CE1-CG 4.01Å; Y247-M251 HydrophobicContact CE2-CG 4.2Å; Y247-M251 HydrophobicContact CE2-SD 4.45Å; Y247-M251 WeakPolarHBondContact O-CG 3.41Å; Y247-M251 PolarHBondContact O-N 3.12Å; G248-M251 PolarHBondContact O-N 3.11Å; M251-S253 PolarHBondContact O-N 2.99Å; M251-L254 PolarHBondContact O-N 3.06Å; M251-G255 PolarHBondContact O-N 3.23Å; M251-V263 HydrophobicContact CE-CG1 3.19Å; M251-V266 HydrophobicContact SD-CG2 3.4Å; M251-V266 WeakPolarHBondContact SD-CG2 3.5Å
252	W	91.4	Very high	90.3	Very high	178 Å²	178	71.4 Å²	71.4	67%	0.674	37%	0.372	S	S	*	.	H	α-helix	trans	-59.8	-44.7	174.8	177.8	-99.8	0	0	0	112.5	G248 L250 K256	G248-W252 WeakPolarHBondContact O-CB 3.49Å; G248-W252 PolarHBondContact O-N 3.5Å; L250-W252 VanDerWaalsContact C-N 3.32Å; L250-W252 PolarHBondContact O-N 3.08Å; W252-K256 VanDerWaalsContact NE1-CE 3.27Å; W252-K256 VanDerWaalsContact NE1-NZ 3.18Å; W252-K256 PolarHBondContact O-N 3.06Å
253	S	91.6	Very high	89.9	Confident	40 Å²	40	73 Å²	73	28%	0.28	39%	0.387	S	S	.	.	H	α-helix	trans	-69.1	-43.6	179.1	-62.7	0	0	0	0	112.2	A249 L250 M251 G255 K256 I257	A249-S253 WeakPolarHBondContact O-CB 3.48Å; A249-S253 PolarHBondContact O-N 2.98Å; A249-S253 PolarHBondContact O-OG 2.95Å; A249-S253 VanDerWaalsContact O-OG 3.06Å; L250-S253 PolarHBondContact O-N 3.25Å; M251-S253 PolarHBondContact O-N 2.99Å; S253-G255 PolarHBondContact O-N 3.37Å; S253-K256 PolarHBondContact O-N 3.29Å; S253-I257 WeakPolarHBondContact O-CG1 3.47Å; S253-I257 PolarHBondContact O-N 3.45Å
254	L	91	Very high	89.6	Confident	6 Å²	6	74.2 Å²	74.2	3%	0.031	40%	0.395	C	S	.	.	H	α-helix	trans	-63.3	-40.7	176.9	-71.7	178.6	0	0	0	112.2	F203 I218 V230 L250 M251 K256 I257 I258	F203-L254 HydrophobicContact CE2-CD2 4.46Å; F203-L254 HydrophobicContact CZ-CD2 4.03Å; I218-L254 HydrophobicContact CD1-CD2 4.32Å; V230-L254 HydrophobicContact CB-CD1 4.47Å; V230-L254 HydrophobicContact CG1-CD1 4.1Å; V230-L254 HydrophobicContact CG2-CD1 3.75Å; L250-L254 HydrophobicContact CD1-CD1 3.81Å; L250-L254 HydrophobicContact CD1-CG 3.89Å; L250-L254 HydrophobicContact CG-CD1 3.95Å; L250-L254 HydrophobicContact CG-CG 4.38Å; L250-L254 WeakPolarHBondContact O-CB 3.42Å; L250-L254 WeakPolarHBondContact O-CG 3.36Å; L250-L254 PolarHBondContact O-N 3.35Å; M251-L254 PolarHBondContact O-N 3.06Å; L254-K256 PolarHBondContact O-N 3.47Å; L254-I257 PolarHBondContact O-N 3.3Å; L254-I258 HydrophobicContact CB-CD1 4.49Å; L254-I258 HydrophobicContact CD2-CD1 4.25Å; L254-I258 PolarHBondContact O-N 2.99Å
255	G	88.5	Confident	89.5	Confident	51 Å²	51	74.4 Å²	74.4	53%	0.526	39%	0.39	S	S	.	.	H	α-helix	trans	-58.1	-33.9	176.8	0	0	0	0	0	113	M251 S253	M251-G255 PolarHBondContact O-N 3.23Å; S253-G255 PolarHBondContact O-N 3.37Å
256	K	87.6	Confident	89.5	Confident	142 Å²	142	65.7 Å²	65.7	62%	0.617	36%	0.357	S	S	*	.	H	α-helix	trans	-73.6	-27.5	174.7	-69.1	179.8	178	-176.1	0	113.9	W252 S253 L254	W252-K256 VanDerWaalsContact NE1-CE 3.27Å; W252-K256 VanDerWaalsContact NE1-NZ 3.18Å; W252-K256 PolarHBondContact O-N 3.06Å; S253-K256 PolarHBondContact O-N 3.29Å; L254-K256 PolarHBondContact O-N 3.47Å
257	I	89.4	Confident	89.6	Confident	24 Å²	24	65.3 Å²	65.3	12%	0.123	35%	0.354	C	S	.	.	H	α-helix	trans	-94.8	-48.3	-171	-62.4	167.6	0	0	0	111.3	I210 S215 I218 K219 S253 L254	I210-I257 HydrophobicContact CD1-CD1 4.45Å; I210-I257 HydrophobicContact CG2-CD1 3.91Å; S215-I257 WeakPolarHBondContact OG-CD1 3.28Å; I218-I257 HydrophobicContact CB-CG2 3.81Å; I218-I257 HydrophobicContact CG2-CG2 3.55Å; K219-I257 HydrophobicContact CG-CG2 4Å; S253-I257 WeakPolarHBondContact O-CG1 3.47Å; S253-I257 PolarHBondContact O-N 3.45Å; L254-I257 PolarHBondContact O-N 3.3Å
258	I	85	Confident	89.7	Confident	14 Å²	14	62.3 Å²	62.3	7%	0.072	34%	0.343	C	S	.	.	H	α-helix	trans	-76	-27.9	-174.9	-59.5	-179.4	0	0	0	110.7	I218 E225 L254 T260 V264	I218-I258 HydrophobicContact CG2-CD1 4.29Å; I218-I258 HydrophobicContact CG2-CG1 3.74Å; E225-I258 HydrophobicContact CB-CG2 4.4Å; L254-I258 HydrophobicContact CB-CD1 4.49Å; L254-I258 HydrophobicContact CD2-CD1 4.25Å; L254-I258 PolarHBondContact O-N 2.99Å; I258-T260 HydrophobicContact CG2-CG2 3.55Å; I258-T260 PolarHBondContact O-N 3.23Å; I258-T260 VanDerWaalsContact O-N 3.16Å; I258-V264 HydrophobicContact CD1-CG2 3.71Å
259	N	77.1	Confident	89.7	Confident	143 Å²	143	60.5 Å²	60.5	77%	0.765	32%	0.324	S	S	*	.			trans	49.7	41.2	172.3	-167.7	59.3	0	0	0	113.5
260	T	80.9	Confident	89.6	Confident	34 Å²	34	58.9 Å²	58.9	21%	0.209	31%	0.31	C	S	.	.			trans	-117.5	145	172.3	-170.4	0	0	0	0	108.7	E225 I258 E262	E225-T260 PolarHBondContact OE1-OG1 2.7Å; E225-T260 WeakPolarHBondContact OE2-CB 3.14Å; E225-T260 VanDerWaalsContact OE2-CG2 3.31Å; E225-T260 WeakPolarHBondContact OE2-CG2 3.38Å; E225-T260 PolarHBondContact OE2-OG1 3.16Å; I258-T260 HydrophobicContact CG2-CG2 3.55Å; I258-T260 PolarHBondContact O-N 3.23Å; I258-T260 VanDerWaalsContact O-N 3.16Å; T260-E262 HydrophobicContact CG2-CB 4.38Å; T260-E262 VanDerWaalsContact CG2-O 3.29Å; T260-E262 WeakPolarHBondContact CG2-O 3.22Å; T260-E262 PolarHBondContact O-N 3.21Å
261	P	81.9	Confident	89.5	Confident	129 Å²	129	59 Å²	59	84%	0.838	31%	0.311	S	S	*	.	S	Bend	trans	-67	-18.2	175.8	27.9	-35.7	0	0	0	112.7
262	E	83.5	Confident	89.1	Confident	150 Å²	150	59.6 Å²	59.6	70%	0.701	31%	0.311	S	S	*	.	S	Bend	trans	-80	131.5	-179.7	-62	-170.5	179	0	0	111.8	T260 V264	T260-E262 HydrophobicContact CG2-CB 4.38Å; T260-E262 VanDerWaalsContact CG2-O 3.29Å; T260-E262 WeakPolarHBondContact CG2-O 3.22Å; T260-E262 PolarHBondContact O-N 3.21Å; E262-V264 PolarHBondContact O-N 3.13Å
263	V	85.9	Confident	88.5	Confident	120 Å²	120	55.6 Å²	55.6	73%	0.727	31%	0.31	S	S	*	.	P	Polyproline II helix	trans	-82	122.2	-179.8	-177.3	0	0	0	0	109.3	M251 R265	M251-V263 HydrophobicContact CE-CG1 3.19Å; V263-R265 PolarHBondContact O-N 3.29Å
264	V	88.9	Confident	87.9	Confident	26 Å²	26	60 Å²	60	16%	0.158	33%	0.326	C	S	.	.	P	Polyproline II helix	trans	-68.6	131.8	177.7	-177.7	0	0	0	0	110.6	I228 V230 I258 E262 V266	I228-V264 HydrophobicContact CG2-CG1 4.1Å; V230-V264 HydrophobicContact CB-CG1 4.4Å; V230-V264 HydrophobicContact CG2-CB 4.5Å; V230-V264 HydrophobicContact CG2-CG1 3.6Å; I258-V264 HydrophobicContact CD1-CG2 3.71Å; E262-V264 PolarHBondContact O-N 3.13Å; V264-V266 PolarHBondContact O-N 2.89Å
265	R	91.9	Very high	87.1	Confident	97 Å²	97	65.1 Å²	65.1	37%	0.366	36%	0.359	S	S	.	.	P	Polyproline II helix	trans	-65.2	124.4	173.7	-178.6	63.6	166.6	129.3	-8.9	110.3	V230 V263 Y267 E288 D291	V230-R265 PolarHBondContact N-O 3.4Å; V263-R265 PolarHBondContact O-N 3.29Å; R265-Y267 HydrophobicContact CG-CD2 4.47Å; R265-Y267 HydrophobicContact CG-CE1 4.11Å; R265-Y267 HydrophobicContact CG-CE2 3.9Å; R265-E288 IonicContact CZ-OE1 2.76Å; R265-E288 IonicContact CZ-OE2 2.82Å; R265-E288 VanDerWaalsContact NH1-CD 3.31Å; R265-E288 IonicContact NH1-OE1 2.73Å; R265-E288 PolarHBondContact NH1-OE1 3.01Å; R265-E288 IonicContact NH1-OE2 2.78Å; R265-E288 PolarHBondContact NH1-OE2 3.47Å; R265-E288 VanDerWaalsContact NH2-CD 3.28Å; R265-E288 IonicContact NH2-OE1 3.51Å; R265-E288 PolarHBondContact NH2-OE1 3.35Å; R265-E288 IonicContact NH2-OE2 2.87Å; R265-E288 PolarHBondContact NH2-OE2 2.97Å; R265-E288 VanDerWaalsContact NH2-OE2 3.16Å; R265-D291 IonicContact NH2-OD2 3.43Å; R265-D291 PolarHBondContact NH2-OD2 2.9Å; R265-D291 VanDerWaalsContact NH2-OD2 3.16Å
266	V	96.4	Very high	86.9	Confident	2 Å²	2	64.9 Å²	64.9	1%	0.012	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	131.4	171.7	180	0	0	0	0	108.6	V230 L232 Y247 L250 M251 V264 I268	V230-V266 HydrophobicContact CB-CB 4.41Å; V230-V266 HydrophobicContact CB-CG2 3.92Å; V230-V266 HydrophobicContact CG1-CB 4.42Å; V230-V266 HydrophobicContact CG1-CG1 4.13Å; V230-V266 HydrophobicContact CG1-CG2 3.9Å; V230-V266 CarbonylContact O-C 3.59Å; V230-V266 VanDerWaalsContact O-CA 3.3Å; V230-V266 WeakPolarHBondContact O-CA 3.33Å; L232-V266 HydrophobicContact CB-CG1 4Å; Y247-V266 HydrophobicContact CD2-CG1 4.24Å; Y247-V266 HydrophobicContact CE2-CB 3.84Å; Y247-V266 HydrophobicContact CE2-CG1 3.95Å; Y247-V266 HydrophobicContact CE2-CG2 4.16Å; L250-V266 HydrophobicContact CD2-CG1 4.31Å; M251-V266 HydrophobicContact SD-CG2 3.4Å; M251-V266 WeakPolarHBondContact SD-CG2 3.5Å; V264-V266 PolarHBondContact O-N 2.89Å; V266-I268 HydrophobicContact CG1-CG1 4.2Å
267	Y	97.8	Very high	86.7	Confident	12 Å²	12	63.9 Å²	63.9	5%	0.047	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	125.4	171.3	-56.9	-86.7	0	0	0	109.4	R229 V230 V231 L232 R265 E288 D291 L292	R229-Y267 HydrophobicContact CB-CE2 3.96Å; R229-Y267 HydrophobicContact CG-CE2 4.16Å; V230-Y267 WeakPolarHBondContact O-CD2 3.35Å; V230-Y267 PolarHBondContact O-N 2.89Å; V231-Y267 CarbonylContact C-O 3.3Å; V231-Y267 WeakPolarHBondContact CA-O 3.3Å; V231-Y267 HydrophobicContact CG2-CD2 4.45Å; L232-Y267 PolarHBondContact N-O 3.35Å; R265-Y267 HydrophobicContact CG-CD2 4.47Å; R265-Y267 HydrophobicContact CG-CE1 4.11Å; R265-Y267 HydrophobicContact CG-CE2 3.9Å; Y267-E288 WeakPolarHBondContact CA-OE2 3.32Å; Y267-E288 WeakPolarHBondContact CD1-O 3.48Å; Y267-D291 HydrophobicContact CD1-CB 4.28Å; Y267-D291 HydrophobicContact CE1-CB 3.84Å; Y267-L292 HydrophobicContact CD1-CB 3.73Å; Y267-L292 HydrophobicContact CD2-CB 4.45Å; Y267-L292 HydrophobicContact CD2-CD1 3.89Å; Y267-L292 HydrophobicContact CE1-CB 3.99Å; Y267-L292 HydrophobicContact CE2-CD1 3.93Å; Y267-L292 HydrophobicContact CG-CB 3.96Å; Y267-L292 HydrophobicContact CG-CD1 4.22Å
268	I	97.2	Very high	86.5	Confident	13 Å²	13	64.8 Å²	64.8	7%	0.067	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	125.2	-174.4	-55.1	174.1	0	0	0	109	L232 A235 L243 Y247 V266 F285 E288	L232-I268 HydrophobicContact CB-CG1 4.46Å; A235-I268 HydrophobicContact CB-CG2 3.62Å; L243-I268 HydrophobicContact CD1-CG2 3.88Å; L243-I268 HydrophobicContact CD2-CG2 4.08Å; L243-I268 HydrophobicContact CG-CG2 4.43Å; Y247-I268 HydrophobicContact CD2-CD1 3.72Å; Y247-I268 HydrophobicContact CD2-CG1 4.33Å; Y247-I268 HydrophobicContact CE2-CD1 4Å; Y247-I268 HydrophobicContact CG-CD1 4.44Å; V266-I268 HydrophobicContact CG1-CG1 4.2Å; I268-F285 HydrophobicContact CG2-CD1 4.25Å; I268-F285 HydrophobicContact CG2-CE1 4Å; I268-E288 VanDerWaalsContact O-CB 3.3Å; I268-E288 WeakPolarHBondContact O-CB 3.45Å
269	G	94.8	Very high	86.4	Confident	1 Å²	1	66.9 Å²	66.9	1%	0.01	37%	0.365	C	S	.	.	S	Bend	trans	174.5	-165.9	177.5	0	0	0	0	0	113.8	L232 N233 K234 A235	L232-G269 PolarHBondContact O-N 3.49Å; L232-G269 VanDerWaalsContact O-N 3.12Å; N233-G269 CarbonylContact C-O 3.6Å; N233-G269 VanDerWaalsContact C-O 3.3Å; N233-G269 VanDerWaalsContact CA-O 3.26Å; N233-G269 WeakPolarHBondContact CA-O 3.43Å; K234-G269 PolarHBondContact N-O 3.43Å; A235-G269 PolarHBondContact N-O 3.1Å
270	S	93.1	Very high	86.7	Confident	11 Å²	11	65.7 Å²	65.7	8%	0.077	36%	0.359	C	S	.	.			trans	-132.2	98.1	177	-65.2	0	0	0	0	109	K234 A235 D236 W272	K234-S270 VanDerWaalsContact CA-OG 3.31Å; K234-S270 WeakPolarHBondContact CA-OG 3.31Å; A235-S270 PolarHBondContact N-OG 3.3Å; D236-S270 WeakPolarHBondContact CB-OG 3.3Å; D236-S270 PolarHBondContact N-OG 3.4Å; D236-S270 VanDerWaalsContact OD1-CB 3.32Å; D236-S270 WeakPolarHBondContact OD1-CB 3.35Å; D236-S270 PolarHBondContact OD1-OG 2.97Å; S270-W272 VanDerWaalsContact C-N 3.3Å; S270-W272 PolarHBondContact O-N 3.1Å
271	F	92.4	Very high	86.8	Confident	2 Å²	2	65.3 Å²	65.3	1%	0.009	36%	0.356	C	S	.	.			trans	-87.6	70	-168.3	-63	-89.9	0	0	0	111	F88 V231 N233 E289 L292 F293	F88-F271 HydrophobicContact CD2-CB 3.42Å; F88-F271 VanDerWaalsContact CD2-CB 3.42Å; F88-F271 HydrophobicContact CD2-CD1 4.05Å; F88-F271 HydrophobicContact CD2-CD2 4.22Å; F88-F271 AromaticContact CD2-CG 3.62Å; F88-F271 HydrophobicContact CD2-CG 3.62Å; F88-F271 HydrophobicContact CE2-CB 3.86Å; F88-F271 AromaticContact CE2-CD1 3.54Å; F88-F271 HydrophobicContact CE2-CD1 3.54Å; F88-F271 HydrophobicContact CE2-CD2 4.17Å; F88-F271 HydrophobicContact CE2-CE1 4.12Å; F88-F271 AromaticContact CE2-CG 3.56Å; F88-F271 HydrophobicContact CE2-CG 3.56Å; F88-F271 HydrophobicContact CG-CB 4.39Å; F88-F271 HydrophobicContact CZ-CD1 4.49Å; V231-F271 HydrophobicContact CG1-CD2 3.61Å; V231-F271 HydrophobicContact CG1-CE2 3.3Å; V231-F271 HydrophobicContact CG1-CZ 4.08Å; N233-F271 PolarHBondContact OD1-N 3.03Å; N233-F271 VanDerWaalsContact OD1-N 3.11Å; F271-E289 HydrophobicContact CD1-CG 4.28Å; F271-E289 HydrophobicContact CE1-CB 3.95Å; F271-E289 HydrophobicContact CE1-CG 3.95Å; F271-L292 HydrophobicContact CD1-CD2 4.06Å; F271-L292 HydrophobicContact CE1-CD2 3.34Å; F271-L292 HydrophobicContact CE1-CG 4.46Å; F271-L292 HydrophobicContact CZ-CD2 3.63Å; F271-F293 HydrophobicContact CD1-CE1 4.37Å
272	W	84.9	Confident	86.8	Confident	57 Å²	57	64.4 Å²	64.4	22%	0.216	34%	0.335	C	S	.	.	S	Bend	trans	-151.1	170.5	177.3	61.3	23	0	0	0	111.2	T87 H91 Q237 S270 H274	T87-W272 HydrophobicContact CG2-CB 3.9Å; H91-W272 PolarHBondContact CE1-O 3.32Å; H91-W272 WeakPolarHBondContact ND1-CA 3.44Å; H91-W272 PolarHBondContact ND1-O 3.02Å; Q237-W272 VanDerWaalsContact NE2-CH2 3.34Å; S270-W272 VanDerWaalsContact C-N 3.3Å; S270-W272 PolarHBondContact O-N 3.1Å; W272-H274 HydrophobicContact CD2-CB 4.46Å; W272-H274 HydrophobicContact CG-CB 4.3Å; W272-H274 PolarHBondContact NE1-O 2.79Å
273	S	78.4	Confident	86.6	Confident	93 Å²	93	62 Å²	62	65%	0.65	32%	0.323	S	S	*	.	S	Bend	trans	-92.7	12	-179.7	-35.6	0	0	0	0	114.1
274	H	78.9	Confident	86.7	Confident	134 Å²	134	59.2 Å²	59.2	62%	0.62	30%	0.304	S	S	*	.	S	Bend	trans	-92.4	153.2	-179.8	-68.1	80.5	0	0	0	111.6	W272	W272-H274 HydrophobicContact CD2-CB 4.46Å; W272-H274 HydrophobicContact CG-CB 4.3Å; W272-H274 PolarHBondContact NE1-O 2.79Å
275	P	75.3	Confident	86.7	Confident	112 Å²	112	58.4 Å²	58.4	73%	0.727	30%	0.298	S	S	*	.	P	Polyproline II helix	trans	-55.6	144.3	173.9	-24	33.9	0	0	0	112.5
276	L	82.8	Confident	86.3	Confident	47 Å²	47	58 Å²	58	25%	0.246	30%	0.3	C	S	.	.	P	Polyproline II helix	trans	-64.2	133.2	174.1	-58.9	176.7	0	0	0	110.3	D236 R282 F285	D236-L276 HydrophobicContact CB-CB 4.16Å; D236-L276 HydrophobicContact CB-CD2 3.75Å; D236-L276 WeakPolarHBondContact OD2-CA 3.4Å; L276-R282 HydrophobicContact CD1-CB 3.75Å; L276-R282 HydrophobicContact CD1-CG 3.85Å; L276-F285 HydrophobicContact CD1-CD2 4.12Å; L276-F285 HydrophobicContact CD2-CD2 4.1Å
277	L	84.1	Confident	85.7	Confident	120 Å²	120	59.9 Å²	59.9	63%	0.628	32%	0.316	S	S	*	.	S	Bend	trans	-69.6	-48.5	174	-62	-175.7	0	0	0	111.3	D236 Q237	D236-L277 PolarHBondContact OD2-N 3.18Å; Q237-L277 HydrophobicContact CG-CD1 3.98Å
278	I	85.3	Confident	85.5	Confident	43 Å²	43	60.2 Å²	60.2	22%	0.221	32%	0.318	C	S	.	.	S	Bend	trans	-118.3	105.2	175.5	-56.9	172.1	0	0	0	108.2	D236 E239 D280	D236-I278 VanDerWaalsContact O-CB 3.27Å; D236-I278 WeakPolarHBondContact O-CB 3.35Å; D236-I278 WeakPolarHBondContact O-CG1 3.03Å; D236-I278 PolarHBondContact O-N 3.46Å; E239-I278 HydrophobicContact CG-CD1 4.31Å; I278-D280 VanDerWaalsContact C-N 3.33Å; I278-D280 HydrophobicContact CG2-CB 4.19Å; I278-D280 PolarHBondContact O-N 3.01Å
279	P	82.1	Confident	85.2	Confident	58 Å²	58	61.4 Å²	61.4	38%	0.377	32%	0.323	S	S	.	.	G	3₁₀ helix	trans	-83.9	-1.4	-172.4	34	-36	0	0	0	114.3	N281 R282	P279-N281 PolarHBondContact O-N 2.86Å; P279-R282 WeakPolarHBondContact O-CB 3.35Å; P279-R282 PolarHBondContact O-N 2.57Å
280	D	83.3	Confident	84.9	Confident	119 Å²	119	63.4 Å²	63.4	64%	0.636	33%	0.332	S	S	*	.	G	3₁₀ helix	trans	-51.4	-35.5	-173.8	-64.7	8.7	0	0	0	113.8	I278	I278-D280 VanDerWaalsContact C-N 3.33Å; I278-D280 HydrophobicContact CG2-CB 4.19Å; I278-D280 PolarHBondContact O-N 3.01Å
281	N	84.7	Confident	84.8	Confident	25 Å²	25	66.2 Å²	66.2	13%	0.134	35%	0.346	C	S	.	.	G	3₁₀ helix	trans	-105.2	19.7	-179.3	-58.3	-65.7	0	0	0	113.1	T240 P279 K283 L284 F285	T240-N281 WeakPolarHBondContact CG2-OD1 3.4Å; T240-N281 PolarHBondContact OG1-ND2 3.15Å; T240-N281 PolarHBondContact OG1-OD1 3.5Å; P279-N281 PolarHBondContact O-N 2.86Å; N281-K283 VanDerWaalsContact C-N 3.28Å; N281-K283 PolarHBondContact O-N 3.31Å; N281-L284 HydrophobicContact CB-CB 4.42Å; N281-L284 WeakPolarHBondContact O-CB 3.44Å; N281-L284 PolarHBondContact O-N 3.05Å; N281-F285 HydrophobicContact CB-CD1 4.29Å; N281-F285 HydrophobicContact CB-CE1 3.7Å; N281-F285 HydrophobicContact CB-CE2 4.03Å; N281-F285 HydrophobicContact CB-CZ 3.57Å; N281-F285 WeakPolarHBondContact O-CG 3.3Å; N281-F285 PolarHBondContact O-N 2.76Å
282	R	82.1	Confident	84.9	Confident	110 Å²	110	66.1 Å²	66.1	42%	0.415	35%	0.346	S	S	.	.	H	α-helix	trans	-47.7	-49	-177.3	176.2	-178.5	-65.9	163	0.3	112.6	L276 P279 L284 F285 E286	L276-R282 HydrophobicContact CD1-CB 3.75Å; L276-R282 HydrophobicContact CD1-CG 3.85Å; P279-R282 WeakPolarHBondContact O-CB 3.35Å; P279-R282 PolarHBondContact O-N 2.57Å; R282-L284 VanDerWaalsContact C-N 3.3Å; R282-L284 PolarHBondContact O-N 3.46Å; R282-F285 PolarHBondContact O-N 2.76Å; R282-F285 VanDerWaalsContact O-N 3.07Å; R282-E286 VanDerWaalsContact CD-OE1 3.31Å; R282-E286 WeakPolarHBondContact CD-OE1 3.22Å; R282-E286 HydrophobicContact CG-CG 4.28Å; R282-E286 WeakPolarHBondContact CG-OE1 3.4Å; R282-E286 WeakPolarHBondContact O-CG 3.34Å; R282-E286 PolarHBondContact O-N 3.1Å
283	K	79.4	Confident	85.2	Confident	101 Å²	101	63.4 Å²	63.4	44%	0.439	34%	0.336	S	S	.	.	H	α-helix	trans	-56.6	-43.7	179.9	-65.5	-173.6	174.7	-172.1	0	112.3	N281 A287 G441 E442	N281-K283 VanDerWaalsContact C-N 3.28Å; N281-K283 PolarHBondContact O-N 3.31Å; K283-A287 VanDerWaalsContact O-CB 3.31Å; K283-A287 WeakPolarHBondContact O-CB 3.45Å; K283-A287 PolarHBondContact O-N 3.49Å; K283-G441 WeakPolarHBondContact CE-O 3.47Å; K283-G441 PolarHBondContact NZ-O 3Å; K283-E442 HydrophobicContact CD-CG 4.43Å
284	L	86.6	Confident	85.7	Confident	61 Å²	61	62.4 Å²	62.4	32%	0.319	32%	0.32	S	S	.	.	H	α-helix	trans	-63.3	-46	176.4	175.8	65.7	0	0	0	110.7	N281 R282 E286 A287 E288	N281-L284 HydrophobicContact CB-CB 4.42Å; N281-L284 WeakPolarHBondContact O-CB 3.44Å; N281-L284 PolarHBondContact O-N 3.05Å; R282-L284 VanDerWaalsContact C-N 3.3Å; R282-L284 PolarHBondContact O-N 3.46Å; L284-E286 PolarHBondContact O-N 3.1Å; L284-A287 PolarHBondContact O-N 2.94Å; L284-E288 HydrophobicContact CD1-CG 3.86Å; L284-E288 HydrophobicContact CG-CG 4.31Å; L284-E288 WeakPolarHBondContact O-CB 3.06Å; L284-E288 WeakPolarHBondContact O-CG 3.3Å; L284-E288 PolarHBondContact O-N 3.42Å
285	F	89.6	Confident	86.4	Confident	8 Å²	8	57.1 Å²	57.1	4%	0.035	30%	0.296	C	S	.	.	H	α-helix	trans	-61.8	-45	-178.7	-56.7	-24.2	0	0	0	112.1	A235 D236 L243 I268 L276 N281 R282 E288 E289	A235-F285 HydrophobicContact CB-CD1 4.25Å; A235-F285 HydrophobicContact CB-CE1 3.49Å; A235-F285 VanDerWaalsContact CB-CE1 3.49Å; A235-F285 HydrophobicContact CB-CZ 3.72Å; D236-F285 HydrophobicContact CB-CE2 3.88Å; L243-F285 HydrophobicContact CD2-CE1 4.04Å; L243-F285 HydrophobicContact CD2-CZ 4.44Å; I268-F285 HydrophobicContact CG2-CD1 4.25Å; I268-F285 HydrophobicContact CG2-CE1 4Å; L276-F285 HydrophobicContact CD1-CD2 4.12Å; L276-F285 HydrophobicContact CD2-CD2 4.1Å; N281-F285 HydrophobicContact CB-CD1 4.29Å; N281-F285 HydrophobicContact CB-CE1 3.7Å; N281-F285 HydrophobicContact CB-CE2 4.03Å; N281-F285 HydrophobicContact CB-CZ 3.57Å; N281-F285 WeakPolarHBondContact O-CG 3.3Å; N281-F285 PolarHBondContact O-N 2.76Å; R282-F285 PolarHBondContact O-N 2.76Å; R282-F285 VanDerWaalsContact O-N 3.07Å; F285-E288 PolarHBondContact O-N 3.23Å; F285-E289 VanDerWaalsContact O-CB 3.26Å; F285-E289 WeakPolarHBondContact O-CB 3.41Å; F285-E289 PolarHBondContact O-N 3.46Å
286	E	83.7	Confident	87.2	Confident	88 Å²	88	51.8 Å²	51.8	41%	0.411	26%	0.262	S	S	.	.	H	α-helix	trans	-66	-41.7	178.5	-70.5	170.3	-178.6	0	0	111.8	R282 L284 E289 Q290	R282-E286 VanDerWaalsContact CD-OE1 3.31Å; R282-E286 WeakPolarHBondContact CD-OE1 3.22Å; R282-E286 HydrophobicContact CG-CG 4.28Å; R282-E286 WeakPolarHBondContact CG-OE1 3.4Å; R282-E286 WeakPolarHBondContact O-CG 3.34Å; R282-E286 PolarHBondContact O-N 3.1Å; L284-E286 PolarHBondContact O-N 3.1Å; E286-E289 PolarHBondContact O-N 3.28Å; E286-Q290 WeakPolarHBondContact O-CB 3.35Å; E286-Q290 VanDerWaalsContact O-CG 3.28Å; E286-Q290 WeakPolarHBondContact O-CG 3.47Å; E286-Q290 PolarHBondContact O-N 3.26Å
287	A	83.4	Confident	87.6	Confident	42 Å²	42	50.1 Å²	50.1	35%	0.347	25%	0.252	S	S	.	.	H	α-helix	trans	-64	-45	177	0	0	0	0	0	112	K283 L284 Q290 D291	K283-A287 VanDerWaalsContact O-CB 3.31Å; K283-A287 WeakPolarHBondContact O-CB 3.45Å; K283-A287 PolarHBondContact O-N 3.49Å; L284-A287 PolarHBondContact O-N 2.94Å; A287-Q290 PolarHBondContact O-N 3.46Å; A287-D291 PolarHBondContact O-N 2.96Å
288	E	93.5	Very high	87.8	Confident	20 Å²	20	45.9 Å²	45.9	9%	0.093	23%	0.233	C	C	.	.	H	α-helix	trans	-67.8	-35.6	177.9	-69	-69.5	139.7	0	0	112	R265 Y267 I268 L284 F285 D291 L292	R265-E288 IonicContact CZ-OE1 2.76Å; R265-E288 IonicContact CZ-OE2 2.82Å; R265-E288 VanDerWaalsContact NH1-CD 3.31Å; R265-E288 IonicContact NH1-OE1 2.73Å; R265-E288 PolarHBondContact NH1-OE1 3.01Å; R265-E288 IonicContact NH1-OE2 2.78Å; R265-E288 PolarHBondContact NH1-OE2 3.47Å; R265-E288 VanDerWaalsContact NH2-CD 3.28Å; R265-E288 IonicContact NH2-OE1 3.51Å; R265-E288 PolarHBondContact NH2-OE1 3.35Å; R265-E288 IonicContact NH2-OE2 2.87Å; R265-E288 PolarHBondContact NH2-OE2 2.97Å; R265-E288 VanDerWaalsContact NH2-OE2 3.16Å; Y267-E288 WeakPolarHBondContact CA-OE2 3.32Å; Y267-E288 WeakPolarHBondContact CD1-O 3.48Å; I268-E288 VanDerWaalsContact O-CB 3.3Å; I268-E288 WeakPolarHBondContact O-CB 3.45Å; L284-E288 HydrophobicContact CD1-CG 3.86Å; L284-E288 HydrophobicContact CG-CG 4.31Å; L284-E288 WeakPolarHBondContact O-CB 3.06Å; L284-E288 WeakPolarHBondContact O-CG 3.3Å; L284-E288 PolarHBondContact O-N 3.42Å; F285-E288 PolarHBondContact O-N 3.23Å; E288-D291 PolarHBondContact O-N 3.31Å; E288-L292 WeakPolarHBondContact O-CB 3.41Å; E288-L292 PolarHBondContact O-N 3.44Å
289	E	90.8	Very high	88.2	Confident	37 Å²	37	44 Å²	44	17%	0.173	22%	0.223	C	C	.	.	H	α-helix	trans	-63.5	-45.8	172.4	178.4	173.8	-163.6	0	0	111.8	H91 F271 F285 E286 D291 L292 F293	H91-E289 IonicContact CD2-OE1 2.85Å; H91-E289 IonicContact CE1-OE1 3.97Å; H91-E289 IonicContact NE2-OE1 3.16Å; H91-E289 PolarHBondContact NE2-OE1 3.18Å; F271-E289 HydrophobicContact CD1-CG 4.28Å; F271-E289 HydrophobicContact CE1-CB 3.95Å; F271-E289 HydrophobicContact CE1-CG 3.95Å; F285-E289 VanDerWaalsContact O-CB 3.26Å; F285-E289 WeakPolarHBondContact O-CB 3.41Å; F285-E289 PolarHBondContact O-N 3.46Å; E286-E289 PolarHBondContact O-N 3.28Å; E289-D291 PolarHBondContact O-N 2.97Å; E289-L292 WeakPolarHBondContact O-CB 3.39Å; E289-L292 PolarHBondContact O-N 2.82Å; E289-F293 HydrophobicContact CG-CD1 4.44Å; E289-F293 HydrophobicContact CG-CD2 4.08Å; E289-F293 HydrophobicContact CG-CE1 4Å; E289-F293 HydrophobicContact CG-CE2 3.56Å; E289-F293 HydrophobicContact CG-CG 4.48Å; E289-F293 HydrophobicContact CG-CZ 3.53Å; E289-F293 WeakPolarHBondContact O-CB 3.39Å; E289-F293 WeakPolarHBondContact O-CG 3.46Å; E289-F293 PolarHBondContact O-N 2.92Å; E289-F293 VanDerWaalsContact OE1-CE2 3.26Å; E289-F293 WeakPolarHBondContact OE1-CE2 3.47Å; E289-F293 WeakPolarHBondContact OE1-CZ 3.38Å
290	Q	87.8	Confident	88.5	Confident	43 Å²	43	42 Å²	42	20%	0.201	21%	0.21	C	C	.	.	H	α-helix	trans	-60.9	-44	175.7	-75.2	174.1	1.8	0	0	112	E286 A287 L292 F293 K294 T431 H438	E286-Q290 WeakPolarHBondContact O-CB 3.35Å; E286-Q290 VanDerWaalsContact O-CG 3.28Å; E286-Q290 WeakPolarHBondContact O-CG 3.47Å; E286-Q290 PolarHBondContact O-N 3.26Å; A287-Q290 PolarHBondContact O-N 3.46Å; Q290-L292 VanDerWaalsContact C-N 3.32Å; Q290-L292 PolarHBondContact O-N 3.21Å; Q290-F293 PolarHBondContact O-N 3.11Å; Q290-K294 WeakPolarHBondContact O-CB 3.46Å; Q290-K294 VanDerWaalsContact O-CG 3.26Å; Q290-K294 WeakPolarHBondContact O-CG 3.47Å; Q290-K294 PolarHBondContact O-N 2.93Å; Q290-T431 HydrophobicContact CG-CG2 3.82Å; Q290-T431 PolarHBondContact NE2-O 3.42Å; Q290-H438 PolarHBondContact OE1-CE1 3.22Å; Q290-H438 PolarHBondContact OE1-ND1 3.29Å
291	D	91.3	Very high	88.6	Confident	70 Å²	70	40.9 Å²	40.9	37%	0.374	20%	0.197	S	C	.	.	H	α-helix	trans	-61.9	-41.4	176.3	-82.3	-1.5	0	0	0	111.6	R265 Y267 A287 E288 E289 K294 D295	R265-D291 IonicContact NH2-OD2 3.43Å; R265-D291 PolarHBondContact NH2-OD2 2.9Å; R265-D291 VanDerWaalsContact NH2-OD2 3.16Å; Y267-D291 HydrophobicContact CD1-CB 4.28Å; Y267-D291 HydrophobicContact CE1-CB 3.84Å; A287-D291 PolarHBondContact O-N 2.96Å; E288-D291 PolarHBondContact O-N 3.31Å; E289-D291 PolarHBondContact O-N 2.97Å; D291-K294 PolarHBondContact O-N 2.78Å; D291-D295 PolarHBondContact O-N 3.47Å
292	L	94.1	Very high	88.7	Confident	0 Å²	0	42 Å²	42	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-62.4	-44.9	175.4	176.2	58.1	0	0	0	111.5	F88 V231 Y267 F271 E288 E289 Q290 D295 I296	F88-L292 HydrophobicContact CE2-CD2 3.65Å; F88-L292 HydrophobicContact CZ-CD2 3.63Å; F88-L292 HydrophobicContact CZ-CG 4.49Å; V231-L292 HydrophobicContact CG2-CD2 3.91Å; Y267-L292 HydrophobicContact CD1-CB 3.73Å; Y267-L292 HydrophobicContact CD2-CB 4.45Å; Y267-L292 HydrophobicContact CD2-CD1 3.89Å; Y267-L292 HydrophobicContact CE1-CB 3.99Å; Y267-L292 HydrophobicContact CE2-CD1 3.93Å; Y267-L292 HydrophobicContact CG-CB 3.96Å; Y267-L292 HydrophobicContact CG-CD1 4.22Å; F271-L292 HydrophobicContact CD1-CD2 4.06Å; F271-L292 HydrophobicContact CE1-CD2 3.34Å; F271-L292 HydrophobicContact CE1-CG 4.46Å; F271-L292 HydrophobicContact CZ-CD2 3.63Å; E288-L292 WeakPolarHBondContact O-CB 3.41Å; E288-L292 PolarHBondContact O-N 3.44Å; E289-L292 WeakPolarHBondContact O-CB 3.39Å; E289-L292 PolarHBondContact O-N 2.82Å; Q290-L292 VanDerWaalsContact C-N 3.32Å; Q290-L292 PolarHBondContact O-N 3.21Å; L292-D295 WeakPolarHBondContact O-CB 3.31Å; L292-D295 PolarHBondContact O-N 2.89Å; L292-I296 HydrophobicContact CD1-CD1 4.09Å; L292-I296 HydrophobicContact CD1-CG1 4.46Å; L292-I296 HydrophobicContact CG-CD1 4.14Å; L292-I296 WeakPolarHBondContact O-CG1 3.4Å; L292-I296 PolarHBondContact O-N 3.49Å
293	F	92.4	Very high	88.9	Confident	1 Å²	1	37.3 Å²	37.3	0%	0.004	19%	0.188	C	C	.	.	H	α-helix	trans	-69.9	-36	-178.7	-71.5	2.2	0	0	0	111.8	H91 L92 F271 E289 Q290 I296 Q297 A427 F428 T431	H91-F293 AromaticContact CD2-CZ 3.99Å; H91-F293 AromaticContact NE2-CZ 3.99Å; L92-F293 HydrophobicContact CD1-CD1 3.84Å; L92-F293 HydrophobicContact CD1-CE1 3.53Å; L92-F293 HydrophobicContact CD1-CZ 4.06Å; F271-F293 HydrophobicContact CD1-CE1 4.37Å; E289-F293 HydrophobicContact CG-CD1 4.44Å; E289-F293 HydrophobicContact CG-CD2 4.08Å; E289-F293 HydrophobicContact CG-CE1 4Å; E289-F293 HydrophobicContact CG-CE2 3.56Å; E289-F293 HydrophobicContact CG-CG 4.48Å; E289-F293 HydrophobicContact CG-CZ 3.53Å; E289-F293 WeakPolarHBondContact O-CB 3.39Å; E289-F293 WeakPolarHBondContact O-CG 3.46Å; E289-F293 PolarHBondContact O-N 2.92Å; E289-F293 VanDerWaalsContact OE1-CE2 3.26Å; E289-F293 WeakPolarHBondContact OE1-CE2 3.47Å; E289-F293 WeakPolarHBondContact OE1-CZ 3.38Å; Q290-F293 PolarHBondContact O-N 3.11Å; F293-I296 PolarHBondContact O-N 3.25Å; F293-Q297 WeakPolarHBondContact O-CB 3.42Å; F293-Q297 VanDerWaalsContact O-CG 3.26Å; F293-Q297 WeakPolarHBondContact O-CG 3.32Å; F293-Q297 PolarHBondContact O-N 3.46Å; F293-A427 HydrophobicContact CD2-CB 4.36Å; F293-A427 HydrophobicContact CE2-CB 3.49Å; F293-A427 VanDerWaalsContact CE2-CB 3.49Å; F293-A427 HydrophobicContact CZ-CB 3.87Å; F293-F428 HydrophobicContact CB-CD1 3.83Å; F293-F428 HydrophobicContact CB-CE1 3.8Å; F293-F428 HydrophobicContact CD1-CE1 4.32Å; F293-F428 HydrophobicContact CD2-CD1 4.35Å; F293-F428 HydrophobicContact CG-CD1 4.12Å; F293-F428 AromaticContact CG-CE1 3.99Å; F293-F428 HydrophobicContact CG-CE1 3.99Å; F293-T431 HydrophobicContact CD2-CG2 3.61Å; F293-T431 HydrophobicContact CE2-CG2 4.06Å
294	K	89.3	Confident	89.3	Confident	71 Å²	71	33.2 Å²	33.2	31%	0.309	17%	0.173	S	C	.	.	H	α-helix	trans	-60.6	-43	170.7	-74.7	168.5	-177.2	170.7	0	111.8	Q290 D291 I296 Q297 S298 M432 H438	Q290-K294 WeakPolarHBondContact O-CB 3.46Å; Q290-K294 VanDerWaalsContact O-CG 3.26Å; Q290-K294 WeakPolarHBondContact O-CG 3.47Å; Q290-K294 PolarHBondContact O-N 2.93Å; D291-K294 PolarHBondContact O-N 2.78Å; K294-I296 PolarHBondContact O-N 2.87Å; K294-Q297 PolarHBondContact O-N 3.26Å; K294-S298 PolarHBondContact O-N 3.02Å; K294-S298 VanDerWaalsContact O-N 3.12Å; K294-M432 HydrophobicContact CD-CE 4.2Å; K294-M432 WeakPolarHBondContact CE-SD 3.31Å; K294-M432 HydrophobicContact CG-CE 4.02Å; K294-H438 PolarHBondContact NZ-CE1 2.86Å; K294-H438 PolarHBondContact NZ-NE2 3.09Å
295	D	92.1	Very high	89.4	Confident	24 Å²	24	32.6 Å²	32.6	13%	0.128	17%	0.169	C	C	.	.	H	α-helix	trans	-57.9	-47.5	174.1	179.2	64.2	0	0	0	110.6	R198 R229 D291 L292 S298	R198-D295 IonicContact CZ-OD2 3.33Å; R198-D295 IonicContact NE-OD2 2.65Å; R198-D295 PolarHBondContact NE-OD2 2.73Å; R198-D295 VanDerWaalsContact NE-OD2 3.12Å; R198-D295 IonicContact NH2-OD2 2.74Å; R198-D295 PolarHBondContact NH2-OD2 2.92Å; R198-D295 VanDerWaalsContact NH2-OD2 3.08Å; R229-D295 IonicContact CZ-OD1 2.99Å; R229-D295 IonicContact NE-OD1 2.92Å; R229-D295 IonicContact NE-OD2 2.81Å; R229-D295 IonicContact NH2-OD1 3.74Å; R229-D295 PolarHBondContact NH2-OD1 3.39Å; D291-D295 PolarHBondContact O-N 3.47Å; L292-D295 WeakPolarHBondContact O-CB 3.31Å; L292-D295 PolarHBondContact O-N 2.89Å; D295-S298 PolarHBondContact O-N 3.38Å; D295-S298 PolarHBondContact O-OG 3.44Å
296	I	93.3	Very high	89.3	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-68.8	-41	179.1	-62.3	168.2	0	0	0	112.3	F88 L92 I163 I200 L292 F293 K294 S298 L299 F428	F88-I296 HydrophobicContact CZ-CD1 4.48Å; L92-I296 HydrophobicContact CD1-CD1 4.33Å; L92-I296 HydrophobicContact CD2-CD1 4.48Å; I163-I296 HydrophobicContact CD1-CG2 3.74Å; I200-I296 HydrophobicContact CD1-CD1 4.19Å; L292-I296 HydrophobicContact CD1-CD1 4.09Å; L292-I296 HydrophobicContact CD1-CG1 4.46Å; L292-I296 HydrophobicContact CG-CD1 4.14Å; L292-I296 WeakPolarHBondContact O-CG1 3.4Å; L292-I296 PolarHBondContact O-N 3.49Å; F293-I296 PolarHBondContact O-N 3.25Å; K294-I296 PolarHBondContact O-N 2.87Å; I296-S298 PolarHBondContact O-N 3.04Å; I296-L299 HydrophobicContact CG2-CD1 4.18Å; I296-L299 WeakPolarHBondContact O-CB 3.39Å; I296-L299 WeakPolarHBondContact O-CG 3.47Å; I296-L299 PolarHBondContact O-N 3.37Å; I296-L299 VanDerWaalsContact O-N 3.1Å; I296-F428 HydrophobicContact CB-CE1 4.17Å; I296-F428 HydrophobicContact CB-CZ 4.21Å; I296-F428 HydrophobicContact CG2-CE1 4.14Å; I296-F428 HydrophobicContact CG2-CZ 3.7Å
297	Q	90.3	Very high	89.6	Confident	12 Å²	12	31.9 Å²	31.9	6%	0.056	16%	0.164	C	C	.	.	H	α-helix	trans	-61.6	-29	177.3	-79.2	178.1	-17.3	0	0	112.7	F293 K294 L299 P300 V423 F428	F293-Q297 WeakPolarHBondContact O-CB 3.42Å; F293-Q297 VanDerWaalsContact O-CG 3.26Å; F293-Q297 WeakPolarHBondContact O-CG 3.32Å; F293-Q297 PolarHBondContact O-N 3.46Å; K294-Q297 PolarHBondContact O-N 3.26Å; Q297-L299 VanDerWaalsContact C-N 3.26Å; Q297-L299 PolarHBondContact O-N 3.5Å; Q297-P300 WeakPolarHBondContact O-CD 3.28Å; Q297-V423 HydrophobicContact CG-CB 4.15Å; Q297-F428 HydrophobicContact CG-CD1 3.41Å; Q297-F428 VanDerWaalsContact CG-CD1 3.41Å; Q297-F428 HydrophobicContact CG-CE1 3.77Å; Q297-F428 HydrophobicContact CG-CG 4.16Å; Q297-F428 VanDerWaalsContact NE2-CB 3.33Å
298	S	89.5	Confident	90	Very high	31 Å²	31	29.9 Å²	29.9	22%	0.217	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-14.1	178.3	82.3	0	0	0	0	113.7	K294 D295 I296 R301 N302	K294-S298 PolarHBondContact O-N 3.02Å; K294-S298 VanDerWaalsContact O-N 3.12Å; D295-S298 PolarHBondContact O-N 3.38Å; D295-S298 PolarHBondContact O-OG 3.44Å; I296-S298 PolarHBondContact O-N 3.04Å; S298-R301 PolarHBondContact O-N 2.98Å; S298-N302 PolarHBondContact O-N 2.92Å; S298-N302 VanDerWaalsContact O-N 3.16Å
299	L	92	Very high	89.8	Confident	2 Å²	2	32.1 Å²	32.1	1%	0.01	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-50.1	-171.2	-64	177.5	0	0	0	113.3	P73 V75 I163 D197 R198 I296 Q297 R301 N302 A303 R306	P73-L299 HydrophobicContact CB-CB 3.98Å; P73-L299 HydrophobicContact CG-CB 4.42Å; V75-L299 HydrophobicContact CG2-CD1 3.38Å; I163-L299 HydrophobicContact CG2-CB 4.47Å; D197-L299 HydrophobicContact CB-CD2 4.17Å; R198-L299 HydrophobicContact CB-CD1 4.07Å; R198-L299 HydrophobicContact CB-CD2 4.09Å; R198-L299 HydrophobicContact CG-CD2 4.41Å; I296-L299 HydrophobicContact CG2-CD1 4.18Å; I296-L299 WeakPolarHBondContact O-CB 3.39Å; I296-L299 WeakPolarHBondContact O-CG 3.47Å; I296-L299 PolarHBondContact O-N 3.37Å; I296-L299 VanDerWaalsContact O-N 3.1Å; Q297-L299 VanDerWaalsContact C-N 3.26Å; Q297-L299 PolarHBondContact O-N 3.5Å; L299-R301 VanDerWaalsContact C-N 3.32Å; L299-R301 PolarHBondContact O-N 3.1Å; L299-N302 PolarHBondContact O-N 3.31Å; L299-A303 PolarHBondContact O-N 2.95Å; L299-R306 PolarHBondContact O-NH1 2.56Å
300	P	89.5	Confident	89.7	Confident	17 Å²	17	32.1 Å²	32.1	11%	0.11	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-38.8	-178.5	-22.6	35.3	0	0	0	113.2	P73 I163 Q297 N302 A303 V422 V423	P73-P300 HydrophobicContact CG-CB 4.28Å; P73-P300 HydrophobicContact CG-CG 4.28Å; I163-P300 HydrophobicContact CG2-CG 4Å; Q297-P300 WeakPolarHBondContact O-CD 3.28Å; P300-N302 VanDerWaalsContact C-N 3.34Å; P300-N302 PolarHBondContact O-N 3.4Å; P300-A303 WeakPolarHBondContact O-CB 3.49Å; P300-A303 PolarHBondContact O-N 3.35Å; P300-V422 HydrophobicContact CB-CB 3.84Å; P300-V422 HydrophobicContact CB-CG1 3.58Å; P300-V422 HydrophobicContact CB-CG2 4.3Å; P300-V422 HydrophobicContact CG-CB 4.03Å; P300-V422 HydrophobicContact CG-CG1 3.98Å; P300-V423 HydrophobicContact CG-CG2 3.79Å
301	R	85.3	Confident	90	Very high	95 Å²	95	30.3 Å²	30.3	36%	0.358	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-44	178.5	-173.2	177	-177.3	-163.1	-2.6	111.3	S298 L299 A303 E415 M418	S298-R301 PolarHBondContact O-N 2.98Å; L299-R301 VanDerWaalsContact C-N 3.32Å; L299-R301 PolarHBondContact O-N 3.1Å; R301-A303 VanDerWaalsContact C-N 3.34Å; R301-E415 HydrophobicContact CG-CG 4.41Å; R301-E415 PolarHBondContact NE-O 3.26Å; R301-E415 PolarHBondContact NH2-O 2.98Å; R301-E415 WeakPolarHBondContact O-CG 3.4Å; R301-M418 HydrophobicContact CG-CB 4.45Å; R301-M418 WeakPolarHBondContact O-CE 3.35Å
302	N	86.3	Confident	90.1	Very high	49 Å²	49	28.2 Å²	28.2	26%	0.262	14%	0.141	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.3	4.3	-175.5	-60.8	-14.5	0	0	0	113.2	S298 L299 P300 A304 L305 R306	S298-N302 PolarHBondContact O-N 2.92Å; S298-N302 VanDerWaalsContact O-N 3.16Å; L299-N302 PolarHBondContact O-N 3.31Å; P300-N302 VanDerWaalsContact C-N 3.34Å; P300-N302 PolarHBondContact O-N 3.4Å; N302-A304 PolarHBondContact O-N 3.22Å; N302-L305 PolarHBondContact O-N 2.84Å; N302-R306 WeakPolarHBondContact O-CG 3.48Å; N302-R306 PolarHBondContact O-N 2.87Å
303	A	87.5	Confident	89.9	Confident	12 Å²	12	32.1 Å²	32.1	10%	0.099	16%	0.158	C	C	.	.	H	α-helix	trans	-61.8	-42.6	-172.6	0	0	0	0	0	112.3	P73 L299 P300 R301 L305 R306 K307	P73-A303 HydrophobicContact CG-CB 3.89Å; L299-A303 PolarHBondContact O-N 2.95Å; P300-A303 WeakPolarHBondContact O-CB 3.49Å; P300-A303 PolarHBondContact O-N 3.35Å; R301-A303 VanDerWaalsContact C-N 3.34Å; A303-L305 PolarHBondContact O-N 3.35Å; A303-R306 PolarHBondContact O-N 2.88Å; A303-K307 WeakPolarHBondContact O-CG 3.36Å; A303-K307 PolarHBondContact O-N 2.85Å
304	A	87	Confident	90	Very high	14 Å²	14	33.2 Å²	33.2	12%	0.116	16%	0.162	C	C	.	.	H	α-helix	trans	-61.3	-45	178.5	0	0	0	0	0	111.7	V35 N302 K307 L308 V411	V35-A304 HydrophobicContact CB-CB 4.18Å; V35-A304 HydrophobicContact CG1-CB 3.95Å; N302-A304 PolarHBondContact O-N 3.22Å; A304-K307 PolarHBondContact O-N 2.83Å; A304-L308 WeakPolarHBondContact O-CB 2.9Å; A304-L308 PolarHBondContact O-N 2.9Å; A304-V411 HydrophobicContact CB-CG2 4.27Å
305	L	88.4	Confident	90.3	Very high	48 Å²	48	29.8 Å²	29.8	25%	0.251	15%	0.148	S	C	.	.	H	α-helix	trans	-62.9	-41.6	176.2	-176.5	61.8	0	0	0	112	N302 A303 L308 N309 M408 V411	N302-L305 PolarHBondContact O-N 2.84Å; A303-L305 PolarHBondContact O-N 3.35Å; L305-L308 WeakPolarHBondContact O-CB 3.37Å; L305-L308 PolarHBondContact O-N 3.32Å; L305-N309 PolarHBondContact O-N 3.41Å; L305-N309 PolarHBondContact O-ND2 3.07Å; L305-M408 HydrophobicContact CD1-CE 3.83Å; L305-M408 HydrophobicContact CD1-SD 3.74Å; L305-V411 HydrophobicContact CB-CG1 3.88Å; L305-V411 HydrophobicContact CD1-CG1 4.26Å
306	R	88.4	Confident	90.4	Very high	45 Å²	45	34.4 Å²	34.4	17%	0.17	16%	0.163	C	C	.	.	H	α-helix	trans	-65	-46.7	177.3	-70.2	-168.5	-160.9	87.4	6.5	112	D197 L299 N302 A303 L308 N309 D310	D197-R306 IonicContact OD1-NH1 3.55Å; L299-R306 PolarHBondContact O-NH1 2.56Å; N302-R306 WeakPolarHBondContact O-CG 3.48Å; N302-R306 PolarHBondContact O-N 2.87Å; A303-R306 PolarHBondContact O-N 2.88Å; R306-L308 VanDerWaalsContact C-N 3.27Å; R306-L308 PolarHBondContact O-N 2.82Å; R306-N309 WeakPolarHBondContact O-CB 3.46Å; R306-N309 PolarHBondContact O-N 2.8Å; R306-N309 VanDerWaalsContact O-N 3.09Å; R306-D310 PolarHBondContact O-N 3.43Å
307	K	89.7	Confident	90.5	Very high	36 Å²	36	36.6 Å²	36.6	16%	0.157	18%	0.175	C	C	.	.	H	α-helix	trans	-58.8	-39.8	176.2	-73.6	176.4	172.5	174.6	0	111.9	L39 F69 N71 A303 A304 D310 L311	L39-K307 HydrophobicContact CD1-CB 3.71Å; F69-K307 PolarHBondContact O-NZ 3.21Å; N71-K307 PolarHBondContact O-NZ 3.05Å; N71-K307 WeakPolarHBondContact OD1-CE 3.39Å; N71-K307 PolarHBondContact OD1-NZ 3.32Å; A303-K307 WeakPolarHBondContact O-CG 3.36Å; A303-K307 PolarHBondContact O-N 2.85Å; A304-K307 PolarHBondContact O-N 2.83Å; K307-D310 PolarHBondContact O-N 2.78Å; K307-L311 WeakPolarHBondContact O-CB 3.28Å; K307-L311 PolarHBondContact O-N 2.83Å
308	L	91.2	Very high	90.8	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-61.8	-47.7	173	-177.4	77.1	0	0	0	111.7	L39 A304 L305 R306 D310 L311 I312 I404 L407 M408 V411	L39-L308 HydrophobicContact CD2-CB 4.09Å; L39-L308 HydrophobicContact CD2-CD1 3.47Å; L39-L308 VanDerWaalsContact CD2-CD1 3.47Å; L39-L308 HydrophobicContact CD2-CG 4.37Å; A304-L308 WeakPolarHBondContact O-CB 2.9Å; A304-L308 PolarHBondContact O-N 2.9Å; L305-L308 WeakPolarHBondContact O-CB 3.37Å; L305-L308 PolarHBondContact O-N 3.32Å; R306-L308 VanDerWaalsContact C-N 3.27Å; R306-L308 PolarHBondContact O-N 2.82Å; L308-D310 VanDerWaalsContact C-N 3.35Å; L308-D310 PolarHBondContact O-N 3.43Å; L308-L311 PolarHBondContact O-N 2.95Å; L308-I312 HydrophobicContact CG-CD1 4.21Å; L308-I312 VanDerWaalsContact O-CG1 3.3Å; L308-I312 WeakPolarHBondContact O-CG1 3.49Å; L308-I312 PolarHBondContact O-N 3.44Å; L308-I404 HydrophobicContact CD1-CD1 3.37Å; L308-I404 HydrophobicContact CD1-CG2 4.22Å; L308-I404 HydrophobicContact CD2-CG2 4.46Å; L308-I404 HydrophobicContact CG-CD1 4.37Å; L308-L407 HydrophobicContact CD1-CB 4.08Å; L308-L407 HydrophobicContact CD1-CD1 4.02Å; L308-M408 HydrophobicContact CD2-CG 3.76Å; L308-M408 HydrophobicContact CD2-SD 3.14Å; L308-M408 WeakPolarHBondContact CD2-SD 3.37Å; L308-V411 HydrophobicContact CD2-CG2 4.42Å
309	N	89.7	Confident	91.2	Very high	67 Å²	67	36.2 Å²	36.2	36%	0.358	17%	0.169	S	C	.	.	H	α-helix	trans	-61.2	-41.7	177.4	-73.4	-22.6	0	0	0	112.3	L305 R306 I312 K313	L305-N309 PolarHBondContact O-N 3.41Å; L305-N309 PolarHBondContact O-ND2 3.07Å; R306-N309 WeakPolarHBondContact O-CB 3.46Å; R306-N309 PolarHBondContact O-N 2.8Å; R306-N309 VanDerWaalsContact O-N 3.09Å; N309-I312 PolarHBondContact O-N 3.13Å; N309-K313 WeakPolarHBondContact O-CG 3.49Å; N309-K313 PolarHBondContact O-N 2.82Å
310	D	89.3	Confident	91.5	Very high	38 Å²	38	36.2 Å²	36.2	20%	0.203	17%	0.17	C	C	.	.	H	α-helix	trans	-65.4	-39	177	-74.8	-17.8	0	0	0	111.4	K227 R306 K307 L308 I312 K313 R314	K227-D310 IonicContact NZ-OD1 2.79Å; K227-D310 PolarHBondContact NZ-OD1 3.34Å; K227-D310 IonicContact NZ-OD2 3.16Å; K227-D310 PolarHBondContact NZ-OD2 2.92Å; R306-D310 PolarHBondContact O-N 3.43Å; K307-D310 PolarHBondContact O-N 2.78Å; L308-D310 VanDerWaalsContact C-N 3.35Å; L308-D310 PolarHBondContact O-N 3.43Å; D310-I312 PolarHBondContact O-N 2.93Å; D310-K313 PolarHBondContact O-N 3.45Å; D310-R314 VanDerWaalsContact O-CB 3.3Å; D310-R314 WeakPolarHBondContact O-CB 3.46Å; D310-R314 PolarHBondContact O-N 3.08Å
311	L	92.6	Very high	91.9	Very high	5 Å²	5	35.5 Å²	35.5	3%	0.026	17%	0.165	C	C	.	.	H	α-helix	trans	-63.8	-39.2	173.3	-173.1	65.7	0	0	0	112	L39 Y43 L47 K307 L308 R314 A315	L39-L311 HydrophobicContact CD2-CD2 3.64Å; Y43-L311 HydrophobicContact CD2-CD1 3.9Å; Y43-L311 HydrophobicContact CG-CD1 4.44Å; L47-L311 HydrophobicContact CD2-CD1 3.8Å; K307-L311 WeakPolarHBondContact O-CB 3.28Å; K307-L311 PolarHBondContact O-N 2.83Å; L308-L311 PolarHBondContact O-N 2.95Å; L311-R314 PolarHBondContact O-N 3.35Å; L311-A315 VanDerWaalsContact O-CB 3.3Å; L311-A315 WeakPolarHBondContact O-CB 3.22Å; L311-A315 PolarHBondContact O-N 3.3Å
312	I	93.3	Very high	92.5	Very high	26 Å²	26	31 Å²	31	13%	0.133	15%	0.148	C	C	.	.	H	α-helix	trans	-63.8	-48.8	175.1	-67.4	163.7	0	0	0	110.7	L308 N309 D310 R314 A315 R316 L400 I404	L308-I312 HydrophobicContact CG-CD1 4.21Å; L308-I312 VanDerWaalsContact O-CG1 3.3Å; L308-I312 WeakPolarHBondContact O-CG1 3.49Å; L308-I312 PolarHBondContact O-N 3.44Å; N309-I312 PolarHBondContact O-N 3.13Å; D310-I312 PolarHBondContact O-N 2.93Å; I312-R314 VanDerWaalsContact C-N 3.32Å; I312-R314 PolarHBondContact O-N 3.42Å; I312-A315 PolarHBondContact O-N 2.93Å; I312-R316 WeakPolarHBondContact O-CG 3.36Å; I312-R316 PolarHBondContact O-N 2.95Å; I312-L400 HydrophobicContact CB-CD2 4.32Å; I312-L400 HydrophobicContact CG1-CD2 4.15Å; I312-L400 HydrophobicContact CG2-CD2 4.05Å; I312-I404 HydrophobicContact CD1-CD1 4.47Å; I312-I404 HydrophobicContact CD1-CG2 3.66Å; I312-I404 HydrophobicContact CG1-CD1 3.98Å; I312-I404 HydrophobicContact CG1-CG1 4.24Å; I312-I404 HydrophobicContact CG1-CG2 4.18Å
313	K	91.1	Very high	93.1	Very high	82 Å²	82	29.7 Å²	29.7	36%	0.357	14%	0.139	S	C	.	.	H	α-helix	trans	-57.3	-46.8	177	-72.5	177.1	-176.1	175.9	0	110.3	D226 N309 D310 A315 R316 L317	D226-K313 VanDerWaalsContact CG-NZ 3.31Å; D226-K313 IonicContact OD1-NZ 3.56Å; D226-K313 PolarHBondContact OD1-NZ 3.38Å; D226-K313 VanDerWaalsContact OD1-NZ 3.09Å; D226-K313 IonicContact OD2-NZ 2.72Å; D226-K313 PolarHBondContact OD2-NZ 3.09Å; N309-K313 WeakPolarHBondContact O-CG 3.49Å; N309-K313 PolarHBondContact O-N 2.82Å; D310-K313 PolarHBondContact O-N 3.45Å; K313-A315 PolarHBondContact O-N 3.45Å; K313-R316 PolarHBondContact O-N 2.74Å; K313-L317 PolarHBondContact O-N 3Å; K313-L317 VanDerWaalsContact O-N 3.07Å
314	R	93.7	Very high	93.6	Very high	23 Å²	23	29.1 Å²	29.1	9%	0.087	13%	0.134	C	C	.	.	H	α-helix	trans	-61.1	-44.5	177	-172.5	179.4	-179.7	95.3	3.1	112.5	L47 E51 F56 S61 P62 D310 L311 I312 R316 L317 A318	L47-R314 HydrophobicContact CD2-CG 4.21Å; E51-R314 WeakPolarHBondContact OE1-CD 3.09Å; E51-R314 IonicContact OE1-CZ 3.01Å; E51-R314 IonicContact OE1-NE 3.4Å; E51-R314 PolarHBondContact OE1-NE 2.72Å; E51-R314 IonicContact OE1-NH2 3.37Å; E51-R314 IonicContact OE2-CZ 3.75Å; E51-R314 IonicContact OE2-NE 3.97Å; E51-R314 PolarHBondContact OE2-NE 3.46Å; E51-R314 IonicContact OE2-NH2 3.92Å; E51-R314 PolarHBondContact OE2-NH2 3.17Å; F56-R314 HydrophobicContact CZ-CG 4.45Å; S61-R314 PolarHBondContact O-NH2 3.27Å; S61-R314 PolarHBondContact OG-NH1 3.32Å; P62-R314 PolarHBondContact O-NH2 3.41Å; D310-R314 VanDerWaalsContact O-CB 3.3Å; D310-R314 WeakPolarHBondContact O-CB 3.46Å; D310-R314 PolarHBondContact O-N 3.08Å; L311-R314 PolarHBondContact O-N 3.35Å; I312-R314 VanDerWaalsContact C-N 3.32Å; I312-R314 PolarHBondContact O-N 3.42Å; R314-R316 PolarHBondContact O-N 2.72Å; R314-L317 PolarHBondContact O-N 3.13Å; R314-A318 WeakPolarHBondContact O-CB 3.33Å; R314-A318 PolarHBondContact O-N 3.47Å
315	A	96	Very high	94.1	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-61.3	-42.8	178.5	0	0	0	0	0	112.2	L47 L311 I312 K313 A318 K319 V396 M399 L400	L47-A315 HydrophobicContact CD1-CB 4.08Å; L47-A315 HydrophobicContact CD2-CB 3.97Å; L311-A315 VanDerWaalsContact O-CB 3.3Å; L311-A315 WeakPolarHBondContact O-CB 3.22Å; L311-A315 PolarHBondContact O-N 3.3Å; I312-A315 PolarHBondContact O-N 2.93Å; K313-A315 PolarHBondContact O-N 3.45Å; A315-A318 PolarHBondContact O-N 2.97Å; A315-K319 WeakPolarHBondContact O-CG 3.36Å; A315-K319 PolarHBondContact O-N 3.32Å; A315-V396 HydrophobicContact CB-CG1 4.01Å; A315-M399 HydrophobicContact CB-CE 3.7Å; A315-L400 HydrophobicContact CB-CD1 4.32Å; A315-L400 HydrophobicContact CB-CD2 4.01Å; A315-L400 HydrophobicContact CB-CG 4.39Å
316	R	95.1	Very high	94.5	Very high	120 Å²	120	26.6 Å²	26.6	45%	0.453	12%	0.12	S	C	.	.	H	α-helix	trans	-61.5	-48.9	174.9	-69.5	-179.9	-173.1	174.4	2.7	111.3	I312 K313 R314 A318 K319 V320	I312-R316 WeakPolarHBondContact O-CG 3.36Å; I312-R316 PolarHBondContact O-N 2.95Å; K313-R316 PolarHBondContact O-N 2.74Å; R314-R316 PolarHBondContact O-N 2.72Å; R316-A318 VanDerWaalsContact C-N 3.31Å; R316-A318 PolarHBondContact O-N 2.88Å; R316-K319 WeakPolarHBondContact O-CB 3.34Å; R316-K319 PolarHBondContact O-N 3.48Å; R316-V320 WeakPolarHBondContact O-CG2 3.23Å; R316-V320 PolarHBondContact O-N 2.7Å
317	L	94.8	Very high	94.9	Very high	46 Å²	46	25.8 Å²	25.8	24%	0.241	12%	0.121	C	C	.	.	H	α-helix	trans	-59.6	-41.4	177.7	-177.2	61.4	0	0	0	111.9	F56 H60 K313 R314 K319 V320 H321 P368	F56-L317 HydrophobicContact CE2-CB 4.47Å; F56-L317 HydrophobicContact CE2-CD2 4.24Å; F56-L317 HydrophobicContact CE2-CG 3.99Å; F56-L317 HydrophobicContact CZ-CD2 4.1Å; F56-L317 HydrophobicContact CZ-CG 4.32Å; H60-L317 HydrophobicContact CB-CD2 4.4Å; K313-L317 PolarHBondContact O-N 3Å; K313-L317 VanDerWaalsContact O-N 3.07Å; R314-L317 PolarHBondContact O-N 3.13Å; L317-K319 PolarHBondContact O-N 3.01Å; L317-V320 PolarHBondContact O-N 3.08Å; L317-H321 VanDerWaalsContact O-CB 3.3Å; L317-H321 WeakPolarHBondContact O-CB 3.48Å; L317-H321 PolarHBondContact O-N 3.27Å; L317-P368 HydrophobicContact CD1-CB 4.17Å; L317-P368 HydrophobicContact CD1-CG 4.35Å
318	A	97.3	Very high	95.3	Very high	3 Å²	3	24 Å²	24	3%	0.025	11%	0.114	C	C	.	.	H	α-helix	trans	-63.7	-39.3	177.1	0	0	0	0	0	112.6	L47 L50 E51 F56 R314 A315 R316 A322	L47-A318 HydrophobicContact CD1-CB 3.82Å; L50-A318 HydrophobicContact CD2-CB 4.21Å; E51-A318 HydrophobicContact CG-CB 4.09Å; F56-A318 HydrophobicContact CD2-CB 3.93Å; F56-A318 HydrophobicContact CE2-CB 3.92Å; R314-A318 WeakPolarHBondContact O-CB 3.33Å; R314-A318 PolarHBondContact O-N 3.47Å; A315-A318 PolarHBondContact O-N 2.97Å; R316-A318 VanDerWaalsContact C-N 3.31Å; R316-A318 PolarHBondContact O-N 2.88Å; A318-A322 WeakPolarHBondContact O-CB 3.45Å; A318-A322 PolarHBondContact O-N 2.88Å
319	K	97.2	Very high	95.5	Very high	32 Å²	32	27.1 Å²	27.1	14%	0.139	13%	0.127	C	C	.	.	H	α-helix	trans	-63.2	-48.1	172.7	-72.1	-175	73.6	-160.5	0	111.9	L50 A315 R316 L317 H321 A322 Y323 L393 V396 D397 L400	L50-K319 HydrophobicContact CD2-CG 4.13Å; A315-K319 WeakPolarHBondContact O-CG 3.36Å; A315-K319 PolarHBondContact O-N 3.32Å; R316-K319 WeakPolarHBondContact O-CB 3.34Å; R316-K319 PolarHBondContact O-N 3.48Å; L317-K319 PolarHBondContact O-N 3.01Å; K319-H321 VanDerWaalsContact C-N 3.31Å; K319-H321 PolarHBondContact O-N 3.08Å; K319-A322 WeakPolarHBondContact O-CB 3.3Å; K319-A322 PolarHBondContact O-N 3.08Å; K319-A322 VanDerWaalsContact O-N 3.17Å; K319-Y323 HydrophobicContact CB-CE2 4.48Å; K319-Y323 WeakPolarHBondContact O-CD2 3.34Å; K319-Y323 PolarHBondContact O-N 3.08Å; K319-L393 HydrophobicContact CB-CD2 4.22Å; K319-L393 HydrophobicContact CG-CD2 4Å; K319-V396 HydrophobicContact CD-CB 4.49Å; K319-V396 HydrophobicContact CD-CG1 3.95Å; K319-V396 HydrophobicContact CG-CB 4.42Å; K319-V396 HydrophobicContact CG-CG1 3.91Å; K319-D397 WeakPolarHBondContact CE-OD1 3.4Å; K319-D397 WeakPolarHBondContact CE-OD2 3.29Å; K319-D397 IonicContact NZ-OD1 3.16Å; K319-D397 PolarHBondContact NZ-OD1 3.48Å; K319-D397 IonicContact NZ-OD2 3.19Å; K319-D397 PolarHBondContact NZ-OD2 3.25Å; K319-L400 HydrophobicContact CD-CD1 4.36Å
320	V	97.6	Very high	95.7	Very high	3 Å²	3	32.5 Å²	32.5	2%	0.018	15%	0.147	C	C	.	.	H	α-helix	trans	-58.9	-46.1	177.7	177.2	0	0	0	0	110.6	R316 L317 A322 Y323 I324 I362 D366 F367	R316-V320 WeakPolarHBondContact O-CG2 3.23Å; R316-V320 PolarHBondContact O-N 2.7Å; L317-V320 PolarHBondContact O-N 3.08Å; V320-A322 VanDerWaalsContact C-N 3.34Å; V320-A322 PolarHBondContact O-N 3.37Å; V320-Y323 PolarHBondContact O-N 3.35Å; V320-I324 HydrophobicContact CG1-CD1 3.86Å; V320-I324 HydrophobicContact CG1-CG1 4.45Å; V320-I324 WeakPolarHBondContact O-CG1 3.28Å; V320-I324 PolarHBondContact O-N 2.88Å; V320-I362 HydrophobicContact CG2-CD1 4.02Å; V320-I362 HydrophobicContact CG2-CG2 3.65Å; V320-D366 HydrophobicContact CG2-CB 3.97Å; V320-F367 HydrophobicContact CG1-CD1 3.54Å; V320-F367 HydrophobicContact CG1-CD2 4.43Å; V320-F367 HydrophobicContact CG1-CE1 3.73Å; V320-F367 HydrophobicContact CG1-CG 3.93Å; V320-F367 HydrophobicContact CG1-CZ 4.27Å
321	H	98.1	Very high	96	Very high	1 Å²	1	34.1 Å²	34.1	1%	0.005	15%	0.154	C	C	.	.	H	α-helix	trans	-57.7	-44.4	175	-178.1	71.6	0	0	0	112.3	Y54 F56 F59 H60 L317 K319 Y323 I324 I325	Y54-H321 PolarHBondContact O-CD2 2.76Å; Y54-H321 PolarHBondContact O-NE2 3.46Å; F56-H321 HydrophobicContact CD2-CB 4.17Å; F59-H321 AromaticContact CD2-CE1 3.33Å; F59-H321 WeakPolarHBondContact CD2-CE1 3.34Å; F59-H321 AromaticContact CD2-NE2 3.76Å; F59-H321 AromaticContact CE2-CE1 3.87Å; F59-H321 AromaticContact CG-CE1 3.55Å; H60-H321 AromaticContact CD2-CG 3.83Å; H60-H321 AromaticContact CD2-ND1 3.66Å; H60-H321 AromaticContact NE2-CE1 3.73Å; H60-H321 AromaticContact NE2-CG 3.42Å; H60-H321 AromaticContact NE2-ND1 2.95Å; H60-H321 PolarHBondContact NE2-ND1 3.39Å; L317-H321 VanDerWaalsContact O-CB 3.3Å; L317-H321 WeakPolarHBondContact O-CB 3.48Å; L317-H321 PolarHBondContact O-N 3.27Å; K319-H321 VanDerWaalsContact C-N 3.31Å; K319-H321 PolarHBondContact O-N 3.08Å; H321-Y323 VanDerWaalsContact C-N 3.32Å; H321-Y323 PolarHBondContact O-N 2.71Å; H321-I324 PolarHBondContact O-N 3.1Å; H321-I325 VanDerWaalsContact CE1-CG1 3.45Å; H321-I325 WeakPolarHBondContact CE1-CG1 3.49Å; H321-I325 WeakPolarHBondContact NE2-CG1 3.46Å; H321-I325 WeakPolarHBondContact O-CG1 3.46Å; H321-I325 PolarHBondContact O-N 3.32Å
322	A	98.2	Very high	96	Very high	0 Å²	0	35 Å²	35	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-59.1	-41.4	176.2	0	0	0	0	0	112.5	L50 Y54 A318 K319 V320 S326 L393	L50-A322 HydrophobicContact CD1-CB 4.1Å; Y54-A322 HydrophobicContact CD1-CB 4.25Å; Y54-A322 HydrophobicContact CD2-CB 3.35Å; Y54-A322 HydrophobicContact CE2-CB 3.61Å; Y54-A322 HydrophobicContact CG-CB 3.7Å; A318-A322 WeakPolarHBondContact O-CB 3.45Å; A318-A322 PolarHBondContact O-N 2.88Å; K319-A322 WeakPolarHBondContact O-CB 3.3Å; K319-A322 PolarHBondContact O-N 3.08Å; K319-A322 VanDerWaalsContact O-N 3.17Å; V320-A322 VanDerWaalsContact C-N 3.34Å; V320-A322 PolarHBondContact O-N 3.37Å; A322-S326 WeakPolarHBondContact O-CB 3.45Å; A322-S326 PolarHBondContact O-N 3.07Å; A322-S326 PolarHBondContact O-OG 3.32Å; A322-L393 HydrophobicContact CB-CD2 4.21Å
323	Y	98.3	Very high	95.9	Very high	22 Å²	22	35.8 Å²	35.8	9%	0.086	17%	0.165	C	C	.	.	H	α-helix	trans	-65.4	-42.9	174.5	-66.3	-57.4	0	0	0	112.2	K319 V320 H321 S326 S327 I356 H360 I362 L388 L393	K319-Y323 HydrophobicContact CB-CE2 4.48Å; K319-Y323 WeakPolarHBondContact O-CD2 3.34Å; K319-Y323 PolarHBondContact O-N 3.08Å; V320-Y323 PolarHBondContact O-N 3.35Å; H321-Y323 VanDerWaalsContact C-N 3.32Å; H321-Y323 PolarHBondContact O-N 2.71Å; Y323-S326 PolarHBondContact O-N 3.33Å; Y323-S327 VanDerWaalsContact O-CB 3.26Å; Y323-S327 WeakPolarHBondContact O-CB 3.44Å; Y323-S327 PolarHBondContact O-N 3.47Å; Y323-S327 PolarHBondContact O-OG 2.82Å; Y323-I356 HydrophobicContact CD2-CG2 4.46Å; Y323-I356 HydrophobicContact CG-CG2 4.34Å; Y323-H360 AromaticContact CD1-CD2 3.79Å; Y323-H360 AromaticContact CD1-CE1 3.77Å; Y323-H360 AromaticContact CD1-NE2 3.47Å; Y323-H360 WeakPolarHBondContact CD1-NE2 3.45Å; Y323-H360 AromaticContact CE1-CD2 4Å; Y323-H360 AromaticContact CE1-CE1 3.42Å; Y323-H360 VanDerWaalsContact CE1-CE1 3.42Å; Y323-H360 WeakPolarHBondContact CE1-CE1 3.45Å; Y323-H360 AromaticContact CE1-CG 3.97Å; Y323-H360 AromaticContact CE1-ND1 3.62Å; Y323-H360 AromaticContact CE1-NE2 3.64Å; Y323-H360 HydrophobicContact CE2-CB 4.36Å; Y323-H360 AromaticContact CG-CD2 3.98Å; Y323-H360 AromaticContact CZ-CG 3.95Å; Y323-H360 AromaticContact CZ-ND1 3.75Å; Y323-I362 HydrophobicContact CD2-CD1 3.62Å; Y323-I362 HydrophobicContact CE2-CD1 3.75Å; Y323-L388 HydrophobicContact CD1-CD1 3.89Å; Y323-L388 HydrophobicContact CD1-CD2 4.4Å; Y323-L388 HydrophobicContact CE1-CD1 4.18Å; Y323-L388 HydrophobicContact CE1-CD2 4.27Å; Y323-L393 HydrophobicContact CD1-CD1 4.29Å; Y323-L393 HydrophobicContact CE1-CD1 3.48Å; Y323-L393 VanDerWaalsContact CE1-CD1 3.48Å
324	I	98	Very high	95.7	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-59	-56.2	177.2	-66.9	163.5	0	0	0	110.1	V320 H321 S326 S327 L328 L349 Y353 I356 F367 P368 M373	V320-I324 HydrophobicContact CG1-CD1 3.86Å; V320-I324 HydrophobicContact CG1-CG1 4.45Å; V320-I324 WeakPolarHBondContact O-CG1 3.28Å; V320-I324 PolarHBondContact O-N 2.88Å; H321-I324 PolarHBondContact O-N 3.1Å; I324-S326 VanDerWaalsContact C-N 3.31Å; I324-S326 PolarHBondContact O-N 3.04Å; I324-S327 PolarHBondContact O-N 2.89Å; I324-L328 HydrophobicContact CG2-CD1 3.94Å; I324-L328 HydrophobicContact CG2-CG 4.47Å; I324-L328 VanDerWaalsContact O-CG 3.29Å; I324-L328 WeakPolarHBondContact O-CG 3.45Å; I324-L328 PolarHBondContact O-N 3.27Å; I324-L349 HydrophobicContact CG2-CD1 4.27Å; I324-Y353 HydrophobicContact CD1-CD1 4.22Å; I324-Y353 HydrophobicContact CD1-CE1 3.45Å; I324-Y353 VanDerWaalsContact CD1-CE1 3.45Å; I324-Y353 HydrophobicContact CG1-CD1 4.2Å; I324-Y353 HydrophobicContact CG1-CE1 3.76Å; I324-Y353 HydrophobicContact CG2-CE1 4.27Å; I324-I356 HydrophobicContact CB-CD1 4.39Å; I324-I356 HydrophobicContact CG1-CD1 3.82Å; I324-F367 HydrophobicContact CD1-CD1 4.29Å; I324-P368 HydrophobicContact CD1-CG 4.07Å; I324-M373 HydrophobicContact CG2-CE 4.45Å
325	I	98.1	Very high	95	Very high	2 Å²	2	42.5 Å²	42.5	1%	0.01	21%	0.21	C	C	.	.	H	α-helix	trans	-60.1	-42	-178.2	-64.2	-58.3	0	0	0	111.4	Y54 F59 H321 L328 K329 M373 L377 F385	Y54-I325 HydrophobicContact CD1-CB 4.2Å; Y54-I325 HydrophobicContact CD1-CG2 4.02Å; F59-I325 HydrophobicContact CE2-CD1 4.02Å; F59-I325 HydrophobicContact CZ-CD1 3.92Å; H321-I325 VanDerWaalsContact CE1-CG1 3.45Å; H321-I325 WeakPolarHBondContact CE1-CG1 3.49Å; H321-I325 WeakPolarHBondContact NE2-CG1 3.46Å; H321-I325 WeakPolarHBondContact O-CG1 3.46Å; H321-I325 PolarHBondContact O-N 3.32Å; I325-L328 PolarHBondContact O-N 3.25Å; I325-K329 WeakPolarHBondContact O-CB 3.33Å; I325-K329 PolarHBondContact O-N 2.98Å; I325-M373 HydrophobicContact CD1-CE 4.33Å; I325-L377 HydrophobicContact CD1-CD2 4.39Å; I325-F385 HydrophobicContact CD1-CD2 4.39Å; I325-F385 HydrophobicContact CD1-CE1 4.2Å; I325-F385 HydrophobicContact CD1-CE2 3.97Å; I325-F385 HydrophobicContact CD1-CZ 3.88Å; I325-F385 HydrophobicContact CG2-CB 3.77Å; I325-F385 HydrophobicContact CG2-CD1 4.04Å; I325-F385 HydrophobicContact CG2-CD2 4.03Å; I325-F385 HydrophobicContact CG2-CG 3.7Å
326	S	97.4	Very high	94.6	Very high	8 Å²	8	51 Å²	51	6%	0.056	25%	0.247	C	C	.	.	H	α-helix	trans	-67	-37.6	178.6	-61	0	0	0	0	112.7	Y54 A322 Y323 I324 K329 K330 L388	Y54-S326 WeakPolarHBondContact CE1-OG 3.34Å; A322-S326 WeakPolarHBondContact O-CB 3.45Å; A322-S326 PolarHBondContact O-N 3.07Å; A322-S326 PolarHBondContact O-OG 3.32Å; Y323-S326 PolarHBondContact O-N 3.33Å; I324-S326 VanDerWaalsContact C-N 3.31Å; I324-S326 PolarHBondContact O-N 3.04Å; S326-K329 PolarHBondContact O-N 3.47Å; S326-K330 WeakPolarHBondContact O-CB 3.35Å; S326-K330 PolarHBondContact O-N 3.43Å; S326-L388 WeakPolarHBondContact OG-CA 3.34Å; S326-L388 VanDerWaalsContact OG-CD1 3.27Å; S326-L388 WeakPolarHBondContact OG-CD1 3.32Å; S326-L388 PolarHBondContact OG-N 2.91Å
327	S	97	Very high	94.3	Very high	27 Å²	27	47.6 Å²	47.6	19%	0.189	25%	0.249	C	C	.	.	H	α-helix	trans	-67.3	-45.1	177.6	-60.6	0	0	0	0	110.8	Y323 I324 K329 K330 E331	Y323-S327 VanDerWaalsContact O-CB 3.26Å; Y323-S327 WeakPolarHBondContact O-CB 3.44Å; Y323-S327 PolarHBondContact O-N 3.47Å; Y323-S327 PolarHBondContact O-OG 2.82Å; I324-S327 PolarHBondContact O-N 2.89Å; S327-K329 VanDerWaalsContact C-N 3.32Å; S327-K329 PolarHBondContact O-N 3.46Å; S327-K330 WeakPolarHBondContact O-CB 3.39Å; S327-K330 PolarHBondContact O-N 3.47Å; S327-E331 PolarHBondContact O-N 3.32Å
328	L	96.6	Very high	94.1	Very high	0 Å²	0	49 Å²	49	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-59	-44.5	173.2	-64.6	172.2	0	0	0	110.9	I324 I325 K330 E331 M332 L345 L349 I352 L377 F382 F385	I324-L328 HydrophobicContact CG2-CD1 3.94Å; I324-L328 HydrophobicContact CG2-CG 4.47Å; I324-L328 VanDerWaalsContact O-CG 3.29Å; I324-L328 WeakPolarHBondContact O-CG 3.45Å; I324-L328 PolarHBondContact O-N 3.27Å; I325-L328 PolarHBondContact O-N 3.25Å; L328-K330 VanDerWaalsContact C-N 3.33Å; L328-K330 PolarHBondContact O-N 3.25Å; L328-E331 PolarHBondContact O-N 2.88Å; L328-M332 VanDerWaalsContact O-CG 3.26Å; L328-M332 WeakPolarHBondContact O-CG 3.37Å; L328-M332 PolarHBondContact O-N 3.16Å; L328-L345 HydrophobicContact CD2-CB 3.89Å; L328-L345 HydrophobicContact CD2-CD1 4.32Å; L328-L345 HydrophobicContact CD2-CG 4.48Å; L328-L349 HydrophobicContact CD2-CD1 4.3Å; L328-I352 HydrophobicContact CD2-CD1 3.6Å; L328-L377 HydrophobicContact CD1-CD1 3.84Å; L328-L377 HydrophobicContact CD1-CD2 3.74Å; L328-L377 HydrophobicContact CD1-CG 4.48Å; L328-F382 HydrophobicContact CB-CD2 4.19Å; L328-F382 HydrophobicContact CB-CE2 3.97Å; L328-F382 HydrophobicContact CD1-CE2 4.03Å; L328-F382 HydrophobicContact CD1-CZ 3.99Å; L328-F382 HydrophobicContact CD2-CE2 3.93Å; L328-F382 HydrophobicContact CD2-CZ 4.46Å; L328-F382 HydrophobicContact CG-CE2 4.19Å; L328-F385 HydrophobicContact CB-CD2 4.18Å; L328-F385 HydrophobicContact CB-CE2 4.29Å; L328-F385 HydrophobicContact CD1-CE2 4.1Å
329	K	96.1	Very high	93.9	Very high	65 Å²	65	54.8 Å²	54.8	28%	0.283	28%	0.28	S	S	.	.	H	α-helix	trans	-60.5	-41	176.3	179.3	55.4	174.9	-172.7	0	112.5	I325 S326 S327 E331 M332 S383 F385	I325-K329 WeakPolarHBondContact O-CB 3.33Å; I325-K329 PolarHBondContact O-N 2.98Å; S326-K329 PolarHBondContact O-N 3.47Å; S327-K329 VanDerWaalsContact C-N 3.32Å; S327-K329 PolarHBondContact O-N 3.46Å; K329-E331 VanDerWaalsContact C-N 3.29Å; K329-E331 PolarHBondContact O-N 2.95Å; K329-M332 PolarHBondContact O-N 3.19Å; K329-S383 PolarHBondContact NZ-O 3.47Å; K329-F385 HydrophobicContact CB-CB 3.88Å; K329-F385 HydrophobicContact CD-CB 4.2Å; K329-F385 WeakPolarHBondContact CD-O 3.32Å; K329-F385 WeakPolarHBondContact CE-O 3.41Å; K329-F385 HydrophobicContact CG-CB 4.36Å; K329-F385 WeakPolarHBondContact CG-O 3.26Å
330	K	95.1	Very high	93.8	Very high	180 Å²	180	57.5 Å²	57.5	78%	0.783	30%	0.303	S	S	*	.	H	α-helix	trans	-64.5	-33.2	-179.2	-175.3	179.2	176.7	-178.4	0	112.5	S326 S327 L328	S326-K330 WeakPolarHBondContact O-CB 3.35Å; S326-K330 PolarHBondContact O-N 3.43Å; S327-K330 WeakPolarHBondContact O-CB 3.39Å; S327-K330 PolarHBondContact O-N 3.47Å; L328-K330 VanDerWaalsContact C-N 3.33Å; L328-K330 PolarHBondContact O-N 3.25Å
331	E	93.8	Very high	93.6	Very high	72 Å²	72	59.5 Å²	59.5	34%	0.336	31%	0.312	S	S	.	.	H	α-helix	trans	-87.4	-7.4	-179.5	-64.8	-163.3	-162.3	0	0	114.3	S327 L328 K329 K341 L345	S327-E331 PolarHBondContact O-N 3.32Å; L328-E331 PolarHBondContact O-N 2.88Å; K329-E331 VanDerWaalsContact C-N 3.29Å; K329-E331 PolarHBondContact O-N 2.95Å; E331-K341 WeakPolarHBondContact O-CE 3.5Å; E331-K341 IonicContact OE2-NZ 3.82Å; E331-L345 HydrophobicContact CB-CD1 4.14Å; E331-L345 HydrophobicContact CB-CD2 3.75Å; E331-L345 HydrophobicContact CG-CD2 4.34Å; E331-L345 WeakPolarHBondContact OE2-CD2 3.38Å
332	M	93.4	Very high	93.5	Very high	22 Å²	22	60.7 Å²	60.7	11%	0.108	32%	0.317	C	S	.	.	S	Bend	trans	-77.8	134	-179.7	-77.9	-69.2	-65.7	0	0	112.5	L328 K329 K338 K341 L345 F382	L328-M332 VanDerWaalsContact O-CG 3.26Å; L328-M332 WeakPolarHBondContact O-CG 3.37Å; L328-M332 PolarHBondContact O-N 3.16Å; K329-M332 PolarHBondContact O-N 3.19Å; M332-K338 HydrophobicContact CE-CB 3.79Å; M332-K338 HydrophobicContact CE-CG 4.01Å; M332-K341 HydrophobicContact SD-CG 4.44Å; M332-L345 HydrophobicContact CG-CD1 4.2Å; M332-L345 HydrophobicContact SD-CD1 3.94Å; M332-F382 HydrophobicContact CE-CB 3.75Å; M332-F382 HydrophobicContact CG-CB 3.94Å; M332-F382 HydrophobicContact CG-CD2 3.95Å; M332-F382 HydrophobicContact CG-CG 4.49Å; M332-F382 HydrophobicContact SD-CB 3.93Å; M332-F382 HydrophobicContact SD-CD2 3.76Å; M332-F382 HydrophobicContact SD-CG 4.3Å
333	P	91.6	Very high	93.4	Very high	44 Å²	44	67.4 Å²	67.4	29%	0.286	35%	0.346	S	S	.	.			trans	-73.3	147.9	176.3	30.1	-35	0	0	0	111.5	F336 K338 K341	P333-F336 WeakPolarHBondContact CB-O 3.3Å; P333-F336 VanDerWaalsContact CG-O 3.22Å; P333-F336 WeakPolarHBondContact CG-O 3.42Å; P333-K338 HydrophobicContact CG-CG 4.1Å; P333-K338 WeakPolarHBondContact O-CE 3.38Å; P333-K341 HydrophobicContact CG-CB 4.32Å
334	N	85.5	Confident	93.3	Very high	141 Å²	141	70.5 Å²	70.5	75%	0.754	36%	0.361	S	S	*	.	S	Bend	trans	-72.3	-32.7	-176.4	-72.5	-34.6	0	0	0	113.8	K338	N334-K338 VanDerWaalsContact C-CE 3.49Å; N334-K338 WeakPolarHBondContact O-CE 3.42Å; N334-K338 PolarHBondContact O-NZ 3.42Å
335	V	80.3	Confident	93.2	Very high	104 Å²	104	70.6 Å²	70.6	63%	0.63	36%	0.362	S	S	*	.	S	Bend	trans	-125.7	-61.2	-166	-166.1	0	0	0	0	113.5
336	F	86.9	Confident	93.2	Very high	178 Å²	178	70.7 Å²	70.7	78%	0.781	36%	0.362	S	S	*	.	S	Bend	trans	-115.9	155.5	-174.9	-66.4	-78.8	0	0	0	112.7	P333 K338	P333-F336 WeakPolarHBondContact CB-O 3.3Å; P333-F336 VanDerWaalsContact CG-O 3.22Å; P333-F336 WeakPolarHBondContact CG-O 3.42Å; F336-K338 PolarHBondContact O-N 3.38Å
337	G	90	Very high	93.1	Very high	49 Å²	49	75.7 Å²	75.7	51%	0.505	39%	0.388	S	S	.	.			trans	79.5	11	173.4	0	0	0	0	0	116.2	E339 S340 K341	G337-E339 PolarHBondContact O-N 3.03Å; G337-S340 PolarHBondContact O-N 3.37Å; G337-K341 PolarHBondContact O-N 3.33Å
338	K	90.6	Very high	93.1	Very high	75 Å²	75	77.6 Å²	77.6	33%	0.326	40%	0.397	S	S	.	.	H	α-helix	trans	-55.2	-46	-175.4	-69	-179.5	179.8	172.2	0	113.8	M332 P333 N334 F336 K341 K342	M332-K338 HydrophobicContact CE-CB 3.79Å; M332-K338 HydrophobicContact CE-CG 4.01Å; P333-K338 HydrophobicContact CG-CG 4.1Å; P333-K338 WeakPolarHBondContact O-CE 3.38Å; N334-K338 VanDerWaalsContact C-CE 3.49Å; N334-K338 WeakPolarHBondContact O-CE 3.42Å; N334-K338 PolarHBondContact O-NZ 3.42Å; F336-K338 PolarHBondContact O-N 3.38Å; K338-K341 PolarHBondContact O-N 2.93Å; K338-K342 VanDerWaalsContact O-CB 3.31Å; K338-K342 WeakPolarHBondContact O-CB 3.21Å; K338-K342 PolarHBondContact O-N 3.04Å
339	E	92.3	Very high	93.1	Very high	125 Å²	125	77.6 Å²	77.6	58%	0.584	40%	0.397	S	S	*	.	H	α-helix	trans	-66.4	-42	-179.7	-74.2	-56.9	133.9	0	0	112.8	G337 K342 K343	G337-E339 PolarHBondContact O-N 3.03Å; E339-K342 PolarHBondContact O-N 3.31Å; E339-K343 WeakPolarHBondContact O-CG 3.48Å; E339-K343 PolarHBondContact O-N 3.45Å; E339-K343 VanDerWaalsContact O-N 3.11Å
340	S	94.1	Very high	93.2	Very high	89 Å²	89	75.7 Å²	75.7	62%	0.622	40%	0.395	S	S	*	.	H	α-helix	trans	-63.4	-45.9	176.3	-169.5	0	0	0	0	110.8	G337 K343 E344	G337-S340 PolarHBondContact O-N 3.37Å; S340-K343 PolarHBondContact O-N 3.25Å; S340-E344 PolarHBondContact O-N 3.49Å; S340-E344 VanDerWaalsContact O-N 3.08Å
341	K	94.9	Very high	93.3	Very high	46 Å²	46	73.2 Å²	73.2	20%	0.2	39%	0.386	C	S	.	.	H	α-helix	trans	-66.5	-39.1	179.3	-171.4	62.2	178.6	174.9	0	111.9	E331 M332 P333 G337 K338 K343 E344 L345	E331-K341 WeakPolarHBondContact O-CE 3.5Å; E331-K341 IonicContact OE2-NZ 3.82Å; M332-K341 HydrophobicContact SD-CG 4.44Å; P333-K341 HydrophobicContact CG-CB 4.32Å; G337-K341 PolarHBondContact O-N 3.33Å; K338-K341 PolarHBondContact O-N 2.93Å; K341-K343 PolarHBondContact O-N 3.1Å; K341-E344 WeakPolarHBondContact CD-OE2 3.29Å; K341-E344 IonicContact NZ-OE1 2.78Å; K341-E344 PolarHBondContact NZ-OE1 3.27Å; K341-E344 IonicContact NZ-OE2 3.5Å; K341-E344 WeakPolarHBondContact O-CB 3.48Å; K341-E344 PolarHBondContact O-N 2.96Å; K341-L345 HydrophobicContact CD-CG 4.39Å; K341-L345 HydrophobicContact CG-CD1 4.07Å; K341-L345 HydrophobicContact CG-CG 4.24Å; K341-L345 WeakPolarHBondContact O-CB 3.42Å; K341-L345 VanDerWaalsContact O-CG 3.24Å; K341-L345 WeakPolarHBondContact O-CG 3.14Å; K341-L345 PolarHBondContact O-N 2.9Å
342	K	95.3	Very high	93.4	Very high	25 Å²	25	70.3 Å²	70.3	11%	0.109	37%	0.373	C	S	.	.	H	α-helix	trans	-56.6	-48.9	173.9	175.5	-178.4	167.1	-173.2	0	111.3	K338 E339 E344 L345 V346 L377 Q378 Q380 F382	K338-K342 VanDerWaalsContact O-CB 3.31Å; K338-K342 WeakPolarHBondContact O-CB 3.21Å; K338-K342 PolarHBondContact O-N 3.04Å; E339-K342 PolarHBondContact O-N 3.31Å; K342-E344 VanDerWaalsContact C-N 3.34Å; K342-E344 PolarHBondContact O-N 2.92Å; K342-L345 PolarHBondContact O-N 3.43Å; K342-V346 HydrophobicContact CG-CG2 4.5Å; K342-V346 VanDerWaalsContact O-CG2 3.32Å; K342-V346 WeakPolarHBondContact O-CG2 3.34Å; K342-V346 PolarHBondContact O-N 2.78Å; K342-L377 VanDerWaalsContact CE-O 3.29Å; K342-L377 WeakPolarHBondContact CE-O 3.29Å; K342-Q378 WeakPolarHBondContact CE-O 3.34Å; K342-Q378 PolarHBondContact NZ-O 3.06Å; K342-Q380 VanDerWaalsContact CE-O 3.25Å; K342-Q380 WeakPolarHBondContact CE-O 3.47Å; K342-Q380 PolarHBondContact NZ-O 3.48Å; K342-F382 HydrophobicContact CD-CD1 4.15Å; K342-F382 HydrophobicContact CD-CE1 4.32Å; K342-F382 HydrophobicContact CD-CG 4.47Å; K342-F382 HydrophobicContact CG-CD1 4.17Å; K342-F382 HydrophobicContact CG-CD2 4.24Å; K342-F382 HydrophobicContact CG-CE1 4.08Å; K342-F382 HydrophobicContact CG-CE2 4.13Å; K342-F382 HydrophobicContact CG-CG 4.26Å; K342-F382 HydrophobicContact CG-CZ 4.06Å
343	K	95.6	Very high	93.6	Very high	142 Å²	142	70.3 Å²	70.3	62%	0.617	37%	0.372	S	S	*	.	H	α-helix	trans	-60	-44.1	177.7	-72.7	-179.7	-179.3	-178.3	0	112	E339 S340 K341 V346 N347	E339-K343 WeakPolarHBondContact O-CG 3.48Å; E339-K343 PolarHBondContact O-N 3.45Å; E339-K343 VanDerWaalsContact O-N 3.11Å; S340-K343 PolarHBondContact O-N 3.25Å; K341-K343 PolarHBondContact O-N 3.1Å; K343-V346 PolarHBondContact O-N 2.73Å; K343-N347 WeakPolarHBondContact O-CB 3.45Å; K343-N347 PolarHBondContact O-N 2.84Å; K343-N347 PolarHBondContact O-ND2 2.9Å
344	E	96.5	Very high	93.9	Very high	86 Å²	86	72.8 Å²	72.8	40%	0.402	38%	0.38	S	S	.	.	H	α-helix	trans	-58.7	-49.9	175.5	-173.8	-162.1	136.6	0	0	111.7	S340 K341 K342 V346 N347 N348	S340-E344 PolarHBondContact O-N 3.49Å; S340-E344 VanDerWaalsContact O-N 3.08Å; K341-E344 WeakPolarHBondContact CD-OE2 3.29Å; K341-E344 IonicContact NZ-OE1 2.78Å; K341-E344 PolarHBondContact NZ-OE1 3.27Å; K341-E344 IonicContact NZ-OE2 3.5Å; K341-E344 WeakPolarHBondContact O-CB 3.48Å; K341-E344 PolarHBondContact O-N 2.96Å; K342-E344 VanDerWaalsContact C-N 3.34Å; K342-E344 PolarHBondContact O-N 2.92Å; E344-V346 PolarHBondContact O-N 3.12Å; E344-N347 PolarHBondContact O-N 3.09Å; E344-N348 WeakPolarHBondContact O-CB 3.15Å; E344-N348 PolarHBondContact O-N 3.04Å
345	L	96.6	Very high	94.4	Very high	3 Å²	3	70.6 Å²	70.6	2%	0.016	36%	0.364	C	S	.	.	H	α-helix	trans	-62.1	-41.6	179.9	-70.6	172.9	0	0	0	112.8	L328 E331 M332 K341 K342 N348 L349 I352 F382	L328-L345 HydrophobicContact CD2-CB 3.89Å; L328-L345 HydrophobicContact CD2-CD1 4.32Å; L328-L345 HydrophobicContact CD2-CG 4.48Å; E331-L345 HydrophobicContact CB-CD1 4.14Å; E331-L345 HydrophobicContact CB-CD2 3.75Å; E331-L345 HydrophobicContact CG-CD2 4.34Å; E331-L345 WeakPolarHBondContact OE2-CD2 3.38Å; M332-L345 HydrophobicContact CG-CD1 4.2Å; M332-L345 HydrophobicContact SD-CD1 3.94Å; K341-L345 HydrophobicContact CD-CG 4.39Å; K341-L345 HydrophobicContact CG-CD1 4.07Å; K341-L345 HydrophobicContact CG-CG 4.24Å; K341-L345 WeakPolarHBondContact O-CB 3.42Å; K341-L345 VanDerWaalsContact O-CG 3.24Å; K341-L345 WeakPolarHBondContact O-CG 3.14Å; K341-L345 PolarHBondContact O-N 2.9Å; K342-L345 PolarHBondContact O-N 3.43Å; L345-N348 CarbonylContact O-C 3.47Å; L345-N348 PolarHBondContact O-N 3.36Å; L345-L349 PolarHBondContact O-N 3.46Å; L345-I352 HydrophobicContact CB-CD1 4.46Å; L345-I352 HydrophobicContact CD2-CD1 3.92Å; L345-F382 HydrophobicContact CB-CE2 4.31Å; L345-F382 HydrophobicContact CD1-CD2 4.28Å; L345-F382 HydrophobicContact CD1-CE2 4.16Å
346	V	96.8	Very high	95.2	Very high	4 Å²	4	65.7 Å²	65.7	2%	0.024	33%	0.334	C	S	.	.	H	α-helix	trans	-65.3	-44.4	177.1	171.5	0	0	0	0	110.4	K342 K343 E344 N348 L349 Q374 L377 Q378 F382	K342-V346 HydrophobicContact CG-CG2 4.5Å; K342-V346 VanDerWaalsContact O-CG2 3.32Å; K342-V346 WeakPolarHBondContact O-CG2 3.34Å; K342-V346 PolarHBondContact O-N 2.78Å; K343-V346 PolarHBondContact O-N 2.73Å; E344-V346 PolarHBondContact O-N 3.12Å; V346-N348 VanDerWaalsContact C-N 3.31Å; V346-N348 PolarHBondContact O-N 3.24Å; V346-L349 VanDerWaalsContact O-CB 3.32Å; V346-L349 WeakPolarHBondContact O-CB 3.21Å; V346-L349 PolarHBondContact O-N 2.99Å; V346-Q374 HydrophobicContact CG1-CB 3.94Å; V346-Q374 HydrophobicContact CG1-CG 4.12Å; V346-Q374 WeakPolarHBondContact O-CG 3.43Å; V346-Q374 PolarHBondContact O-NE2 3.03Å; V346-L377 HydrophobicContact CG2-CB 3.85Å; V346-Q378 HydrophobicContact CG1-CG 4.21Å; V346-F382 HydrophobicContact CG2-CZ 3.84Å
347	N	96.6	Very high	95.6	Very high	112 Å²	112	60.4 Å²	60.4	60%	0.599	31%	0.312	S	S	*	.	H	α-helix	trans	-64.4	-37.3	178.5	-69.9	-13.5	0	0	0	112.1	K343 E344 L349 Q374	K343-N347 WeakPolarHBondContact O-CB 3.45Å; K343-N347 PolarHBondContact O-N 2.84Å; K343-N347 PolarHBondContact O-ND2 2.9Å; E344-N347 PolarHBondContact O-N 3.09Å; N347-L349 VanDerWaalsContact C-N 3.35Å; N347-Q374 PolarHBondContact O-NE2 3.3Å
348	N	96.6	Very high	95.9	Very high	68 Å²	68	66.7 Å²	66.7	36%	0.364	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.1	16.5	-179	-63.3	-15.6	0	0	0	113.5	E344 L345 V346 G350 E351 I352	E344-N348 WeakPolarHBondContact O-CB 3.15Å; E344-N348 PolarHBondContact O-N 3.04Å; L345-N348 CarbonylContact O-C 3.47Å; L345-N348 PolarHBondContact O-N 3.36Å; V346-N348 VanDerWaalsContact C-N 3.31Å; V346-N348 PolarHBondContact O-N 3.24Å; N348-G350 PolarHBondContact O-N 3.01Å; N348-E351 PolarHBondContact O-N 3.44Å; N348-I352 PolarHBondContact O-N 3.11Å
349	L	97.4	Very high	96.2	Very high	0 Å²	0	68.6 Å²	68.6	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-56.7	-29.6	-176.2	-172.9	66.1	0	0	0	113	I324 L328 L345 V346 N347 E351 I352 Y353 L370 M373 Q374 L377	I324-L349 HydrophobicContact CG2-CD1 4.27Å; L328-L349 HydrophobicContact CD2-CD1 4.3Å; L345-L349 PolarHBondContact O-N 3.46Å; V346-L349 VanDerWaalsContact O-CB 3.32Å; V346-L349 WeakPolarHBondContact O-CB 3.21Å; V346-L349 PolarHBondContact O-N 2.99Å; N347-L349 VanDerWaalsContact C-N 3.35Å; L349-E351 VanDerWaalsContact C-N 3.33Å; L349-E351 PolarHBondContact O-N 3.38Å; L349-I352 HydrophobicContact CD1-CB 4.46Å; L349-I352 HydrophobicContact CD1-CD1 4.37Å; L349-I352 WeakPolarHBondContact O-CB 3.41Å; L349-I352 PolarHBondContact O-N 2.9Å; L349-Y353 HydrophobicContact CD1-CD1 4.15Å; L349-Y353 HydrophobicContact CD1-CE1 3.72Å; L349-Y353 HydrophobicContact CD2-CE1 3.96Å; L349-Y353 HydrophobicContact CG-CD1 4.02Å; L349-Y353 HydrophobicContact CG-CE1 3.58Å; L349-Y353 VanDerWaalsContact O-CD1 3.3Å; L349-Y353 WeakPolarHBondContact O-CD1 3.21Å; L349-Y353 PolarHBondContact O-N 3.24Å; L349-L370 HydrophobicContact CB-CD1 3.84Å; L349-L370 HydrophobicContact CD2-CD1 3.94Å; L349-L370 HydrophobicContact CG-CD1 3.81Å; L349-M373 HydrophobicContact CD2-CB 3.89Å; L349-M373 HydrophobicContact CD2-CG 3.84Å; L349-Q374 HydrophobicContact CB-CG 4.14Å; L349-Q374 HydrophobicContact CD2-CG 3.8Å; L349-L377 HydrophobicContact CD1-CD1 4.11Å; L349-L377 HydrophobicContact CD2-CD1 3.78Å
350	G	97	Very high	96.2	Very high	24 Å²	24	65.9 Å²	65.9	25%	0.247	32%	0.317	C	S	.	.	H	α-helix	trans	-63.6	-36.6	177.1	0	0	0	0	0	113.1	N348 Y353 Q354	N348-G350 PolarHBondContact O-N 3.01Å; G350-Y353 PolarHBondContact O-N 3.41Å; G350-Q354 WeakPolarHBondContact O-CG 3.26Å; G350-Q354 PolarHBondContact O-N 3.18Å; G350-Q354 VanDerWaalsContact O-N 3.13Å
351	E	96.8	Very high	96.2	Very high	129 Å²	129	70.3 Å²	70.3	60%	0.603	33%	0.328	S	S	*	.	H	α-helix	trans	-71	-37.5	175.3	-61.6	-175.8	170.2	0	0	111.1	N348 L349 Y353 Q354 K355	N348-E351 PolarHBondContact O-N 3.44Å; L349-E351 VanDerWaalsContact C-N 3.33Å; L349-E351 PolarHBondContact O-N 3.38Å; E351-Y353 VanDerWaalsContact C-N 3.3Å; E351-Y353 PolarHBondContact O-N 2.99Å; E351-Q354 PolarHBondContact O-N 3.2Å; E351-K355 WeakPolarHBondContact O-CB 3.49Å; E351-K355 PolarHBondContact O-N 3Å
352	I	96.8	Very high	96.1	Very high	11 Å²	11	69.2 Å²	69.2	6%	0.056	32%	0.324	C	S	.	.	H	α-helix	trans	-61	-42.4	174.4	-59.5	176.7	0	0	0	109.9	L328 L345 N348 L349 K355 I356	L328-I352 HydrophobicContact CD2-CD1 3.6Å; L345-I352 HydrophobicContact CB-CD1 4.46Å; L345-I352 HydrophobicContact CD2-CD1 3.92Å; N348-I352 PolarHBondContact O-N 3.11Å; L349-I352 HydrophobicContact CD1-CB 4.46Å; L349-I352 HydrophobicContact CD1-CD1 4.37Å; L349-I352 WeakPolarHBondContact O-CB 3.41Å; L349-I352 PolarHBondContact O-N 2.9Å; I352-K355 PolarHBondContact O-N 2.92Å; I352-I356 HydrophobicContact CG2-CD1 3.82Å; I352-I356 HydrophobicContact CG2-CG1 4.44Å; I352-I356 VanDerWaalsContact O-CG1 3.28Å; I352-I356 WeakPolarHBondContact O-CG1 3.44Å; I352-I356 PolarHBondContact O-N 3.01Å
353	Y	97.6	Very high	95.9	Very high	21 Å²	21	71.1 Å²	71.1	8%	0.082	34%	0.341	C	S	.	.	H	α-helix	trans	-60.9	-49.9	175.9	-78.8	20.2	0	0	0	111.5	I324 L349 G350 E351 K355 I356 E357 F367 P368 L370 M373	I324-Y353 HydrophobicContact CD1-CD1 4.22Å; I324-Y353 HydrophobicContact CD1-CE1 3.45Å; I324-Y353 VanDerWaalsContact CD1-CE1 3.45Å; I324-Y353 HydrophobicContact CG1-CD1 4.2Å; I324-Y353 HydrophobicContact CG1-CE1 3.76Å; I324-Y353 HydrophobicContact CG2-CE1 4.27Å; L349-Y353 HydrophobicContact CD1-CD1 4.15Å; L349-Y353 HydrophobicContact CD1-CE1 3.72Å; L349-Y353 HydrophobicContact CD2-CE1 3.96Å; L349-Y353 HydrophobicContact CG-CD1 4.02Å; L349-Y353 HydrophobicContact CG-CE1 3.58Å; L349-Y353 VanDerWaalsContact O-CD1 3.3Å; L349-Y353 WeakPolarHBondContact O-CD1 3.21Å; L349-Y353 PolarHBondContact O-N 3.24Å; G350-Y353 PolarHBondContact O-N 3.41Å; E351-Y353 VanDerWaalsContact C-N 3.3Å; E351-Y353 PolarHBondContact O-N 2.99Å; Y353-K355 PolarHBondContact O-N 3.39Å; Y353-I356 PolarHBondContact O-N 3.07Å; Y353-E357 WeakPolarHBondContact O-CB 3.36Å; Y353-E357 PolarHBondContact O-N 2.86Å; Y353-F367 AromaticContact CD1-CD1 3.98Å; Y353-F367 HydrophobicContact CD1-CD1 3.98Å; Y353-F367 HydrophobicContact CD1-CE1 4.19Å; Y353-F367 HydrophobicContact CD2-CB 3.97Å; Y353-F367 AromaticContact CD2-CD1 3.49Å; Y353-F367 HydrophobicContact CD2-CD1 3.49Å; Y353-F367 VanDerWaalsContact CD2-CD1 3.49Å; Y353-F367 HydrophobicContact CD2-CE1 4.29Å; Y353-F367 AromaticContact CD2-CG 3.99Å; Y353-F367 HydrophobicContact CD2-CG 3.99Å; Y353-F367 HydrophobicContact CE1-CD1 4.33Å; Y353-F367 HydrophobicContact CE2-CB 4Å; Y353-F367 AromaticContact CE2-CD1 3.89Å; Y353-F367 HydrophobicContact CE2-CD1 3.89Å; Y353-F367 HydrophobicContact CE2-CG 4.38Å; Y353-F367 AromaticContact CG-CD1 3.55Å; Y353-F367 HydrophobicContact CG-CD1 3.55Å; Y353-F367 AromaticContact CG-CE1 3.9Å; Y353-F367 HydrophobicContact CG-CE1 3.9Å; Y353-F367 HydrophobicContact CG-CG 4.41Å; Y353-P368 WeakPolarHBondContact CE2-O 3.47Å; Y353-L370 HydrophobicContact CD2-CD1 4.19Å; Y353-L370 HydrophobicContact CE2-CD1 4.04Å; Y353-M373 VanDerWaalsContact OH-CB 3.3Å; Y353-M373 WeakPolarHBondContact OH-CB 3.47Å; Y353-M373 WeakPolarHBondContact OH-CG 3.4Å
354	Q	96.9	Very high	95.6	Very high	97 Å²	97	68.3 Å²	68.3	45%	0.453	34%	0.337	S	S	.	.	H	α-helix	trans	-60.1	-34.7	178.3	-70.7	179.7	12.1	0	0	112.7	G350 E351 R358	G350-Q354 WeakPolarHBondContact O-CG 3.26Å; G350-Q354 PolarHBondContact O-N 3.18Å; G350-Q354 VanDerWaalsContact O-N 3.13Å; E351-Q354 PolarHBondContact O-N 3.2Å; Q354-R358 WeakPolarHBondContact O-CG 3.2Å; Q354-R358 PolarHBondContact O-N 2.87Å
355	K	96.8	Very high	95	Very high	95 Å²	95	67.3 Å²	67.3	41%	0.413	35%	0.349	S	S	.	.	H	α-helix	trans	-67.2	-49.2	175.4	-177.7	179.4	175.5	-178.1	0	111.2	E351 I352 Y353 E357 R358 E359	E351-K355 WeakPolarHBondContact O-CB 3.49Å; E351-K355 PolarHBondContact O-N 3Å; I352-K355 PolarHBondContact O-N 2.92Å; Y353-K355 PolarHBondContact O-N 3.39Å; K355-E357 VanDerWaalsContact C-N 3.3Å; K355-E357 PolarHBondContact O-N 3.16Å; K355-R358 PolarHBondContact O-N 2.79Å; K355-E359 WeakPolarHBondContact CE-OE1 3.46Å; K355-E359 HydrophobicContact CG-CG 4.32Å; K355-E359 WeakPolarHBondContact CG-OE1 3.38Å; K355-E359 WeakPolarHBondContact O-CB 3.43Å; K355-E359 WeakPolarHBondContact O-CG 3.26Å; K355-E359 PolarHBondContact O-N 3.44Å
356	I	96.9	Very high	94.7	Very high	1 Å²	1	69.5 Å²	69.5	1%	0.005	36%	0.361	C	S	.	.	H	α-helix	trans	-59.6	-43	177	-68.1	168.1	0	0	0	110.4	Y323 I324 I352 Y353 R358 E359 H360 I362 F367	Y323-I356 HydrophobicContact CD2-CG2 4.46Å; Y323-I356 HydrophobicContact CG-CG2 4.34Å; I324-I356 HydrophobicContact CB-CD1 4.39Å; I324-I356 HydrophobicContact CG1-CD1 3.82Å; I352-I356 HydrophobicContact CG2-CD1 3.82Å; I352-I356 HydrophobicContact CG2-CG1 4.44Å; I352-I356 VanDerWaalsContact O-CG1 3.28Å; I352-I356 WeakPolarHBondContact O-CG1 3.44Å; I352-I356 PolarHBondContact O-N 3.01Å; Y353-I356 PolarHBondContact O-N 3.07Å; I356-R358 PolarHBondContact O-N 2.86Å; I356-E359 PolarHBondContact O-N 2.8Å; I356-H360 WeakPolarHBondContact O-CB 3.31Å; I356-H360 PolarHBondContact O-N 3.4Å; I356-I362 HydrophobicContact CG2-CD1 4.1Å; I356-F367 HydrophobicContact CB-CE1 4.14Å; I356-F367 HydrophobicContact CB-CZ 4.06Å; I356-F367 HydrophobicContact CG2-CE1 3.93Å; I356-F367 HydrophobicContact CG2-CZ 3.75Å
357	E	96.1	Very high	94.5	Very high	67 Å²	67	70.5 Å²	70.5	31%	0.313	37%	0.365	S	S	.	.	H	α-helix	trans	-53.7	-51	177.2	-171.1	-163.7	155.8	0	0	111.2	Y353 K355 Q361 I362 P364 F367	Y353-E357 WeakPolarHBondContact O-CB 3.36Å; Y353-E357 PolarHBondContact O-N 2.86Å; K355-E357 VanDerWaalsContact C-N 3.3Å; K355-E357 PolarHBondContact O-N 3.16Å; E357-Q361 WeakPolarHBondContact O-CA 3.1Å; E357-Q361 PolarHBondContact O-N 3.16Å; E357-I362 WeakPolarHBondContact CG-O 3.44Å; E357-I362 PolarHBondContact O-N 2.9Å; E357-P364 WeakPolarHBondContact OE1-CG 3.34Å; E357-F367 HydrophobicContact CB-CE2 4.08Å; E357-F367 HydrophobicContact CB-CZ 4.11Å; E357-F367 HydrophobicContact CG-CE2 4.37Å
358	R	96.2	Very high	94.3	Very high	181 Å²	181	66.1 Å²	66.1	68%	0.683	34%	0.343	S	S	*	.	H	α-helix	trans	-71.5	-44.1	-179.6	-65.9	177.1	-151.5	171.3	8.7	112.9	Q354 K355 I356 H360	Q354-R358 WeakPolarHBondContact O-CG 3.2Å; Q354-R358 PolarHBondContact O-N 2.87Å; K355-R358 PolarHBondContact O-N 2.79Å; I356-R358 PolarHBondContact O-N 2.86Å; R358-H360 VanDerWaalsContact C-N 3.34Å
359	E	95.7	Very high	94	Very high	115 Å²	115	65.6 Å²	65.6	54%	0.537	35%	0.345	S	S	.	.	H	α-helix	trans	-67.5	-35.3	-176.2	-74.5	-179.1	-177.2	0	0	112.1	K355 I356	K355-E359 WeakPolarHBondContact CE-OE1 3.46Å; K355-E359 HydrophobicContact CG-CG 4.32Å; K355-E359 WeakPolarHBondContact CG-OE1 3.38Å; K355-E359 WeakPolarHBondContact O-CB 3.43Å; K355-E359 WeakPolarHBondContact O-CG 3.26Å; K355-E359 PolarHBondContact O-N 3.44Å; I356-E359 PolarHBondContact O-N 2.8Å
360	H	94.1	Very high	93.7	Very high	68 Å²	68	68.7 Å²	68.7	32%	0.315	36%	0.361	S	S	.	.	H	α-helix	trans	-111.4	1.2	-174.8	-62.6	-66.9	0	0	0	114.3	Y323 I356 R358 I362	Y323-H360 AromaticContact CD1-CD2 3.79Å; Y323-H360 AromaticContact CD1-CE1 3.77Å; Y323-H360 AromaticContact CD1-NE2 3.47Å; Y323-H360 WeakPolarHBondContact CD1-NE2 3.45Å; Y323-H360 AromaticContact CE1-CD2 4Å; Y323-H360 AromaticContact CE1-CE1 3.42Å; Y323-H360 VanDerWaalsContact CE1-CE1 3.42Å; Y323-H360 WeakPolarHBondContact CE1-CE1 3.45Å; Y323-H360 AromaticContact CE1-CG 3.97Å; Y323-H360 AromaticContact CE1-ND1 3.62Å; Y323-H360 AromaticContact CE1-NE2 3.64Å; Y323-H360 HydrophobicContact CE2-CB 4.36Å; Y323-H360 AromaticContact CG-CD2 3.98Å; Y323-H360 AromaticContact CZ-CG 3.95Å; Y323-H360 AromaticContact CZ-ND1 3.75Å; I356-H360 WeakPolarHBondContact O-CB 3.31Å; I356-H360 PolarHBondContact O-N 3.4Å; R358-H360 VanDerWaalsContact C-N 3.34Å; H360-I362 VanDerWaalsContact C-N 3.35Å; H360-I362 HydrophobicContact CB-CD1 3.74Å; H360-I362 HydrophobicContact CB-CG1 3.77Å; H360-I362 PolarHBondContact O-N 3.36Å
361	Q	93.4	Very high	93.5	Very high	182 Å²	182	76.7 Å²	76.7	85%	0.85	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.9	47.7	179.8	-57.6	175.7	22.7	0	0	112.6	E357	E357-Q361 WeakPolarHBondContact O-CA 3.1Å; E357-Q361 PolarHBondContact O-N 3.16Å
362	I	93.3	Very high	93.1	Very high	23 Å²	23	74.5 Å²	74.5	12%	0.118	37%	0.372	C	S	.	.			trans	-95.9	141.5	-177.6	-60.3	-179.2	0	0	0	109.1	V320 Y323 I356 E357 H360 D366 F367	V320-I362 HydrophobicContact CG2-CD1 4.02Å; V320-I362 HydrophobicContact CG2-CG2 3.65Å; Y323-I362 HydrophobicContact CD2-CD1 3.62Å; Y323-I362 HydrophobicContact CE2-CD1 3.75Å; I356-I362 HydrophobicContact CG2-CD1 4.1Å; E357-I362 WeakPolarHBondContact CG-O 3.44Å; E357-I362 PolarHBondContact O-N 2.9Å; H360-I362 VanDerWaalsContact C-N 3.35Å; H360-I362 HydrophobicContact CB-CD1 3.74Å; H360-I362 HydrophobicContact CB-CG1 3.77Å; H360-I362 PolarHBondContact O-N 3.36Å; I362-D366 HydrophobicContact CG2-CB 3.93Å; I362-F367 HydrophobicContact CB-CE2 4Å; I362-F367 HydrophobicContact CB-CZ 4.41Å; I362-F367 HydrophobicContact CG2-CD2 4.2Å; I362-F367 HydrophobicContact CG2-CE2 3.62Å; I362-F367 HydrophobicContact CG2-CZ 4.26Å
363	S	91	Very high	93	Very high	65 Å²	65	74.1 Å²	74.1	46%	0.455	37%	0.37	S	S	.	.			trans	-67.1	138.3	174.7	179.7	0	0	0	0	111	G365 D366 F367	S363-G365 PolarHBondContact O-N 3.41Å; S363-G365 PolarHBondContact OG-N 3.1Å; S363-D366 PolarHBondContact O-N 3.39Å; S363-F367 WeakPolarHBondContact O-CD2 3.43Å
364	P	87.9	Confident	92.9	Very high	82 Å²	82	75.1 Å²	75.1	53%	0.532	38%	0.375	S	S	.	.	G	3₁₀ helix	trans	-52.8	-30.3	172.5	-26.8	33.7	0	0	0	113.7	E357 D366 F367	E357-P364 WeakPolarHBondContact OE1-CG 3.34Å; P364-D366 VanDerWaalsContact C-N 3.28Å; P364-D366 PolarHBondContact O-N 3.35Å; P364-F367 PolarHBondContact O-N 3.25Å
365	G	85.5	Confident	92.8	Very high	65 Å²	65	76.4 Å²	76.4	67%	0.67	38%	0.382	S	S	*	.	G	3₁₀ helix	trans	-70.4	-18.6	179.1	0	0	0	0	0	114.7	S363 F367	S363-G365 PolarHBondContact O-N 3.41Å; S363-G365 PolarHBondContact OG-N 3.1Å; G365-F367 VanDerWaalsContact C-N 3.29Å
366	D	89.3	Confident	92.6	Very high	49 Å²	49	74.3 Å²	74.3	26%	0.262	37%	0.374	S	S	.	.	G	3₁₀ helix	trans	-82.4	-10.1	177.1	-65.8	-35	0	0	0	112.1	V320 I362 S363 P364	V320-D366 HydrophobicContact CG2-CB 3.97Å; I362-D366 HydrophobicContact CG2-CB 3.93Å; S363-D366 PolarHBondContact O-N 3.39Å; P364-D366 VanDerWaalsContact C-N 3.28Å; P364-D366 PolarHBondContact O-N 3.35Å
367	F	93.1	Very high	92.6	Very high	26 Å²	26	74.2 Å²	74.2	11%	0.114	37%	0.374	C	S	.	.	S	Bend	trans	-80	139	179.2	-74.9	-97.9	0	0	0	112	V320 I324 Y353 I356 E357 I362 S363 P364 G365	V320-F367 HydrophobicContact CG1-CD1 3.54Å; V320-F367 HydrophobicContact CG1-CD2 4.43Å; V320-F367 HydrophobicContact CG1-CE1 3.73Å; V320-F367 HydrophobicContact CG1-CG 3.93Å; V320-F367 HydrophobicContact CG1-CZ 4.27Å; I324-F367 HydrophobicContact CD1-CD1 4.29Å; Y353-F367 AromaticContact CD1-CD1 3.98Å; Y353-F367 HydrophobicContact CD1-CD1 3.98Å; Y353-F367 HydrophobicContact CD1-CE1 4.19Å; Y353-F367 HydrophobicContact CD2-CB 3.97Å; Y353-F367 AromaticContact CD2-CD1 3.49Å; Y353-F367 HydrophobicContact CD2-CD1 3.49Å; Y353-F367 VanDerWaalsContact CD2-CD1 3.49Å; Y353-F367 HydrophobicContact CD2-CE1 4.29Å; Y353-F367 AromaticContact CD2-CG 3.99Å; Y353-F367 HydrophobicContact CD2-CG 3.99Å; Y353-F367 HydrophobicContact CE1-CD1 4.33Å; Y353-F367 HydrophobicContact CE2-CB 4Å; Y353-F367 AromaticContact CE2-CD1 3.89Å; Y353-F367 HydrophobicContact CE2-CD1 3.89Å; Y353-F367 HydrophobicContact CE2-CG 4.38Å; Y353-F367 AromaticContact CG-CD1 3.55Å; Y353-F367 HydrophobicContact CG-CD1 3.55Å; Y353-F367 AromaticContact CG-CE1 3.9Å; Y353-F367 HydrophobicContact CG-CE1 3.9Å; Y353-F367 HydrophobicContact CG-CG 4.41Å; I356-F367 HydrophobicContact CB-CE1 4.14Å; I356-F367 HydrophobicContact CB-CZ 4.06Å; I356-F367 HydrophobicContact CG2-CE1 3.93Å; I356-F367 HydrophobicContact CG2-CZ 3.75Å; E357-F367 HydrophobicContact CB-CE2 4.08Å; E357-F367 HydrophobicContact CB-CZ 4.11Å; E357-F367 HydrophobicContact CG-CE2 4.37Å; I362-F367 HydrophobicContact CB-CE2 4Å; I362-F367 HydrophobicContact CB-CZ 4.41Å; I362-F367 HydrophobicContact CG2-CD2 4.2Å; I362-F367 HydrophobicContact CG2-CE2 3.62Å; I362-F367 HydrophobicContact CG2-CZ 4.26Å; S363-F367 WeakPolarHBondContact O-CD2 3.43Å; P364-F367 PolarHBondContact O-N 3.25Å; G365-F367 VanDerWaalsContact C-N 3.29Å
368	P	92	Very high	92.5	Very high	20 Å²	20	77 Å²	77	13%	0.13	39%	0.387	C	S	.	.	P	Polyproline II helix	trans	-67	160.2	173.7	27.6	-31.7	0	0	0	111	L317 I324 Y353 L370 M373	L317-P368 HydrophobicContact CD1-CB 4.17Å; L317-P368 HydrophobicContact CD1-CG 4.35Å; I324-P368 HydrophobicContact CD1-CG 4.07Å; Y353-P368 WeakPolarHBondContact CE2-O 3.47Å; P368-L370 PolarHBondContact O-N 3.24Å; P368-L370 VanDerWaalsContact O-N 3.12Å; P368-M373 HydrophobicContact CG-SD 4.45Å
369	S	89.4	Confident	92.4	Very high	57 Å²	57	73.7 Å²	73.7	40%	0.399	39%	0.387	S	S	.	.	P	Polyproline II helix	trans	-51.5	120.8	176.3	173	0	0	0	0	111.3	R371 K372 M373	S369-R371 VanDerWaalsContact C-N 3.33Å; S369-R371 PolarHBondContact O-N 2.72Å; S369-K372 PolarHBondContact O-N 3.18Å; S369-M373 WeakPolarHBondContact O-CB 3.36Å; S369-M373 PolarHBondContact O-N 3.21Å
370	L	92.6	Very high	92.4	Very high	65 Å²	65	69.7 Å²	69.7	34%	0.34	37%	0.368	S	S	.	.	H	α-helix	trans	-53.8	-49.9	-178.9	-178.2	70.3	0	0	0	111.4	L349 Y353 P368 M373 Q374	L349-L370 HydrophobicContact CB-CD1 3.84Å; L349-L370 HydrophobicContact CD2-CD1 3.94Å; L349-L370 HydrophobicContact CG-CD1 3.81Å; Y353-L370 HydrophobicContact CD2-CD1 4.19Å; Y353-L370 HydrophobicContact CE2-CD1 4.04Å; P368-L370 PolarHBondContact O-N 3.24Å; P368-L370 VanDerWaalsContact O-N 3.12Å; L370-M373 PolarHBondContact O-N 3.35Å; L370-Q374 VanDerWaalsContact O-CG 3.27Å; L370-Q374 WeakPolarHBondContact O-CG 3.5Å; L370-Q374 PolarHBondContact O-N 3.07Å
371	R	91.2	Very high	92.2	Very high	191 Å²	191	69.7 Å²	69.7	72%	0.721	37%	0.371	S	S	*	.	H	α-helix	trans	-62.5	-48.1	-178.3	-68	-174.9	-177.6	173.9	0.6	112.2	S369 M373 Q374 E375	S369-R371 VanDerWaalsContact C-N 3.33Å; S369-R371 PolarHBondContact O-N 2.72Å; R371-M373 VanDerWaalsContact C-N 3.29Å; R371-M373 PolarHBondContact O-N 3.41Å; R371-Q374 WeakPolarHBondContact O-CB 3.36Å; R371-Q374 PolarHBondContact O-N 3.1Å; R371-E375 WeakPolarHBondContact O-CG 3.41Å; R371-E375 PolarHBondContact O-N 2.86Å
372	K	89.2	Confident	92.3	Very high	84 Å²	84	61.1 Å²	61.1	37%	0.365	33%	0.331	S	S	.	.	H	α-helix	trans	-59.7	-43	178.4	-171.4	172.5	177.4	175.2	0	110.3	E190 S369 E375 L376	E190-K372 IonicContact OE1-NZ 3.6Å; E190-K372 PolarHBondContact OE1-NZ 3.47Å; E190-K372 IonicContact OE2-NZ 2.89Å; E190-K372 PolarHBondContact OE2-NZ 3.46Å; S369-K372 PolarHBondContact O-N 3.18Å; K372-E375 PolarHBondContact O-N 3.33Å; K372-L376 HydrophobicContact CG-CD1 4.14Å; K372-L376 VanDerWaalsContact O-CG 3.28Å; K372-L376 WeakPolarHBondContact O-CG 3.43Å; K372-L376 PolarHBondContact O-N 3.16Å
373	M	94.9	Very high	92	Very high	3 Å²	3	62.5 Å²	62.5	2%	0.015	34%	0.343	C	S	.	.	H	α-helix	trans	-66	-40.6	177.9	-163	68.9	-165.3	0	0	112.2	F59 I324 I325 L349 Y353 P368 S369 L370 R371 L376 L377	F59-M373 HydrophobicContact CB-CE 4.41Å; F59-M373 HydrophobicContact CB-SD 4.49Å; F59-M373 HydrophobicContact CD1-CE 3.2Å; F59-M373 HydrophobicContact CD1-SD 3.79Å; F59-M373 HydrophobicContact CE1-CE 3.43Å; F59-M373 VanDerWaalsContact CE1-CE 3.43Å; F59-M373 HydrophobicContact CE1-SD 4.45Å; F59-M373 HydrophobicContact CG-CE 3.86Å; F59-M373 HydrophobicContact CG-SD 4.45Å; F59-M373 HydrophobicContact CZ-CE 4.24Å; I324-M373 HydrophobicContact CG2-CE 4.45Å; I325-M373 HydrophobicContact CD1-CE 4.33Å; L349-M373 HydrophobicContact CD2-CB 3.89Å; L349-M373 HydrophobicContact CD2-CG 3.84Å; Y353-M373 VanDerWaalsContact OH-CB 3.3Å; Y353-M373 WeakPolarHBondContact OH-CB 3.47Å; Y353-M373 WeakPolarHBondContact OH-CG 3.4Å; P368-M373 HydrophobicContact CG-SD 4.45Å; S369-M373 WeakPolarHBondContact O-CB 3.36Å; S369-M373 PolarHBondContact O-N 3.21Å; L370-M373 PolarHBondContact O-N 3.35Å; R371-M373 VanDerWaalsContact C-N 3.29Å; R371-M373 PolarHBondContact O-N 3.41Å; M373-L376 PolarHBondContact O-N 3.24Å; M373-L377 HydrophobicContact CE-CD1 4.12Å; M373-L377 HydrophobicContact CE-CD2 3.96Å; M373-L377 HydrophobicContact CE-CG 3.92Å; M373-L377 HydrophobicContact CG-CD1 3.85Å; M373-L377 HydrophobicContact CG-CG 4.28Å; M373-L377 VanDerWaalsContact O-CB 3.29Å; M373-L377 WeakPolarHBondContact O-CB 3.44Å; M373-L377 WeakPolarHBondContact O-CD1 3.43Å; M373-L377 WeakPolarHBondContact O-CG 3.31Å; M373-L377 PolarHBondContact O-N 3.5Å
374	Q	96.2	Very high	92	Very high	41 Å²	41	64.5 Å²	64.5	19%	0.192	34%	0.343	C	S	.	.	H	α-helix	trans	-59.8	-47.6	175.4	-73.8	176.3	-45.3	0	0	111.7	V346 N347 L349 L370 R371 L377 Q378	V346-Q374 HydrophobicContact CG1-CB 3.94Å; V346-Q374 HydrophobicContact CG1-CG 4.12Å; V346-Q374 WeakPolarHBondContact O-CG 3.43Å; V346-Q374 PolarHBondContact O-NE2 3.03Å; N347-Q374 PolarHBondContact O-NE2 3.3Å; L349-Q374 HydrophobicContact CB-CG 4.14Å; L349-Q374 HydrophobicContact CD2-CG 3.8Å; L370-Q374 VanDerWaalsContact O-CG 3.27Å; L370-Q374 WeakPolarHBondContact O-CG 3.5Å; L370-Q374 PolarHBondContact O-N 3.07Å; R371-Q374 WeakPolarHBondContact O-CB 3.36Å; R371-Q374 PolarHBondContact O-N 3.1Å; Q374-L377 PolarHBondContact O-N 3.38Å; Q374-Q378 WeakPolarHBondContact O-CG 3.26Å; Q374-Q378 PolarHBondContact O-N 3.29Å
375	E	93.8	Very high	92.4	Very high	125 Å²	125	60.8 Å²	60.8	58%	0.584	32%	0.319	S	S	*	.	H	α-helix	trans	-59.1	-48.5	177.3	-71.6	167.2	-170.7	0	0	111.7	R371 K372 L377 Q378	R371-E375 WeakPolarHBondContact O-CG 3.41Å; R371-E375 PolarHBondContact O-N 2.86Å; K372-E375 PolarHBondContact O-N 3.33Å; E375-L377 PolarHBondContact O-N 3.12Å; E375-Q378 WeakPolarHBondContact O-CB 3.34Å; E375-Q378 PolarHBondContact O-N 3.48Å
376	L	93.8	Very high	92.9	Very high	50 Å²	50	61.5 Å²	61.5	26%	0.262	30%	0.304	S	S	.	.	H	α-helix	trans	-61.6	-47.1	178.4	-69.6	167.8	0	0	0	111.4	F59 K372 M373 Q378 T379 Q380	F59-L376 HydrophobicContact CB-CD1 4.44Å; F59-L376 HydrophobicContact CD1-CB 3.86Å; F59-L376 HydrophobicContact CD1-CD1 4.33Å; F59-L376 HydrophobicContact CE1-CB 4.23Å; F59-L376 VanDerWaalsContact O-CD1 3.25Å; F59-L376 WeakPolarHBondContact O-CD1 3.16Å; K372-L376 HydrophobicContact CG-CD1 4.14Å; K372-L376 VanDerWaalsContact O-CG 3.28Å; K372-L376 WeakPolarHBondContact O-CG 3.43Å; K372-L376 PolarHBondContact O-N 3.16Å; M373-L376 PolarHBondContact O-N 3.24Å; L376-Q378 PolarHBondContact O-N 3.46Å; L376-T379 PolarHBondContact O-N 2.88Å; L376-T379 VanDerWaalsContact O-N 3.15Å; L376-T379 PolarHBondContact O-OG1 3.3Å; L376-Q380 WeakPolarHBondContact O-CG 3.42Å
377	L	96.4	Very high	93.2	Very high	0 Å²	0	62.2 Å²	62.2	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-61.9	-26.8	-179.2	-74.8	168.3	0	0	0	113.7	F59 I325 L328 K342 V346 L349 M373 Q374 E375 T379 Q380 F382 F385	F59-L377 HydrophobicContact CE1-CD2 3.57Å; F59-L377 HydrophobicContact CE1-CG 3.97Å; F59-L377 HydrophobicContact CZ-CD2 3.88Å; I325-L377 HydrophobicContact CD1-CD2 4.39Å; L328-L377 HydrophobicContact CD1-CD1 3.84Å; L328-L377 HydrophobicContact CD1-CD2 3.74Å; L328-L377 HydrophobicContact CD1-CG 4.48Å; K342-L377 VanDerWaalsContact CE-O 3.29Å; K342-L377 WeakPolarHBondContact CE-O 3.29Å; V346-L377 HydrophobicContact CG2-CB 3.85Å; L349-L377 HydrophobicContact CD1-CD1 4.11Å; L349-L377 HydrophobicContact CD2-CD1 3.78Å; M373-L377 HydrophobicContact CE-CD1 4.12Å; M373-L377 HydrophobicContact CE-CD2 3.96Å; M373-L377 HydrophobicContact CE-CG 3.92Å; M373-L377 HydrophobicContact CG-CD1 3.85Å; M373-L377 HydrophobicContact CG-CG 4.28Å; M373-L377 VanDerWaalsContact O-CB 3.29Å; M373-L377 WeakPolarHBondContact O-CB 3.44Å; M373-L377 WeakPolarHBondContact O-CD1 3.43Å; M373-L377 WeakPolarHBondContact O-CG 3.31Å; M373-L377 PolarHBondContact O-N 3.5Å; Q374-L377 PolarHBondContact O-N 3.38Å; E375-L377 PolarHBondContact O-N 3.12Å; L377-T379 PolarHBondContact O-N 2.7Å; L377-Q380 PolarHBondContact O-N 2.87Å; L377-Q380 VanDerWaalsContact O-N 3.16Å; L377-F382 HydrophobicContact CB-CE1 4.06Å; L377-F382 HydrophobicContact CB-CZ 4.09Å; L377-F382 HydrophobicContact CD2-CE1 3.68Å; L377-F382 HydrophobicContact CD2-CZ 3.81Å; L377-F382 HydrophobicContact CG-CE1 4.44Å; L377-F382 HydrophobicContact CG-CZ 4.36Å; L377-F385 HydrophobicContact CD2-CE2 4.04Å; L377-F385 HydrophobicContact CD2-CZ 3.85Å
378	Q	94.5	Very high	93.4	Very high	124 Å²	124	64.4 Å²	64.4	58%	0.579	33%	0.329	S	S	*	.	H	α-helix	trans	-58.9	-35	176.6	-74.3	174.9	20.9	0	0	112.2	K342 V346 Q374 E375 L376 Q380	K342-Q378 WeakPolarHBondContact CE-O 3.34Å; K342-Q378 PolarHBondContact NZ-O 3.06Å; V346-Q378 HydrophobicContact CG1-CG 4.21Å; Q374-Q378 WeakPolarHBondContact O-CG 3.26Å; Q374-Q378 PolarHBondContact O-N 3.29Å; E375-Q378 WeakPolarHBondContact O-CB 3.34Å; E375-Q378 PolarHBondContact O-N 3.48Å; L376-Q378 PolarHBondContact O-N 3.46Å; Q378-Q380 VanDerWaalsContact C-N 3.33Å
379	T	93.1	Very high	93.7	Very high	113 Å²	113	68.1 Å²	68.1	69%	0.693	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.5	-8	-178.1	66.8	0	0	0	0	113.7	L376 L377	L376-T379 PolarHBondContact O-N 2.88Å; L376-T379 VanDerWaalsContact O-N 3.15Å; L376-T379 PolarHBondContact O-OG1 3.3Å; L377-T379 PolarHBondContact O-N 2.7Å
380	Q	94.9	Very high	94.1	Very high	30 Å²	30	69 Å²	69	14%	0.14	35%	0.348	C	S	.	.	S	Bend	trans	-95.7	148.1	-168.1	-65.1	-67.5	-13.8	0	0	113.4	E58 F59 K342 L376 L377 Q378 F385	E58-Q380 PolarHBondContact OE2-OE1 3.24Å; F59-Q380 HydrophobicContact CE1-CG 3.85Å; F59-Q380 HydrophobicContact CE2-CG 4.49Å; F59-Q380 HydrophobicContact CZ-CB 4.27Å; F59-Q380 HydrophobicContact CZ-CG 3.61Å; K342-Q380 VanDerWaalsContact CE-O 3.25Å; K342-Q380 WeakPolarHBondContact CE-O 3.47Å; K342-Q380 PolarHBondContact NZ-O 3.48Å; L376-Q380 WeakPolarHBondContact O-CG 3.42Å; L377-Q380 PolarHBondContact O-N 2.87Å; L377-Q380 VanDerWaalsContact O-N 3.16Å; Q378-Q380 VanDerWaalsContact C-N 3.33Å; Q380-F385 HydrophobicContact CB-CE1 4.3Å; Q380-F385 HydrophobicContact CB-CZ 4.06Å
381	D	91.3	Very high	94.3	Very high	68 Å²	68	74.1 Å²	74.1	36%	0.364	37%	0.367	S	S	.	.			trans	-93.2	101.8	175.6	178.6	2.3	0	0	0	110.7	S383 K384	D381-S383 PolarHBondContact O-N 2.97Å; D381-S383 VanDerWaalsContact O-N 3.14Å; D381-S383 VanDerWaalsContact OD1-CB 3.23Å; D381-S383 WeakPolarHBondContact OD1-CB 3.34Å; D381-S383 PolarHBondContact OD1-N 2.94Å; D381-S383 PolarHBondContact OD1-OG 3.08Å; D381-S383 PolarHBondContact OD2-OG 3.35Å; D381-S383 VanDerWaalsContact OD2-OG 3.08Å; D381-K384 HydrophobicContact CB-CD 4.11Å; D381-K384 HydrophobicContact CB-CG 4.28Å; D381-K384 WeakPolarHBondContact O-CB 3.44Å; D381-K384 PolarHBondContact O-N 3.05Å; D381-K384 VanDerWaalsContact O-N 3.09Å; D381-K384 VanDerWaalsContact OD2-CE 3.23Å; D381-K384 WeakPolarHBondContact OD2-CE 3.37Å; D381-K384 IonicContact OD2-NZ 3.99Å
382	F	94.3	Very high	94.6	Very high	3 Å²	3	66.9 Å²	66.9	1%	0.013	34%	0.343	C	S	.	.	G	3₁₀ helix	trans	-65.5	-17	-177.1	-78.5	32.9	0	0	0	112.9	L328 M332 K342 L345 V346 L377 K384 F385	L328-F382 HydrophobicContact CB-CD2 4.19Å; L328-F382 HydrophobicContact CB-CE2 3.97Å; L328-F382 HydrophobicContact CD1-CE2 4.03Å; L328-F382 HydrophobicContact CD1-CZ 3.99Å; L328-F382 HydrophobicContact CD2-CE2 3.93Å; L328-F382 HydrophobicContact CD2-CZ 4.46Å; L328-F382 HydrophobicContact CG-CE2 4.19Å; M332-F382 HydrophobicContact CE-CB 3.75Å; M332-F382 HydrophobicContact CG-CB 3.94Å; M332-F382 HydrophobicContact CG-CD2 3.95Å; M332-F382 HydrophobicContact CG-CG 4.49Å; M332-F382 HydrophobicContact SD-CB 3.93Å; M332-F382 HydrophobicContact SD-CD2 3.76Å; M332-F382 HydrophobicContact SD-CG 4.3Å; K342-F382 HydrophobicContact CD-CD1 4.15Å; K342-F382 HydrophobicContact CD-CE1 4.32Å; K342-F382 HydrophobicContact CD-CG 4.47Å; K342-F382 HydrophobicContact CG-CD1 4.17Å; K342-F382 HydrophobicContact CG-CD2 4.24Å; K342-F382 HydrophobicContact CG-CE1 4.08Å; K342-F382 HydrophobicContact CG-CE2 4.13Å; K342-F382 HydrophobicContact CG-CG 4.26Å; K342-F382 HydrophobicContact CG-CZ 4.06Å; L345-F382 HydrophobicContact CB-CE2 4.31Å; L345-F382 HydrophobicContact CD1-CD2 4.28Å; L345-F382 HydrophobicContact CD1-CE2 4.16Å; V346-F382 HydrophobicContact CG2-CZ 3.84Å; L377-F382 HydrophobicContact CB-CE1 4.06Å; L377-F382 HydrophobicContact CB-CZ 4.09Å; L377-F382 HydrophobicContact CD2-CE1 3.68Å; L377-F382 HydrophobicContact CD2-CZ 3.81Å; L377-F382 HydrophobicContact CG-CE1 4.44Å; L377-F382 HydrophobicContact CG-CZ 4.36Å; F382-K384 PolarHBondContact O-N 2.9Å; F382-F385 HydrophobicContact CB-CD2 4.05Å; F382-F385 HydrophobicContact CB-CE2 4.11Å; F382-F385 HydrophobicContact CD1-CD2 4.07Å; F382-F385 HydrophobicContact CD1-CE1 4.48Å; F382-F385 AromaticContact CD1-CE2 3.25Å; F382-F385 HydrophobicContact CD1-CE2 3.25Å; F382-F385 AromaticContact CD1-CZ 3.5Å; F382-F385 HydrophobicContact CD1-CZ 3.5Å; F382-F385 HydrophobicContact CD2-CD2 4.29Å; F382-F385 AromaticContact CD2-CE2 3.96Å; F382-F385 HydrophobicContact CD2-CE2 3.96Å; F382-F385 AromaticContact CE1-CE2 3.53Å; F382-F385 HydrophobicContact CE1-CE2 3.53Å; F382-F385 AromaticContact CE1-CZ 3.75Å; F382-F385 HydrophobicContact CE1-CZ 3.75Å; F382-F385 HydrophobicContact CE2-CE2 4.21Å; F382-F385 AromaticContact CG-CD2 3.87Å; F382-F385 HydrophobicContact CG-CD2 3.87Å; F382-F385 AromaticContact CG-CE2 3.49Å; F382-F385 HydrophobicContact CG-CE2 3.49Å; F382-F385 VanDerWaalsContact CG-CE2 3.49Å; F382-F385 HydrophobicContact CG-CZ 4.17Å; F382-F385 HydrophobicContact CZ-CE2 4.01Å; F382-F385 WeakPolarHBondContact O-CB 3.43Å; F382-F385 PolarHBondContact O-N 3.05Å
383	S	88.1	Confident	95	Very high	52 Å²	52	63.1 Å²	63.1	36%	0.364	33%	0.327	S	S	.	.	G	3₁₀ helix	trans	-65.6	-30.3	175.3	75.5	0	0	0	0	111.9	K329 D381 F385	K329-S383 PolarHBondContact NZ-O 3.47Å; D381-S383 PolarHBondContact O-N 2.97Å; D381-S383 VanDerWaalsContact O-N 3.14Å; D381-S383 VanDerWaalsContact OD1-CB 3.23Å; D381-S383 WeakPolarHBondContact OD1-CB 3.34Å; D381-S383 PolarHBondContact OD1-N 2.94Å; D381-S383 PolarHBondContact OD1-OG 3.08Å; D381-S383 PolarHBondContact OD2-OG 3.35Å; D381-S383 VanDerWaalsContact OD2-OG 3.08Å; S383-F385 VanDerWaalsContact C-N 3.31Å
384	K	91.1	Very high	95.1	Very high	107 Å²	107	67.6 Å²	67.6	47%	0.465	35%	0.351	S	S	.	.	G	3₁₀ helix	trans	-80.4	-9.5	179.3	-60.7	179.3	-177.4	170.1	0	113.8	D381 F382 Q386	D381-K384 HydrophobicContact CB-CD 4.11Å; D381-K384 HydrophobicContact CB-CG 4.28Å; D381-K384 WeakPolarHBondContact O-CB 3.44Å; D381-K384 PolarHBondContact O-N 3.05Å; D381-K384 VanDerWaalsContact O-N 3.09Å; D381-K384 VanDerWaalsContact OD2-CE 3.23Å; D381-K384 WeakPolarHBondContact OD2-CE 3.37Å; D381-K384 IonicContact OD2-NZ 3.99Å; F382-K384 PolarHBondContact O-N 2.9Å; K384-Q386 PolarHBondContact O-NE2 3.49Å; K384-Q386 VanDerWaalsContact O-NE2 3.17Å
385	F	95.9	Very high	95.2	Very high	4 Å²	4	68.2 Å²	68.2	2%	0.018	36%	0.357	C	S	.	.	P	Polyproline II helix	trans	-65.8	146.4	176.6	-67.1	-8.5	0	0	0	111.2	F59 I325 L328 K329 L377 Q380 F382 S383	F59-F385 HydrophobicContact CZ-CE1 4.24Å; F59-F385 HydrophobicContact CZ-CZ 4.06Å; I325-F385 HydrophobicContact CD1-CD2 4.39Å; I325-F385 HydrophobicContact CD1-CE1 4.2Å; I325-F385 HydrophobicContact CD1-CE2 3.97Å; I325-F385 HydrophobicContact CD1-CZ 3.88Å; I325-F385 HydrophobicContact CG2-CB 3.77Å; I325-F385 HydrophobicContact CG2-CD1 4.04Å; I325-F385 HydrophobicContact CG2-CD2 4.03Å; I325-F385 HydrophobicContact CG2-CG 3.7Å; L328-F385 HydrophobicContact CB-CD2 4.18Å; L328-F385 HydrophobicContact CB-CE2 4.29Å; L328-F385 HydrophobicContact CD1-CE2 4.1Å; K329-F385 HydrophobicContact CB-CB 3.88Å; K329-F385 HydrophobicContact CD-CB 4.2Å; K329-F385 WeakPolarHBondContact CD-O 3.32Å; K329-F385 WeakPolarHBondContact CE-O 3.41Å; K329-F385 HydrophobicContact CG-CB 4.36Å; K329-F385 WeakPolarHBondContact CG-O 3.26Å; L377-F385 HydrophobicContact CD2-CE2 4.04Å; L377-F385 HydrophobicContact CD2-CZ 3.85Å; Q380-F385 HydrophobicContact CB-CE1 4.3Å; Q380-F385 HydrophobicContact CB-CZ 4.06Å; F382-F385 HydrophobicContact CB-CD2 4.05Å; F382-F385 HydrophobicContact CB-CE2 4.11Å; F382-F385 HydrophobicContact CD1-CD2 4.07Å; F382-F385 HydrophobicContact CD1-CE1 4.48Å; F382-F385 AromaticContact CD1-CE2 3.25Å; F382-F385 HydrophobicContact CD1-CE2 3.25Å; F382-F385 AromaticContact CD1-CZ 3.5Å; F382-F385 HydrophobicContact CD1-CZ 3.5Å; F382-F385 HydrophobicContact CD2-CD2 4.29Å; F382-F385 AromaticContact CD2-CE2 3.96Å; F382-F385 HydrophobicContact CD2-CE2 3.96Å; F382-F385 AromaticContact CE1-CE2 3.53Å; F382-F385 HydrophobicContact CE1-CE2 3.53Å; F382-F385 AromaticContact CE1-CZ 3.75Å; F382-F385 HydrophobicContact CE1-CZ 3.75Å; F382-F385 HydrophobicContact CE2-CE2 4.21Å; F382-F385 AromaticContact CG-CD2 3.87Å; F382-F385 HydrophobicContact CG-CD2 3.87Å; F382-F385 AromaticContact CG-CE2 3.49Å; F382-F385 HydrophobicContact CG-CE2 3.49Å; F382-F385 VanDerWaalsContact CG-CE2 3.49Å; F382-F385 HydrophobicContact CG-CZ 4.17Å; F382-F385 HydrophobicContact CZ-CE2 4.01Å; F382-F385 WeakPolarHBondContact O-CB 3.43Å; F382-F385 PolarHBondContact O-N 3.05Å; S383-F385 VanDerWaalsContact C-N 3.31Å
386	Q	95.8	Very high	95.4	Very high	80 Å²	80	62.2 Å²	62.2	37%	0.374	33%	0.329	S	S	.	.	P	Polyproline II helix	trans	-96.8	149.5	-174.9	-59	-61.9	-41.7	0	0	110.4	H53 Y54 K384	H53-Q386 VanDerWaalsContact CE1-CG 3.48Å; H53-Q386 WeakPolarHBondContact CE1-CG 3.22Å; H53-Q386 WeakPolarHBondContact NE2-CB 3.38Å; H53-Q386 WeakPolarHBondContact O-CG 3.1Å; Y54-Q386 HydrophobicContact CD1-CB 4.45Å; Y54-Q386 HydrophobicContact CE1-CB 4.13Å; K384-Q386 PolarHBondContact O-NE2 3.49Å; K384-Q386 VanDerWaalsContact O-NE2 3.17Å
387	A	96.4	Very high	95.5	Very high	64 Å²	64	62.8 Å²	62.8	53%	0.529	33%	0.333	S	S	.	.	P	Polyproline II helix	trans	-70.4	163.4	170.8	0	0	0	0	0	110.7	Y54 K389	Y54-A387 PolarHBondContact OH-O 3.11Å; A387-K389 PolarHBondContact O-N 2.85Å
388	L	96.9	Very high	95.5	Very high	71 Å²	71	66 Å²	66	37%	0.372	35%	0.35	S	S	.	.	P	Polyproline II helix	trans	-62.6	131.5	177.6	-160.6	69.8	0	0	0	110.7	Y54 Y323 S326 P390 L393	Y54-L388 VanDerWaalsContact OH-CA 3.25Å; Y54-L388 WeakPolarHBondContact OH-CA 3.24Å; Y323-L388 HydrophobicContact CD1-CD1 3.89Å; Y323-L388 HydrophobicContact CD1-CD2 4.4Å; Y323-L388 HydrophobicContact CE1-CD1 4.18Å; Y323-L388 HydrophobicContact CE1-CD2 4.27Å; S326-L388 WeakPolarHBondContact OG-CA 3.34Å; S326-L388 VanDerWaalsContact OG-CD1 3.27Å; S326-L388 WeakPolarHBondContact OG-CD1 3.32Å; S326-L388 PolarHBondContact OG-N 2.91Å; L388-P390 WeakPolarHBondContact O-CD 3.43Å; L388-L393 HydrophobicContact CD1-CD1 3.69Å; L388-L393 HydrophobicContact CD2-CD1 4.3Å; L388-L393 HydrophobicContact CG-CD1 4.07Å
389	K	97.9	Very high	95.6	Very high	98 Å²	98	60 Å²	60	43%	0.426	32%	0.322	S	S	.	.			trans	-115.2	93.5	175	-74.9	-165.7	-178.6	168.6	0	109	H53 Y54 A387 K391 L392	H53-K389 WeakPolarHBondContact CE1-CE 3.38Å; H53-K389 PolarHBondContact CE1-NZ 3.2Å; H53-K389 PolarHBondContact ND1-NZ 3.22Å; H53-K389 WeakPolarHBondContact NE2-CD 3.5Å; H53-K389 WeakPolarHBondContact NE2-CE 3.31Å; H53-K389 PolarHBondContact NE2-NZ 2.5Å; Y54-K389 PolarHBondContact OH-N 3.35Å; A387-K389 PolarHBondContact O-N 2.85Å; K389-K391 VanDerWaalsContact C-N 3.26Å; K389-K391 PolarHBondContact O-N 3.17Å; K389-L392 HydrophobicContact CB-CD1 4.11Å; K389-L392 HydrophobicContact CB-CG 4.25Å; K389-L392 HydrophobicContact CD-CD1 4.02Å; K389-L392 PolarHBondContact O-N 3.12Å; K389-L392 VanDerWaalsContact O-N 3.08Å
390	P	96.9	Very high	95.6	Very high	75 Å²	75	56.6 Å²	56.6	49%	0.487	30%	0.299	S	S	.	.	H	α-helix	trans	-52.3	-42.4	-176.2	-29.3	35.8	0	0	0	113.3	L388 L392 L393 D394	L388-P390 WeakPolarHBondContact O-CD 3.43Å; P390-L392 VanDerWaalsContact C-N 3.26Å; P390-L392 PolarHBondContact O-N 2.82Å; P390-L392 VanDerWaalsContact O-N 3.12Å; P390-L393 CarbonylContact O-C 3.59Å; P390-L393 WeakPolarHBondContact O-CA 3.44Å; P390-L393 WeakPolarHBondContact O-CB 3.31Å; P390-L393 PolarHBondContact O-N 2.8Å; P390-D394 PolarHBondContact O-N 3.35Å
391	K	97.4	Very high	95.5	Very high	173 Å²	173	58.2 Å²	58.2	75%	0.752	32%	0.318	S	S	*	.	H	α-helix	trans	-54.5	-36.3	179.7	-65.5	-174.4	177.2	-176.4	0	114.6	K389 T395	K389-K391 VanDerWaalsContact C-N 3.26Å; K389-K391 PolarHBondContact O-N 3.17Å; K391-T395 WeakPolarHBondContact O-CB 3.32Å; K391-T395 PolarHBondContact O-N 3.47Å; K391-T395 VanDerWaalsContact O-N 3.14Å; K391-T395 PolarHBondContact O-OG1 3.21Å
392	L	97.9	Very high	95.6	Very high	39 Å²	39	58.8 Å²	58.8	20%	0.204	32%	0.321	C	S	.	.	H	α-helix	trans	-72.4	-38.5	178.4	-67.3	178.2	0	0	0	110.9	P49 L50 H53 K389 P390 T395 V396	P49-L392 HydrophobicContact CB-CD2 4.18Å; L50-L392 HydrophobicContact CD1-CB 3.7Å; H53-L392 HydrophobicContact CB-CD1 3.77Å; K389-L392 HydrophobicContact CB-CD1 4.11Å; K389-L392 HydrophobicContact CB-CG 4.25Å; K389-L392 HydrophobicContact CD-CD1 4.02Å; K389-L392 PolarHBondContact O-N 3.12Å; K389-L392 VanDerWaalsContact O-N 3.08Å; P390-L392 VanDerWaalsContact C-N 3.26Å; P390-L392 PolarHBondContact O-N 2.82Å; P390-L392 VanDerWaalsContact O-N 3.12Å; L392-T395 PolarHBondContact O-N 2.94Å; L392-V396 PolarHBondContact O-N 3.27Å
393	L	97.4	Very high	95.5	Very high	6 Å²	6	59.9 Å²	59.9	3%	0.031	33%	0.327	C	S	.	.	H	α-helix	trans	-66.6	-46.6	174.7	-68.2	170.4	0	0	0	111.3	L50 K319 A322 Y323 L388 P390 T395 V396 D397	L50-L393 HydrophobicContact CD1-CD2 4.04Å; L50-L393 HydrophobicContact CD1-CG 4.41Å; L50-L393 HydrophobicContact CD2-CD2 4.26Å; K319-L393 HydrophobicContact CB-CD2 4.22Å; K319-L393 HydrophobicContact CG-CD2 4Å; A322-L393 HydrophobicContact CB-CD2 4.21Å; Y323-L393 HydrophobicContact CD1-CD1 4.29Å; Y323-L393 HydrophobicContact CE1-CD1 3.48Å; Y323-L393 VanDerWaalsContact CE1-CD1 3.48Å; L388-L393 HydrophobicContact CD1-CD1 3.69Å; L388-L393 HydrophobicContact CD2-CD1 4.3Å; L388-L393 HydrophobicContact CG-CD1 4.07Å; P390-L393 CarbonylContact O-C 3.59Å; P390-L393 WeakPolarHBondContact O-CA 3.44Å; P390-L393 WeakPolarHBondContact O-CB 3.31Å; P390-L393 PolarHBondContact O-N 2.8Å; L393-T395 PolarHBondContact O-N 3.25Å; L393-V396 CarbonylContact O-C 3.56Å; L393-V396 PolarHBondContact O-N 3.48Å; L393-D397 PolarHBondContact O-N 2.99Å
394	D	97.3	Very high	95.7	Very high	96 Å²	96	58 Å²	58	51%	0.513	31%	0.312	S	S	.	.	H	α-helix	trans	-57	-36.2	177.2	-59.8	-27.9	0	0	0	111.2	P390 D397 D398	P390-D394 PolarHBondContact O-N 3.35Å; D394-D397 PolarHBondContact O-N 2.92Å; D394-D398 WeakPolarHBondContact O-CB 3.45Å; D394-D398 PolarHBondContact O-N 2.99Å
395	T	98.1	Very high	95.6	Very high	54 Å²	54	55.5 Å²	55.5	33%	0.331	31%	0.312	S	S	.	.	H	α-helix	trans	-66.5	-41.4	176.8	-59	0	0	0	0	111.8	K46 K391 L392 L393 M399	K46-T395 HydrophobicContact CB-CG2 3.83Å; K46-T395 HydrophobicContact CD-CG2 4.03Å; K46-T395 HydrophobicContact CG-CG2 3.76Å; K391-T395 WeakPolarHBondContact O-CB 3.32Å; K391-T395 PolarHBondContact O-N 3.47Å; K391-T395 VanDerWaalsContact O-N 3.14Å; K391-T395 PolarHBondContact O-OG1 3.21Å; L392-T395 PolarHBondContact O-N 2.94Å; L393-T395 PolarHBondContact O-N 3.25Å; T395-M399 PolarHBondContact O-N 3.26Å
396	V	97.6	Very high	95.2	Very high	0 Å²	0	62.2 Å²	62.2	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-72.9	-34.2	176.2	177.8	0	0	0	0	111.2	K46 L47 L50 A315 K319 L392 L393 M399 L400	K46-V396 VanDerWaalsContact O-CG2 3.28Å; K46-V396 WeakPolarHBondContact O-CG2 3.3Å; L47-V396 HydrophobicContact CD1-CG1 4.33Å; L47-V396 HydrophobicContact CD1-CG2 4.15Å; L50-V396 HydrophobicContact CB-CG2 4.21Å; L50-V396 HydrophobicContact CD2-CB 4.48Å; L50-V396 HydrophobicContact CD2-CG2 3.82Å; A315-V396 HydrophobicContact CB-CG1 4.01Å; K319-V396 HydrophobicContact CD-CB 4.49Å; K319-V396 HydrophobicContact CD-CG1 3.95Å; K319-V396 HydrophobicContact CG-CB 4.42Å; K319-V396 HydrophobicContact CG-CG1 3.91Å; L392-V396 PolarHBondContact O-N 3.27Å; L393-V396 CarbonylContact O-C 3.56Å; L393-V396 PolarHBondContact O-N 3.48Å; V396-M399 HydrophobicContact CG1-CE 4.17Å; V396-M399 WeakPolarHBondContact O-CB 3.27Å; V396-M399 PolarHBondContact O-N 3.48Å; V396-L400 HydrophobicContact CG1-CD1 4.2Å; V396-L400 HydrophobicContact CG1-CG 4.49Å; V396-L400 WeakPolarHBondContact O-CG 3.47Å; V396-L400 PolarHBondContact O-N 3Å
397	D	96.1	Very high	94.9	Very high	62 Å²	62	58.5 Å²	58.5	33%	0.332	32%	0.32	S	S	.	.	H	α-helix	trans	-65.3	-43.8	173.9	-82.7	-40	0	0	0	112.4	K319 L393 D394 M399 L400 A401	K319-D397 WeakPolarHBondContact CE-OD1 3.4Å; K319-D397 WeakPolarHBondContact CE-OD2 3.29Å; K319-D397 IonicContact NZ-OD1 3.16Å; K319-D397 PolarHBondContact NZ-OD1 3.48Å; K319-D397 IonicContact NZ-OD2 3.19Å; K319-D397 PolarHBondContact NZ-OD2 3.25Å; L393-D397 PolarHBondContact O-N 2.99Å; D394-D397 PolarHBondContact O-N 2.92Å; D397-M399 VanDerWaalsContact C-N 3.31Å; D397-M399 PolarHBondContact O-N 3.06Å; D397-L400 PolarHBondContact O-N 2.86Å; D397-A401 VanDerWaalsContact O-CB 3.29Å; D397-A401 WeakPolarHBondContact O-CB 3.5Å; D397-A401 PolarHBondContact O-N 3.42Å
398	D	96.4	Very high	94.5	Very high	66 Å²	66	58 Å²	58	35%	0.353	31%	0.307	S	S	.	.	H	α-helix	trans	-60.4	-41.3	171.8	178.2	63.3	0	0	0	111.7	K46 D394 A401 N402	K46-D398 IonicContact NZ-OD2 3.05Å; K46-D398 PolarHBondContact NZ-OD2 2.89Å; D394-D398 WeakPolarHBondContact O-CB 3.45Å; D394-D398 PolarHBondContact O-N 2.99Å; D398-A401 PolarHBondContact O-N 3.47Å; D398-N402 WeakPolarHBondContact O-CB 3.34Å; D398-N402 PolarHBondContact O-N 3.25Å; D398-N402 PolarHBondContact OD1-ND2 3.48Å
399	M	96.4	Very high	94.1	Very high	0 Å²	0	58.5 Å²	58.5	0%	0	31%	0.313	C	S	.	.	I	π-helix	trans	-56.3	-53.1	173.9	-173.1	-172.2	74.2	0	0	111.4	L42 K46 L47 A315 T395 V396 D397 A401 D403 I404	L42-M399 HydrophobicContact CB-CG 4.36Å; L42-M399 HydrophobicContact CB-SD 4.07Å; L42-M399 HydrophobicContact CD1-CG 4.19Å; L42-M399 HydrophobicContact CD2-CG 4.36Å; K46-M399 HydrophobicContact CB-CB 4.25Å; K46-M399 HydrophobicContact CB-CG 4.33Å; K46-M399 HydrophobicContact CB-SD 3.84Å; K46-M399 HydrophobicContact CD-CB 3.72Å; K46-M399 HydrophobicContact CD-CG 4.09Å; L47-M399 HydrophobicContact CB-CE 4.45Å; L47-M399 HydrophobicContact CB-SD 4.46Å; A315-M399 HydrophobicContact CB-CE 3.7Å; T395-M399 PolarHBondContact O-N 3.26Å; V396-M399 HydrophobicContact CG1-CE 4.17Å; V396-M399 WeakPolarHBondContact O-CB 3.27Å; V396-M399 PolarHBondContact O-N 3.48Å; D397-M399 VanDerWaalsContact C-N 3.31Å; D397-M399 PolarHBondContact O-N 3.06Å; M399-A401 PolarHBondContact O-N 3.18Å; M399-D403 WeakPolarHBondContact CA-OD2 3.42Å; M399-D403 PolarHBondContact O-N 3.04Å; M399-D403 VanDerWaalsContact O-N 3.15Å; M399-I404 WeakPolarHBondContact O-CG1 3.47Å; M399-I404 PolarHBondContact O-N 3.41Å
400	L	94.4	Very high	93.5	Very high	40 Å²	40	55.8 Å²	55.8	21%	0.209	30%	0.302	C	S	.	.	I	π-helix	trans	-65.8	-37.8	-177.2	-71.8	172.4	0	0	0	112.9	I312 A315 K319 V396 D397 I404	I312-L400 HydrophobicContact CB-CD2 4.32Å; I312-L400 HydrophobicContact CG1-CD2 4.15Å; I312-L400 HydrophobicContact CG2-CD2 4.05Å; A315-L400 HydrophobicContact CB-CD1 4.32Å; A315-L400 HydrophobicContact CB-CD2 4.01Å; A315-L400 HydrophobicContact CB-CG 4.39Å; K319-L400 HydrophobicContact CD-CD1 4.36Å; V396-L400 HydrophobicContact CG1-CD1 4.2Å; V396-L400 HydrophobicContact CG1-CG 4.49Å; V396-L400 WeakPolarHBondContact O-CG 3.47Å; V396-L400 PolarHBondContact O-N 3Å; D397-L400 PolarHBondContact O-N 2.86Å; L400-I404 HydrophobicContact CD2-CG1 4.44Å
401	A	92.8	Very high	93.1	Very high	65 Å²	65	52.2 Å²	52.2	54%	0.537	28%	0.279	S	S	.	.	I	π-helix	trans	-80.7	-41.8	-177	0	0	0	0	0	113	D397 D398 M399	D397-A401 VanDerWaalsContact O-CB 3.29Å; D397-A401 WeakPolarHBondContact O-CB 3.5Å; D397-A401 PolarHBondContact O-N 3.42Å; D398-A401 PolarHBondContact O-N 3.47Å; M399-A401 PolarHBondContact O-N 3.18Å
402	N	92.6	Very high	92.5	Very high	80 Å²	80	52.2 Å²	52.2	43%	0.428	28%	0.275	S	S	.	.	I	π-helix	trans	-112.3	-47.6	-166.7	-63.3	-50.1	0	0	0	113.5	D398 R406	D398-N402 WeakPolarHBondContact O-CB 3.34Å; D398-N402 PolarHBondContact O-N 3.25Å; D398-N402 PolarHBondContact OD1-ND2 3.48Å; N402-R406 PolarHBondContact O-N 3.25Å
403	D	93	Very high	91.9	Very high	25 Å²	25	55.7 Å²	55.7	13%	0.134	29%	0.29	C	S	.	.	I	π-helix	trans	-76.1	-42.2	-174.5	-59.5	-47.9	0	0	0	112.2	L42 K46 M399 A405 R406 L407	L42-D403 HydrophobicContact CD1-CB 3.69Å; L42-D403 HydrophobicContact CD2-CB 3.73Å; L42-D403 HydrophobicContact CG-CB 4.38Å; K46-D403 VanDerWaalsContact CE-OD2 3.24Å; K46-D403 WeakPolarHBondContact CE-OD2 3.13Å; K46-D403 IonicContact NZ-OD1 3.08Å; K46-D403 IonicContact NZ-OD2 3.72Å; K46-D403 PolarHBondContact NZ-OD2 2.93Å; M399-D403 WeakPolarHBondContact CA-OD2 3.42Å; M399-D403 PolarHBondContact O-N 3.04Å; M399-D403 VanDerWaalsContact O-N 3.15Å; D403-A405 PolarHBondContact O-N 3.48Å; D403-R406 WeakPolarHBondContact O-CB 3.37Å; D403-R406 PolarHBondContact O-N 3.45Å; D403-L407 PolarHBondContact O-N 3.49Å
404	I	91.3	Very high	91.3	Very high	12 Å²	12	58 Å²	58	6%	0.062	30%	0.3	C	S	.	.	H	α-helix	trans	-57.4	-40.7	175.9	-67.3	-64.8	0	0	0	110.5	L308 I312 M399 L400 R406 L407 M408	L308-I404 HydrophobicContact CD1-CD1 3.37Å; L308-I404 HydrophobicContact CD1-CG2 4.22Å; L308-I404 HydrophobicContact CD2-CG2 4.46Å; L308-I404 HydrophobicContact CG-CD1 4.37Å; I312-I404 HydrophobicContact CD1-CD1 4.47Å; I312-I404 HydrophobicContact CD1-CG2 3.66Å; I312-I404 HydrophobicContact CG1-CD1 3.98Å; I312-I404 HydrophobicContact CG1-CG1 4.24Å; I312-I404 HydrophobicContact CG1-CG2 4.18Å; M399-I404 WeakPolarHBondContact O-CG1 3.47Å; M399-I404 PolarHBondContact O-N 3.41Å; L400-I404 HydrophobicContact CD2-CG1 4.44Å; I404-R406 VanDerWaalsContact C-N 3.27Å; I404-R406 PolarHBondContact O-N 3.42Å; I404-L407 PolarHBondContact O-N 3.16Å; I404-M408 WeakPolarHBondContact O-CG 3.38Å; I404-M408 PolarHBondContact O-N 3.39Å
405	A	88.8	Confident	90.7	Very high	56 Å²	56	54.8 Å²	54.8	46%	0.463	28%	0.282	S	S	.	.	H	α-helix	trans	-61.1	-35.1	177.3	0	0	0	0	0	112.5	D403	D403-A405 PolarHBondContact O-N 3.48Å
406	R	88.1	Confident	89.9	Confident	145 Å²	145	56.3 Å²	56.3	55%	0.547	30%	0.295	S	S	.	.	H	α-helix	trans	-72.5	-44.4	175.1	-63.9	177.2	-168.6	-170.6	4.3	111.6	N402 D403 I404 M408 V409 M410	N402-R406 PolarHBondContact O-N 3.25Å; D403-R406 WeakPolarHBondContact O-CB 3.37Å; D403-R406 PolarHBondContact O-N 3.45Å; I404-R406 VanDerWaalsContact C-N 3.27Å; I404-R406 PolarHBondContact O-N 3.42Å; R406-M408 VanDerWaalsContact C-N 3.25Å; R406-M408 PolarHBondContact O-N 3.43Å; R406-V409 WeakPolarHBondContact O-CB 3.36Å; R406-V409 PolarHBondContact O-N 2.98Å; R406-V409 VanDerWaalsContact O-N 3.08Å; R406-M410 PolarHBondContact O-N 3.49Å
407	L	88.9	Confident	89.2	Confident	1 Å²	1	63.5 Å²	63.5	1%	0.005	33%	0.333	C	S	.	.	H	α-helix	trans	-60.8	-35.5	175.9	-74	-178	0	0	0	111.9	F32 L39 L42 L308 D403 I404 V409 M410 V411	F32-L407 HydrophobicContact CD2-CD2 4Å; F32-L407 HydrophobicContact CE2-CD2 4.26Å; L39-L407 HydrophobicContact CD2-CD1 3.83Å; L39-L407 HydrophobicContact CG-CD1 4.23Å; L42-L407 HydrophobicContact CD1-CD1 3.4Å; L42-L407 HydrophobicContact CD1-CG 4.28Å; L42-L407 HydrophobicContact CG-CD1 4.42Å; L308-L407 HydrophobicContact CD1-CB 4.08Å; L308-L407 HydrophobicContact CD1-CD1 4.02Å; D403-L407 PolarHBondContact O-N 3.49Å; I404-L407 PolarHBondContact O-N 3.16Å; L407-V409 PolarHBondContact O-N 3.03Å; L407-M410 HydrophobicContact CD2-SD 4.06Å; L407-M410 CarbonylContact O-C 3.32Å; L407-M410 WeakPolarHBondContact O-CB 3.26Å; L407-M410 PolarHBondContact O-N 3.49Å; L407-V411 WeakPolarHBondContact O-CG2 3.31Å; L407-V411 PolarHBondContact O-N 3.33Å
408	M	87.8	Confident	88.3	Confident	54 Å²	54	63.2 Å²	63.2	27%	0.266	33%	0.33	S	S	.	.	H	α-helix	trans	-58.5	-34	174.5	-79.5	-61.3	-61.4	0	0	113.3	L305 L308 I404 R406 R412	L305-M408 HydrophobicContact CD1-CE 3.83Å; L305-M408 HydrophobicContact CD1-SD 3.74Å; L308-M408 HydrophobicContact CD2-CG 3.76Å; L308-M408 HydrophobicContact CD2-SD 3.14Å; L308-M408 WeakPolarHBondContact CD2-SD 3.37Å; I404-M408 WeakPolarHBondContact O-CG 3.38Å; I404-M408 PolarHBondContact O-N 3.39Å; R406-M408 VanDerWaalsContact C-N 3.25Å; R406-M408 PolarHBondContact O-N 3.43Å; M408-R412 WeakPolarHBondContact O-CG 3.11Å; M408-R412 PolarHBondContact O-N 2.96Å
409	V	88.1	Confident	87.2	Confident	82 Å²	82	63.8 Å²	63.8	50%	0.497	34%	0.338	S	S	.	.	H	α-helix	trans	-69.5	-42.5	175	179	0	0	0	0	110.3	R406 L407 R412 Q413	R406-V409 WeakPolarHBondContact O-CB 3.36Å; R406-V409 PolarHBondContact O-N 2.98Å; R406-V409 VanDerWaalsContact O-N 3.08Å; L407-V409 PolarHBondContact O-N 3.03Å; V409-R412 PolarHBondContact O-N 2.94Å; V409-Q413 WeakPolarHBondContact O-CG 3.47Å; V409-Q413 PolarHBondContact O-N 3.16Å
410	M	86.6	Confident	85.8	Confident	40 Å²	40	68.4 Å²	68.4	20%	0.197	37%	0.37	C	S	.	.	H	α-helix	trans	-64.9	-41.9	177	-67.3	178.9	67	0	0	112.4	F32 V35 R406 L407 R412 Q413 E414	F32-M410 HydrophobicContact CB-CE 3.82Å; F32-M410 HydrophobicContact CB-SD 4.39Å; F32-M410 HydrophobicContact CD2-SD 4.08Å; V35-M410 HydrophobicContact CG2-CB 3.84Å; R406-M410 PolarHBondContact O-N 3.49Å; L407-M410 HydrophobicContact CD2-SD 4.06Å; L407-M410 CarbonylContact O-C 3.32Å; L407-M410 WeakPolarHBondContact O-CB 3.26Å; L407-M410 PolarHBondContact O-N 3.49Å; M410-R412 VanDerWaalsContact C-N 3.31Å; M410-R412 PolarHBondContact O-N 3.07Å; M410-Q413 WeakPolarHBondContact O-CB 3.28Å; M410-Q413 PolarHBondContact O-N 3.04Å; M410-Q413 VanDerWaalsContact O-N 3.08Å; M410-E414 PolarHBondContact O-N 2.99Å
411	V	87.4	Confident	84.4	Confident	1 Å²	1	69.6 Å²	69.6	1%	0.006	37%	0.374	C	S	.	.	H	α-helix	trans	-53.7	-49.3	175.2	168.2	0	0	0	0	110.5	V35 A304 L305 L308 L407 Q413 E414 E415	V35-V411 HydrophobicContact CB-CG2 4.37Å; V35-V411 HydrophobicContact CG1-CG2 3.71Å; V35-V411 HydrophobicContact CG2-CB 4.46Å; V35-V411 HydrophobicContact CG2-CG2 3.77Å; A304-V411 HydrophobicContact CB-CG2 4.27Å; L305-V411 HydrophobicContact CB-CG1 3.88Å; L305-V411 HydrophobicContact CD1-CG1 4.26Å; L308-V411 HydrophobicContact CD2-CG2 4.42Å; L407-V411 WeakPolarHBondContact O-CG2 3.31Å; L407-V411 PolarHBondContact O-N 3.33Å; V411-Q413 VanDerWaalsContact C-N 3.29Å; V411-Q413 PolarHBondContact O-N 2.81Å; V411-E414 PolarHBondContact O-N 2.9Å; V411-E415 HydrophobicContact CG1-CG 4.27Å; V411-E415 WeakPolarHBondContact CG1-OE1 3.48Å; V411-E415 VanDerWaalsContact O-CB 3.31Å; V411-E415 WeakPolarHBondContact O-CB 3.22Å; V411-E415 VanDerWaalsContact O-CG 3.29Å; V411-E415 WeakPolarHBondContact O-CG 3.39Å; V411-E415 PolarHBondContact O-N 3.4Å
412	R	86.6	Confident	83.5	Confident	172 Å²	172	68.1 Å²	68.1	65%	0.649	36%	0.358	S	S	*	.	H	α-helix	trans	-62.6	-36.3	179	-69.3	177.7	-174.9	-171.7	2.3	112.6	M408 V409 M410 S416	M408-R412 WeakPolarHBondContact O-CG 3.11Å; M408-R412 PolarHBondContact O-N 2.96Å; V409-R412 PolarHBondContact O-N 2.94Å; M410-R412 VanDerWaalsContact C-N 3.31Å; M410-R412 PolarHBondContact O-N 3.07Å; R412-S416 WeakPolarHBondContact O-CB 3.38Å; R412-S416 PolarHBondContact O-N 3.16Å; R412-S416 VanDerWaalsContact O-N 3.1Å
413	Q	85.4	Confident	82.9	Confident	113 Å²	113	64.4 Å²	64.4	53%	0.528	34%	0.338	S	S	.	.	H	α-helix	trans	-67.4	-49.4	176.4	-70.7	174.2	-6.2	0	0	111.2	V409 M410 V411 E415 S416 L417	V409-Q413 WeakPolarHBondContact O-CG 3.47Å; V409-Q413 PolarHBondContact O-N 3.16Å; M410-Q413 WeakPolarHBondContact O-CB 3.28Å; M410-Q413 PolarHBondContact O-N 3.04Å; M410-Q413 VanDerWaalsContact O-N 3.08Å; V411-Q413 VanDerWaalsContact C-N 3.29Å; V411-Q413 PolarHBondContact O-N 2.81Å; Q413-E415 PolarHBondContact O-N 2.74Å; Q413-S416 PolarHBondContact O-N 2.88Å; Q413-S416 PolarHBondContact O-OG 3.34Å; Q413-L417 WeakPolarHBondContact O-CG 3.48Å; Q413-L417 PolarHBondContact O-N 2.91Å
414	E	84.3	Confident	82.4	Confident	53 Å²	53	69.5 Å²	69.5	25%	0.248	36%	0.36	C	S	.	.	H	α-helix	trans	-58.9	-45.4	175.2	-73.5	-173.6	179.2	0	0	111.7	T34 V35 M410 V411 S416 L417 M418	T34-E414 WeakPolarHBondContact CA-OE1 3.2Å; V35-E414 WeakPolarHBondContact CB-OE2 3.37Å; V35-E414 VanDerWaalsContact CG2-CD 3.45Å; V35-E414 HydrophobicContact CG2-CG 4.28Å; V35-E414 VanDerWaalsContact CG2-OE2 3.3Å; V35-E414 WeakPolarHBondContact CG2-OE2 3.3Å; V35-E414 PolarHBondContact N-OE1 2.86Å; M410-E414 PolarHBondContact O-N 2.99Å; V411-E414 PolarHBondContact O-N 2.9Å; E414-S416 PolarHBondContact O-N 3.05Å; E414-L417 PolarHBondContact O-N 3.32Å; E414-L417 VanDerWaalsContact O-N 3.1Å; E414-M418 PolarHBondContact O-N 3.44Å; E414-M418 VanDerWaalsContact O-N 3.08Å
415	E	83.8	Confident	81.9	Confident	30 Å²	30	69.3 Å²	69.3	14%	0.14	36%	0.361	C	S	.	.	H	α-helix	trans	-61.6	-28.8	177.2	-78.5	178.3	172.8	0	0	113.8	R301 V411 Q413	R301-E415 HydrophobicContact CG-CG 4.41Å; R301-E415 PolarHBondContact NE-O 3.26Å; R301-E415 PolarHBondContact NH2-O 2.98Å; R301-E415 WeakPolarHBondContact O-CG 3.4Å; V411-E415 HydrophobicContact CG1-CG 4.27Å; V411-E415 WeakPolarHBondContact CG1-OE1 3.48Å; V411-E415 VanDerWaalsContact O-CB 3.31Å; V411-E415 WeakPolarHBondContact O-CB 3.22Å; V411-E415 VanDerWaalsContact O-CG 3.29Å; V411-E415 WeakPolarHBondContact O-CG 3.39Å; V411-E415 PolarHBondContact O-N 3.4Å; Q413-E415 PolarHBondContact O-N 2.74Å
416	S	82.7	Confident	81.7	Confident	85 Å²	85	67.2 Å²	67.2	59%	0.594	34%	0.344	S	S	*	.	H	α-helix	trans	-78.7	-25.3	176.3	76.9	0	0	0	0	113.4	R412 Q413 E414	R412-S416 WeakPolarHBondContact O-CB 3.38Å; R412-S416 PolarHBondContact O-N 3.16Å; R412-S416 VanDerWaalsContact O-N 3.1Å; Q413-S416 PolarHBondContact O-N 2.88Å; Q413-S416 PolarHBondContact O-OG 3.34Å; E414-S416 PolarHBondContact O-N 3.05Å
417	L	82.2	Confident	81.5	Confident	152 Å²	152	60.6 Å²	60.6	80%	0.796	32%	0.32	S	S	*	.	H	α-helix	trans	-87.3	-22.7	179.1	-66.3	172.3	0	0	0	111.7	Q413 E414	Q413-L417 WeakPolarHBondContact O-CG 3.48Å; Q413-L417 PolarHBondContact O-N 2.91Å; E414-L417 PolarHBondContact O-N 3.32Å; E414-L417 VanDerWaalsContact O-N 3.1Å
418	M	77.5	Confident	81.2	Confident	55 Å²	55	60.7 Å²	60.7	27%	0.271	32%	0.321	S	S	.	.	S	Bend	trans	-72.2	139.1	175.8	-76.1	-164.8	-95.8	0	0	112	R301 E414	R301-M418 HydrophobicContact CG-CB 4.45Å; R301-M418 WeakPolarHBondContact O-CE 3.35Å; E414-M418 PolarHBondContact O-N 3.44Å; E414-M418 VanDerWaalsContact O-N 3.08Å
419	P	73.5	Confident	80.4	Confident	79 Å²	79	62.8 Å²	62.8	51%	0.513	33%	0.333	S	S	.	.			trans	-62.6	149.9	174.9	26.1	-31.5	0	0	0	110.7	Q421 V422	P419-Q421 PolarHBondContact O-N 3.41Å; P419-V422 HydrophobicContact CG-CG2 4.24Å; P419-V422 WeakPolarHBondContact O-CG2 3.27Å
420	S	66.2	Low	78.9	Confident	96 Å²	96	61.6 Å²	61.6	67%	0.671	34%	0.337	S	S	*	.	S	Bend	trans	-62.2	-27.3	179.3	52.3	0	0	0	0	113.3
421	Q	65.6	Low	77.5	Confident	66 Å²	66	60.5 Å²	60.5	31%	0.308	33%	0.333	S	S	.	.			trans	-118.6	99.2	176.1	-70.8	178	-21.9	0	0	110	P419	P419-Q421 PolarHBondContact O-N 3.41Å
422	V	73.8	Confident	75.8	Confident	33 Å²	33	63 Å²	63	20%	0.2	35%	0.345	C	S	.	.			trans	-93.2	-36.2	178.7	-171.8	0	0	0	0	111.5	S162 P300 P419	S162-V422 PolarHBondContact OG-O 3.11Å; P300-V422 HydrophobicContact CB-CB 3.84Å; P300-V422 HydrophobicContact CB-CG1 3.58Å; P300-V422 HydrophobicContact CB-CG2 4.3Å; P300-V422 HydrophobicContact CG-CB 4.03Å; P300-V422 HydrophobicContact CG-CG1 3.98Å; P419-V422 HydrophobicContact CG-CG2 4.24Å; P419-V422 WeakPolarHBondContact O-CG2 3.27Å
423	V	80.6	Confident	73.8	Confident	2 Å²	2	61 Å²	61	1%	0.012	35%	0.347	C	S	.	.			trans	-83.6	125.7	174.2	-170.9	0	0	0	0	108.5	V159 I163 Q297 P300 F428	V159-V423 HydrophobicContact CB-CG1 4.44Å; V159-V423 HydrophobicContact CG1-CG1 3.97Å; I163-V423 HydrophobicContact CG2-CG2 4Å; Q297-V423 HydrophobicContact CG-CB 4.15Å; P300-V423 HydrophobicContact CG-CG2 3.79Å; V423-F428 HydrophobicContact CG1-CD2 3.7Å; V423-F428 HydrophobicContact CG1-CE2 3.63Å; V423-F428 HydrophobicContact CG1-CG 4.24Å; V423-F428 HydrophobicContact CG1-CZ 4.1Å
424	K	81.4	Confident	72.1	Confident	133 Å²	133	56.5 Å²	56.5	58%	0.578	33%	0.332	S	S	*	.			trans	-128.7	157.2	-176.9	-61.9	-177.2	-179.8	-179.1	0	110	P158 V159	P158-K424 CarbonylContact C-O 3.52Å; P158-K424 VanDerWaalsContact CB-O 3.31Å; P158-K424 WeakPolarHBondContact CB-O 3.49Å; V159-K424 PolarHBondContact N-O 3.31Å
425	G	81.9	Confident	70.2	Confident	8 Å²	8	59.9 Å²	59.9	8%	0.082	36%	0.358	C	S	.	.	S	Bend	trans	76.6	172.9	177.7	0	0	0	0	0	113.4	V159 F428 D429	V159-G425 WeakPolarHBondContact CG2-O 3.47Å; G425-F428 WeakPolarHBondContact O-CB 3.47Å; G425-F428 WeakPolarHBondContact O-CD2 3.31Å; G425-D429 VanDerWaalsContact CA-OD2 3.3Å; G425-D429 WeakPolarHBondContact CA-OD2 3.4Å; G425-D429 PolarHBondContact N-OD1 3.36Å; G425-D429 PolarHBondContact N-OD2 2.96Å
426	G	84.6	Confident	68.6	Low	11 Å²	11	65 Å²	65	11%	0.113	38%	0.38	C	S	.	.	T	Hydrogen-bonded Turn	trans	61.9	-152	-174.2	0	0	0	0	0	112.3	F428 D429	G426-F428 PolarHBondContact O-N 3.4Å; G426-D429 PolarHBondContact O-N 3.12Å
427	A	83.4	Confident	67.1	Low	6 Å²	6	62.8 Å²	62.8	5%	0.05	37%	0.371	C	S	.	.	H	α-helix	trans	-65.8	-7.4	-174.6	0	0	0	0	0	113.9	H91 L92 E94 F293 T431	H91-A427 WeakPolarHBondContact O-CB 3.42Å; L92-A427 PolarHBondContact O-N 2.96Å; L92-A427 VanDerWaalsContact O-N 3.11Å; E94-A427 HydrophobicContact CG-CB 4.32Å; F293-A427 HydrophobicContact CD2-CB 4.36Å; F293-A427 HydrophobicContact CE2-CB 3.49Å; F293-A427 VanDerWaalsContact CE2-CB 3.49Å; F293-A427 HydrophobicContact CZ-CB 3.87Å; A427-T431 PolarHBondContact O-OG1 3Å
428	F	81.9	Confident	65.3	Low	3 Å²	3	60.6 Å²	60.6	1%	0.013	36%	0.356	C	S	.	.	H	α-helix	trans	-75.6	-24.9	177.8	-66	-66	0	0	0	114.1	L92 V159 F293 I296 Q297 V423 G425 G426 T431	L92-F428 HydrophobicContact CD1-CE1 3.98Å; L92-F428 HydrophobicContact CD1-CE2 3.7Å; L92-F428 HydrophobicContact CD1-CZ 3.33Å; L92-F428 HydrophobicContact CD2-CE2 4.24Å; L92-F428 HydrophobicContact CD2-CZ 4.05Å; L92-F428 HydrophobicContact CG-CE2 3.65Å; L92-F428 HydrophobicContact CG-CZ 3.7Å; V159-F428 HydrophobicContact CB-CE2 4.46Å; V159-F428 HydrophobicContact CG1-CD2 4.3Å; V159-F428 HydrophobicContact CG1-CE2 3.66Å; V159-F428 HydrophobicContact CG2-CD2 3.77Å; V159-F428 HydrophobicContact CG2-CE2 3.95Å; F293-F428 HydrophobicContact CB-CD1 3.83Å; F293-F428 HydrophobicContact CB-CE1 3.8Å; F293-F428 HydrophobicContact CD1-CE1 4.32Å; F293-F428 HydrophobicContact CD2-CD1 4.35Å; F293-F428 HydrophobicContact CG-CD1 4.12Å; F293-F428 AromaticContact CG-CE1 3.99Å; F293-F428 HydrophobicContact CG-CE1 3.99Å; I296-F428 HydrophobicContact CB-CE1 4.17Å; I296-F428 HydrophobicContact CB-CZ 4.21Å; I296-F428 HydrophobicContact CG2-CE1 4.14Å; I296-F428 HydrophobicContact CG2-CZ 3.7Å; Q297-F428 HydrophobicContact CG-CD1 3.41Å; Q297-F428 VanDerWaalsContact CG-CD1 3.41Å; Q297-F428 HydrophobicContact CG-CE1 3.77Å; Q297-F428 HydrophobicContact CG-CG 4.16Å; Q297-F428 VanDerWaalsContact NE2-CB 3.33Å; V423-F428 HydrophobicContact CG1-CD2 3.7Å; V423-F428 HydrophobicContact CG1-CE2 3.63Å; V423-F428 HydrophobicContact CG1-CG 4.24Å; V423-F428 HydrophobicContact CG1-CZ 4.1Å; G425-F428 WeakPolarHBondContact O-CB 3.47Å; G425-F428 WeakPolarHBondContact O-CD2 3.31Å; G426-F428 PolarHBondContact O-N 3.4Å; F428-T431 PolarHBondContact O-OG1 3.5Å
429	D	71.1	Confident	64.1	Low	99 Å²	99	59.6 Å²	59.6	53%	0.529	36%	0.359	S	S	.	.	H	α-helix	trans	-78.3	-34.1	-178.3	-74.6	-4.8	0	0	0	111.3	G425 G426 T431	G425-D429 VanDerWaalsContact CA-OD2 3.3Å; G425-D429 WeakPolarHBondContact CA-OD2 3.4Å; G425-D429 PolarHBondContact N-OD1 3.36Å; G425-D429 PolarHBondContact N-OD2 2.96Å; G426-D429 PolarHBondContact O-N 3.12Å; D429-T431 PolarHBondContact O-N 2.85Å
430	G	57.3	Low	63.3	Low	56 Å²	56	60.1 Å²	60.1	58%	0.577	35%	0.352	S	S	*	.	H	α-helix	trans	-73.7	-20.9	-179	0	0	0	0	0	115
431	T	55.6	Low	63	Low	17 Å²	17	56.2 Å²	56.2	10%	0.104	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.2	-14.4	-169.3	40.3	0	0	0	0	115.6	Q290 F293 A427 F428 D429	Q290-T431 HydrophobicContact CG-CG2 3.82Å; Q290-T431 PolarHBondContact NE2-O 3.42Å; F293-T431 HydrophobicContact CD2-CG2 3.61Å; F293-T431 HydrophobicContact CE2-CG2 4.06Å; A427-T431 PolarHBondContact O-OG1 3Å; F428-T431 PolarHBondContact O-OG1 3.5Å; D429-T431 PolarHBondContact O-N 2.85Å
432	M	51.8	Low	62.9	Low	53 Å²	53	56.7 Å²	56.7	26%	0.261	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-131.9	-28.9	-173.8	-69.7	-89	-115.5	0	0	114.1	K294 H438	K294-M432 HydrophobicContact CD-CE 4.2Å; K294-M432 WeakPolarHBondContact CE-SD 3.31Å; K294-M432 HydrophobicContact CG-CE 4.02Å; M432-H438 PolarHBondContact SD-NE2 3.19Å
433	N	46.3	Very low	63.2	Low	130 Å²	130	55.4 Å²	55.4	70%	0.695	32%	0.323	S	S	*	.	S	Bend	trans	-136.3	19.1	-172.7	-69.8	-39.6	0	0	0	113.5
434	G	48.8	Very low	62.9	Low	20 Å²	20	55.9 Å²	55.9	21%	0.206	33%	0.326	C	S	.	.	S	Bend	trans	-61.7	157.9	169.8	0	0	0	0	0	111.1	F436 G437	G434-F436 PolarHBondContact O-N 3.15Å; G434-G437 PolarHBondContact O-N 2.96Å
435	P	44.4	Very low	62.5	Low	124 Å²	124	50.2 Å²	50.2	81%	0.805	31%	0.306	S	S	*	.	S	Bend	trans	-58.8	-10.6	173.5	24.5	-32.5	0	0	0	113.3
436	F	50.3	Low	62.4	Low	138 Å²	138	52.3 Å²	52.3	61%	0.605	31%	0.313	S	S	*	.	S	Bend	trans	-111.8	56.6	176	-48.8	-71.1	0	0	0	110.5	G434 Y440	G434-F436 PolarHBondContact O-N 3.15Å; F436-Y440 HydrophobicContact CB-CD2 3.81Å; F436-Y440 HydrophobicContact CB-CE2 4.31Å; F436-Y440 HydrophobicContact CB-CG 4.07Å; F436-Y440 AromaticContact CD1-CD2 3.84Å; F436-Y440 HydrophobicContact CD1-CD2 3.84Å; F436-Y440 AromaticContact CD1-CE2 3.48Å; F436-Y440 HydrophobicContact CD1-CE2 3.48Å; F436-Y440 VanDerWaalsContact CD1-CE2 3.48Å; F436-Y440 HydrophobicContact CE1-CE2 4.23Å; F436-Y440 HydrophobicContact CG-CD2 4.28Å; F436-Y440 HydrophobicContact CG-CE2 4.28Å
437	G	50.6	Low	62	Low	38 Å²	38	52.3 Å²	52.3	39%	0.392	31%	0.313	S	S	.	.			trans	-53.9	177.9	-170.7	0	0	0	0	0	116.2	G434 G439 Y440	G434-G437 PolarHBondContact O-N 2.96Å; G437-G439 PolarHBondContact O-N 3.26Å; G437-G439 VanDerWaalsContact O-N 3.15Å; G437-Y440 PolarHBondContact O-N 2.63Å
438	H	45.2	Very low	61.7	Low	106 Å²	106	55.1 Å²	55.1	49%	0.491	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-41.9	120.4	177.8	-96.9	-55.2	0	0	0	112.4	Q290 K294 M432	Q290-H438 PolarHBondContact OE1-CE1 3.22Å; Q290-H438 PolarHBondContact OE1-ND1 3.29Å; K294-H438 PolarHBondContact NZ-CE1 2.86Å; K294-H438 PolarHBondContact NZ-NE2 3.09Å; M432-H438 PolarHBondContact SD-NE2 3.19Å
439	G	52.6	Low	61.3	Low	33 Å²	33	59.8 Å²	59.8	34%	0.34	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	96.1	14.5	179	0	0	0	0	0	115.9	G437 G441 E442	G437-G439 PolarHBondContact O-N 3.26Å; G437-G439 VanDerWaalsContact O-N 3.15Å; G439-G441 PolarHBondContact O-N 3.49Å; G439-E442 PolarHBondContact O-N 3.29Å
440	Y	56.1	Low	61.5	Low	90 Å²	90	58.7 Å²	58.7	35%	0.353	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	121.9	167	-168.5	-96.3	0	0	0	109.9	F436 G437 I448 D449	F436-Y440 HydrophobicContact CB-CD2 3.81Å; F436-Y440 HydrophobicContact CB-CE2 4.31Å; F436-Y440 HydrophobicContact CB-CG 4.07Å; F436-Y440 AromaticContact CD1-CD2 3.84Å; F436-Y440 HydrophobicContact CD1-CD2 3.84Å; F436-Y440 AromaticContact CD1-CE2 3.48Å; F436-Y440 HydrophobicContact CD1-CE2 3.48Å; F436-Y440 VanDerWaalsContact CD1-CE2 3.48Å; F436-Y440 HydrophobicContact CE1-CE2 4.23Å; F436-Y440 HydrophobicContact CG-CD2 4.28Å; F436-Y440 HydrophobicContact CG-CE2 4.28Å; G437-Y440 PolarHBondContact O-N 2.63Å; Y440-I448 HydrophobicContact CD1-CG2 4.3Å; Y440-I448 HydrophobicContact CD2-CG2 4.45Å; Y440-I448 HydrophobicContact CE1-CG2 3.8Å; Y440-I448 HydrophobicContact CE2-CD1 4.03Å; Y440-I448 HydrophobicContact CE2-CG2 3.97Å; Y440-D449 VanDerWaalsContact CE1-OD2 3.31Å; Y440-D449 WeakPolarHBondContact CE1-OD2 3.35Å; Y440-D449 PolarHBondContact OH-OD1 3.45Å
441	G	59.2	Low	62.4	Low	14 Å²	14	63 Å²	63	14%	0.144	36%	0.361	C	S	.	.	T	Hydrogen-bonded Turn	trans	82.2	6.4	-174.4	0	0	0	0	0	115.8	K283 G439 G445 E446	K283-G441 WeakPolarHBondContact CE-O 3.47Å; K283-G441 PolarHBondContact NZ-O 3Å; G439-G441 PolarHBondContact O-N 3.49Å; G441-G445 CarbonylContact C-O 3.55Å; G441-G445 WeakPolarHBondContact CA-O 3.5Å; G441-G445 PolarHBondContact N-O 3.2Å; G441-E446 WeakPolarHBondContact O-CA 3.12Å
442	E	63.6	Low	63.8	Low	77 Å²	77	69.8 Å²	69.8	36%	0.36	39%	0.391	S	S	.	.	S	Bend	trans	-122.5	155.7	-178.9	-63.4	-168.3	162	0	0	113.7	K283 G439 A444 G445 H529	K283-E442 HydrophobicContact CD-CG 4.43Å; G439-E442 PolarHBondContact O-N 3.29Å; E442-A444 PolarHBondContact O-N 3.32Å; E442-G445 WeakPolarHBondContact O-CA 3.28Å; E442-G445 PolarHBondContact O-N 3.18Å; E442-H529 IonicContact OE2-CE1 3.65Å
443	G	80.1	Confident	65.7	Low	6 Å²	6	68.2 Å²	68.2	6%	0.062	38%	0.383	C	S	.	.	G	3₁₀ helix	trans	53.2	-120.3	-176.4	0	0	0	0	0	111.3	G445 E446	G443-G445 PolarHBondContact O-N 3.47Å; G443-E446 WeakPolarHBondContact O-CB 3.45Å; G443-E446 PolarHBondContact O-N 3.38Å
444	A	75.1	Confident	67.7	Low	11 Å²	11	62.3 Å²	62.3	9%	0.091	35%	0.351	C	S	.	.	G	3₁₀ helix	trans	-77.4	0.6	176.6	0	0	0	0	0	115	E442 P532 H538 L539	E442-A444 PolarHBondContact O-N 3.32Å; A444-P532 HydrophobicContact CB-CB 4.07Å; A444-P532 VanDerWaalsContact CB-CD 3.46Å; A444-P532 HydrophobicContact CB-CG 3.64Å; A444-H538 PolarHBondContact O-CE1 3.39Å; A444-H538 VanDerWaalsContact O-CE1 3.32Å; A444-H538 PolarHBondContact O-NE2 3.1Å; A444-L539 HydrophobicContact CB-CD1 4.05Å; A444-L539 WeakPolarHBondContact O-CD1 3.28Å
445	G	73.6	Confident	69.7	Low	14 Å²	14	61.3 Å²	61.3	14%	0.144	34%	0.341	C	S	.	.	G	3₁₀ helix	trans	-95.7	2.1	167.4	0	0	0	0	0	113.5	G441 E442 G443 G447 I448	G441-G445 CarbonylContact C-O 3.55Å; G441-G445 WeakPolarHBondContact CA-O 3.5Å; G441-G445 PolarHBondContact N-O 3.2Å; E442-G445 WeakPolarHBondContact O-CA 3.28Å; E442-G445 PolarHBondContact O-N 3.18Å; G443-G445 PolarHBondContact O-N 3.47Å; G445-G447 PolarHBondContact O-N 3.2Å; G445-I448 VanDerWaalsContact O-CB 3.28Å; G445-I448 WeakPolarHBondContact O-CB 3.35Å; G445-I448 WeakPolarHBondContact O-CG2 3.23Å; G445-I448 PolarHBondContact O-N 2.82Å
446	E	79.2	Confident	71.8	Confident	52 Å²	52	57.2 Å²	57.2	24%	0.243	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	129.6	178.7	-163.4	-170.6	175.4	0	0	111.1	G441 G443 I448 V454 H520 H538	G441-E446 WeakPolarHBondContact O-CA 3.12Å; G443-E446 WeakPolarHBondContact O-CB 3.45Å; G443-E446 PolarHBondContact O-N 3.38Å; E446-I448 VanDerWaalsContact C-N 3.31Å; E446-I448 PolarHBondContact O-N 3.17Å; E446-V454 HydrophobicContact CB-CG2 4.28Å; E446-V454 HydrophobicContact CG-CG2 3.85Å; E446-V454 WeakPolarHBondContact O-CG1 3.41Å; E446-H520 IonicContact OE2-CE1 2.75Å; E446-H520 PolarHBondContact OE2-CE1 3.29Å; E446-H538 PolarHBondContact O-CD2 3.38Å; E446-H538 VanDerWaalsContact O-CD2 3.28Å; E446-H538 PolarHBondContact O-NE2 2.62Å
447	G	75.8	Confident	73.6	Confident	11 Å²	11	56.9 Å²	56.9	11%	0.113	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	71.3	21.6	-177.9	0	0	0	0	0	114.5	G445 D449 D450	G445-G447 PolarHBondContact O-N 3.2Å; G447-D449 PolarHBondContact O-N 2.97Å; G447-D450 PolarHBondContact O-N 3.08Å; G447-D450 VanDerWaalsContact O-N 3.08Å
448	I	77.3	Confident	75.6	Confident	66 Å²	66	57.4 Å²	57.4	34%	0.338	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-29.2	174.7	-165.1	161	0	0	0	113.6	Y440 G445 E446	Y440-I448 HydrophobicContact CD1-CG2 4.3Å; Y440-I448 HydrophobicContact CD2-CG2 4.45Å; Y440-I448 HydrophobicContact CE1-CG2 3.8Å; Y440-I448 HydrophobicContact CE2-CD1 4.03Å; Y440-I448 HydrophobicContact CE2-CG2 3.97Å; G445-I448 VanDerWaalsContact O-CB 3.28Å; G445-I448 WeakPolarHBondContact O-CB 3.35Å; G445-I448 WeakPolarHBondContact O-CG2 3.23Å; G445-I448 PolarHBondContact O-N 2.82Å; E446-I448 VanDerWaalsContact C-N 3.31Å; E446-I448 PolarHBondContact O-N 3.17Å
449	D	73.4	Confident	77.8	Confident	100 Å²	100	54 Å²	54	54%	0.535	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101	-2.5	174.6	-61.4	-33	0	0	0	112.9	Y440 G447	Y440-D449 VanDerWaalsContact CE1-OD2 3.31Å; Y440-D449 WeakPolarHBondContact CE1-OD2 3.35Å; Y440-D449 PolarHBondContact OH-OD1 3.45Å; G447-D449 PolarHBondContact O-N 2.97Å
450	D	75.8	Confident	79.8	Confident	77 Å²	77	56.1 Å²	56.1	41%	0.412	31%	0.305	S	S	.	.			trans	-75.6	133.9	179.6	-77.5	-0.9	0	0	0	109.1	G447 E452 K457	G447-D450 PolarHBondContact O-N 3.08Å; G447-D450 VanDerWaalsContact O-N 3.08Å; D450-E452 PolarHBondContact O-N 2.92Å; D450-K457 IonicContact OD2-NZ 2.73Å; D450-K457 PolarHBondContact OD2-NZ 2.89Å
451	V	75.3	Confident	81.6	Confident	147 Å²	147	55.7 Å²	55.7	89%	0.891	31%	0.312	S	S	*	.	S	Bend	trans	-68.1	-31	175.9	-179.4	0	0	0	0	111
452	E	84.9	Confident	83.3	Confident	158 Å²	158	56.1 Å²	56.1	74%	0.738	31%	0.31	S	S	*	.	S	Bend	trans	-93.9	154.8	179.3	-65.8	-173.6	170.2	0	0	111.8	D450 V454	D450-E452 PolarHBondContact O-N 2.92Å; E452-V454 PolarHBondContact O-N 3.24Å
453	W	91.7	Very high	84.7	Confident	21 Å²	21	54 Å²	54	8%	0.08	30%	0.3	C	S	.	.			trans	-67	116.4	176.9	-174.1	44.3	0	0	0	110.3	V455 G456 K459 E513 A516 L517 L539 P541 P542	W453-V455 HydrophobicContact CD2-CB 3.81Å; W453-V455 HydrophobicContact CD2-CG2 4.3Å; W453-V455 HydrophobicContact CE3-CB 4.02Å; W453-V455 HydrophobicContact CH2-CB 3.8Å; W453-V455 HydrophobicContact CH2-CG1 3.8Å; W453-V455 HydrophobicContact CH2-CG2 4.39Å; W453-V455 HydrophobicContact CZ2-CB 3.58Å; W453-V455 HydrophobicContact CZ2-CG1 3.95Å; W453-V455 HydrophobicContact CZ2-CG2 3.7Å; W453-V455 HydrophobicContact CZ3-CB 4.01Å; W453-V455 HydrophobicContact CZ3-CG1 4.17Å; W453-V455 PolarHBondContact O-N 2.79Å; W453-V455 VanDerWaalsContact O-N 3.12Å; W453-G456 WeakPolarHBondContact O-CA 3.44Å; W453-G456 PolarHBondContact O-N 3.26Å; W453-K459 HydrophobicContact CZ3-CD 4.38Å; W453-E513 HydrophobicContact CH2-CB 3.97Å; W453-E513 WeakPolarHBondContact CH2-O 3.44Å; W453-E513 HydrophobicContact CZ3-CB 4.27Å; W453-E513 HydrophobicContact CZ3-CG 4.43Å; W453-A516 HydrophobicContact CH2-CB 4.31Å; W453-L517 HydrophobicContact CZ2-CB 4.26Å; W453-L539 PolarHBondContact NE1-O 3.05Å; W453-P541 HydrophobicContact CH2-CB 4.37Å; W453-P541 HydrophobicContact CH2-CG 4.36Å; W453-P541 HydrophobicContact CZ2-CB 4.21Å; W453-P541 HydrophobicContact CZ2-CG 3.98Å; W453-P542 HydrophobicContact CB-CG 3.87Å; W453-P542 HydrophobicContact CD2-CG 4.17Å; W453-P542 HydrophobicContact CE3-CG 4.17Å; W453-P542 HydrophobicContact CG-CG 4.09Å
454	V	88.6	Confident	85.4	Confident	5 Å²	5	60.5 Å²	60.5	3%	0.03	33%	0.329	C	S	.	.	G	3₁₀ helix	trans	-53.6	-36.7	-173.5	71.6	0	0	0	0	113.5	E446 E452 G456 K457 L539	E446-V454 HydrophobicContact CB-CG2 4.28Å; E446-V454 HydrophobicContact CG-CG2 3.85Å; E446-V454 WeakPolarHBondContact O-CG1 3.41Å; E452-V454 PolarHBondContact O-N 3.24Å; V454-G456 PolarHBondContact O-N 3.39Å; V454-K457 PolarHBondContact O-N 3.01Å; V454-L539 HydrophobicContact CG1-CD2 3.42Å; V454-L539 VanDerWaalsContact CG1-CD2 3.42Å
455	V	91.7	Very high	86.3	Confident	0 Å²	0	62.3 Å²	62.3	0%	0	34%	0.337	C	S	.	.	G	3₁₀ helix	trans	-67	-23.3	179	-173.7	0	0	0	0	111.6	W453 K457 D458 K459 Y462 A516 L517 H520 L539	W453-V455 HydrophobicContact CD2-CB 3.81Å; W453-V455 HydrophobicContact CD2-CG2 4.3Å; W453-V455 HydrophobicContact CE3-CB 4.02Å; W453-V455 HydrophobicContact CH2-CB 3.8Å; W453-V455 HydrophobicContact CH2-CG1 3.8Å; W453-V455 HydrophobicContact CH2-CG2 4.39Å; W453-V455 HydrophobicContact CZ2-CB 3.58Å; W453-V455 HydrophobicContact CZ2-CG1 3.95Å; W453-V455 HydrophobicContact CZ2-CG2 3.7Å; W453-V455 HydrophobicContact CZ3-CB 4.01Å; W453-V455 HydrophobicContact CZ3-CG1 4.17Å; W453-V455 PolarHBondContact O-N 2.79Å; W453-V455 VanDerWaalsContact O-N 3.12Å; V455-K457 PolarHBondContact O-N 3.39Å; V455-K457 VanDerWaalsContact O-N 3.12Å; V455-D458 PolarHBondContact O-N 3.2Å; V455-D458 VanDerWaalsContact O-N 3.08Å; V455-K459 PolarHBondContact O-N 3.21Å; V455-Y462 HydrophobicContact CG1-CD2 4.4Å; V455-Y462 HydrophobicContact CG1-CE2 4.26Å; V455-A516 HydrophobicContact CG1-CB 3.85Å; V455-L517 HydrophobicContact CG2-CD1 4.4Å; V455-H520 HydrophobicContact CG1-CB 3.98Å; V455-H520 HydrophobicContact CG2-CB 3.93Å; V455-L539 HydrophobicContact CG2-CD2 4.5Å
456	G	88.4	Confident	87.3	Confident	38 Å²	38	61.7 Å²	61.7	39%	0.392	33%	0.331	S	S	.	.	G	3₁₀ helix	trans	-57	-26.8	177.9	0	0	0	0	0	113.8	W453 V454	W453-G456 WeakPolarHBondContact O-CA 3.44Å; W453-G456 PolarHBondContact O-N 3.26Å; V454-G456 PolarHBondContact O-N 3.39Å
457	K	88.1	Confident	88	Confident	131 Å²	131	66 Å²	66	57%	0.57	35%	0.346	S	S	*	.	G	3₁₀ helix	trans	-62.8	-41.9	176.2	-65	172.1	-173.5	163	0	112.1	D450 V454 V455	D450-K457 IonicContact OD2-NZ 2.73Å; D450-K457 PolarHBondContact OD2-NZ 2.89Å; V454-K457 PolarHBondContact O-N 3.01Å; V455-K457 PolarHBondContact O-N 3.39Å; V455-K457 VanDerWaalsContact O-N 3.12Å
458	D	91	Very high	88.9	Confident	49 Å²	49	70.5 Å²	70.5	26%	0.262	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.9	-7.3	-176.4	-68.8	-26.7	0	0	0	112.9	V455 P460 T461 Y462 K523	V455-D458 PolarHBondContact O-N 3.2Å; V455-D458 VanDerWaalsContact O-N 3.08Å; D458-P460 VanDerWaalsContact C-CD 3.42Å; D458-T461 WeakPolarHBondContact O-CB 3.37Å; D458-T461 PolarHBondContact O-N 3.21Å; D458-T461 VanDerWaalsContact O-N 3.08Å; D458-Y462 HydrophobicContact CB-CD2 4.18Å; D458-Y462 HydrophobicContact CB-CE1 4.5Å; D458-Y462 HydrophobicContact CB-CE2 3.48Å; D458-Y462 VanDerWaalsContact CB-CE2 3.48Å; D458-Y462 WeakPolarHBondContact O-CD2 3.42Å; D458-Y462 PolarHBondContact O-N 3.18Å; D458-K523 IonicContact OD2-NZ 3.92Å; D458-K523 PolarHBondContact OD2-NZ 2.92Å
459	K	92.6	Very high	89.6	Confident	33 Å²	33	68.5 Å²	68.5	14%	0.143	36%	0.361	C	S	.	.	H	α-helix	trans	-50.7	-43.7	-177.9	-169	-172.5	-171.8	-52.7	0	113.9	W453 V455 T461 Y462 D463 D512 A516	W453-K459 HydrophobicContact CZ3-CD 4.38Å; V455-K459 PolarHBondContact O-N 3.21Å; K459-T461 VanDerWaalsContact C-N 3.25Å; K459-T461 PolarHBondContact O-N 3.39Å; K459-Y462 PolarHBondContact O-N 3.28Å; K459-D463 IonicContact NZ-OD1 3.02Å; K459-D463 PolarHBondContact NZ-OD1 3.18Å; K459-D463 IonicContact NZ-OD2 2.82Å; K459-D463 PolarHBondContact NZ-OD2 3.18Å; K459-D463 VanDerWaalsContact O-CG 3.31Å; K459-D463 PolarHBondContact O-N 3.29Å; K459-D512 IonicContact NZ-OD2 3.05Å; K459-D512 PolarHBondContact NZ-OD2 3.21Å; K459-A516 HydrophobicContact CG-CB 4.11Å
460	P	94.8	Very high	90.4	Very high	78 Å²	78	68.1 Å²	68.1	51%	0.506	37%	0.366	S	S	.	.	H	α-helix	trans	-56.7	-38.4	179.6	-26.2	35.8	0	0	0	113.4	D458 E464	D458-P460 VanDerWaalsContact C-CD 3.42Å; P460-E464 PolarHBondContact O-N 3.29Å
461	T	92.9	Very high	91.2	Very high	82 Å²	82	66 Å²	66	50%	0.503	36%	0.356	S	S	.	.	H	α-helix	trans	-70.4	-37	177	-55.8	0	0	0	0	111.8	D458 K459	D458-T461 WeakPolarHBondContact O-CB 3.37Å; D458-T461 PolarHBondContact O-N 3.21Å; D458-T461 VanDerWaalsContact O-N 3.08Å; K459-T461 VanDerWaalsContact C-N 3.25Å; K459-T461 PolarHBondContact O-N 3.39Å
462	Y	95.1	Very high	92	Very high	23 Å²	23	64 Å²	64	9%	0.09	34%	0.344	C	S	.	.	H	α-helix	trans	-71.2	-35.6	176.8	-57.3	-34.8	0	0	0	112.4	V455 D458 K459 E464 I465 F466 A516 N519 H520	V455-Y462 HydrophobicContact CG1-CD2 4.4Å; V455-Y462 HydrophobicContact CG1-CE2 4.26Å; D458-Y462 HydrophobicContact CB-CD2 4.18Å; D458-Y462 HydrophobicContact CB-CE1 4.5Å; D458-Y462 HydrophobicContact CB-CE2 3.48Å; D458-Y462 VanDerWaalsContact CB-CE2 3.48Å; D458-Y462 WeakPolarHBondContact O-CD2 3.42Å; D458-Y462 PolarHBondContact O-N 3.18Å; K459-Y462 PolarHBondContact O-N 3.28Å; Y462-E464 VanDerWaalsContact C-N 3.35Å; Y462-E464 PolarHBondContact O-N 3.12Å; Y462-I465 PolarHBondContact O-N 2.82Å; Y462-F466 WeakPolarHBondContact O-CB 3.46Å; Y462-F466 PolarHBondContact O-N 3.12Å; Y462-A516 HydrophobicContact CD2-CB 3.82Å; Y462-A516 HydrophobicContact CG-CB 4.41Å; Y462-N519 HydrophobicContact CD1-CB 3.55Å; Y462-N519 HydrophobicContact CD2-CB 4.19Å; Y462-N519 HydrophobicContact CE1-CB 3.54Å; Y462-N519 HydrophobicContact CE2-CB 4.15Å; Y462-N519 HydrophobicContact CG-CB 3.89Å; Y462-H520 HydrophobicContact CE2-CB 4.35Å
463	D	94	Very high	92.3	Very high	31 Å²	31	64.3 Å²	64.3	17%	0.166	35%	0.351	C	S	.	.	H	α-helix	trans	-62.1	-41.7	176.3	-73.3	-5.2	0	0	0	111.2	K459 I465 F466 Y467	K459-D463 IonicContact NZ-OD1 3.02Å; K459-D463 PolarHBondContact NZ-OD1 3.18Å; K459-D463 IonicContact NZ-OD2 2.82Å; K459-D463 PolarHBondContact NZ-OD2 3.18Å; K459-D463 VanDerWaalsContact O-CG 3.31Å; K459-D463 PolarHBondContact O-N 3.29Å; D463-I465 VanDerWaalsContact C-N 3.29Å; D463-I465 PolarHBondContact O-N 2.82Å; D463-F466 WeakPolarHBondContact O-CB 3.41Å; D463-F466 PolarHBondContact O-N 3.43Å; D463-F466 VanDerWaalsContact O-N 3.16Å; D463-Y467 HydrophobicContact CB-CD2 4.42Å; D463-Y467 HydrophobicContact CB-CE2 4.11Å; D463-Y467 WeakPolarHBondContact O-CD2 3.35Å; D463-Y467 PolarHBondContact O-N 3.38Å
464	E	94.6	Very high	92.3	Very high	143 Å²	143	65.3 Å²	65.3	67%	0.668	37%	0.367	S	S	*	.	H	α-helix	trans	-54.4	-46.8	174.4	-73.4	-178.8	-176.9	0	0	111.5	P460 Y462 T468	P460-E464 PolarHBondContact O-N 3.29Å; Y462-E464 VanDerWaalsContact C-N 3.35Å; Y462-E464 PolarHBondContact O-N 3.12Å; E464-T468 VanDerWaalsContact O-CG2 3.24Å; E464-T468 WeakPolarHBondContact O-CG2 2.98Å; E464-T468 PolarHBondContact O-N 2.88Å
465	I	93.6	Very high	92.6	Very high	50 Å²	50	67.2 Å²	67.2	26%	0.256	38%	0.375	S	S	.	.	H	α-helix	trans	-65.9	-46.2	177.6	-58.7	169.7	0	0	0	110.1	Y462 D463 Y467 T468 L469 E484 F515	Y462-I465 PolarHBondContact O-N 2.82Å; D463-I465 VanDerWaalsContact C-N 3.29Å; D463-I465 PolarHBondContact O-N 2.82Å; I465-Y467 VanDerWaalsContact C-N 3.32Å; I465-Y467 PolarHBondContact O-N 3.2Å; I465-T468 PolarHBondContact O-N 3.3Å; I465-T468 PolarHBondContact O-OG1 3.14Å; I465-L469 PolarHBondContact O-N 2.87Å; I465-E484 HydrophobicContact CG2-CG 3.87Å; I465-F515 HydrophobicContact CB-CE1 4.1Å; I465-F515 HydrophobicContact CB-CZ 4.45Å; I465-F515 HydrophobicContact CG2-CE1 3.98Å; I465-F515 HydrophobicContact CG2-CZ 3.82Å
466	F	95.4	Very high	92.8	Very high	1 Å²	1	67.4 Å²	67.4	0%	0.004	38%	0.376	C	S	.	.	H	α-helix	trans	-53.6	-47.4	-179.1	-179.7	-103.8	0	0	0	112.1	Y462 D463 T468 L469 P471 G474 I476 D511 D512 F515	Y462-F466 WeakPolarHBondContact O-CB 3.46Å; Y462-F466 PolarHBondContact O-N 3.12Å; D463-F466 WeakPolarHBondContact O-CB 3.41Å; D463-F466 PolarHBondContact O-N 3.43Å; D463-F466 VanDerWaalsContact O-N 3.16Å; F466-T468 VanDerWaalsContact C-N 3.31Å; F466-T468 PolarHBondContact O-N 3.45Å; F466-L469 WeakPolarHBondContact O-CB 3.41Å; F466-L469 PolarHBondContact O-N 3.44Å; F466-L469 VanDerWaalsContact O-N 3.1Å; F466-P471 HydrophobicContact CD1-CG 4.14Å; F466-P471 HydrophobicContact CE1-CB 3.72Å; F466-P471 HydrophobicContact CE1-CG 3.7Å; F466-P471 HydrophobicContact CZ-CB 3.8Å; F466-P471 HydrophobicContact CZ-CG 4.29Å; F466-G474 WeakPolarHBondContact CZ-O 3.4Å; F466-I476 HydrophobicContact CD2-CD1 4.11Å; F466-I476 HydrophobicContact CD2-CG1 4.41Å; F466-I476 HydrophobicContact CD2-CG2 4.07Å; F466-I476 HydrophobicContact CE2-CB 4.31Å; F466-I476 HydrophobicContact CE2-CD1 4.11Å; F466-I476 HydrophobicContact CE2-CG1 3.9Å; F466-I476 HydrophobicContact CE2-CG2 3.67Å; F466-I476 HydrophobicContact CZ-CG2 4.11Å; F466-D511 WeakPolarHBondContact CE2-O 3.46Å; F466-D512 HydrophobicContact CD1-CB 3.94Å; F466-D512 HydrophobicContact CE1-CB 3.82Å; F466-D512 HydrophobicContact CG-CB 4.39Å; F466-D512 HydrophobicContact CZ-CB 4.15Å; F466-F515 HydrophobicContact CB-CD1 3.63Å; F466-F515 HydrophobicContact CB-CE1 3.9Å; F466-F515 HydrophobicContact CB-CG 4.38Å; F466-F515 HydrophobicContact CD2-CB 3.56Å; F466-F515 AromaticContact CD2-CD1 3.75Å; F466-F515 HydrophobicContact CD2-CD1 3.75Å; F466-F515 HydrophobicContact CD2-CD2 4.31Å; F466-F515 HydrophobicContact CD2-CE1 4.49Å; F466-F515 AromaticContact CD2-CG 3.61Å; F466-F515 HydrophobicContact CD2-CG 3.61Å; F466-F515 HydrophobicContact CE2-CB 3.98Å; F466-F515 HydrophobicContact CE2-CG 4.42Å; F466-F515 HydrophobicContact CG-CD1 4.16Å; F466-F515 HydrophobicContact CG-CG 4.46Å
467	Y	93.6	Very high	93.1	Very high	143 Å²	143	68.7 Å²	68.7	56%	0.561	38%	0.376	S	S	*	.	H	α-helix	trans	-69.1	-27.3	-179.5	-69.8	-63.2	0	0	0	113.3	D463 I465 L469 S470 P471	D463-Y467 HydrophobicContact CB-CD2 4.42Å; D463-Y467 HydrophobicContact CB-CE2 4.11Å; D463-Y467 WeakPolarHBondContact O-CD2 3.35Å; D463-Y467 PolarHBondContact O-N 3.38Å; I465-Y467 VanDerWaalsContact C-N 3.32Å; I465-Y467 PolarHBondContact O-N 3.2Å; Y467-L469 PolarHBondContact O-N 3.34Å; Y467-S470 PolarHBondContact O-N 2.94Å; Y467-P471 HydrophobicContact CD1-CG 3.98Å; Y467-P471 HydrophobicContact CE1-CG 4.41Å
468	T	93.6	Very high	93.2	Very high	104 Å²	104	63.5 Å²	63.5	64%	0.638	36%	0.36	S	S	*	.	H	α-helix	trans	-66.3	-20.1	172.6	72.9	0	0	0	0	113.4	E464 I465 F466 S470	E464-T468 VanDerWaalsContact O-CG2 3.24Å; E464-T468 WeakPolarHBondContact O-CG2 2.98Å; E464-T468 PolarHBondContact O-N 2.88Å; I465-T468 PolarHBondContact O-N 3.3Å; I465-T468 PolarHBondContact O-OG1 3.14Å; F466-T468 VanDerWaalsContact C-N 3.31Å; F466-T468 PolarHBondContact O-N 3.45Å; T468-S470 PolarHBondContact O-N 3.44Å
469	L	92	Very high	93.2	Very high	25 Å²	25	64 Å²	64	13%	0.131	37%	0.372	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.6	4.9	178.4	-58.7	176.7	0	0	0	113.2	I465 F466 Y467 I476 N480 E484 F515	I465-L469 PolarHBondContact O-N 2.87Å; F466-L469 WeakPolarHBondContact O-CB 3.41Å; F466-L469 PolarHBondContact O-N 3.44Å; F466-L469 VanDerWaalsContact O-N 3.1Å; Y467-L469 PolarHBondContact O-N 3.34Å; L469-I476 HydrophobicContact CB-CG2 4.07Å; L469-I476 HydrophobicContact CD1-CD1 3.84Å; L469-N480 PolarHBondContact O-ND2 3.21Å; L469-E484 HydrophobicContact CD1-CB 3.99Å; L469-E484 HydrophobicContact CD1-CG 4.25Å; L469-E484 HydrophobicContact CD2-CB 4.34Å; L469-F515 HydrophobicContact CD1-CE2 3.79Å; L469-F515 HydrophobicContact CD1-CZ 3.78Å
470	S	91.3	Very high	93.1	Very high	91 Å²	91	64.9 Å²	64.9	64%	0.636	38%	0.378	S	S	*	.			trans	53.7	66.3	178.2	-62	0	0	0	0	112.8	Y467 T468	Y467-S470 PolarHBondContact O-N 2.94Å; T468-S470 PolarHBondContact O-N 3.44Å
471	P	93.1	Very high	93	Very high	33 Å²	33	61.1 Å²	61.1	21%	0.214	35%	0.353	C	S	.	.			trans	-61.2	143.8	177.4	26.3	-34	0	0	0	111.5	F466 Y467 K475 I476	F466-P471 HydrophobicContact CD1-CG 4.14Å; F466-P471 HydrophobicContact CE1-CB 3.72Å; F466-P471 HydrophobicContact CE1-CG 3.7Å; F466-P471 HydrophobicContact CZ-CB 3.8Å; F466-P471 HydrophobicContact CZ-CG 4.29Å; Y467-P471 HydrophobicContact CD1-CG 3.98Å; Y467-P471 HydrophobicContact CE1-CG 4.41Å; P471-K475 CarbonylContact C-O 3.57Å; P471-K475 WeakPolarHBondContact CA-O 3.49Å; P471-I476 HydrophobicContact CB-CG2 3.82Å
472	V	91.7	Very high	93	Very high	105 Å²	105	63.3 Å²	63.3	64%	0.636	36%	0.356	S	S	*	.	B	Isolated β-bridge	trans	-108.9	123.4	174.6	-179.3	0	0	0	0	107.5	G474 K475	V472-G474 PolarHBondContact O-N 2.94Å; V472-K475 PolarHBondContact N-O 3.39Å; V472-K475 PolarHBondContact O-N 2.89Å; V472-K475 VanDerWaalsContact O-N 3.13Å
473	N	91	Very high	92.8	Very high	165 Å²	165	69.2 Å²	69.2	88%	0.882	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.6	38.1	-173.8	-58.7	-33.6	0	0	0	113.5	K475	N473-K475 VanDerWaalsContact C-N 3.27Å; N473-K475 PolarHBondContact O-N 3.1Å
474	G	92.1	Very high	92.8	Very high	41 Å²	41	69.2 Å²	69.2	42%	0.423	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.8	11.3	179.3	0	0	0	0	0	114.7	F466 V472	F466-G474 WeakPolarHBondContact CZ-O 3.4Å; V472-G474 PolarHBondContact O-N 2.94Å
475	K	94.6	Very high	92.7	Very high	46 Å²	46	62.7 Å²	62.7	20%	0.2	35%	0.351	C	S	.	.	B	Isolated β-bridge	trans	-129.1	147.2	177.3	-62	-161	171.5	-151.6	0	112.7	P471 V472 N473 D505 D507 L509 L510 D511	P471-K475 CarbonylContact C-O 3.57Å; P471-K475 WeakPolarHBondContact CA-O 3.49Å; V472-K475 PolarHBondContact N-O 3.39Å; V472-K475 PolarHBondContact O-N 2.89Å; V472-K475 VanDerWaalsContact O-N 3.13Å; N473-K475 VanDerWaalsContact C-N 3.27Å; N473-K475 PolarHBondContact O-N 3.1Å; K475-D505 IonicContact NZ-OD1 2.62Å; K475-D505 IonicContact NZ-OD2 3.73Å; K475-D505 PolarHBondContact NZ-OD2 2.94Å; K475-D507 IonicContact NZ-OD1 2.73Å; K475-D507 IonicContact NZ-OD2 3.56Å; K475-D507 PolarHBondContact NZ-OD2 3.13Å; K475-L509 HydrophobicContact CB-CB 4.08Å; K475-L509 HydrophobicContact CB-CD1 4.22Å; K475-L509 HydrophobicContact CD-CB 3.98Å; K475-L509 HydrophobicContact CD-CD1 4.06Å; K475-L510 CarbonylContact C-O 3.55Å; K475-L510 VanDerWaalsContact CA-O 3.32Å; K475-L510 WeakPolarHBondContact CA-O 3.08Å; K475-D511 HydrophobicContact CG-CB 4.14Å
476	I	95.4	Very high	92.7	Very high	3 Å²	3	63.5 Å²	63.5	2%	0.015	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	148.3	171	63.4	175.6	0	0	0	111.2	F466 L469 P471 A481 L509 L510 F515	F466-I476 HydrophobicContact CD2-CD1 4.11Å; F466-I476 HydrophobicContact CD2-CG1 4.41Å; F466-I476 HydrophobicContact CD2-CG2 4.07Å; F466-I476 HydrophobicContact CE2-CB 4.31Å; F466-I476 HydrophobicContact CE2-CD1 4.11Å; F466-I476 HydrophobicContact CE2-CG1 3.9Å; F466-I476 HydrophobicContact CE2-CG2 3.67Å; F466-I476 HydrophobicContact CZ-CG2 4.11Å; L469-I476 HydrophobicContact CB-CG2 4.07Å; L469-I476 HydrophobicContact CD1-CD1 3.84Å; P471-I476 HydrophobicContact CB-CG2 3.82Å; I476-A481 HydrophobicContact CD1-CB 3.68Å; I476-A481 HydrophobicContact CG1-CB 4.22Å; I476-L509 WeakPolarHBondContact O-CA 3.5Å; I476-L509 WeakPolarHBondContact O-CB 3.08Å; I476-L510 HydrophobicContact CG1-CB 4.02Å; I476-L510 PolarHBondContact N-O 3.08Å; I476-L510 PolarHBondContact O-N 3.28Å; I476-F515 HydrophobicContact CD1-CD2 3.48Å; I476-F515 VanDerWaalsContact CD1-CD2 3.48Å; I476-F515 HydrophobicContact CD1-CE2 3.82Å; I476-F515 HydrophobicContact CD1-CG 4.23Å
477	T	94.4	Very high	92.6	Very high	65 Å²	65	70.1 Å²	70.1	40%	0.399	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	152	175.2	64.7	0	0	0	0	111.5	A479 N480 A481 L509	T477-A479 PolarHBondContact O-N 2.9Å; T477-A479 VanDerWaalsContact O-N 3.09Å; T477-N480 PolarHBondContact O-N 3.27Å; T477-N480 PolarHBondContact OG1-N 3.5Å; T477-A481 PolarHBondContact O-N 3.35Å; T477-L509 HydrophobicContact CG2-CD2 4.13Å
478	G	90.1	Very high	92.5	Very high	22 Å²	22	64.5 Å²	64.5	23%	0.227	37%	0.368	C	S	.	.	H	α-helix	trans	-56.9	-26.4	173.6	0	0	0	0	0	114.4	K482	G478-K482 WeakPolarHBondContact O-CB 3.32Å; G478-K482 PolarHBondContact O-N 2.92Å
479	A	90.8	Very high	92.5	Very high	61 Å²	61	68.8 Å²	68.8	50%	0.504	38%	0.378	S	S	.	.	H	α-helix	trans	-67.8	-40.6	172.8	0	0	0	0	0	112.7	T477 K483	T477-A479 PolarHBondContact O-N 2.9Å; T477-A479 VanDerWaalsContact O-N 3.09Å; A479-K483 WeakPolarHBondContact O-CG 3.39Å; A479-K483 PolarHBondContact O-N 3.12Å
480	N	92.2	Very high	92.4	Very high	50 Å²	50	68.9 Å²	68.9	27%	0.267	38%	0.379	S	S	.	.	H	α-helix	trans	-73.4	-45.3	177.9	-75.6	-2.5	0	0	0	111.3	L469 T477 K482 K483 E484	L469-N480 PolarHBondContact O-ND2 3.21Å; T477-N480 PolarHBondContact O-N 3.27Å; T477-N480 PolarHBondContact OG1-N 3.5Å; N480-K482 VanDerWaalsContact C-N 3.35Å; N480-K482 PolarHBondContact O-N 2.96Å; N480-K483 WeakPolarHBondContact O-CB 3.37Å; N480-K483 PolarHBondContact O-N 3.04Å; N480-E484 PolarHBondContact O-N 3.19Å
481	A	92.3	Very high	92.3	Very high	0 Å²	0	68.2 Å²	68.2	0%	0	37%	0.372	C	S	.	.	H	α-helix	trans	-58.2	-46.1	174.8	0	0	0	0	0	111.7	I476 T477 K483 E484 M485 W499 L510	I476-A481 HydrophobicContact CD1-CB 3.68Å; I476-A481 HydrophobicContact CG1-CB 4.22Å; T477-A481 PolarHBondContact O-N 3.35Å; A481-K483 VanDerWaalsContact C-N 3.3Å; A481-K483 PolarHBondContact O-N 3.08Å; A481-E484 PolarHBondContact O-N 2.78Å; A481-M485 VanDerWaalsContact O-CG 3.25Å; A481-M485 WeakPolarHBondContact O-CG 3.41Å; A481-M485 PolarHBondContact O-N 3.14Å; A481-W499 HydrophobicContact CB-CE3 4.32Å; A481-W499 HydrophobicContact CB-CH2 4.35Å; A481-W499 HydrophobicContact CB-CZ3 3.49Å; A481-W499 VanDerWaalsContact CB-CZ3 3.49Å; A481-L510 HydrophobicContact CB-CD1 3.92Å
482	K	91.7	Very high	92	Very high	128 Å²	128	72 Å²	72	56%	0.557	39%	0.39	S	S	*	.	H	α-helix	trans	-58.1	-40.4	177	-178.7	178.5	-179.2	179.3	0	112.6	G478 N480 E484 M485 V486	G478-K482 WeakPolarHBondContact O-CB 3.32Å; G478-K482 PolarHBondContact O-N 2.92Å; N480-K482 VanDerWaalsContact C-N 3.35Å; N480-K482 PolarHBondContact O-N 2.96Å; K482-E484 VanDerWaalsContact C-N 3.25Å; K482-E484 PolarHBondContact O-N 3.44Å; K482-M485 PolarHBondContact O-N 3.27Å; K482-V486 HydrophobicContact CG-CG2 4.23Å; K482-V486 WeakPolarHBondContact O-CB 3.34Å; K482-V486 WeakPolarHBondContact O-CG2 3.43Å; K482-V486 PolarHBondContact O-N 3.32Å
483	K	92.5	Very high	91.8	Very high	146 Å²	146	72.6 Å²	72.6	64%	0.635	40%	0.395	S	S	*	.	H	α-helix	trans	-59.9	-38.5	177	-76	172.3	-175.9	172.8	0	111.6	A479 N480 A481	A479-K483 WeakPolarHBondContact O-CG 3.39Å; A479-K483 PolarHBondContact O-N 3.12Å; N480-K483 WeakPolarHBondContact O-CB 3.37Å; N480-K483 PolarHBondContact O-N 3.04Å; A481-K483 VanDerWaalsContact C-N 3.3Å; A481-K483 PolarHBondContact O-N 3.08Å
484	E	93.5	Very high	91.7	Very high	31 Å²	31	66 Å²	66	15%	0.145	36%	0.36	C	S	.	.	H	α-helix	trans	-73.2	-51	176.8	-164.7	58.3	-144.3	0	0	111.6	I465 L469 N480 A481 K482 V486 K487 F515	I465-E484 HydrophobicContact CG2-CG 3.87Å; L469-E484 HydrophobicContact CD1-CB 3.99Å; L469-E484 HydrophobicContact CD1-CG 4.25Å; L469-E484 HydrophobicContact CD2-CB 4.34Å; N480-E484 PolarHBondContact O-N 3.19Å; A481-E484 PolarHBondContact O-N 2.78Å; K482-E484 VanDerWaalsContact C-N 3.25Å; K482-E484 PolarHBondContact O-N 3.44Å; E484-V486 PolarHBondContact O-N 3.17Å; E484-V486 VanDerWaalsContact O-N 3.17Å; E484-K487 VanDerWaalsContact O-CB 3.24Å; E484-K487 WeakPolarHBondContact O-CB 3.48Å; E484-K487 WeakPolarHBondContact O-CG 3.39Å; E484-K487 PolarHBondContact O-N 3.36Å; E484-K487 WeakPolarHBondContact OE1-CD 3.2Å; E484-K487 IonicContact OE1-NZ 3.81Å; E484-K487 PolarHBondContact OE1-NZ 3.23Å; E484-K487 VanDerWaalsContact OE2-CE 3.28Å; E484-K487 WeakPolarHBondContact OE2-CE 3.46Å; E484-K487 IonicContact OE2-NZ 3.36Å; E484-K487 PolarHBondContact OE2-NZ 3.06Å; E484-F515 HydrophobicContact CG-CE2 4.47Å; E484-F515 HydrophobicContact CG-CZ 4.08Å
485	M	92.4	Very high	91.7	Very high	7 Å²	7	64.6 Å²	64.6	3%	0.034	34%	0.343	C	S	.	.	H	α-helix	trans	-57.5	-35.3	-177.4	-67.6	174	77	0	0	112.9	A481 K482 K487 S488 L495 I498 W499 I522	A481-M485 VanDerWaalsContact O-CG 3.25Å; A481-M485 WeakPolarHBondContact O-CG 3.41Å; A481-M485 PolarHBondContact O-N 3.14Å; K482-M485 PolarHBondContact O-N 3.27Å; M485-K487 PolarHBondContact O-N 3.1Å; M485-S488 WeakPolarHBondContact O-CB 3.32Å; M485-S488 PolarHBondContact O-N 2.9Å; M485-S488 PolarHBondContact O-OG 2.76Å; M485-L495 HydrophobicContact CB-CD1 4.45Å; M485-L495 HydrophobicContact CB-CD2 4.16Å; M485-L495 HydrophobicContact CE-CD2 4.34Å; M485-I498 HydrophobicContact CE-CB 4.02Å; M485-I498 HydrophobicContact CE-CG2 3.67Å; M485-W499 HydrophobicContact SD-CE3 4.18Å; M485-I522 HydrophobicContact CB-CD1 4.12Å; M485-I522 HydrophobicContact CE-CD1 4.32Å; M485-I522 HydrophobicContact CG-CD1 3.96Å
486	V	93.8	Very high	91.6	Very high	67 Å²	67	64.3 Å²	64.3	41%	0.406	35%	0.353	S	S	.	.	G	3₁₀ helix	trans	-63.8	-23.5	177.8	167.9	0	0	0	0	112.7	K482 E484 S488 K489 L495	K482-V486 HydrophobicContact CG-CG2 4.23Å; K482-V486 WeakPolarHBondContact O-CB 3.34Å; K482-V486 WeakPolarHBondContact O-CG2 3.43Å; K482-V486 PolarHBondContact O-N 3.32Å; E484-V486 PolarHBondContact O-N 3.17Å; E484-V486 VanDerWaalsContact O-N 3.17Å; V486-S488 PolarHBondContact O-N 3.33Å; V486-K489 PolarHBondContact O-N 3.22Å; V486-L495 HydrophobicContact CB-CD1 4.47Å; V486-L495 HydrophobicContact CG2-CD1 3.87Å
487	K	93.1	Very high	91.4	Very high	139 Å²	139	68 Å²	68	60%	0.604	37%	0.369	S	S	*	.	G	3₁₀ helix	trans	-64.2	-22.3	176.4	-62	178.8	-173.6	167.2	0	113.1	E484 M485 K489	E484-K487 VanDerWaalsContact O-CB 3.24Å; E484-K487 WeakPolarHBondContact O-CB 3.48Å; E484-K487 WeakPolarHBondContact O-CG 3.39Å; E484-K487 PolarHBondContact O-N 3.36Å; E484-K487 WeakPolarHBondContact OE1-CD 3.2Å; E484-K487 IonicContact OE1-NZ 3.81Å; E484-K487 PolarHBondContact OE1-NZ 3.23Å; E484-K487 VanDerWaalsContact OE2-CE 3.28Å; E484-K487 WeakPolarHBondContact OE2-CE 3.46Å; E484-K487 IonicContact OE2-NZ 3.36Å; E484-K487 PolarHBondContact OE2-NZ 3.06Å; M485-K487 PolarHBondContact O-N 3.1Å; K487-K489 PolarHBondContact O-N 2.96Å
488	S	91.6	Very high	91.5	Very high	26 Å²	26	64.9 Å²	64.9	18%	0.182	35%	0.35	C	S	.	.	G	3₁₀ helix	trans	-64.1	-15.1	173.1	68.9	0	0	0	0	113.8	M485 V486 L490	M485-S488 WeakPolarHBondContact O-CB 3.32Å; M485-S488 PolarHBondContact O-N 2.9Å; M485-S488 PolarHBondContact O-OG 2.76Å; V486-S488 PolarHBondContact O-N 3.33Å; S488-L490 PolarHBondContact O-N 2.92Å; S488-L490 PolarHBondContact OG-N 3.16Å
489	K	92.2	Very high	91.8	Very high	194 Å²	194	66.6 Å²	66.6	84%	0.843	35%	0.349	S	S	*	.			trans	62.2	15.8	-175.6	-52.8	179.2	-178.1	175.3	0	114.7	V486 K487	V486-K489 PolarHBondContact O-N 3.22Å; K487-K489 PolarHBondContact O-N 2.96Å
490	L	89.8	Confident	91.9	Very high	27 Å²	27	71.8 Å²	71.8	14%	0.141	36%	0.361	C	S	.	.			trans	-71.1	150.2	171.2	-68.3	174.7	0	0	0	111.3	S488 V494 L495 I498 I522 K525 L526	S488-L490 PolarHBondContact O-N 2.92Å; S488-L490 PolarHBondContact OG-N 3.16Å; L490-V494 HydrophobicContact CB-CG1 4.4Å; L490-V494 HydrophobicContact CD1-CG1 4.25Å; L490-L495 HydrophobicContact CB-CD2 3.83Å; L490-L495 HydrophobicContact CB-CG 4.06Å; L490-L495 HydrophobicContact CD1-CD2 4.17Å; L490-I498 HydrophobicContact CD1-CD1 4.07Å; L490-I522 HydrophobicContact CD1-CB 4.43Å; L490-I522 HydrophobicContact CD1-CG1 4.31Å; L490-I522 HydrophobicContact CD1-CG2 4.06Å; L490-K525 HydrophobicContact CD1-CB 4.14Å; L490-K525 HydrophobicContact CD1-CG 4.23Å; L490-K525 HydrophobicContact CD2-CG 4.07Å; L490-L526 HydrophobicContact CD2-CD2 3.88Å; L490-L526 HydrophobicContact CD2-CG 4.46Å; L490-L526 HydrophobicContact CG-CD2 4.15Å
491	P	90.8	Very high	92	Very high	76 Å²	76	70.1 Å²	70.1	49%	0.494	35%	0.352	S	S	.	.			trans	-57.2	143.6	175.2	-24.5	33.8	0	0	0	112.5	T493 V494 L495	P491-T493 PolarHBondContact O-N 2.9Å; P491-T493 VanDerWaalsContact O-N 3.09Å; P491-V494 HydrophobicContact CB-CG2 4.17Å; P491-V494 HydrophobicContact CG-CG2 4.21Å; P491-V494 WeakPolarHBondContact O-CA 3.26Å; P491-V494 WeakPolarHBondContact O-CB 3.37Å; P491-V494 PolarHBondContact O-N 2.96Å; P491-L495 PolarHBondContact O-N 3.34Å
492	N	86.5	Confident	92.2	Very high	112 Å²	112	70.1 Å²	70.1	60%	0.599	35%	0.352	S	S	*	.	H	α-helix	trans	-56.3	-30.5	179.4	-80	-31.4	0	0	0	113.5	V494 G496	N492-V494 VanDerWaalsContact C-N 3.34Å; N492-G496 PolarHBondContact O-N 2.52Å
493	T	87.9	Confident	92.4	Very high	119 Å²	119	64.8 Å²	64.8	73%	0.73	33%	0.329	S	S	*	.	H	α-helix	trans	-64.6	-39	175	49.6	0	0	0	0	112.1	P491 K497	P491-T493 PolarHBondContact O-N 2.9Å; P491-T493 VanDerWaalsContact O-N 3.09Å; T493-K497 PolarHBondContact O-N 3.44Å
494	V	88.7	Confident	92.5	Very high	26 Å²	26	59.9 Å²	59.9	16%	0.158	31%	0.311	C	S	.	.	H	α-helix	trans	-72.4	-46	177	176.1	0	0	0	0	110.4	L490 P491 N492 G496 K497 I498 K525 L531	L490-V494 HydrophobicContact CB-CG1 4.4Å; L490-V494 HydrophobicContact CD1-CG1 4.25Å; P491-V494 HydrophobicContact CB-CG2 4.17Å; P491-V494 HydrophobicContact CG-CG2 4.21Å; P491-V494 WeakPolarHBondContact O-CA 3.26Å; P491-V494 WeakPolarHBondContact O-CB 3.37Å; P491-V494 PolarHBondContact O-N 2.96Å; N492-V494 VanDerWaalsContact C-N 3.34Å; V494-G496 VanDerWaalsContact C-N 3.28Å; V494-G496 PolarHBondContact O-N 2.73Å; V494-K497 WeakPolarHBondContact O-CB 3.45Å; V494-K497 PolarHBondContact O-N 2.92Å; V494-I498 HydrophobicContact CG1-CD1 4.06Å; V494-I498 WeakPolarHBondContact O-CG1 3.37Å; V494-I498 PolarHBondContact O-N 3.49Å; V494-K525 HydrophobicContact CG1-CG 3.75Å; V494-L531 HydrophobicContact CG1-CD1 3.85Å
495	L	92.3	Very high	92.4	Very high	11 Å²	11	61.6 Å²	61.6	6%	0.058	32%	0.321	C	S	.	.	H	α-helix	trans	-60.7	-37.2	176.2	-65.1	-179.4	0	0	0	112.3	M485 V486 L490 P491 K497 I498 W499 I522	M485-L495 HydrophobicContact CB-CD1 4.45Å; M485-L495 HydrophobicContact CB-CD2 4.16Å; M485-L495 HydrophobicContact CE-CD2 4.34Å; V486-L495 HydrophobicContact CB-CD1 4.47Å; V486-L495 HydrophobicContact CG2-CD1 3.87Å; L490-L495 HydrophobicContact CB-CD2 3.83Å; L490-L495 HydrophobicContact CB-CG 4.06Å; L490-L495 HydrophobicContact CD1-CD2 4.17Å; P491-L495 PolarHBondContact O-N 3.34Å; L495-K497 VanDerWaalsContact C-N 3.35Å; L495-I498 HydrophobicContact CD2-CD1 4.35Å; L495-I498 PolarHBondContact O-N 2.87Å; L495-W499 WeakPolarHBondContact O-CB 3.13Å; L495-W499 PolarHBondContact O-N 3.49Å; L495-I522 HydrophobicContact CD2-CD1 4.39Å; L495-I522 HydrophobicContact CD2-CG1 4.38Å
496	G	90.8	Very high	92.5	Very high	40 Å²	40	69.4 Å²	69.4	41%	0.412	36%	0.355	S	S	.	.	H	α-helix	trans	-64.4	-36.7	173.4	0	0	0	0	0	113.2	N492 V494 K500	N492-G496 PolarHBondContact O-N 2.52Å; V494-G496 VanDerWaalsContact C-N 3.28Å; V494-G496 PolarHBondContact O-N 2.73Å; G496-K500 PolarHBondContact O-N 2.89Å; G496-K500 VanDerWaalsContact O-N 3.17Å
497	K	93.1	Very high	92.4	Very high	81 Å²	81	69.8 Å²	69.8	35%	0.352	36%	0.355	S	S	.	.	H	α-helix	trans	-66.8	-43.1	173.2	-174.3	176.6	175.7	-173.8	0	111.3	T493 V494 L495 K500 L501 L531 P532	T493-K497 PolarHBondContact O-N 3.44Å; V494-K497 WeakPolarHBondContact O-CB 3.45Å; V494-K497 PolarHBondContact O-N 2.92Å; L495-K497 VanDerWaalsContact C-N 3.35Å; K497-K500 PolarHBondContact O-N 3.3Å; K497-L501 HydrophobicContact CG-CD1 4.3Å; K497-L501 WeakPolarHBondContact O-CG 3.17Å; K497-L501 PolarHBondContact O-N 3.29Å; K497-L501 VanDerWaalsContact O-N 3.14Å; K497-L531 HydrophobicContact CB-CD1 4.39Å; K497-L531 HydrophobicContact CD-CB 4.08Å; K497-L531 HydrophobicContact CD-CD1 4.15Å; K497-L531 HydrophobicContact CG-CD1 4.31Å; K497-L531 PolarHBondContact NZ-O 3.45Å; K497-P532 WeakPolarHBondContact CE-O 3.46Å; K497-P532 PolarHBondContact NZ-O 2.86Å; K497-P532 VanDerWaalsContact NZ-O 3.12Å
498	I	95.8	Very high	92.4	Very high	0 Å²	0	64.8 Å²	64.8	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-61.6	-46.9	176.8	-67	165.8	0	0	0	110.7	M485 L490 V494 L495 K500 L501 A502 A518 L521 I522 L531	M485-I498 HydrophobicContact CE-CB 4.02Å; M485-I498 HydrophobicContact CE-CG2 3.67Å; L490-I498 HydrophobicContact CD1-CD1 4.07Å; V494-I498 HydrophobicContact CG1-CD1 4.06Å; V494-I498 WeakPolarHBondContact O-CG1 3.37Å; V494-I498 PolarHBondContact O-N 3.49Å; L495-I498 HydrophobicContact CD2-CD1 4.35Å; L495-I498 PolarHBondContact O-N 2.87Å; I498-K500 VanDerWaalsContact C-N 3.31Å; I498-K500 PolarHBondContact O-N 3.43Å; I498-L501 PolarHBondContact O-N 3.04Å; I498-L501 VanDerWaalsContact O-N 3.1Å; I498-A502 WeakPolarHBondContact O-CB 3.3Å; I498-A502 PolarHBondContact O-N 3.48Å; I498-A518 HydrophobicContact CG2-CB 4.26Å; I498-L521 HydrophobicContact CG1-CB 4.23Å; I498-L521 HydrophobicContact CG2-CB 3.89Å; I498-L521 HydrophobicContact CG2-CD1 4.33Å; I498-I522 HydrophobicContact CD1-CG1 3.75Å; I498-I522 HydrophobicContact CG2-CG1 4.34Å; I498-L531 HydrophobicContact CD1-CD1 4.03Å; I498-L531 HydrophobicContact CD1-CD2 4.49Å; I498-L531 HydrophobicContact CG1-CD1 3.49Å; I498-L531 VanDerWaalsContact CG1-CD1 3.49Å; I498-L531 HydrophobicContact CG1-CD2 4.01Å; I498-L531 HydrophobicContact CG1-CG 4.41Å
499	W	95.3	Very high	92.6	Very high	57 Å²	57	66.3 Å²	66.3	22%	0.216	35%	0.349	C	S	.	.	H	α-helix	trans	-52.9	-50	175.3	175.8	-83.7	0	0	0	111.6	A481 M485 L495 L501 A502 D503 G508 L510	A481-W499 HydrophobicContact CB-CE3 4.32Å; A481-W499 HydrophobicContact CB-CH2 4.35Å; A481-W499 HydrophobicContact CB-CZ3 3.49Å; A481-W499 VanDerWaalsContact CB-CZ3 3.49Å; M485-W499 HydrophobicContact SD-CE3 4.18Å; L495-W499 WeakPolarHBondContact O-CB 3.13Å; L495-W499 PolarHBondContact O-N 3.49Å; W499-L501 PolarHBondContact O-N 3.01Å; W499-A502 PolarHBondContact O-N 3.26Å; W499-A502 VanDerWaalsContact O-N 3.16Å; W499-D503 WeakPolarHBondContact O-CB 3.47Å; W499-D503 PolarHBondContact O-N 3.31Å; W499-G508 WeakPolarHBondContact CZ2-O 3.48Å; W499-L510 HydrophobicContact CE3-CD1 3.98Å; W499-L510 HydrophobicContact CE3-CG 4.35Å; W499-L510 HydrophobicContact CH2-CD1 4.16Å; W499-L510 HydrophobicContact CH2-CD2 4.21Å; W499-L510 HydrophobicContact CH2-CG 3.74Å; W499-L510 HydrophobicContact CZ3-CD1 3.45Å; W499-L510 VanDerWaalsContact CZ3-CD1 3.45Å; W499-L510 HydrophobicContact CZ3-CD2 4.14Å; W499-L510 HydrophobicContact CZ3-CG 3.57Å
500	K	94.5	Very high	92.8	Very high	171 Å²	171	57.1 Å²	57.1	74%	0.743	31%	0.309	S	S	*	.	H	α-helix	trans	-62.5	-30.2	-179.2	-172.5	-176.9	175.7	-167.8	0	113.2	G496 K497 I498	G496-K500 PolarHBondContact O-N 2.89Å; G496-K500 VanDerWaalsContact O-N 3.17Å; K497-K500 PolarHBondContact O-N 3.3Å; I498-K500 VanDerWaalsContact C-N 3.31Å; I498-K500 PolarHBondContact O-N 3.43Å
501	L	94.1	Very high	93.1	Very high	15 Å²	15	56.6 Å²	56.6	8%	0.079	31%	0.306	C	S	.	.	H	α-helix	trans	-80.2	-33.8	176.7	-70.6	168.8	0	0	0	112	K497 I498 W499 L521 P532 L535	K497-L501 HydrophobicContact CG-CD1 4.3Å; K497-L501 WeakPolarHBondContact O-CG 3.17Å; K497-L501 PolarHBondContact O-N 3.29Å; K497-L501 VanDerWaalsContact O-N 3.14Å; I498-L501 PolarHBondContact O-N 3.04Å; I498-L501 VanDerWaalsContact O-N 3.1Å; W499-L501 PolarHBondContact O-N 3.01Å; L501-L521 HydrophobicContact CB-CD1 3.74Å; L501-L521 HydrophobicContact CD1-CD1 4.21Å; L501-P532 HydrophobicContact CD1-CG 4.1Å; L501-L535 HydrophobicContact CD2-CB 4.22Å
502	A	96.1	Very high	93.3	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-83.8	-32.6	-175.9	0	0	0	0	0	114	I498 W499 V504 L510 E514 L517 A518	I498-A502 WeakPolarHBondContact O-CB 3.3Å; I498-A502 PolarHBondContact O-N 3.48Å; W499-A502 PolarHBondContact O-N 3.26Å; W499-A502 VanDerWaalsContact O-N 3.16Å; A502-V504 VanDerWaalsContact C-N 3.26Å; A502-V504 PolarHBondContact O-N 2.98Å; A502-L510 HydrophobicContact CB-CD2 4.35Å; A502-E514 WeakPolarHBondContact O-CB 3.44Å; A502-E514 VanDerWaalsContact O-CG 3.26Å; A502-E514 WeakPolarHBondContact O-CG 3.5Å; A502-L517 HydrophobicContact CB-CG 4.47Å; A502-A518 HydrophobicContact CB-CB 3.68Å
503	D	95.9	Very high	93.8	Very high	15 Å²	15	51.3 Å²	51.3	8%	0.08	27%	0.273	C	S	.	.			trans	-76.2	76.4	174.1	-177.8	5.6	0	0	0	109.6	W499 K506 D507 G508 L510	W499-D503 WeakPolarHBondContact O-CB 3.47Å; W499-D503 PolarHBondContact O-N 3.31Å; D503-K506 PolarHBondContact O-N 3.28Å; D503-K506 WeakPolarHBondContact OD1-CA 3.32Å; D503-K506 PolarHBondContact OD1-N 2.92Å; D503-D507 PolarHBondContact OD1-N 2.73Å; D503-G508 WeakPolarHBondContact OD2-CA 3.31Å; D503-G508 PolarHBondContact OD2-N 3.49Å; D503-L510 HydrophobicContact CB-CD2 4.01Å
504	V	94.2	Very high	94.3	Very high	43 Å²	43	45.7 Å²	45.7	26%	0.261	24%	0.238	S	C	.	.	S	Bend	trans	-71.6	-40.7	-169.5	177.5	0	0	0	0	111	A502 K506 E514 L517 L535 V540 P541 K544	A502-V504 VanDerWaalsContact C-N 3.26Å; A502-V504 PolarHBondContact O-N 2.98Å; V504-K506 VanDerWaalsContact C-N 3.33Å; V504-E514 PolarHBondContact N-OE1 2.79Å; V504-L517 HydrophobicContact CG2-CD2 4.17Å; V504-L535 HydrophobicContact CG2-CD2 3.72Å; V504-V540 HydrophobicContact CG1-CG1 4.48Å; V504-P541 HydrophobicContact CG2-CG 4.44Å; V504-K544 HydrophobicContact CG1-CB 3.98Å; V504-K544 HydrophobicContact CG1-CG 4.47Å
505	D	92.3	Very high	94.6	Very high	67 Å²	67	44.4 Å²	44.4	36%	0.358	23%	0.231	S	C	.	.	S	Bend	trans	-82.6	-9	177.6	70.2	17.8	0	0	0	113.9	K475 D507 E514 K544	K475-D505 IonicContact NZ-OD1 2.62Å; K475-D505 IonicContact NZ-OD2 3.73Å; K475-D505 PolarHBondContact NZ-OD2 2.94Å; D505-D507 VanDerWaalsContact C-N 3.28Å; D505-D507 PolarHBondContact O-N 2.75Å; D505-D507 WeakPolarHBondContact OD1-CB 3.45Å; D505-D507 VanDerWaalsContact OD1-CG 3.24Å; D505-D507 PolarHBondContact OD1-N 2.84Å; D505-E514 PolarHBondContact N-OE1 2.63Å; D505-K544 IonicContact OD2-NZ 2.74Å; D505-K544 PolarHBondContact OD2-NZ 2.81Å
506	K	93.1	Very high	94.8	Very high	172 Å²	172	43.9 Å²	43.9	75%	0.748	23%	0.228	S	C	*	.			trans	62.8	31.4	174.2	-55.9	-179.8	-177.2	174.6	0	113.2	D503 V504 G508	D503-K506 PolarHBondContact O-N 3.28Å; D503-K506 WeakPolarHBondContact OD1-CA 3.32Å; D503-K506 PolarHBondContact OD1-N 2.92Å; V504-K506 VanDerWaalsContact C-N 3.33Å; K506-G508 VanDerWaalsContact C-N 3.32Å
507	D	92.6	Very high	95.1	Very high	74 Å²	74	42 Å²	42	40%	0.396	21%	0.208	S	C	.	.	S	Bend	trans	-87.3	-4.1	178.2	84	-10.6	0	0	0	113.4	K475 D503 D505 L509	K475-D507 IonicContact NZ-OD1 2.73Å; K475-D507 IonicContact NZ-OD2 3.56Å; K475-D507 PolarHBondContact NZ-OD2 3.13Å; D503-D507 PolarHBondContact OD1-N 2.73Å; D505-D507 VanDerWaalsContact C-N 3.28Å; D505-D507 PolarHBondContact O-N 2.75Å; D505-D507 WeakPolarHBondContact OD1-CB 3.45Å; D505-D507 VanDerWaalsContact OD1-CG 3.24Å; D505-D507 PolarHBondContact OD1-N 2.84Å; D507-L509 VanDerWaalsContact C-N 3.26Å; D507-L509 PolarHBondContact O-N 3.22Å; D507-L509 WeakPolarHBondContact OD1-CA 3.33Å; D507-L509 VanDerWaalsContact OD1-CB 3.28Å; D507-L509 WeakPolarHBondContact OD1-CB 3.45Å; D507-L509 PolarHBondContact OD1-N 3.03Å
508	G	92.5	Very high	95.3	Very high	34 Å²	34	38.1 Å²	38.1	35%	0.351	19%	0.192	S	C	.	.	S	Bend	trans	78.6	9.2	178.7	0	0	0	0	0	114	W499 D503 K506	W499-G508 WeakPolarHBondContact CZ2-O 3.48Å; D503-G508 WeakPolarHBondContact OD2-CA 3.31Å; D503-G508 PolarHBondContact OD2-N 3.49Å; K506-G508 VanDerWaalsContact C-N 3.32Å
509	L	95.4	Very high	95.3	Very high	59 Å²	59	39.3 Å²	39.3	31%	0.309	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	171.2	171.9	-52.1	175	0	0	0	108.4	K475 I476 T477 D507	K475-L509 HydrophobicContact CB-CB 4.08Å; K475-L509 HydrophobicContact CB-CD1 4.22Å; K475-L509 HydrophobicContact CD-CB 3.98Å; K475-L509 HydrophobicContact CD-CD1 4.06Å; I476-L509 WeakPolarHBondContact O-CA 3.5Å; I476-L509 WeakPolarHBondContact O-CB 3.08Å; T477-L509 HydrophobicContact CG2-CD2 4.13Å; D507-L509 VanDerWaalsContact C-N 3.26Å; D507-L509 PolarHBondContact O-N 3.22Å; D507-L509 WeakPolarHBondContact OD1-CA 3.33Å; D507-L509 VanDerWaalsContact OD1-CB 3.28Å; D507-L509 WeakPolarHBondContact OD1-CB 3.45Å; D507-L509 PolarHBondContact OD1-N 3.03Å
510	L	96.6	Very high	95.3	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	128.5	168.6	-59.5	176.3	0	0	0	108.8	K475 I476 A481 W499 A502 D503 E514 F515 A518	K475-L510 CarbonylContact C-O 3.55Å; K475-L510 VanDerWaalsContact CA-O 3.32Å; K475-L510 WeakPolarHBondContact CA-O 3.08Å; I476-L510 HydrophobicContact CG1-CB 4.02Å; I476-L510 PolarHBondContact N-O 3.08Å; I476-L510 PolarHBondContact O-N 3.28Å; A481-L510 HydrophobicContact CB-CD1 3.92Å; W499-L510 HydrophobicContact CE3-CD1 3.98Å; W499-L510 HydrophobicContact CE3-CG 4.35Å; W499-L510 HydrophobicContact CH2-CD1 4.16Å; W499-L510 HydrophobicContact CH2-CD2 4.21Å; W499-L510 HydrophobicContact CH2-CG 3.74Å; W499-L510 HydrophobicContact CZ3-CD1 3.45Å; W499-L510 VanDerWaalsContact CZ3-CD1 3.45Å; W499-L510 HydrophobicContact CZ3-CD2 4.14Å; W499-L510 HydrophobicContact CZ3-CG 3.57Å; A502-L510 HydrophobicContact CB-CD2 4.35Å; D503-L510 HydrophobicContact CB-CD2 4.01Å; L510-E514 HydrophobicContact CB-CB 4.1Å; L510-E514 HydrophobicContact CD2-CB 3.84Å; L510-F515 HydrophobicContact CB-CB 4.43Å; L510-F515 HydrophobicContact CD1-CD2 4.4Å; L510-A518 HydrophobicContact CD1-CB 4.42Å
511	D	96.6	Very high	95.3	Very high	16 Å²	16	28.5 Å²	28.5	9%	0.086	15%	0.152	C	C	.	.			trans	-77.1	-177.4	161.9	62.6	39.8	0	0	0	111.7	F466 K475 E513 E514 F515 K544	F466-D511 WeakPolarHBondContact CE2-O 3.46Å; K475-D511 HydrophobicContact CG-CB 4.14Å; D511-E513 PolarHBondContact OD1-N 3.43Å; D511-E513 VanDerWaalsContact OD1-N 3.16Å; D511-E514 PolarHBondContact N-OE2 3.01Å; D511-E514 VanDerWaalsContact N-OE2 3.13Å; D511-E514 PolarHBondContact O-N 3.35Å; D511-E514 WeakPolarHBondContact OD1-CB 3.48Å; D511-E514 VanDerWaalsContact OD1-CG 3.3Å; D511-E514 WeakPolarHBondContact OD1-CG 3.25Å; D511-E514 PolarHBondContact OD1-N 2.93Å; D511-F515 VanDerWaalsContact O-CB 3.25Å; D511-F515 WeakPolarHBondContact O-CB 3.38Å; D511-F515 PolarHBondContact O-N 3.13Å; D511-K544 WeakPolarHBondContact OD2-CE 3.37Å; D511-K544 IonicContact OD2-NZ 3.31Å; D511-K544 PolarHBondContact OD2-NZ 3.09Å
512	D	95.9	Very high	95.3	Very high	48 Å²	48	28.4 Å²	28.4	26%	0.257	15%	0.152	S	C	.	.	H	α-helix	trans	-66.4	-36	-176	62.5	-53.5	0	0	0	112.7	K459 F466 A516	K459-D512 IonicContact NZ-OD2 3.05Å; K459-D512 PolarHBondContact NZ-OD2 3.21Å; F466-D512 HydrophobicContact CD1-CB 3.94Å; F466-D512 HydrophobicContact CE1-CB 3.82Å; F466-D512 HydrophobicContact CG-CB 4.39Å; F466-D512 HydrophobicContact CZ-CB 4.15Å; D512-A516 WeakPolarHBondContact O-CB 3.25Å; D512-A516 PolarHBondContact O-N 2.89Å
513	E	96.6	Very high	95.2	Very high	30 Å²	30	31.5 Å²	31.5	14%	0.14	17%	0.165	C	C	.	.	H	α-helix	trans	-73.7	-40.5	176.3	-57.9	-168.2	134.4	0	0	111.9	W453 D511 F515 A516 L517 P541 S543	W453-E513 HydrophobicContact CH2-CB 3.97Å; W453-E513 WeakPolarHBondContact CH2-O 3.44Å; W453-E513 HydrophobicContact CZ3-CB 4.27Å; W453-E513 HydrophobicContact CZ3-CG 4.43Å; D511-E513 PolarHBondContact OD1-N 3.43Å; D511-E513 VanDerWaalsContact OD1-N 3.16Å; E513-F515 VanDerWaalsContact C-N 3.32Å; E513-F515 PolarHBondContact O-N 3.2Å; E513-A516 PolarHBondContact O-N 2.97Å; E513-L517 WeakPolarHBondContact O-CB 3.33Å; E513-L517 PolarHBondContact O-N 3.26Å; E513-P541 HydrophobicContact CB-CB 3.74Å; E513-P541 HydrophobicContact CB-CG 4.18Å; E513-P541 VanDerWaalsContact OE2-CB 3.32Å; E513-P541 WeakPolarHBondContact OE2-CB 3.44Å; E513-S543 WeakPolarHBondContact OE2-CB 3.24Å; E513-S543 PolarHBondContact OE2-N 3.07Å; E513-S543 PolarHBondContact OE2-OG 3.32Å
514	E	97.1	Very high	94.8	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-65.8	-36.6	175.7	-69.9	174.8	152.4	0	0	111.6	A502 V504 D505 L510 D511 L517 A518 K544	A502-E514 WeakPolarHBondContact O-CB 3.44Å; A502-E514 VanDerWaalsContact O-CG 3.26Å; A502-E514 WeakPolarHBondContact O-CG 3.5Å; V504-E514 PolarHBondContact N-OE1 2.79Å; D505-E514 PolarHBondContact N-OE1 2.63Å; L510-E514 HydrophobicContact CB-CB 4.1Å; L510-E514 HydrophobicContact CD2-CB 3.84Å; D511-E514 PolarHBondContact N-OE2 3.01Å; D511-E514 VanDerWaalsContact N-OE2 3.13Å; D511-E514 PolarHBondContact O-N 3.35Å; D511-E514 WeakPolarHBondContact OD1-CB 3.48Å; D511-E514 VanDerWaalsContact OD1-CG 3.3Å; D511-E514 WeakPolarHBondContact OD1-CG 3.25Å; D511-E514 PolarHBondContact OD1-N 2.93Å; E514-L517 PolarHBondContact O-N 3.09Å; E514-A518 WeakPolarHBondContact O-CB 3.49Å; E514-A518 PolarHBondContact O-N 2.91Å; E514-K544 IonicContact OE1-NZ 2.63Å; E514-K544 PolarHBondContact OE1-NZ 2.9Å; E514-K544 IonicContact OE2-NZ 3.37Å
515	F	96.9	Very high	94.5	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-68.3	-40.9	172.9	-175.7	-103	0	0	0	112.4	I465 F466 L469 I476 E484 L510 D511 E513 L517 A518 N519	I465-F515 HydrophobicContact CB-CE1 4.1Å; I465-F515 HydrophobicContact CB-CZ 4.45Å; I465-F515 HydrophobicContact CG2-CE1 3.98Å; I465-F515 HydrophobicContact CG2-CZ 3.82Å; F466-F515 HydrophobicContact CB-CD1 3.63Å; F466-F515 HydrophobicContact CB-CE1 3.9Å; F466-F515 HydrophobicContact CB-CG 4.38Å; F466-F515 HydrophobicContact CD2-CB 3.56Å; F466-F515 AromaticContact CD2-CD1 3.75Å; F466-F515 HydrophobicContact CD2-CD1 3.75Å; F466-F515 HydrophobicContact CD2-CD2 4.31Å; F466-F515 HydrophobicContact CD2-CE1 4.49Å; F466-F515 AromaticContact CD2-CG 3.61Å; F466-F515 HydrophobicContact CD2-CG 3.61Å; F466-F515 HydrophobicContact CE2-CB 3.98Å; F466-F515 HydrophobicContact CE2-CG 4.42Å; F466-F515 HydrophobicContact CG-CD1 4.16Å; F466-F515 HydrophobicContact CG-CG 4.46Å; L469-F515 HydrophobicContact CD1-CE2 3.79Å; L469-F515 HydrophobicContact CD1-CZ 3.78Å; I476-F515 HydrophobicContact CD1-CD2 3.48Å; I476-F515 VanDerWaalsContact CD1-CD2 3.48Å; I476-F515 HydrophobicContact CD1-CE2 3.82Å; I476-F515 HydrophobicContact CD1-CG 4.23Å; E484-F515 HydrophobicContact CG-CE2 4.47Å; E484-F515 HydrophobicContact CG-CZ 4.08Å; L510-F515 HydrophobicContact CB-CB 4.43Å; L510-F515 HydrophobicContact CD1-CD2 4.4Å; D511-F515 VanDerWaalsContact O-CB 3.25Å; D511-F515 WeakPolarHBondContact O-CB 3.38Å; D511-F515 PolarHBondContact O-N 3.13Å; E513-F515 VanDerWaalsContact C-N 3.32Å; E513-F515 PolarHBondContact O-N 3.2Å; F515-L517 VanDerWaalsContact C-N 3.32Å; F515-L517 PolarHBondContact O-N 3.39Å; F515-A518 PolarHBondContact O-N 3.05Å; F515-N519 VanDerWaalsContact CD1-ND2 3.34Å; F515-N519 WeakPolarHBondContact CD1-ND2 3.46Å; F515-N519 WeakPolarHBondContact CE1-ND2 3.26Å; F515-N519 VanDerWaalsContact CZ-ND2 3.26Å; F515-N519 WeakPolarHBondContact CZ-ND2 3.09Å; F515-N519 PolarHBondContact O-N 3.18Å; F515-N519 PolarHBondContact O-ND2 3.16Å
516	A	96.5	Very high	94.2	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-60.3	-43.5	173.2	0	0	0	0	0	111.2	W453 V455 K459 Y462 D512 E513 A518 N519 H520	W453-A516 HydrophobicContact CH2-CB 4.31Å; V455-A516 HydrophobicContact CG1-CB 3.85Å; K459-A516 HydrophobicContact CG-CB 4.11Å; Y462-A516 HydrophobicContact CD2-CB 3.82Å; Y462-A516 HydrophobicContact CG-CB 4.41Å; D512-A516 WeakPolarHBondContact O-CB 3.25Å; D512-A516 PolarHBondContact O-N 2.89Å; E513-A516 PolarHBondContact O-N 2.97Å; A516-A518 PolarHBondContact O-N 3.2Å; A516-N519 PolarHBondContact O-N 3.22Å; A516-H520 WeakPolarHBondContact O-CB 3.34Å; A516-H520 PolarHBondContact O-N 2.74Å
517	L	96.5	Very high	93.7	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-60.6	-43.8	174.2	177.2	59.5	0	0	0	112	W453 V455 A502 V504 E513 E514 F515 N519 H520 L521 L535 L539 P541	W453-L517 HydrophobicContact CZ2-CB 4.26Å; V455-L517 HydrophobicContact CG2-CD1 4.4Å; A502-L517 HydrophobicContact CB-CG 4.47Å; V504-L517 HydrophobicContact CG2-CD2 4.17Å; E513-L517 WeakPolarHBondContact O-CB 3.33Å; E513-L517 PolarHBondContact O-N 3.26Å; E514-L517 PolarHBondContact O-N 3.09Å; F515-L517 VanDerWaalsContact C-N 3.32Å; F515-L517 PolarHBondContact O-N 3.39Å; L517-N519 VanDerWaalsContact C-N 3.33Å; L517-N519 PolarHBondContact O-N 3.25Å; L517-H520 PolarHBondContact O-N 3.22Å; L517-L521 HydrophobicContact CD1-CD1 4.27Å; L517-L521 HydrophobicContact CD1-CG 4.19Å; L517-L521 HydrophobicContact CG-CD1 4.27Å; L517-L521 WeakPolarHBondContact O-CG 3.28Å; L517-L521 PolarHBondContact O-N 2.99Å; L517-L535 HydrophobicContact CD1-CD1 4.12Å; L517-L535 HydrophobicContact CD2-CD1 3.93Å; L517-L535 HydrophobicContact CD2-CD2 3.66Å; L517-L535 HydrophobicContact CD2-CG 4.47Å; L517-L539 HydrophobicContact CD1-CB 4.22Å; L517-P541 HydrophobicContact CD2-CG 4.26Å
518	A	96.8	Very high	93	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-59.5	-43.2	176.9	0	0	0	0	0	112.1	I498 A502 L510 E514 F515 A516 L521 I522	I498-A518 HydrophobicContact CG2-CB 4.26Å; A502-A518 HydrophobicContact CB-CB 3.68Å; L510-A518 HydrophobicContact CD1-CB 4.42Å; E514-A518 WeakPolarHBondContact O-CB 3.49Å; E514-A518 PolarHBondContact O-N 2.91Å; F515-A518 PolarHBondContact O-N 3.05Å; A516-A518 PolarHBondContact O-N 3.2Å; A518-L521 PolarHBondContact O-N 3.16Å; A518-I522 VanDerWaalsContact O-CG1 3.31Å; A518-I522 WeakPolarHBondContact O-CG1 3.4Å; A518-I522 PolarHBondContact O-N 2.63Å
519	N	96.5	Very high	92.5	Very high	24 Å²	24	29.7 Å²	29.7	13%	0.128	16%	0.16	C	C	.	.	H	α-helix	trans	-69.4	-37.6	178	-75.7	-77.1	0	0	0	112.5	Y462 F515 A516 L517 I522 K523	Y462-N519 HydrophobicContact CD1-CB 3.55Å; Y462-N519 HydrophobicContact CD2-CB 4.19Å; Y462-N519 HydrophobicContact CE1-CB 3.54Å; Y462-N519 HydrophobicContact CE2-CB 4.15Å; Y462-N519 HydrophobicContact CG-CB 3.89Å; F515-N519 VanDerWaalsContact CD1-ND2 3.34Å; F515-N519 WeakPolarHBondContact CD1-ND2 3.46Å; F515-N519 WeakPolarHBondContact CE1-ND2 3.26Å; F515-N519 VanDerWaalsContact CZ-ND2 3.26Å; F515-N519 WeakPolarHBondContact CZ-ND2 3.09Å; F515-N519 PolarHBondContact O-N 3.18Å; F515-N519 PolarHBondContact O-ND2 3.16Å; A516-N519 PolarHBondContact O-N 3.22Å; L517-N519 VanDerWaalsContact C-N 3.33Å; L517-N519 PolarHBondContact O-N 3.25Å; N519-I522 WeakPolarHBondContact O-CB 3.43Å; N519-I522 PolarHBondContact O-N 3.22Å; N519-K523 PolarHBondContact O-N 2.87Å
520	H	94.6	Very high	91.9	Very high	2 Å²	2	33.7 Å²	33.7	1%	0.009	18%	0.178	C	C	.	.	H	α-helix	trans	-62	-44.6	172.9	179.3	78	0	0	0	111.7	E446 V455 Y462 A516 L517 I522 K523 V524	E446-H520 IonicContact OE2-CE1 2.75Å; E446-H520 PolarHBondContact OE2-CE1 3.29Å; V455-H520 HydrophobicContact CG1-CB 3.98Å; V455-H520 HydrophobicContact CG2-CB 3.93Å; Y462-H520 HydrophobicContact CE2-CB 4.35Å; A516-H520 WeakPolarHBondContact O-CB 3.34Å; A516-H520 PolarHBondContact O-N 2.74Å; L517-H520 PolarHBondContact O-N 3.22Å; H520-I522 VanDerWaalsContact C-N 3.31Å; H520-I522 PolarHBondContact O-N 3.29Å; H520-K523 WeakPolarHBondContact O-CB 3.01Å; H520-K523 PolarHBondContact O-N 3.49Å; H520-K523 VanDerWaalsContact O-N 3.13Å; H520-V524 WeakPolarHBondContact O-CG2 3.32Å; H520-V524 PolarHBondContact O-N 3.5Å
521	L	94.9	Very high	91.4	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-65.9	-31.9	175.7	-69	175.3	0	0	0	113	I498 L501 L517 A518 K525 L531 L539	I498-L521 HydrophobicContact CG1-CB 4.23Å; I498-L521 HydrophobicContact CG2-CB 3.89Å; I498-L521 HydrophobicContact CG2-CD1 4.33Å; L501-L521 HydrophobicContact CB-CD1 3.74Å; L501-L521 HydrophobicContact CD1-CD1 4.21Å; L517-L521 HydrophobicContact CD1-CD1 4.27Å; L517-L521 HydrophobicContact CD1-CG 4.19Å; L517-L521 HydrophobicContact CG-CD1 4.27Å; L517-L521 WeakPolarHBondContact O-CG 3.28Å; L517-L521 PolarHBondContact O-N 2.99Å; A518-L521 PolarHBondContact O-N 3.16Å; L521-K525 PolarHBondContact O-N 3.33Å; L521-K525 VanDerWaalsContact O-N 3.1Å; L521-L531 HydrophobicContact CB-CD2 4.11Å; L521-L531 HydrophobicContact CD2-CD2 4.22Å; L521-L539 HydrophobicContact CD2-CD1 4.25Å
522	I	94.7	Very high	90.9	Very high	12 Å²	12	34.6 Å²	34.6	6%	0.062	18%	0.184	C	C	.	.	H	α-helix	trans	-63.1	-47.4	170	-73.2	168.8	0	0	0	110.1	M485 L490 L495 I498 A518 N519 H520 K525 L526	M485-I522 HydrophobicContact CB-CD1 4.12Å; M485-I522 HydrophobicContact CE-CD1 4.32Å; M485-I522 HydrophobicContact CG-CD1 3.96Å; L490-I522 HydrophobicContact CD1-CB 4.43Å; L490-I522 HydrophobicContact CD1-CG1 4.31Å; L490-I522 HydrophobicContact CD1-CG2 4.06Å; L495-I522 HydrophobicContact CD2-CD1 4.39Å; L495-I522 HydrophobicContact CD2-CG1 4.38Å; I498-I522 HydrophobicContact CD1-CG1 3.75Å; I498-I522 HydrophobicContact CG2-CG1 4.34Å; A518-I522 VanDerWaalsContact O-CG1 3.31Å; A518-I522 WeakPolarHBondContact O-CG1 3.4Å; A518-I522 PolarHBondContact O-N 2.63Å; N519-I522 WeakPolarHBondContact O-CB 3.43Å; N519-I522 PolarHBondContact O-N 3.22Å; H520-I522 VanDerWaalsContact C-N 3.31Å; H520-I522 PolarHBondContact O-N 3.29Å; I522-K525 PolarHBondContact O-N 2.83Å; I522-L526 HydrophobicContact CG2-CD1 3.75Å; I522-L526 HydrophobicContact CG2-CG 4.27Å; I522-L526 WeakPolarHBondContact O-CG 3.46Å; I522-L526 PolarHBondContact O-N 2.87Å
523	K	92.2	Very high	90.3	Very high	66 Å²	66	36.4 Å²	36.4	29%	0.287	21%	0.205	S	C	.	.	H	α-helix	trans	-57.1	-51.1	176.7	-178.9	-171.6	179	-169.3	0	110.9	D458 N519 H520 K525 L526 E527	D458-K523 IonicContact OD2-NZ 3.92Å; D458-K523 PolarHBondContact OD2-NZ 2.92Å; N519-K523 PolarHBondContact O-N 2.87Å; H520-K523 WeakPolarHBondContact O-CB 3.01Å; H520-K523 PolarHBondContact O-N 3.49Å; H520-K523 VanDerWaalsContact O-N 3.13Å; K523-K525 VanDerWaalsContact C-N 3.25Å; K523-K525 PolarHBondContact O-N 2.93Å; K523-L526 PolarHBondContact O-N 2.85Å; K523-E527 WeakPolarHBondContact CE-OE1 3.21Å; K523-E527 WeakPolarHBondContact CG-OE1 3.38Å; K523-E527 WeakPolarHBondContact O-CG 3.08Å; K523-E527 PolarHBondContact O-N 3.03Å
524	V	87.9	Confident	89.8	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-51	-44.6	175	164.9	0	0	0	0	111.7	H520 E527 H529	H520-V524 WeakPolarHBondContact O-CG2 3.32Å; H520-V524 PolarHBondContact O-N 3.5Å; V524-E527 PolarHBondContact O-N 2.94Å; V524-H529 HydrophobicContact CG1-CB 3.85Å; V524-H529 WeakPolarHBondContact O-CB 3.33Å; V524-H529 PolarHBondContact O-N 3.29Å
525	K	88.5	Confident	89.4	Confident	40 Å²	40	43.1 Å²	43.1	17%	0.174	24%	0.242	C	C	.	.	H	α-helix	trans	-74.8	-32.5	-179.6	-168	53.3	173.8	179.2	0	113.3	L490 V494 L521 I522 K523 E527 G528 H529 E530 L531	L490-K525 HydrophobicContact CD1-CB 4.14Å; L490-K525 HydrophobicContact CD1-CG 4.23Å; L490-K525 HydrophobicContact CD2-CG 4.07Å; V494-K525 HydrophobicContact CG1-CG 3.75Å; L521-K525 PolarHBondContact O-N 3.33Å; L521-K525 VanDerWaalsContact O-N 3.1Å; I522-K525 PolarHBondContact O-N 2.83Å; K523-K525 VanDerWaalsContact C-N 3.25Å; K523-K525 PolarHBondContact O-N 2.93Å; K525-E527 VanDerWaalsContact C-N 3.32Å; K525-G528 PolarHBondContact O-N 2.97Å; K525-H529 WeakPolarHBondContact CD-O 3.32Å; K525-H529 PolarHBondContact NZ-O 3.2Å; K525-E530 IonicContact NZ-OE1 2.79Å; K525-E530 PolarHBondContact NZ-OE1 3.05Å; K525-E530 IonicContact NZ-OE2 2.91Å; K525-E530 PolarHBondContact NZ-OE2 3.17Å; K525-L531 HydrophobicContact CB-CD2 4.33Å; K525-L531 HydrophobicContact CB-CG 4.44Å; K525-L531 HydrophobicContact CD-CG 4.33Å
526	L	85.6	Confident	89	Confident	104 Å²	104	44.4 Å²	44.4	55%	0.545	25%	0.25	S	S	.	.	H	α-helix	trans	-70.2	-29.5	174.7	-72.6	172.9	0	0	0	112.2	L490 I522 K523 G528	L490-L526 HydrophobicContact CD2-CD2 3.88Å; L490-L526 HydrophobicContact CD2-CG 4.46Å; L490-L526 HydrophobicContact CG-CD2 4.15Å; I522-L526 HydrophobicContact CG2-CD1 3.75Å; I522-L526 HydrophobicContact CG2-CG 4.27Å; I522-L526 WeakPolarHBondContact O-CG 3.46Å; I522-L526 PolarHBondContact O-N 2.87Å; K523-L526 PolarHBondContact O-N 2.85Å; L526-G528 PolarHBondContact O-N 3.43Å
527	E	83.7	Confident	88.6	Confident	103 Å²	103	49.6 Å²	49.6	48%	0.481	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-3.3	173.5	-71.2	169.8	175.5	0	0	113.1	K523 V524 K525	K523-E527 WeakPolarHBondContact CE-OE1 3.21Å; K523-E527 WeakPolarHBondContact CG-OE1 3.38Å; K523-E527 WeakPolarHBondContact O-CG 3.08Å; K523-E527 PolarHBondContact O-N 3.03Å; V524-E527 PolarHBondContact O-N 2.94Å; K525-E527 VanDerWaalsContact C-N 3.32Å
528	G	76.7	Confident	88.1	Confident	60 Å²	60	50.9 Å²	50.9	62%	0.619	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	96	4.2	173.4	0	0	0	0	0	114.8	K525 L526	K525-G528 PolarHBondContact O-N 2.97Å; L526-G528 PolarHBondContact O-N 3.43Å
529	H	82.6	Confident	88	Confident	59 Å²	59	50.9 Å²	50.9	27%	0.273	29%	0.29	S	S	.	.	P	Polyproline II helix	trans	-82.2	156	178.4	-61.7	-76.5	0	0	0	112.4	E442 V524 K525	E442-H529 IonicContact OE2-CE1 3.65Å; V524-H529 HydrophobicContact CG1-CB 3.85Å; V524-H529 WeakPolarHBondContact O-CB 3.33Å; V524-H529 PolarHBondContact O-N 3.29Å; K525-H529 WeakPolarHBondContact CD-O 3.32Å; K525-H529 PolarHBondContact NZ-O 3.2Å
530	E	83.6	Confident	87.8	Confident	143 Å²	143	51 Å²	51	67%	0.668	29%	0.291	S	S	*	.	P	Polyproline II helix	trans	-81.3	145	173.5	-77.1	-58.1	150.7	0	0	112.3	K525	K525-E530 IonicContact NZ-OE1 2.79Å; K525-E530 PolarHBondContact NZ-OE1 3.05Å; K525-E530 IonicContact NZ-OE2 2.91Å; K525-E530 PolarHBondContact NZ-OE2 3.17Å
531	L	85.5	Confident	87.8	Confident	11 Å²	11	50.9 Å²	50.9	6%	0.058	29%	0.291	C	S	.	.	P	Polyproline II helix	trans	-77.9	141.8	175.9	-67.9	170.3	0	0	0	109.9	V494 K497 I498 L521 K525	V494-L531 HydrophobicContact CG1-CD1 3.85Å; K497-L531 HydrophobicContact CB-CD1 4.39Å; K497-L531 HydrophobicContact CD-CB 4.08Å; K497-L531 HydrophobicContact CD-CD1 4.15Å; K497-L531 HydrophobicContact CG-CD1 4.31Å; K497-L531 PolarHBondContact NZ-O 3.45Å; I498-L531 HydrophobicContact CD1-CD1 4.03Å; I498-L531 HydrophobicContact CD1-CD2 4.49Å; I498-L531 HydrophobicContact CG1-CD1 3.49Å; I498-L531 VanDerWaalsContact CG1-CD1 3.49Å; I498-L531 HydrophobicContact CG1-CD2 4.01Å; I498-L531 HydrophobicContact CG1-CG 4.41Å; L521-L531 HydrophobicContact CB-CD2 4.11Å; L521-L531 HydrophobicContact CD2-CD2 4.22Å; K525-L531 HydrophobicContact CB-CD2 4.33Å; K525-L531 HydrophobicContact CB-CG 4.44Å; K525-L531 HydrophobicContact CD-CG 4.33Å
532	P	85.4	Confident	87.7	Confident	24 Å²	24	53.5 Å²	53.5	16%	0.156	31%	0.308	C	S	.	.	P	Polyproline II helix	trans	-68	159.1	-178.1	34.1	-36.3	0	0	0	110.1	A444 K497 L501 D534 P536	A444-P532 HydrophobicContact CB-CB 4.07Å; A444-P532 VanDerWaalsContact CB-CD 3.46Å; A444-P532 HydrophobicContact CB-CG 3.64Å; K497-P532 WeakPolarHBondContact CE-O 3.46Å; K497-P532 PolarHBondContact NZ-O 2.86Å; K497-P532 VanDerWaalsContact NZ-O 3.12Å; L501-P532 HydrophobicContact CD1-CG 4.1Å; P532-D534 WeakPolarHBondContact CB-O 3.46Å; P532-P536 HydrophobicContact CB-CG 4.29Å; P532-P536 HydrophobicContact CG-CG 4.44Å
533	A	82.9	Confident	87.5	Confident	86 Å²	86	56.7 Å²	56.7	71%	0.711	33%	0.332	S	S	*	.	S	Bend	trans	-71.2	-41.2	176.1	0	0	0	0	0	111.2
534	D	86.4	Confident	87.4	Confident	133 Å²	133	56 Å²	56	71%	0.711	33%	0.328	S	S	*	.	S	Bend	trans	-129.4	153.6	176.7	-62.4	-67.1	0	0	0	109.3	P532 P536	P532-D534 WeakPolarHBondContact CB-O 3.46Å; D534-P536 VanDerWaalsContact O-CD 3.23Å; D534-P536 WeakPolarHBondContact O-CD 3.41Å
535	L	89.3	Confident	87.4	Confident	38 Å²	38	60.4 Å²	60.4	20%	0.199	35%	0.345	C	S	.	.			trans	-69.1	119	-178.2	-172.5	69.4	0	0	0	110.4	L501 V504 L517 L539 V540	L501-L535 HydrophobicContact CD2-CB 4.22Å; V504-L535 HydrophobicContact CG2-CD2 3.72Å; L517-L535 HydrophobicContact CD1-CD1 4.12Å; L517-L535 HydrophobicContact CD2-CD1 3.93Å; L517-L535 HydrophobicContact CD2-CD2 3.66Å; L517-L535 HydrophobicContact CD2-CG 4.47Å; L535-L539 HydrophobicContact CD1-CB 3.82Å; L535-L539 HydrophobicContact CD1-CD1 4.34Å; L535-L539 HydrophobicContact CG-CB 4.31Å; L535-V540 HydrophobicContact CD2-CG2 3.98Å; L535-V540 HydrophobicContact CG-CG2 4.37Å
536	P	88.4	Confident	86.7	Confident	27 Å²	27	70 Å²	70	18%	0.175	38%	0.38	C	S	.	.			trans	-63.5	147.9	177.8	-24	36.2	0	0	0	112.5	P532 D534 H538 L539 V540	P532-P536 HydrophobicContact CB-CG 4.29Å; P532-P536 HydrophobicContact CG-CG 4.44Å; D534-P536 VanDerWaalsContact O-CD 3.23Å; D534-P536 WeakPolarHBondContact O-CD 3.41Å; P536-H538 VanDerWaalsContact C-N 3.29Å; P536-H538 VanDerWaalsContact CB-CE1 3.44Å; P536-H538 WeakPolarHBondContact CB-CE1 3.39Å; P536-H538 PolarHBondContact O-N 3.39Å; P536-L539 HydrophobicContact CG-CD1 4.44Å; P536-L539 PolarHBondContact O-N 3.06Å; P536-V540 PolarHBondContact O-N 3.31Å
537	P	87.9	Confident	85.2	Confident	110 Å²	110	73.9 Å²	73.9	71%	0.714	40%	0.395	S	S	*	.	G	3₁₀ helix	trans	-56.1	-37.9	-176.3	-27.4	34.7	0	0	0	114.7	L539 V540	P537-L539 VanDerWaalsContact C-N 3.28Å; P537-L539 PolarHBondContact O-N 3.28Å; P537-V540 WeakPolarHBondContact O-CB 3.38Å; P537-V540 PolarHBondContact O-N 2.94Å
538	H	86.9	Confident	83	Confident	27 Å²	27	81.7 Å²	81.7	13%	0.125	43%	0.432	C	S	.	.	G	3₁₀ helix	trans	-68.3	-26.3	-179.9	68.1	-85.1	0	0	0	112.6	A444 E446 P536 R545	A444-H538 PolarHBondContact O-CE1 3.39Å; A444-H538 VanDerWaalsContact O-CE1 3.32Å; A444-H538 PolarHBondContact O-NE2 3.1Å; E446-H538 PolarHBondContact O-CD2 3.38Å; E446-H538 VanDerWaalsContact O-CD2 3.28Å; E446-H538 PolarHBondContact O-NE2 2.62Å; P536-H538 VanDerWaalsContact C-N 3.29Å; P536-H538 VanDerWaalsContact CB-CE1 3.44Å; P536-H538 WeakPolarHBondContact CB-CE1 3.39Å; P536-H538 PolarHBondContact O-N 3.39Å; H538-R545 PolarHBondContact O-NH2 3.38Å
539	L	92.9	Very high	83.3	Confident	0 Å²	0	82.8 Å²	82.8	0%	0	42%	0.422	C	S	.	.	G	3₁₀ helix	trans	-84.3	-12.5	175.5	-67.5	-170.7	0	0	0	113.5	A444 W453 V454 V455 L517 L521 L535 P536 P537	A444-L539 HydrophobicContact CB-CD1 4.05Å; A444-L539 WeakPolarHBondContact O-CD1 3.28Å; W453-L539 PolarHBondContact NE1-O 3.05Å; V454-L539 HydrophobicContact CG1-CD2 3.42Å; V454-L539 VanDerWaalsContact CG1-CD2 3.42Å; V455-L539 HydrophobicContact CG2-CD2 4.5Å; L517-L539 HydrophobicContact CD1-CB 4.22Å; L521-L539 HydrophobicContact CD2-CD1 4.25Å; L535-L539 HydrophobicContact CD1-CB 3.82Å; L535-L539 HydrophobicContact CD1-CD1 4.34Å; L535-L539 HydrophobicContact CG-CB 4.31Å; P536-L539 HydrophobicContact CG-CD1 4.44Å; P536-L539 PolarHBondContact O-N 3.06Å; P537-L539 VanDerWaalsContact C-N 3.28Å; P537-L539 PolarHBondContact O-N 3.28Å
540	V	93.7	Very high	83.4	Confident	25 Å²	25	84 Å²	84	15%	0.152	43%	0.43	C	S	.	.	S	Bend	trans	-62.5	126.6	176.7	-178.5	0	0	0	0	109.1	V504 L535 P536 P537 K544 R545	V504-V540 HydrophobicContact CG1-CG1 4.48Å; L535-V540 HydrophobicContact CD2-CG2 3.98Å; L535-V540 HydrophobicContact CG-CG2 4.37Å; P536-V540 PolarHBondContact O-N 3.31Å; P537-V540 WeakPolarHBondContact O-CB 3.38Å; P537-V540 PolarHBondContact O-N 2.94Å; V540-K544 HydrophobicContact CG1-CB 4.17Å; V540-R545 HydrophobicContact CB-CG 4.1Å; V540-R545 HydrophobicContact CG1-CG 3.9Å; V540-R545 PolarHBondContact O-NE 3.41Å; V540-R545 PolarHBondContact O-NH2 3.22Å
541	P	94.5	Very high	83.3	Confident	0 Å²	0	80.7 Å²	80.7	0%	0	42%	0.417	C	S	.	.			trans	-49.8	135.9	175.9	-31.6	38.3	0	0	0	112	W453 V504 E513 L517 S543 K544 R545	W453-P541 HydrophobicContact CH2-CB 4.37Å; W453-P541 HydrophobicContact CH2-CG 4.36Å; W453-P541 HydrophobicContact CZ2-CB 4.21Å; W453-P541 HydrophobicContact CZ2-CG 3.98Å; V504-P541 HydrophobicContact CG2-CG 4.44Å; E513-P541 HydrophobicContact CB-CB 3.74Å; E513-P541 HydrophobicContact CB-CG 4.18Å; E513-P541 VanDerWaalsContact OE2-CB 3.32Å; E513-P541 WeakPolarHBondContact OE2-CB 3.44Å; L517-P541 HydrophobicContact CD2-CG 4.26Å; P541-S543 PolarHBondContact O-N 3.41Å; P541-S543 VanDerWaalsContact O-N 3.14Å; P541-K544 HydrophobicContact CB-CB 4.24Å; P541-K544 HydrophobicContact CB-CG 4.06Å; P541-K544 HydrophobicContact CG-CG 4.44Å; P541-K544 CarbonylContact O-C 3.55Å; P541-K544 WeakPolarHBondContact O-CA 3.24Å; P541-K544 PolarHBondContact O-N 2.67Å; P541-R545 PolarHBondContact O-N 3.13Å
542	P	91.4	Very high	83.2	Confident	55 Å²	55	84.8 Å²	84.8	36%	0.357	44%	0.438	S	S	.	.	G	3₁₀ helix	trans	-51	-40.1	-177.1	-29.6	36	0	0	0	113.6	W453 K544 R545	W453-P542 HydrophobicContact CB-CG 3.87Å; W453-P542 HydrophobicContact CD2-CG 4.17Å; W453-P542 HydrophobicContact CE3-CG 4.17Å; W453-P542 HydrophobicContact CG-CG 4.09Å; P542-K544 VanDerWaalsContact C-N 3.25Å; P542-K544 PolarHBondContact O-N 3.46Å; P542-R545 PolarHBondContact O-N 3.3Å
543	S	90.8	Very high	83.1	Confident	80 Å²	80	88.6 Å²	88.6	56%	0.559	46%	0.456	S	S	*	.	G	3₁₀ helix	trans	-68.9	-20.9	179	73.6	0	0	0	0	114.2	E513 P541	E513-S543 WeakPolarHBondContact OE2-CB 3.24Å; E513-S543 PolarHBondContact OE2-N 3.07Å; E513-S543 PolarHBondContact OE2-OG 3.32Å; P541-S543 PolarHBondContact O-N 3.41Å; P541-S543 VanDerWaalsContact O-N 3.14Å
544	K	89.9	Confident	83.1	Confident	50 Å²	50	88.8 Å²	88.8	22%	0.217	44%	0.439	C	S	.	.	G	3₁₀ helix	trans	-103.1	0	-177.1	-55.2	-63.4	175.8	89.2	0	112.9	V504 D505 D511 E514 V540 P541 P542	V504-K544 HydrophobicContact CG1-CB 3.98Å; V504-K544 HydrophobicContact CG1-CG 4.47Å; D505-K544 IonicContact OD2-NZ 2.74Å; D505-K544 PolarHBondContact OD2-NZ 2.81Å; D511-K544 WeakPolarHBondContact OD2-CE 3.37Å; D511-K544 IonicContact OD2-NZ 3.31Å; D511-K544 PolarHBondContact OD2-NZ 3.09Å; E514-K544 IonicContact OE1-NZ 2.63Å; E514-K544 PolarHBondContact OE1-NZ 2.9Å; E514-K544 IonicContact OE2-NZ 3.37Å; V540-K544 HydrophobicContact CG1-CB 4.17Å; P541-K544 HydrophobicContact CB-CB 4.24Å; P541-K544 HydrophobicContact CB-CG 4.06Å; P541-K544 HydrophobicContact CG-CG 4.44Å; P541-K544 CarbonylContact O-C 3.55Å; P541-K544 WeakPolarHBondContact O-CA 3.24Å; P541-K544 PolarHBondContact O-N 2.67Å; P542-K544 VanDerWaalsContact C-N 3.25Å; P542-K544 PolarHBondContact O-N 3.46Å
545	R	88.9	Confident	82.9	Confident	93 Å²	93	85.6 Å²	85.6	35%	0.351	42%	0.419	S	S	.	.	S	Bend	trans	-68.6	132.2	175	-69.2	175.5	-171.8	-179.2	-3.7	109.3	H538 V540 P541 P542 H547	H538-R545 PolarHBondContact O-NH2 3.38Å; V540-R545 HydrophobicContact CB-CG 4.1Å; V540-R545 HydrophobicContact CG1-CG 3.9Å; V540-R545 PolarHBondContact O-NE 3.41Å; V540-R545 PolarHBondContact O-NH2 3.22Å; P541-R545 PolarHBondContact O-N 3.13Å; P542-R545 PolarHBondContact O-N 3.3Å; R545-H547 PolarHBondContact O-N 3.39Å
546	R	73.2	Confident	82.4	Confident	241 Å²	241	89.3 Å²	89.3	91%	0.909	44%	0.436	S	S	*	.			trans	-67	120.2	171.2	-68.1	-177	-178	-179.9	0.4	107.6	E548	R546-E548 PolarHBondContact O-N 3.27Å
547	H	54.1	Low	81.9	Confident	187 Å²	187	94.5 Å²	94.5	87%	0.866	46%	0.458	S	S	*	.			trans	-68	113.6	165.1	-73.5	-74.5	0	0	0	107.7	R545	R545-H547 PolarHBondContact O-N 3.39Å
548	E	37.9	Very low	81.3	Confident	266 Å²	266	93.1 Å²	93.1	100%	1.243	44%	0.435	S	S	*	.			trans	-77.4	0	160.5	-78.8	-171.7	159.3	0	0	110.8	R546	R546-E548 PolarHBondContact O-N 3.27Å

Retrieved 548 of 548 residues in 554.7 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).