A0A077Z5J0_TRITR Loading...

NAD dependent deacetylase sirtuin 1

AlphaFold DB , UniProt , Accession A0A077Z5J0, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 457 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	30.5	Very low	31.9	Very low	206 Å²	206	163.8 Å²	163.8	100%	1.015	81%	0.808	S	S	*	*				0	-31.2	0	-76.5	-174.4	60.1	0	0	116.2	E4	M1-E4 PolarHBondContact N-OE2 3.17Å
2	S	35.3	Very low	31.8	Very low	124 Å²	124	160 Å²	160	87%	0.867	81%	0.81	S	S	*	*			trans	-115.6	17.8	173.3	62.3	0	0	0	0	115.1
3	R	30.4	Very low	31.5	Very low	227 Å²	227	160.9 Å²	160.9	86%	0.857	82%	0.818	S	S	*	*	S	Bend	trans	-135.2	-6.9	175.7	-84.2	-174.4	174.1	175.7	-2.8	116.1
4	E	33.4	Very low	31.7	Very low	140 Å²	140	155.9 Å²	155.9	65%	0.654	81%	0.813	S	S	*	*	S	Bend	trans	-107.1	0.8	-176.1	-73	139.3	153.2	0	0	114.2	M1	M1-E4 PolarHBondContact N-OE2 3.17Å
5	V	33.1	Very low	31.9	Very low	113 Å²	113	158.4 Å²	158.4	69%	0.685	82%	0.819	S	S	*	*	S	Bend	trans	-95.6	-2.4	-178.3	-179.1	0	0	0	0	112.5
6	Q	31.4	Very low	31.9	Very low	178 Å²	178	158.4 Å²	158.4	83%	0.832	82%	0.821	S	S	*	*	S	Bend	trans	-99.8	-2.9	-179.3	-81.6	-173.8	-23.6	0	0	115.1
7	E	32.9	Very low	31.9	Very low	167 Å²	167	156.1 Å²	156.1	78%	0.78	82%	0.821	S	S	*	*	S	Bend	trans	-106	-2.5	-177.7	-76.7	-178.3	159.7	0	0	114.6
8	I	31.1	Very low	31.9	Very low	146 Å²	146	151.6 Å²	151.6	75%	0.749	82%	0.819	S	S	*	*	S	Bend	trans	-96.2	-0.2	-175.2	-64.1	174.8	0	0	0	113.4
9	I	31	Very low	31.8	Very low	153 Å²	153	151.4 Å²	151.4	79%	0.785	82%	0.817	S	S	*	*	S	Bend	trans	-109.2	12.5	-175.2	-62.6	174.3	0	0	0	112.9
10	M	31.7	Very low	31.7	Very low	165 Å²	165	149.9 Å²	149.9	81%	0.813	81%	0.814	S	S	*	*	S	Bend	trans	-120.4	8.9	-173.3	-75.2	-170	59.5	0	0	117.2
11	E	30.5	Very low	31.5	Very low	183 Å²	183	146.1 Å²	146.1	86%	0.855	81%	0.81	S	S	*	*			trans	-137.5	92.7	178.6	-69.5	-176.9	165.9	0	0	111.5
12	S	30.1	Very low	31.4	Very low	118 Å²	118	142.9 Å²	142.9	83%	0.825	80%	0.802	S	S	*	*			trans	-176.5	55	155	39.4	0	0	0	0	112.2
13	D	28.3	Very low	31.1	Very low	172 Å²	172	145.4 Å²	145.4	92%	0.92	81%	0.805	S	S	*	*			trans	-121.8	81.1	162	-86	-31.2	0	0	0	108.2
14	A	33.7	Very low	31	Very low	90 Å²	90	139.9 Å²	139.9	74%	0.744	80%	0.801	S	S	*	*			trans	-169.5	117.3	160.6	0	0	0	0	0	112.6
15	E	35.5	Very low	30.8	Very low	194 Å²	194	138.7 Å²	138.7	91%	0.907	81%	0.808	S	S	*	*			trans	82	91.9	139.7	-61	-175.1	173.6	0	0	121.1
16	N	31	Very low	30.7	Very low	158 Å²	158	142.3 Å²	142.3	85%	0.845	82%	0.817	S	S	*	*			trans	-5.1	141.9	135.3	-114.2	-14.8	0	0	0	120.8
17	S	31.8	Very low	30.7	Very low	119 Å²	119	141.6 Å²	141.6	83%	0.832	82%	0.819	S	S	*	*			trans	85.6	125.7	142.7	75.3	0	0	0	0	119.6
18	G	32.2	Very low	30.7	Very low	75 Å²	75	140.2 Å²	140.2	77%	0.773	81%	0.812	S	S	*	*			trans	136	78.7	154.8	0	0	0	0	0	116.8
19	D	30.1	Very low	31	Very low	148 Å²	148	136.4 Å²	136.4	79%	0.791	80%	0.795	S	S	*	*			trans	57	130.5	133	-130.3	9.3	0	0	0	124
20	T	30.5	Very low	31.2	Very low	122 Å²	122	134.3 Å²	134.3	75%	0.748	79%	0.792	S	S	*	*			trans	58.9	108.9	149.3	58.3	0	0	0	0	121.7
21	G	27.1	Very low	31.3	Very low	71 Å²	71	133.8 Å²	133.8	73%	0.732	79%	0.788	S	S	*	*				101.8	137.4	111.9	0	0	0	0	0	118.6
22	T	29	Very low	31.4	Very low	137 Å²	137	129.9 Å²	129.9	84%	0.84	77%	0.769	S	S	*	*			trans	83.8	94.8	157.7	20.4	0	0	0	0	119.8
23	L	28.1	Very low	31.5	Very low	178 Å²	178	126.3 Å²	126.3	93%	0.932	75%	0.747	S	S	*	*			trans	19.1	107.6	132.7	-76.5	148.6	0	0	0	117.8
24	S	28.7	Very low	31.8	Very low	111 Å²	111	125 Å²	125	78%	0.776	74%	0.735	S	S	*	*			trans	-146.2	129.4	146.2	50.5	0	0	0	0	110.2	E26	S24-E26 PolarHBondContact O-N 3.36Å
25	S	28.3	Very low	31.9	Very low	115 Å²	115	125.6 Å²	125.6	80%	0.804	72%	0.723	S	S	*	*			trans	-62.6	115.1	178.8	51.1	0	0	0	0	111.8
26	E	32.5	Very low	31.8	Very low	188 Å²	188	118.7 Å²	118.7	88%	0.879	70%	0.696	S	S	*	*	P	Polyproline II helix	trans	-81.3	116.8	170.7	-76.3	176.4	157.6	0	0	109.8	S24 Q28	S24-E26 PolarHBondContact O-N 3.36Å; E26-Q28 PolarHBondContact O-N 3.06Å
27	L	31	Very low	32.5	Very low	164 Å²	164	113.8 Å²	113.8	86%	0.859	67%	0.674	S	S	*	*	P	Polyproline II helix	trans	-64.7	117.2	167.1	-109.4	78.3	0	0	0	108.1	T29	L27-T29 PolarHBondContact O-N 3.46Å
28	Q	33.1	Very low	33	Very low	137 Å²	137	112.3 Å²	112.3	64%	0.64	65%	0.653	S	S	*	*	P	Polyproline II helix	trans	-58.2	134.9	167	-83.2	175.1	-34	0	0	110.1	E26	E26-Q28 PolarHBondContact O-N 3.06Å
29	T	36.8	Very low	33.7	Very low	66 Å²	66	113.4 Å²	113.4	41%	0.405	64%	0.64	S	S	.	*	P	Polyproline II helix	trans	-69.5	154.9	173.7	60.3	0	0	0	0	110.5	L27 E31 E32 A33	L27-T29 PolarHBondContact O-N 3.46Å; T29-E31 PolarHBondContact O-N 3.01Å; T29-E32 PolarHBondContact N-OE2 2.73Å; T29-E32 PolarHBondContact O-N 3.21Å; T29-E32 VanDerWaalsContact O-N 3.13Å; T29-E32 VanDerWaalsContact OG1-CD 3.24Å; T29-E32 VanDerWaalsContact OG1-CG 3.25Å; T29-E32 WeakPolarHBondContact OG1-CG 3.16Å; T29-E32 PolarHBondContact OG1-N 3.4Å; T29-E32 PolarHBondContact OG1-OE2 2.91Å; T29-A33 PolarHBondContact O-N 3.43Å
30	P	34.7	Very low	34.6	Very low	109 Å²	109	112.6 Å²	112.6	71%	0.708	63%	0.632	S	S	*	*	H	α-helix	trans	-56.4	-31.4	177.4	-24.6	33.8	0	0	0	113.6	E34	P30-E34 PolarHBondContact O-N 2.99Å
31	E	33.9	Very low	35.6	Very low	155 Å²	155	112 Å²	112	72%	0.724	62%	0.624	S	S	*	*	H	α-helix	trans	-71.3	-39.8	176.7	-76.4	175.7	150.1	0	0	112.2	T29 A33 E34 E35	T29-E31 PolarHBondContact O-N 3.01Å; E31-A33 VanDerWaalsContact C-N 3.32Å; E31-A33 PolarHBondContact O-N 2.85Å; E31-E34 PolarHBondContact O-N 3.4Å; E31-E35 PolarHBondContact O-N 3.36Å
32	E	33.4	Very low	36.5	Very low	100 Å²	100	112.1 Å²	112.1	47%	0.467	60%	0.604	S	S	.	*	H	α-helix	trans	-68.4	-32	174.6	-72	165.8	150.3	0	0	112.3	T29 S36	T29-E32 PolarHBondContact N-OE2 2.73Å; T29-E32 PolarHBondContact O-N 3.21Å; T29-E32 VanDerWaalsContact O-N 3.13Å; T29-E32 VanDerWaalsContact OG1-CD 3.24Å; T29-E32 VanDerWaalsContact OG1-CG 3.25Å; T29-E32 WeakPolarHBondContact OG1-CG 3.16Å; T29-E32 PolarHBondContact OG1-N 3.4Å; T29-E32 PolarHBondContact OG1-OE2 2.91Å; E32-S36 WeakPolarHBondContact O-CB 3.17Å; E32-S36 PolarHBondContact O-N 2.79Å
33	A	32.4	Very low	37.6	Very low	43 Å²	43	109.8 Å²	109.8	36%	0.355	59%	0.587	S	S	.	*	H	α-helix	trans	-71.3	-34	173.6	0	0	0	0	0	112.5	T29 E31 S36 S37	T29-A33 PolarHBondContact O-N 3.43Å; E31-A33 VanDerWaalsContact C-N 3.32Å; E31-A33 PolarHBondContact O-N 2.85Å; A33-S36 PolarHBondContact O-OG 2.89Å; A33-S37 VanDerWaalsContact O-CB 3.22Å; A33-S37 WeakPolarHBondContact O-CB 3.05Å; A33-S37 PolarHBondContact O-N 3.13Å; A33-S37 VanDerWaalsContact O-N 3.12Å
34	E	35	Very low	38.9	Very low	144 Å²	144	105.9 Å²	105.9	67%	0.673	57%	0.567	S	S	*	*	H	α-helix	trans	-71.9	-39	173.4	-80.2	-173.4	170.7	0	0	112.2	P30 E31 F38	P30-E34 PolarHBondContact O-N 2.99Å; E31-E34 PolarHBondContact O-N 3.4Å; E34-F38 WeakPolarHBondContact O-CB 3.04Å; E34-F38 PolarHBondContact O-N 2.68Å
35	E	34	Very low	39.9	Very low	103 Å²	103	106 Å²	106	48%	0.481	55%	0.553	S	S	.	*	H	α-helix	trans	-67	-38.6	173.8	-86.3	-162.3	140.6	0	0	112.8	E31 F38 L39 R71	E31-E35 PolarHBondContact O-N 3.36Å; E35-F38 PolarHBondContact O-N 2.66Å; E35-L39 PolarHBondContact O-N 3.49Å; E35-R71 IonicContact OE1-CZ 2.7Å; E35-R71 IonicContact OE1-NH2 2.92Å; E35-R71 PolarHBondContact OE1-NH2 2.87Å
36	S	34.9	Very low	40.9	Very low	49 Å²	49	102.2 Å²	102.2	34%	0.343	52%	0.523	S	S	.	.	H	α-helix	trans	-68.5	-41.9	177.3	93.5	0	0	0	0	112	E32 A33 F38 L39 E40	E32-S36 WeakPolarHBondContact O-CB 3.17Å; E32-S36 PolarHBondContact O-N 2.79Å; A33-S36 PolarHBondContact O-OG 2.89Å; S36-F38 VanDerWaalsContact C-N 3.32Å; S36-F38 PolarHBondContact O-N 2.78Å; S36-L39 PolarHBondContact O-N 3.37Å; S36-E40 WeakPolarHBondContact O-CG 3.08Å; S36-E40 PolarHBondContact O-N 2.93Å
37	S	45.4	Very low	41.9	Very low	56 Å²	56	95.5 Å²	95.5	39%	0.392	50%	0.5	S	S	.	.	H	α-helix	trans	-57.6	-43	172.6	162.4	0	0	0	0	112.1	A33 E40 L41	A33-S37 VanDerWaalsContact O-CB 3.22Å; A33-S37 WeakPolarHBondContact O-CB 3.05Å; A33-S37 PolarHBondContact O-N 3.13Å; A33-S37 VanDerWaalsContact O-N 3.12Å; S37-E40 PolarHBondContact O-N 3.37Å; S37-L41 WeakPolarHBondContact O-CB 3.46Å; S37-L41 VanDerWaalsContact O-CG 3.29Å; S37-L41 WeakPolarHBondContact O-CG 3.45Å; S37-L41 PolarHBondContact O-N 3.38Å
38	F	42.4	Very low	42.9	Very low	88 Å²	88	93.6 Å²	93.6	39%	0.386	49%	0.491	S	S	.	.	H	α-helix	trans	-66.3	-44.5	177.7	173.7	-97.5	0	0	0	112.4	E34 E35 S36 E40 L41 F42 W74	E34-F38 WeakPolarHBondContact O-CB 3.04Å; E34-F38 PolarHBondContact O-N 2.68Å; E35-F38 PolarHBondContact O-N 2.66Å; S36-F38 VanDerWaalsContact C-N 3.32Å; S36-F38 PolarHBondContact O-N 2.78Å; F38-E40 VanDerWaalsContact C-N 3.32Å; F38-E40 PolarHBondContact O-N 2.97Å; F38-L41 PolarHBondContact O-N 3.24Å; F38-F42 HydrophobicContact CE1-CB 4.49Å; F38-F42 HydrophobicContact CZ-CB 4.44Å; F38-F42 VanDerWaalsContact O-CB 3.31Å; F38-F42 WeakPolarHBondContact O-CB 3.39Å; F38-F42 PolarHBondContact O-N 3.08Å; F38-W74 HydrophobicContact CE1-CH2 4.39Å; F38-W74 HydrophobicContact CE1-CZ3 4.19Å; F38-W74 AromaticContact CE2-CH2 3.25Å; F38-W74 HydrophobicContact CE2-CH2 3.25Å; F38-W74 AromaticContact CE2-CZ2 3.84Å; F38-W74 HydrophobicContact CE2-CZ2 3.84Å; F38-W74 AromaticContact CE2-CZ3 3.78Å; F38-W74 HydrophobicContact CE2-CZ3 3.78Å; F38-W74 HydrophobicContact CZ-CD2 4.35Å; F38-W74 AromaticContact CZ-CE3 3.92Å; F38-W74 HydrophobicContact CZ-CE3 3.92Å; F38-W74 AromaticContact CZ-CH2 3.16Å; F38-W74 HydrophobicContact CZ-CH2 3.16Å; F38-W74 AromaticContact CZ-CZ2 3.63Å; F38-W74 HydrophobicContact CZ-CZ2 3.63Å; F38-W74 AromaticContact CZ-CZ3 3.3Å; F38-W74 HydrophobicContact CZ-CZ3 3.3Å
39	L	45.7	Very low	43.6	Very low	98 Å²	98	92.6 Å²	92.6	51%	0.513	49%	0.486	S	S	.	.	H	α-helix	trans	-63.7	-38.8	177.5	-110.6	113.4	0	0	0	111.9	E35 S36 F42 N43	E35-L39 PolarHBondContact O-N 3.49Å; S36-L39 PolarHBondContact O-N 3.37Å; L39-F42 PolarHBondContact O-N 3.41Å; L39-N43 VanDerWaalsContact O-CB 3.3Å; L39-N43 WeakPolarHBondContact O-CB 3.45Å; L39-N43 PolarHBondContact O-N 3.24Å; L39-N43 PolarHBondContact O-ND2 3.25Å
40	E	50.7	Low	43.9	Very low	130 Å²	130	91.2 Å²	91.2	61%	0.607	48%	0.475	S	S	*	.	H	α-helix	trans	-62.1	-50	173.4	-76.3	-178.9	171.9	0	0	111.2	S36 S37 F38 F42 N43 D44	S36-E40 WeakPolarHBondContact O-CG 3.08Å; S36-E40 PolarHBondContact O-N 2.93Å; S37-E40 PolarHBondContact O-N 3.37Å; F38-E40 VanDerWaalsContact C-N 3.32Å; F38-E40 PolarHBondContact O-N 2.97Å; E40-F42 VanDerWaalsContact C-N 3.31Å; E40-F42 PolarHBondContact O-N 3.25Å; E40-N43 PolarHBondContact O-N 3.03Å; E40-D44 WeakPolarHBondContact O-CB 3.21Å; E40-D44 PolarHBondContact O-N 3.45Å
41	L	50	Low	44.5	Very low	111 Å²	111	90.3 Å²	90.3	58%	0.581	47%	0.469	S	S	*	.	H	α-helix	trans	-61.2	-38.2	177.3	-73.9	169.7	0	0	0	112.8	S37 F38 F45	S37-L41 WeakPolarHBondContact O-CB 3.46Å; S37-L41 VanDerWaalsContact O-CG 3.29Å; S37-L41 WeakPolarHBondContact O-CG 3.45Å; S37-L41 PolarHBondContact O-N 3.38Å; F38-L41 PolarHBondContact O-N 3.24Å; L41-F45 WeakPolarHBondContact O-CB 3.24Å; L41-F45 PolarHBondContact O-N 3.07Å
42	F	47	Very low	44.7	Very low	72 Å²	72	86.3 Å²	86.3	32%	0.316	46%	0.463	S	S	.	.	H	α-helix	trans	-67.6	-45.3	176.5	-179.1	-101.2	0	0	0	111.4	F38 L39 E40 F45 I46 W74	F38-F42 HydrophobicContact CE1-CB 4.49Å; F38-F42 HydrophobicContact CZ-CB 4.44Å; F38-F42 VanDerWaalsContact O-CB 3.31Å; F38-F42 WeakPolarHBondContact O-CB 3.39Å; F38-F42 PolarHBondContact O-N 3.08Å; L39-F42 PolarHBondContact O-N 3.41Å; E40-F42 VanDerWaalsContact C-N 3.31Å; E40-F42 PolarHBondContact O-N 3.25Å; F42-F45 PolarHBondContact O-N 3.49Å; F42-I46 HydrophobicContact CD1-CG1 4.35Å; F42-I46 HydrophobicContact CE1-CG1 3.98Å; F42-I46 HydrophobicContact CE2-CD1 4.42Å; F42-I46 HydrophobicContact CE2-CG1 4.29Å; F42-I46 HydrophobicContact CZ-CD1 4.14Å; F42-I46 HydrophobicContact CZ-CG1 3.95Å; F42-I46 VanDerWaalsContact O-CG1 3.29Å; F42-I46 WeakPolarHBondContact O-CG1 3.47Å; F42-I46 PolarHBondContact O-N 3.3Å; F42-W74 AromaticContact CE2-CD1 3.96Å; F42-W74 AromaticContact CE2-NE1 3.75Å
43	N	52	Low	45.1	Very low	89 Å²	89	83.8 Å²	83.8	48%	0.476	45%	0.45	S	S	.	.	H	α-helix	trans	-64.5	-40.2	176.8	-73.7	-32.5	0	0	0	111.7	L39 E40 I46 A47	L39-N43 VanDerWaalsContact O-CB 3.3Å; L39-N43 WeakPolarHBondContact O-CB 3.45Å; L39-N43 PolarHBondContact O-N 3.24Å; L39-N43 PolarHBondContact O-ND2 3.25Å; E40-N43 PolarHBondContact O-N 3.03Å; N43-I46 PolarHBondContact O-N 3.47Å; N43-A47 VanDerWaalsContact O-CB 3.24Å; N43-A47 WeakPolarHBondContact O-CB 3.42Å; N43-A47 PolarHBondContact O-N 3.38Å
44	D	54.8	Low	45.6	Very low	96 Å²	96	85.4 Å²	85.4	51%	0.513	46%	0.463	S	S	.	.	H	α-helix	trans	-63.8	-42.4	174.7	-86.8	-2.6	0	0	0	111.8	E40 A47 N48	E40-D44 WeakPolarHBondContact O-CB 3.21Å; E40-D44 PolarHBondContact O-N 3.45Å; D44-A47 PolarHBondContact O-N 3.22Å; D44-N48 VanDerWaalsContact O-CB 3.3Å; D44-N48 WeakPolarHBondContact O-CB 3.43Å; D44-N48 VanDerWaalsContact O-CG 3.29Å; D44-N48 PolarHBondContact O-N 2.71Å; D44-N48 PolarHBondContact O-ND2 3.22Å
45	F	50.7	Low	45.9	Very low	114 Å²	114	83 Å²	83	50%	0.5	46%	0.463	S	S	.	.	H	α-helix	trans	-61	-47.9	174.8	175.8	-95.1	0	0	0	111.4	L41 F42 A47 N48 E49	L41-F45 WeakPolarHBondContact O-CB 3.24Å; L41-F45 PolarHBondContact O-N 3.07Å; F42-F45 PolarHBondContact O-N 3.49Å; F45-A47 VanDerWaalsContact C-N 3.35Å; F45-A47 PolarHBondContact O-N 3.09Å; F45-N48 PolarHBondContact O-N 3.42Å; F45-E49 HydrophobicContact CD2-CG 3.88Å; F45-E49 HydrophobicContact CE2-CB 4.37Å; F45-E49 HydrophobicContact CE2-CG 3.64Å; F45-E49 HydrophobicContact CZ-CB 4.33Å; F45-E49 HydrophobicContact CZ-CG 4.08Å; F45-E49 WeakPolarHBondContact O-CB 3.38Å; F45-E49 PolarHBondContact O-N 3.44Å
46	I	48.5	Very low	46.1	Very low	34 Å²	34	81.5 Å²	81.5	17%	0.174	46%	0.458	C	S	.	.	H	α-helix	trans	-63.3	-41.5	178.4	-66.8	-66.5	0	0	0	111.1	F42 N43 H50 F53	F42-I46 HydrophobicContact CD1-CG1 4.35Å; F42-I46 HydrophobicContact CE1-CG1 3.98Å; F42-I46 HydrophobicContact CE2-CD1 4.42Å; F42-I46 HydrophobicContact CE2-CG1 4.29Å; F42-I46 HydrophobicContact CZ-CD1 4.14Å; F42-I46 HydrophobicContact CZ-CG1 3.95Å; F42-I46 VanDerWaalsContact O-CG1 3.29Å; F42-I46 WeakPolarHBondContact O-CG1 3.47Å; F42-I46 PolarHBondContact O-N 3.3Å; N43-I46 PolarHBondContact O-N 3.47Å; I46-H50 CarbonylContact O-C 3.57Å; I46-H50 WeakPolarHBondContact O-CA 3.42Å; I46-H50 PolarHBondContact O-N 3.27Å; I46-H50 VanDerWaalsContact O-O 3.08Å; I46-F53 HydrophobicContact CG2-CB 3.47Å; I46-F53 VanDerWaalsContact CG2-CB 3.47Å; I46-F53 HydrophobicContact CG2-CG 4.04Å
47	A	53.1	Low	46.1	Very low	47 Å²	47	82.9 Å²	82.9	39%	0.388	47%	0.466	S	S	.	.	H	α-helix	trans	-66.5	-37.8	179	0	0	0	0	0	112.9	N43 D44 F45	N43-A47 VanDerWaalsContact O-CB 3.24Å; N43-A47 WeakPolarHBondContact O-CB 3.42Å; N43-A47 PolarHBondContact O-N 3.38Å; D44-A47 PolarHBondContact O-N 3.22Å; F45-A47 VanDerWaalsContact C-N 3.35Å; F45-A47 PolarHBondContact O-N 3.09Å
48	N	52.5	Low	45.7	Very low	124 Å²	124	86 Å²	86	66%	0.663	49%	0.488	S	S	*	.	H	α-helix	trans	-82.9	-45.6	-176.9	-73.5	-50.3	0	0	0	113.4	D44 F45	D44-N48 VanDerWaalsContact O-CB 3.3Å; D44-N48 WeakPolarHBondContact O-CB 3.43Å; D44-N48 VanDerWaalsContact O-CG 3.29Å; D44-N48 PolarHBondContact O-N 2.71Å; D44-N48 PolarHBondContact O-ND2 3.22Å; F45-N48 PolarHBondContact O-N 3.42Å
49	E	47.4	Very low	45.4	Very low	117 Å²	117	87.2 Å²	87.2	55%	0.547	50%	0.502	S	S	.	.	H	α-helix	trans	-87.7	-24.3	-174.8	-63.4	-64.7	156.2	0	0	112.2	F45	F45-E49 HydrophobicContact CD2-CG 3.88Å; F45-E49 HydrophobicContact CE2-CB 4.37Å; F45-E49 HydrophobicContact CE2-CG 3.64Å; F45-E49 HydrophobicContact CZ-CB 4.33Å; F45-E49 HydrophobicContact CZ-CG 4.08Å; F45-E49 WeakPolarHBondContact O-CB 3.38Å; F45-E49 PolarHBondContact O-N 3.44Å
50	H	43.4	Very low	44.9	Very low	37 Å²	37	86.3 Å²	86.3	17%	0.171	50%	0.5	C	S	.	.			trans	-137.6	66.9	-176	-58.2	-67.7	0	0	0	112.8	I46 A52 F53	I46-H50 CarbonylContact O-C 3.57Å; I46-H50 WeakPolarHBondContact O-CA 3.42Å; I46-H50 PolarHBondContact O-N 3.27Å; I46-H50 VanDerWaalsContact O-O 3.08Å; H50-A52 PolarHBondContact O-N 2.74Å; H50-F53 HydrophobicContact CB-CD2 3.54Å; H50-F53 HydrophobicContact CB-CE2 3.99Å; H50-F53 WeakPolarHBondContact O-CB 3.29Å; H50-F53 PolarHBondContact O-N 3.32Å
51	P	46.6	Very low	44.2	Very low	89 Å²	89	88.7 Å²	88.7	58%	0.578	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-19.3	-176.3	20.8	-32.5	0	0	0	114.5	F53 A54	P51-F53 VanDerWaalsContact C-N 3.25Å; P51-F53 PolarHBondContact O-N 3.01Å; P51-A54 WeakPolarHBondContact O-CB 3.47Å; P51-A54 PolarHBondContact O-N 2.77Å
52	A	39.8	Very low	43.7	Very low	72 Å²	72	90.4 Å²	90.4	60%	0.595	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-31	171.2	0	0	0	0	0	113	H50 S55	H50-A52 PolarHBondContact O-N 2.74Å; A52-S55 PolarHBondContact O-N 2.73Å; A52-S55 PolarHBondContact O-OG 3Å
53	F	40.3	Very low	43.3	Very low	47 Å²	47	89.7 Å²	89.7	21%	0.206	52%	0.52	C	S	.	.	G	3₁₀ helix	trans	-74.1	-28.5	176.1	-76.8	-100.8	0	0	0	113	I46 H50 P51 S55 L56 C445 L448	I46-F53 HydrophobicContact CG2-CB 3.47Å; I46-F53 VanDerWaalsContact CG2-CB 3.47Å; I46-F53 HydrophobicContact CG2-CG 4.04Å; H50-F53 HydrophobicContact CB-CD2 3.54Å; H50-F53 HydrophobicContact CB-CE2 3.99Å; H50-F53 WeakPolarHBondContact O-CB 3.29Å; H50-F53 PolarHBondContact O-N 3.32Å; P51-F53 VanDerWaalsContact C-N 3.25Å; P51-F53 PolarHBondContact O-N 3.01Å; F53-S55 PolarHBondContact O-N 3.13Å; F53-L56 HydrophobicContact CB-CD1 4.39Å; F53-L56 HydrophobicContact CD1-CD1 3.73Å; F53-L56 HydrophobicContact CE1-CD1 4.47Å; F53-L56 HydrophobicContact CG-CD1 4.32Å; F53-L56 WeakPolarHBondContact O-CB 3.49Å; F53-L56 PolarHBondContact O-N 3.47Å; F53-C445 HydrophobicContact CE1-CB 4.02Å; F53-C445 WeakPolarHBondContact CE1-SG 3.46Å; F53-C445 HydrophobicContact CZ-CB 4.26Å; F53-L448 HydrophobicContact CE2-CD2 3.56Å; F53-L448 HydrophobicContact CZ-CD2 4.15Å
54	A	42.9	Very low	43.1	Very low	76 Å²	76	89.9 Å²	89.9	63%	0.628	53%	0.529	S	S	*	.	G	3₁₀ helix	trans	-65.7	-15.9	174.1	0	0	0	0	0	112.7	P51	P51-A54 WeakPolarHBondContact O-CB 3.47Å; P51-A54 PolarHBondContact O-N 2.77Å
55	S	41.2	Very low	43	Very low	94 Å²	94	88.7 Å²	88.7	66%	0.657	53%	0.528	S	S	*	.	G	3₁₀ helix	trans	-95.4	1.5	178.2	74.2	0	0	0	0	114.6	A52 F53	A52-S55 PolarHBondContact O-N 2.73Å; A52-S55 PolarHBondContact O-OG 3Å; F53-S55 PolarHBondContact O-N 3.13Å
56	L	39	Very low	42.9	Very low	72 Å²	72	84.6 Å²	84.6	38%	0.377	52%	0.515	S	S	.	.	S	Bend	trans	-65.4	129.9	178.8	-84.9	164.8	0	0	0	110.7	F53 S58 L441	F53-L56 HydrophobicContact CB-CD1 4.39Å; F53-L56 HydrophobicContact CD1-CD1 3.73Å; F53-L56 HydrophobicContact CE1-CD1 4.47Å; F53-L56 HydrophobicContact CG-CD1 4.32Å; F53-L56 WeakPolarHBondContact O-CB 3.49Å; F53-L56 PolarHBondContact O-N 3.47Å; L56-S58 PolarHBondContact O-N 3.48Å; L56-L441 HydrophobicContact CD2-CD1 4.31Å; L56-L441 HydrophobicContact CD2-CD2 3.76Å; L56-L441 HydrophobicContact CD2-CG 4.31Å
57	P	34.7	Very low	42.9	Very low	78 Å²	78	87.7 Å²	87.7	51%	0.506	53%	0.529	S	S	.	.			trans	-56.2	134.4	-178.7	-23.7	32.3	0	0	0	111.6	T59 V60	P57-T59 WeakPolarHBondContact CB-OG1 3.22Å; P57-T59 PolarHBondContact O-N 2.97Å; P57-V60 PolarHBondContact O-N 3.24Å
58	S	37.8	Very low	42.8	Very low	122 Å²	122	90 Å²	90	85%	0.853	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-0.4	168.6	51.9	0	0	0	0	113.9	L56	L56-S58 PolarHBondContact O-N 3.48Å
59	T	34.4	Very low	43	Very low	113 Å²	113	88.6 Å²	88.6	69%	0.693	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.4	4.9	-177.1	53.6	0	0	0	0	114.4	P57 E61	P57-T59 WeakPolarHBondContact CB-OG1 3.22Å; P57-T59 PolarHBondContact O-N 2.97Å; T59-E61 PolarHBondContact O-N 3.18Å
60	V	36.8	Very low	43.2	Very low	78 Å²	78	87.1 Å²	87.1	47%	0.473	52%	0.519	S	S	.	.	S	Bend	trans	-68.4	94.6	153.9	-176.6	0	0	0	0	104.9	P57 Q62 L441	P57-V60 PolarHBondContact O-N 3.24Å; V60-Q62 PolarHBondContact O-N 2.8Å; V60-L441 HydrophobicContact CG2-CD2 4.11Å
61	E	36	Very low	43.5	Very low	180 Å²	180	90.6 Å²	90.6	84%	0.841	53%	0.531	S	S	*	.			trans	-43.2	110.9	169.5	-84.6	-178.5	159.8	0	0	107.2	T59 S63	T59-E61 PolarHBondContact O-N 3.18Å; E61-S63 PolarHBondContact O-N 3.04Å
62	Q	38.3	Very low	43.9	Very low	148 Å²	148	89.8 Å²	89.8	69%	0.692	52%	0.521	S	S	*	.			trans	-66.6	73	179.6	-69.2	176.1	-11.6	0	0	107.1	V60 S64	V60-Q62 PolarHBondContact O-N 2.8Å; Q62-S64 PolarHBondContact O-N 3.25Å; Q62-S64 VanDerWaalsContact O-N 3.14Å
63	S	39.7	Very low	44.7	Very low	56 Å²	56	88.6 Å²	88.6	39%	0.392	51%	0.505	S	S	.	.			trans	-63.2	121.3	163.5	77	0	0	0	0	104.8	E61 S65 A66	E61-S63 PolarHBondContact O-N 3.04Å; S63-S65 PolarHBondContact O-N 3Å; S63-S65 PolarHBondContact OG-OG 3.13Å; S63-A66 PolarHBondContact O-N 3.31Å
64	S	47.8	Very low	45.4	Very low	94 Å²	94	89.7 Å²	89.7	66%	0.657	51%	0.507	S	S	*	.	H	α-helix	trans	-44	-32.9	174.6	52	0	0	0	0	111.3	Q62 A66 Q68	Q62-S64 PolarHBondContact O-N 3.25Å; Q62-S64 VanDerWaalsContact O-N 3.14Å; S64-A66 PolarHBondContact O-N 3.3Å; S64-Q68 WeakPolarHBondContact O-CB 3.39Å; S64-Q68 PolarHBondContact O-N 3.37Å
65	S	52	Low	45.7	Very low	70 Å²	70	88.8 Å²	88.8	49%	0.49	49%	0.492	S	S	.	.	H	α-helix	trans	-58.7	-37.9	176.6	81.2	0	0	0	0	115.6	S63 L69	S63-S65 PolarHBondContact O-N 3Å; S63-S65 PolarHBondContact OG-OG 3.13Å; S65-L69 VanDerWaalsContact O-CB 3.26Å; S65-L69 WeakPolarHBondContact O-CB 3.33Å; S65-L69 WeakPolarHBondContact O-CD1 3.33Å; S65-L69 WeakPolarHBondContact O-CG 3.42Å; S65-L69 PolarHBondContact O-N 3.36Å
66	A	48.5	Very low	46.2	Very low	28 Å²	28	88.5 Å²	88.5	23%	0.231	48%	0.483	C	S	.	.	H	α-helix	trans	-80.5	-39.9	-176	0	0	0	0	0	111.8	S63 S64 L69 L70	S63-A66 PolarHBondContact O-N 3.31Å; S64-A66 PolarHBondContact O-N 3.3Å; A66-L69 PolarHBondContact O-N 2.78Å; A66-L70 WeakPolarHBondContact O-CG 3.22Å; A66-L70 PolarHBondContact O-N 2.95Å
67	Q	49.1	Very low	46.9	Very low	100 Å²	100	87.6 Å²	87.6	47%	0.467	48%	0.477	S	S	.	.	H	α-helix	trans	-66.2	-41.3	171.6	-74.7	175.2	-32.8	0	0	111	L70 R71	Q67-L70 PolarHBondContact O-N 3.46Å; Q67-R71 WeakPolarHBondContact O-CB 3.33Å; Q67-R71 PolarHBondContact O-N 2.86Å
68	Q	51.5	Low	47.5	Very low	94 Å²	94	86.9 Å²	86.9	44%	0.439	47%	0.468	S	S	.	.	H	α-helix	trans	-60.8	-45.5	172.8	-163.7	77.4	37.7	0	0	110.9	S64 L70 R71 D72	S64-Q68 WeakPolarHBondContact O-CB 3.39Å; S64-Q68 PolarHBondContact O-N 3.37Å; Q68-L70 VanDerWaalsContact C-N 3.34Å; Q68-L70 PolarHBondContact O-N 3.21Å; Q68-R71 PolarHBondContact O-N 3.42Å; Q68-D72 WeakPolarHBondContact O-CB 3.34Å; Q68-D72 PolarHBondContact O-N 3.46Å
69	L	55	Low	47.8	Very low	95 Å²	95	87.1 Å²	87.1	50%	0.497	46%	0.46	S	S	.	.	H	α-helix	trans	-59.9	-41.3	175.8	-95.1	158.4	0	0	0	112.7	S65 A66 L73	S65-L69 VanDerWaalsContact O-CB 3.26Å; S65-L69 WeakPolarHBondContact O-CB 3.33Å; S65-L69 WeakPolarHBondContact O-CD1 3.33Å; S65-L69 WeakPolarHBondContact O-CG 3.42Å; S65-L69 PolarHBondContact O-N 3.36Å; A66-L69 PolarHBondContact O-N 2.78Å; L69-L73 VanDerWaalsContact O-CB 3.28Å; L69-L73 WeakPolarHBondContact O-CB 3.26Å; L69-L73 PolarHBondContact O-N 3.45Å
70	L	52.3	Low	48.5	Very low	86 Å²	86	88.8 Å²	88.8	45%	0.45	46%	0.458	S	S	.	.	H	α-helix	trans	-67.3	-41.3	175.2	-79.9	167.4	0	0	0	111.9	A66 Q67 Q68 L73 W74 L442	A66-L70 WeakPolarHBondContact O-CG 3.22Å; A66-L70 PolarHBondContact O-N 2.95Å; Q67-L70 PolarHBondContact O-N 3.46Å; Q68-L70 VanDerWaalsContact C-N 3.34Å; Q68-L70 PolarHBondContact O-N 3.21Å; L70-L73 PolarHBondContact O-N 2.86Å; L70-W74 VanDerWaalsContact O-CB 3.26Å; L70-W74 WeakPolarHBondContact O-CB 3.39Å; L70-W74 PolarHBondContact O-N 2.91Å; L70-L442 HydrophobicContact CD1-CD2 4.1Å; L70-L442 HydrophobicContact CD2-CD2 3.51Å; L70-L442 HydrophobicContact CG-CD2 3.64Å
71	R	49.8	Very low	48.9	Very low	111 Å²	111	87 Å²	87	42%	0.419	45%	0.445	S	S	.	.	H	α-helix	trans	-62.8	-46.9	175.1	-174.4	178.4	-176.3	-92.5	9.8	110.8	E35 Q67 Q68 W74 L75	E35-R71 IonicContact OE1-CZ 2.7Å; E35-R71 IonicContact OE1-NH2 2.92Å; E35-R71 PolarHBondContact OE1-NH2 2.87Å; Q67-R71 WeakPolarHBondContact O-CB 3.33Å; Q67-R71 PolarHBondContact O-N 2.86Å; Q68-R71 PolarHBondContact O-N 3.42Å; R71-W74 PolarHBondContact O-N 2.88Å; R71-L75 HydrophobicContact CG-CD1 3.99Å; R71-L75 HydrophobicContact CG-CG 4.39Å; R71-L75 VanDerWaalsContact O-CB 3.3Å; R71-L75 WeakPolarHBondContact O-CB 3.15Å; R71-L75 VanDerWaalsContact O-CG 3.26Å; R71-L75 WeakPolarHBondContact O-CG 3.24Å; R71-L75 PolarHBondContact O-N 3.48Å
72	D	54.9	Low	49.4	Very low	71 Å²	71	81.1 Å²	81.1	38%	0.38	42%	0.422	S	S	.	.	H	α-helix	trans	-64.6	-41	176.9	-66.1	-13	0	0	0	110.7	Q68 W74 D76	Q68-D72 WeakPolarHBondContact O-CB 3.34Å; Q68-D72 PolarHBondContact O-N 3.46Å; D72-W74 PolarHBondContact O-N 3.25Å; D72-D76 WeakPolarHBondContact O-CB 3.37Å; D72-D76 PolarHBondContact O-N 3.28Å
73	L	57.3	Low	49.9	Very low	48 Å²	48	79.3 Å²	79.3	25%	0.251	41%	0.412	S	S	.	.	H	α-helix	trans	-63.3	-40.2	173.5	-112.6	126.9	0	0	0	112.2	L69 L70 M77 W424 Y446	L69-L73 VanDerWaalsContact O-CB 3.28Å; L69-L73 WeakPolarHBondContact O-CB 3.26Å; L69-L73 PolarHBondContact O-N 3.45Å; L70-L73 PolarHBondContact O-N 2.86Å; L73-M77 WeakPolarHBondContact O-CB 3.34Å; L73-M77 PolarHBondContact O-N 3.24Å; L73-W424 HydrophobicContact CD1-CH2 4.03Å; L73-W424 HydrophobicContact CD2-CH2 4.13Å; L73-W424 HydrophobicContact CD2-CZ2 4.19Å; L73-W424 HydrophobicContact CG-CH2 4.2Å; L73-W424 HydrophobicContact CG-CZ2 4.46Å; L73-Y446 HydrophobicContact CD2-CD2 3.89Å; L73-Y446 HydrophobicContact CD2-CE2 3.97Å
74	W	53.6	Low	50.4	Low	69 Å²	69	78.6 Å²	78.6	26%	0.261	41%	0.406	S	S	.	.	H	α-helix	trans	-73.2	-41	179.5	-172.2	94.1	0	0	0	111.3	F38 F42 L70 R71 D72 M77 M78	F38-W74 HydrophobicContact CE1-CH2 4.39Å; F38-W74 HydrophobicContact CE1-CZ3 4.19Å; F38-W74 AromaticContact CE2-CH2 3.25Å; F38-W74 HydrophobicContact CE2-CH2 3.25Å; F38-W74 AromaticContact CE2-CZ2 3.84Å; F38-W74 HydrophobicContact CE2-CZ2 3.84Å; F38-W74 AromaticContact CE2-CZ3 3.78Å; F38-W74 HydrophobicContact CE2-CZ3 3.78Å; F38-W74 HydrophobicContact CZ-CD2 4.35Å; F38-W74 AromaticContact CZ-CE3 3.92Å; F38-W74 HydrophobicContact CZ-CE3 3.92Å; F38-W74 AromaticContact CZ-CH2 3.16Å; F38-W74 HydrophobicContact CZ-CH2 3.16Å; F38-W74 AromaticContact CZ-CZ2 3.63Å; F38-W74 HydrophobicContact CZ-CZ2 3.63Å; F38-W74 AromaticContact CZ-CZ3 3.3Å; F38-W74 HydrophobicContact CZ-CZ3 3.3Å; F42-W74 AromaticContact CE2-CD1 3.96Å; F42-W74 AromaticContact CE2-NE1 3.75Å; L70-W74 VanDerWaalsContact O-CB 3.26Å; L70-W74 WeakPolarHBondContact O-CB 3.39Å; L70-W74 PolarHBondContact O-N 2.91Å; R71-W74 PolarHBondContact O-N 2.88Å; D72-W74 PolarHBondContact O-N 3.25Å; W74-M77 CarbonylContact O-C 3.15Å; W74-M77 WeakPolarHBondContact O-CB 3.28Å; W74-M77 PolarHBondContact O-N 3.48Å; W74-M78 HydrophobicContact CD2-CE 4.36Å; W74-M78 HydrophobicContact CD2-CG 3.79Å; W74-M78 HydrophobicContact CE3-CB 4.49Å; W74-M78 HydrophobicContact CE3-CG 3.6Å; W74-M78 HydrophobicContact CH2-CE 4.39Å; W74-M78 HydrophobicContact CH2-CG 3.31Å; W74-M78 HydrophobicContact CH2-SD 3.87Å; W74-M78 HydrophobicContact CZ2-CE 3.66Å; W74-M78 HydrophobicContact CZ2-CG 3.53Å; W74-M78 HydrophobicContact CZ2-SD 3.7Å; W74-M78 HydrophobicContact CZ3-CB 4.31Å; W74-M78 HydrophobicContact CZ3-CG 3.37Å; W74-M78 WeakPolarHBondContact O-CB 3.41Å; W74-M78 WeakPolarHBondContact O-CG 3.41Å; W74-M78 PolarHBondContact O-N 2.92Å
75	L	50.1	Low	50.7	Low	57 Å²	57	84.3 Å²	84.3	30%	0.298	41%	0.413	S	S	.	.	H	α-helix	trans	-64.9	-42.7	173.1	-74.3	173.2	0	0	0	111	R71 M77 M78 N79	R71-L75 HydrophobicContact CG-CD1 3.99Å; R71-L75 HydrophobicContact CG-CG 4.39Å; R71-L75 VanDerWaalsContact O-CB 3.3Å; R71-L75 WeakPolarHBondContact O-CB 3.15Å; R71-L75 VanDerWaalsContact O-CG 3.26Å; R71-L75 WeakPolarHBondContact O-CG 3.24Å; R71-L75 PolarHBondContact O-N 3.48Å; L75-M77 VanDerWaalsContact C-N 3.34Å; L75-M78 PolarHBondContact O-N 3.12Å; L75-N79 WeakPolarHBondContact O-CB 3.41Å; L75-N79 PolarHBondContact O-N 3.05Å; L75-N79 PolarHBondContact O-ND2 3.04Å
76	D	52.7	Low	51.3	Low	88 Å²	88	91.9 Å²	91.9	47%	0.471	43%	0.431	S	S	.	.	H	α-helix	trans	-59.2	-48.5	169.5	-85.4	-11.6	0	0	0	109.5	D72 M78 N79 F80	D72-D76 WeakPolarHBondContact O-CB 3.37Å; D72-D76 PolarHBondContact O-N 3.28Å; D76-M78 VanDerWaalsContact C-N 3.32Å; D76-M78 PolarHBondContact O-N 3.18Å; D76-N79 CarbonylContact O-C 3.52Å; D76-N79 PolarHBondContact O-N 3.22Å; D76-F80 HydrophobicContact CB-CD2 4.4Å; D76-F80 VanDerWaalsContact O-CB 3.27Å; D76-F80 WeakPolarHBondContact O-CB 3.47Å; D76-F80 WeakPolarHBondContact O-CD2 3.43Å; D76-F80 PolarHBondContact O-N 3.43Å
77	M	52.3	Low	53	Low	53 Å²	53	91.3 Å²	91.3	26%	0.261	42%	0.423	S	S	.	.	H	α-helix	trans	-60	-40.9	178.6	-166.2	179.1	71.5	0	0	111.5	L73 W74 L75 F80 M81 V449	L73-M77 WeakPolarHBondContact O-CB 3.34Å; L73-M77 PolarHBondContact O-N 3.24Å; W74-M77 CarbonylContact O-C 3.15Å; W74-M77 WeakPolarHBondContact O-CB 3.28Å; W74-M77 PolarHBondContact O-N 3.48Å; L75-M77 VanDerWaalsContact C-N 3.34Å; M77-F80 CarbonylContact O-C 3.55Å; M77-F80 PolarHBondContact O-N 3.01Å; M77-M81 HydrophobicContact CE-CE 3.89Å; M77-M81 HydrophobicContact CG-CE 4.01Å; M77-M81 HydrophobicContact CG-CG 4.43Å; M77-M81 HydrophobicContact CG-SD 4.33Å; M77-M81 WeakPolarHBondContact O-CA 3.24Å; M77-M81 WeakPolarHBondContact O-CB 3.44Å; M77-M81 WeakPolarHBondContact O-CG 3.49Å; M77-M81 PolarHBondContact O-N 3.34Å; M77-M81 HydrophobicContact SD-CE 4.43Å; M77-V449 HydrophobicContact CE-CG1 4Å; M77-V449 HydrophobicContact SD-CG1 3.83Å
78	M	47.6	Very low	54.9	Low	64 Å²	64	96.9 Å²	96.9	32%	0.315	44%	0.44	S	S	.	.	H	α-helix	trans	-69.6	-41.3	175.1	-74.2	-57.3	121.7	0	0	112.6	W74 L75 D76 F80 M81	W74-M78 HydrophobicContact CD2-CE 4.36Å; W74-M78 HydrophobicContact CD2-CG 3.79Å; W74-M78 HydrophobicContact CE3-CB 4.49Å; W74-M78 HydrophobicContact CE3-CG 3.6Å; W74-M78 HydrophobicContact CH2-CE 4.39Å; W74-M78 HydrophobicContact CH2-CG 3.31Å; W74-M78 HydrophobicContact CH2-SD 3.87Å; W74-M78 HydrophobicContact CZ2-CE 3.66Å; W74-M78 HydrophobicContact CZ2-CG 3.53Å; W74-M78 HydrophobicContact CZ2-SD 3.7Å; W74-M78 HydrophobicContact CZ3-CB 4.31Å; W74-M78 HydrophobicContact CZ3-CG 3.37Å; W74-M78 WeakPolarHBondContact O-CB 3.41Å; W74-M78 WeakPolarHBondContact O-CG 3.41Å; W74-M78 PolarHBondContact O-N 2.92Å; L75-M78 PolarHBondContact O-N 3.12Å; D76-M78 VanDerWaalsContact C-N 3.32Å; D76-M78 PolarHBondContact O-N 3.18Å; M78-F80 VanDerWaalsContact C-N 3.25Å; M78-F80 PolarHBondContact O-N 2.92Å; M78-M81 HydrophobicContact CE-CE 3.1Å; M78-M81 CarbonylContact O-C 3.5Å; M78-M81 WeakPolarHBondContact O-CA 3.39Å; M78-M81 PolarHBondContact O-N 2.82Å; M78-M81 VanDerWaalsContact O-O 3.1Å; M78-M81 HydrophobicContact SD-CE 4.1Å
79	N	45.2	Very low	56.8	Low	126 Å²	126	96.5 Å²	96.5	67%	0.674	43%	0.434	S	S	*	.	H	α-helix	trans	-65.6	-31.2	174.9	-73.9	-33.3	0	0	0	111.5	L75 D76	L75-N79 WeakPolarHBondContact O-CB 3.41Å; L75-N79 PolarHBondContact O-N 3.05Å; L75-N79 PolarHBondContact O-ND2 3.04Å; D76-N79 CarbonylContact O-C 3.52Å; D76-N79 PolarHBondContact O-N 3.22Å
80	F	47.4	Very low	58.8	Low	148 Å²	148	93.4 Å²	93.4	65%	0.649	42%	0.418	S	S	*	.	H	α-helix	trans	-86.6	-9.6	171.5	-81.5	-73.3	0	0	0	113.4	D76 M77 M78 P82	D76-F80 HydrophobicContact CB-CD2 4.4Å; D76-F80 VanDerWaalsContact O-CB 3.27Å; D76-F80 WeakPolarHBondContact O-CB 3.47Å; D76-F80 WeakPolarHBondContact O-CD2 3.43Å; D76-F80 PolarHBondContact O-N 3.43Å; M77-F80 CarbonylContact O-C 3.55Å; M77-F80 PolarHBondContact O-N 3.01Å; M78-F80 VanDerWaalsContact C-N 3.25Å; M78-F80 PolarHBondContact O-N 2.92Å; F80-P82 WeakPolarHBondContact O-CD 3.43Å
81	M	46.5	Very low	60.8	Low	42 Å²	42	95.6 Å²	95.6	21%	0.207	43%	0.426	C	S	.	.			trans	-107.9	70.8	171.2	-72.5	-161	-50	0	0	110	M77 M78 F83 F453	M77-M81 HydrophobicContact CE-CE 3.89Å; M77-M81 HydrophobicContact CG-CE 4.01Å; M77-M81 HydrophobicContact CG-CG 4.43Å; M77-M81 HydrophobicContact CG-SD 4.33Å; M77-M81 WeakPolarHBondContact O-CA 3.24Å; M77-M81 WeakPolarHBondContact O-CB 3.44Å; M77-M81 WeakPolarHBondContact O-CG 3.49Å; M77-M81 PolarHBondContact O-N 3.34Å; M77-M81 HydrophobicContact SD-CE 4.43Å; M78-M81 HydrophobicContact CE-CE 3.1Å; M78-M81 CarbonylContact O-C 3.5Å; M78-M81 WeakPolarHBondContact O-CA 3.39Å; M78-M81 PolarHBondContact O-N 2.82Å; M78-M81 VanDerWaalsContact O-O 3.1Å; M78-M81 HydrophobicContact SD-CE 4.1Å; M81-F83 HydrophobicContact CB-CD2 3.95Å; M81-F83 HydrophobicContact CB-CE2 4.13Å; M81-F83 HydrophobicContact CG-CD2 4.11Å; M81-F83 HydrophobicContact CG-CE2 3.77Å; M81-F83 PolarHBondContact O-N 3.45Å; M81-F83 HydrophobicContact SD-CD2 3.95Å; M81-F83 HydrophobicContact SD-CE2 3.49Å; M81-F83 WeakPolarHBondContact SD-CE2 3.35Å; M81-F453 HydrophobicContact CE-CE2 4.43Å; M81-F453 HydrophobicContact CG-CZ 4.49Å; M81-F453 HydrophobicContact SD-CD2 4.1Å; M81-F453 HydrophobicContact SD-CE2 3.24Å; M81-F453 WeakPolarHBondContact SD-CE2 3.36Å; M81-F453 HydrophobicContact SD-CZ 3.48Å; M81-F453 WeakPolarHBondContact SD-CZ 3.25Å
82	P	44.9	Very low	63	Low	55 Å²	55	95.6 Å²	95.6	36%	0.357	43%	0.431	S	S	.	.			trans	-70.4	86.8	146.6	33.2	-23.4	0	0	0	104.2	F80 P84 A303	F80-P82 WeakPolarHBondContact O-CD 3.43Å; P82-P84 VanDerWaalsContact C-N 3.3Å; P82-P84 WeakPolarHBondContact O-CD 3.14Å; P82-A303 HydrophobicContact CB-CB 3.52Å; P82-A303 HydrophobicContact CG-CB 4.07Å
83	F	49.1	Very low	65	Low	110 Å²	110	94.9 Å²	94.9	48%	0.482	42%	0.423	S	S	.	.			trans	-83.3	92.6	146.7	-73.8	-69	0	0	0	104.8	M81 R85 F453	M81-F83 HydrophobicContact CB-CD2 3.95Å; M81-F83 HydrophobicContact CB-CE2 4.13Å; M81-F83 HydrophobicContact CG-CD2 4.11Å; M81-F83 HydrophobicContact CG-CE2 3.77Å; M81-F83 PolarHBondContact O-N 3.45Å; M81-F83 HydrophobicContact SD-CD2 3.95Å; M81-F83 HydrophobicContact SD-CE2 3.49Å; M81-F83 WeakPolarHBondContact SD-CE2 3.35Å; F83-R85 PolarHBondContact O-N 2.83Å; F83-F453 HydrophobicContact CD2-CE2 4.47Å; F83-F453 AromaticContact CE2-CE2 3.48Å; F83-F453 HydrophobicContact CE2-CE2 3.48Å; F83-F453 VanDerWaalsContact CE2-CE2 3.48Å; F83-F453 AromaticContact CE2-CZ 3.36Å; F83-F453 HydrophobicContact CE2-CZ 3.36Å; F83-F453 AromaticContact CZ-CE2 3.94Å; F83-F453 HydrophobicContact CZ-CE2 3.94Å; F83-F453 AromaticContact CZ-CZ 3.48Å; F83-F453 HydrophobicContact CZ-CZ 3.48Å; F83-F453 VanDerWaalsContact CZ-CZ 3.48Å
84	P	50.4	Low	66.7	Low	42 Å²	42	96.2 Å²	96.2	27%	0.273	43%	0.43	S	S	.	.			trans	-48.9	124.9	159.9	18.2	-26.6	0	0	0	106.2	P82 R86	P82-P84 VanDerWaalsContact C-N 3.3Å; P82-P84 WeakPolarHBondContact O-CD 3.14Å; P84-R86 PolarHBondContact O-N 3.32Å
85	R	55.1	Low	68.7	Low	214 Å²	214	96 Å²	96	81%	0.808	44%	0.437	S	S	*	.			trans	-44.8	132.5	168.1	-72	-176	173.8	-173.3	-0.6	106.4	F83 R87	F83-R85 PolarHBondContact O-N 2.83Å; R85-R87 VanDerWaalsContact C-N 3.28Å; R85-R87 PolarHBondContact O-N 2.79Å
86	R	64.2	Low	70.9	Confident	229 Å²	229	95.5 Å²	95.5	86%	0.864	43%	0.434	S	S	*	.			trans	-61.7	97.9	177.8	-77.2	-170	179.9	179.5	1	107.7	P84 R88	P84-R86 PolarHBondContact O-N 3.32Å; R86-R88 PolarHBondContact O-N 2.9Å
87	R	85	Confident	73	Confident	15 Å²	15	95.5 Å²	95.5	6%	0.057	43%	0.434	C	S	.	.	P	Polyproline II helix	trans	-56.8	134.6	176.4	178.6	-178.3	170.5	-81.2	4.5	108.3	R85 L90 D310 V312 D328	R85-R87 VanDerWaalsContact C-N 3.28Å; R85-R87 PolarHBondContact O-N 2.79Å; R87-L90 VanDerWaalsContact NH2-CG 3.29Å; R87-D310 PolarHBondContact NE-O 3.21Å; R87-V312 PolarHBondContact NE-O 2.79Å; R87-V312 PolarHBondContact NH2-O 2.8Å; R87-D328 IonicContact CZ-OD1 3.87Å; R87-D328 IonicContact CZ-OD2 3.47Å; R87-D328 IonicContact NH1-OD1 3.67Å; R87-D328 PolarHBondContact NH1-OD1 2.89Å; R87-D328 IonicContact NH1-OD2 2.79Å; R87-D328 IonicContact NH2-OD1 3.51Å; R87-D328 PolarHBondContact NH2-OD1 3.42Å; R87-D328 IonicContact NH2-OD2 3.21Å; R87-D328 PolarHBondContact NH2-OD2 2.92Å
88	R	87.1	Confident	75.2	Confident	217 Å²	217	94.8 Å²	94.8	82%	0.819	43%	0.431	S	S	*	.	P	Polyproline II helix	trans	-79	140.3	172.6	-66.7	-176.4	179.9	-178.3	0.5	109.7	R86	R86-R88 PolarHBondContact O-N 2.9Å
89	R	93.1	Very high	77.6	Confident	86 Å²	86	91.8 Å²	91.8	33%	0.325	42%	0.417	S	S	.	.	P	Polyproline II helix	trans	-59.9	137.9	172.8	-161	173.8	171.9	-128.7	-7.4	110.3	E91 N94 T326 F327 D328	R89-E91 PolarHBondContact O-N 2.81Å; R89-N94 PolarHBondContact NH1-OD1 2.89Å; R89-N94 PolarHBondContact NH2-OD1 3.25Å; R89-T326 HydrophobicContact CB-CG2 3.7Å; R89-T326 HydrophobicContact CG-CG2 4.33Å; R89-F327 WeakPolarHBondContact CD-O 3.29Å; R89-F327 WeakPolarHBondContact CG-O 3.43Å; R89-F327 PolarHBondContact NE-O 3.38Å; R89-D328 HydrophobicContact CG-CB 4.49Å; R89-D328 VanDerWaalsContact CZ-O 3.29Å; R89-D328 PolarHBondContact NE-O 3.38Å; R89-D328 PolarHBondContact NH2-O 3.28Å
90	L	96.1	Very high	80.1	Confident	30 Å²	30	86.1 Å²	86.1	16%	0.157	39%	0.387	C	S	.	.			trans	-83.7	99.7	171.3	-65.8	179.3	0	0	0	109.3	R87 Q92 Y93 D311 P313 D328	R87-L90 VanDerWaalsContact NH2-CG 3.29Å; L90-Q92 PolarHBondContact O-N 3.31Å; L90-Y93 HydrophobicContact CB-CD2 3.96Å; L90-Y93 HydrophobicContact CB-CE2 4.42Å; L90-Y93 HydrophobicContact CD1-CD2 4.23Å; L90-Y93 HydrophobicContact CD1-CE2 4.04Å; L90-Y93 PolarHBondContact O-N 2.99Å; L90-Y93 VanDerWaalsContact O-N 3.13Å; L90-D311 WeakPolarHBondContact CD1-O 3.26Å; L90-P313 HydrophobicContact CD1-CB 4.37Å; L90-D328 PolarHBondContact N-OD1 2.95Å
91	E	94.2	Very high	82.5	Confident	133 Å²	133	82.7 Å²	82.7	62%	0.621	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-16.1	-174.2	-63.8	-63	161.6	0	0	114.4	R89 Y93 N94	R89-E91 PolarHBondContact O-N 2.81Å; E91-Y93 VanDerWaalsContact C-N 3.33Å; E91-N94 PolarHBondContact O-ND2 3.38Å
92	Q	95.2	Very high	85	Confident	110 Å²	110	81 Å²	81	51%	0.514	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-15.7	177.3	69.8	-87.1	21.1	0	0	114.4	L90	L90-Q92 PolarHBondContact O-N 3.31Å
93	Y	96.9	Very high	87.5	Confident	57 Å²	57	78.4 Å²	78.4	22%	0.224	35%	0.35	C	S	.	.			trans	-115	120.2	-179.5	-54	-61.4	0	0	0	110.5	L90 E91 D98 L102 P313 D328	L90-Y93 HydrophobicContact CB-CD2 3.96Å; L90-Y93 HydrophobicContact CB-CE2 4.42Å; L90-Y93 HydrophobicContact CD1-CD2 4.23Å; L90-Y93 HydrophobicContact CD1-CE2 4.04Å; L90-Y93 PolarHBondContact O-N 2.99Å; L90-Y93 VanDerWaalsContact O-N 3.13Å; E91-Y93 VanDerWaalsContact C-N 3.33Å; Y93-D98 HydrophobicContact CD1-CB 4.12Å; Y93-L102 HydrophobicContact CD1-CD1 4Å; Y93-L102 HydrophobicContact CD1-CD2 4.18Å; Y93-L102 HydrophobicContact CD1-CG 4.14Å; Y93-L102 HydrophobicContact CD2-CD1 4.45Å; Y93-L102 HydrophobicContact CE1-CD1 4.31Å; Y93-L102 HydrophobicContact CE1-CD2 3.63Å; Y93-L102 HydrophobicContact CE1-CG 4.03Å; Y93-L102 HydrophobicContact CE2-CD2 4.2Å; Y93-L102 HydrophobicContact CG-CD1 4.07Å; Y93-P313 HydrophobicContact CD2-CB 3.9Å; Y93-P313 HydrophobicContact CE2-CB 3.79Å; Y93-P313 HydrophobicContact CE2-CG 4.28Å; Y93-D328 VanDerWaalsContact O-O 3.09Å
94	N	94.5	Very high	89.8	Confident	75 Å²	75	78.1 Å²	78.1	40%	0.401	35%	0.349	S	S	.	.			trans	-143.3	-20.2	-173.9	-65.4	-82.3	0	0	0	114.7	R89 E91 D98	R89-N94 PolarHBondContact NH1-OD1 2.89Å; R89-N94 PolarHBondContact NH2-OD1 3.25Å; E91-N94 PolarHBondContact O-ND2 3.38Å; N94-D98 PolarHBondContact N-OD2 3.15Å
95	T	95.8	Very high	92.1	Very high	65 Å²	65	82.6 Å²	82.6	40%	0.399	37%	0.366	S	S	.	.	S	Bend	trans	-116.5	161.1	-167.7	71	0	0	0	0	111.7	N97 D98 V99	T95-N97 PolarHBondContact O-N 2.55Å; T95-N97 PolarHBondContact OG1-N 3.38Å; T95-D98 WeakPolarHBondContact CB-OD2 3.23Å; T95-D98 PolarHBondContact N-OD2 3.25Å; T95-D98 WeakPolarHBondContact O-CB 3.46Å; T95-D98 PolarHBondContact O-N 2.7Å; T95-D98 PolarHBondContact OG1-N 3.48Å; T95-D98 VanDerWaalsContact OG1-N 3.13Å; T95-D98 PolarHBondContact OG1-OD2 3.42Å; T95-V99 PolarHBondContact O-N 2.95Å
96	I	95.7	Very high	94.1	Very high	47 Å²	47	72.7 Å²	72.7	24%	0.241	33%	0.329	C	S	.	.	H	α-helix	trans	-58.7	-30.8	169.9	-169.6	170.3	0	0	0	112.3	D98 V99 V100 L331 E341 L342	I96-D98 VanDerWaalsContact C-N 3.31Å; I96-D98 PolarHBondContact O-N 3Å; I96-V99 WeakPolarHBondContact O-CB 3.18Å; I96-V99 PolarHBondContact O-N 2.83Å; I96-V100 WeakPolarHBondContact O-CG2 3.49Å; I96-V100 PolarHBondContact O-N 3.14Å; I96-L331 HydrophobicContact CB-CD2 4.35Å; I96-L331 HydrophobicContact CG1-CD1 4.49Å; I96-L331 HydrophobicContact CG1-CD2 4.46Å; I96-E341 HydrophobicContact CD1-CG 3.91Å; I96-L342 HydrophobicContact CD1-CD2 4.24Å; I96-L342 HydrophobicContact CG1-CD2 3.91Å
97	N	96.5	Very high	95.8	Very high	87 Å²	87	68.7 Å²	68.7	47%	0.465	32%	0.318	S	S	.	.	H	α-helix	trans	-68.3	-33.4	175.8	-70.8	-22.5	0	0	0	111.6	T95 V99 V100 N101 R345	T95-N97 PolarHBondContact O-N 2.55Å; T95-N97 PolarHBondContact OG1-N 3.38Å; N97-V99 VanDerWaalsContact C-N 3.35Å; N97-V100 PolarHBondContact O-N 2.82Å; N97-N101 WeakPolarHBondContact O-CB 3.32Å; N97-N101 VanDerWaalsContact O-CG 3.27Å; N97-N101 PolarHBondContact O-N 2.78Å; N97-N101 PolarHBondContact O-ND2 3.36Å; N97-R345 PolarHBondContact OD1-NH1 3.42Å
98	D	97.8	Very high	96.4	Very high	39 Å²	39	72.5 Å²	72.5	21%	0.209	33%	0.333	C	S	.	.	H	α-helix	trans	-64.2	-42.6	172	-58.2	-41	0	0	0	110.5	Y93 N94 T95 I96 V100 N101 L102	Y93-D98 HydrophobicContact CD1-CB 4.12Å; N94-D98 PolarHBondContact N-OD2 3.15Å; T95-D98 WeakPolarHBondContact CB-OD2 3.23Å; T95-D98 PolarHBondContact N-OD2 3.25Å; T95-D98 WeakPolarHBondContact O-CB 3.46Å; T95-D98 PolarHBondContact O-N 2.7Å; T95-D98 PolarHBondContact OG1-N 3.48Å; T95-D98 VanDerWaalsContact OG1-N 3.13Å; T95-D98 PolarHBondContact OG1-OD2 3.42Å; I96-D98 VanDerWaalsContact C-N 3.31Å; I96-D98 PolarHBondContact O-N 3Å; D98-V100 PolarHBondContact O-N 2.86Å; D98-N101 PolarHBondContact O-N 3.45Å; D98-L102 WeakPolarHBondContact O-CB 3.49Å; D98-L102 VanDerWaalsContact O-CG 3.22Å; D98-L102 WeakPolarHBondContact O-CG 3.46Å; D98-L102 PolarHBondContact O-N 3.06Å
99	V	98.1	Very high	97	Very high	1 Å²	1	62.2 Å²	62.2	1%	0.006	29%	0.294	C	S	.	.	H	α-helix	trans	-59.6	-45.1	174.4	-179.6	0	0	0	0	111.5	T95 I96 N97 N101 L102 I103 V315 V329 L331 L342	T95-V99 PolarHBondContact O-N 2.95Å; I96-V99 WeakPolarHBondContact O-CB 3.18Å; I96-V99 PolarHBondContact O-N 2.83Å; N97-V99 VanDerWaalsContact C-N 3.35Å; V99-N101 VanDerWaalsContact C-N 3.34Å; V99-N101 PolarHBondContact O-N 3.44Å; V99-L102 PolarHBondContact O-N 3.03Å; V99-I103 HydrophobicContact CG1-CD1 3.94Å; V99-I103 WeakPolarHBondContact O-CG1 3.48Å; V99-I103 PolarHBondContact O-N 3.43Å; V99-V315 HydrophobicContact CG1-CG1 4.14Å; V99-V315 HydrophobicContact CG1-CG2 4.4Å; V99-V315 HydrophobicContact CG2-CG1 3.9Å; V99-V315 HydrophobicContact CG2-CG2 3.99Å; V99-V329 HydrophobicContact CG2-CB 3.72Å; V99-V329 HydrophobicContact CG2-CG1 3.6Å; V99-V329 HydrophobicContact CG2-CG2 3.9Å; V99-L331 HydrophobicContact CG1-CD1 4.37Å; V99-L331 HydrophobicContact CG2-CD1 4.4Å; V99-L342 HydrophobicContact CG1-CD1 4.48Å; V99-L342 HydrophobicContact CG1-CD2 4.07Å
100	V	98	Very high	97.2	Very high	7 Å²	7	58.1 Å²	58.1	4%	0.042	28%	0.278	C	S	.	.	H	α-helix	trans	-60.8	-43.9	176.2	172.4	0	0	0	0	111.1	I96 N97 D98 I103 K104 L342 R345 L346	I96-V100 WeakPolarHBondContact O-CG2 3.49Å; I96-V100 PolarHBondContact O-N 3.14Å; N97-V100 PolarHBondContact O-N 2.82Å; D98-V100 PolarHBondContact O-N 2.86Å; V100-I103 PolarHBondContact O-N 3.35Å; V100-K104 HydrophobicContact CG1-CD 4.29Å; V100-K104 WeakPolarHBondContact O-CG 3.23Å; V100-K104 PolarHBondContact O-N 2.98Å; V100-L342 HydrophobicContact CG2-CD2 3.9Å; V100-R345 HydrophobicContact CG1-CB 4.3Å; V100-R345 HydrophobicContact CG2-CB 3.71Å; V100-R345 HydrophobicContact CG2-CG 4.42Å; V100-L346 HydrophobicContact CG1-CD2 4Å; V100-L346 HydrophobicContact CG1-CG 4.32Å
101	N	98.1	Very high	97.4	Very high	75 Å²	75	56.7 Å²	56.7	40%	0.401	27%	0.271	S	S	.	.	H	α-helix	trans	-66.7	-41.4	178.3	-72.9	-27.6	0	0	0	112.1	N97 D98 V99 K104 Q105	N97-N101 WeakPolarHBondContact O-CB 3.32Å; N97-N101 VanDerWaalsContact O-CG 3.27Å; N97-N101 PolarHBondContact O-N 2.78Å; N97-N101 PolarHBondContact O-ND2 3.36Å; D98-N101 PolarHBondContact O-N 3.45Å; V99-N101 VanDerWaalsContact C-N 3.34Å; V99-N101 PolarHBondContact O-N 3.44Å; N101-K104 PolarHBondContact O-N 3.3Å; N101-Q105 WeakPolarHBondContact O-CB 3.44Å; N101-Q105 VanDerWaalsContact O-CG 3.28Å; N101-Q105 WeakPolarHBondContact O-CG 3.39Å; N101-Q105 PolarHBondContact O-N 3.41Å
102	L	98.5	Very high	97.6	Very high	7 Å²	7	50.3 Å²	50.3	4%	0.037	24%	0.241	C	C	.	.	H	α-helix	trans	-57.1	-52.3	173.8	-77.1	171.7	0	0	0	110.4	Y93 D98 V99 K104 Q105 S106 L288 P313 V315	Y93-L102 HydrophobicContact CD1-CD1 4Å; Y93-L102 HydrophobicContact CD1-CD2 4.18Å; Y93-L102 HydrophobicContact CD1-CG 4.14Å; Y93-L102 HydrophobicContact CD2-CD1 4.45Å; Y93-L102 HydrophobicContact CE1-CD1 4.31Å; Y93-L102 HydrophobicContact CE1-CD2 3.63Å; Y93-L102 HydrophobicContact CE1-CG 4.03Å; Y93-L102 HydrophobicContact CE2-CD2 4.2Å; Y93-L102 HydrophobicContact CG-CD1 4.07Å; D98-L102 WeakPolarHBondContact O-CB 3.49Å; D98-L102 VanDerWaalsContact O-CG 3.22Å; D98-L102 WeakPolarHBondContact O-CG 3.46Å; D98-L102 PolarHBondContact O-N 3.06Å; V99-L102 PolarHBondContact O-N 3.03Å; L102-K104 VanDerWaalsContact C-N 3.28Å; L102-K104 PolarHBondContact O-N 2.97Å; L102-Q105 PolarHBondContact O-N 3.24Å; L102-Q105 VanDerWaalsContact O-N 3.14Å; L102-S106 VanDerWaalsContact O-CB 3.23Å; L102-S106 WeakPolarHBondContact O-CB 3.44Å; L102-S106 PolarHBondContact O-N 3.45Å; L102-S106 PolarHBondContact O-OG 3.08Å; L102-L288 HydrophobicContact CB-CD1 4.21Å; L102-L288 HydrophobicContact CB-CD2 4.22Å; L102-L288 HydrophobicContact CD1-CD1 4.22Å; L102-P313 HydrophobicContact CD1-CB 3.91Å; L102-P313 HydrophobicContact CD1-CG 4.35Å; L102-P313 HydrophobicContact CD2-CB 3.95Å; L102-P313 HydrophobicContact CD2-CG 3.56Å; L102-V315 HydrophobicContact CD1-CG2 4.42Å
103	I	98.2	Very high	97.7	Very high	1 Å²	1	45.1 Å²	45.1	1%	0.005	22%	0.217	C	C	.	.	H	α-helix	trans	-58.8	-39.6	177.9	-66.7	167.6	0	0	0	111.5	V99 V100 F182 L186 K191 L288 L342 L346	V99-I103 HydrophobicContact CG1-CD1 3.94Å; V99-I103 WeakPolarHBondContact O-CG1 3.48Å; V99-I103 PolarHBondContact O-N 3.43Å; V100-I103 PolarHBondContact O-N 3.35Å; I103-F182 HydrophobicContact CD1-CZ 4.36Å; I103-L186 HydrophobicContact CG2-CD2 3.87Å; I103-K191 PolarHBondContact O-NZ 2.78Å; I103-L288 HydrophobicContact CG1-CD2 4.1Å; I103-L342 HydrophobicContact CD1-CD1 4.49Å; I103-L346 HydrophobicContact CB-CD2 4.17Å; I103-L346 HydrophobicContact CD1-CD1 4.37Å; I103-L346 HydrophobicContact CG2-CD1 3.83Å; I103-L346 HydrophobicContact CG2-CD2 3.85Å
104	K	97.3	Very high	97.7	Very high	104 Å²	104	42.5 Å²	42.5	45%	0.452	21%	0.207	S	C	.	.	H	α-helix	trans	-64.6	-42	176.5	-74.6	178.3	-178.7	-179.9	0	112.6	V100 N101 L102 K191 L346	V100-K104 HydrophobicContact CG1-CD 4.29Å; V100-K104 WeakPolarHBondContact O-CG 3.23Å; V100-K104 PolarHBondContact O-N 2.98Å; N101-K104 PolarHBondContact O-N 3.3Å; L102-K104 VanDerWaalsContact C-N 3.28Å; L102-K104 PolarHBondContact O-N 2.97Å; K104-K191 PolarHBondContact O-NZ 3.15Å; K104-L346 HydrophobicContact CD-CD2 4.36Å; K104-L346 HydrophobicContact CG-CD2 3.63Å
105	Q	97.8	Very high	97.7	Very high	135 Å²	135	39.9 Å²	39.9	63%	0.631	20%	0.196	S	C	*	.	H	α-helix	trans	-85.4	-36.2	-172.4	-69.4	174.3	5.2	0	0	113.4	N101 L102	N101-Q105 WeakPolarHBondContact O-CB 3.44Å; N101-Q105 VanDerWaalsContact O-CG 3.28Å; N101-Q105 WeakPolarHBondContact O-CG 3.39Å; N101-Q105 PolarHBondContact O-N 3.41Å; L102-Q105 PolarHBondContact O-N 3.24Å; L102-Q105 VanDerWaalsContact O-N 3.14Å
106	S	98.5	Very high	97.7	Very high	7 Å²	7	37.9 Å²	37.9	5%	0.049	19%	0.188	C	C	.	.			trans	-63.6	144.9	-179.2	-67.8	0	0	0	0	112.1	L102 K191 D287 L288	L102-S106 VanDerWaalsContact O-CB 3.23Å; L102-S106 WeakPolarHBondContact O-CB 3.44Å; L102-S106 PolarHBondContact O-N 3.45Å; L102-S106 PolarHBondContact O-OG 3.08Å; S106-K191 PolarHBondContact O-NZ 3Å; S106-D287 VanDerWaalsContact CB-OD1 3.25Å; S106-D287 WeakPolarHBondContact CB-OD1 3.43Å; S106-L288 WeakPolarHBondContact OG-CB 3.4Å
107	K	98.3	Very high	97.7	Very high	144 Å²	144	35.7 Å²	35.7	63%	0.626	18%	0.177	S	C	*	.	S	Bend	trans	-121.3	-15.2	-178.5	-61.2	-177.6	-177.7	179.4	0	112.3	K191 D287	K107-K191 CarbonylContact C-O 3.56Å; K107-K191 VanDerWaalsContact O-O 3.14Å; K107-D287 PolarHBondContact N-OD1 3.17Å; K107-D287 PolarHBondContact N-OD2 3.43Å
108	R	98.6	Very high	97.6	Very high	96 Å²	96	31.6 Å²	31.6	36%	0.362	16%	0.155	S	C	.	.	S	Bend	trans	-137.8	66.3	-173.8	-65.3	-176.4	-55.3	-74.4	-13.4	109.3	L193 E285 A286 D287	R108-L193 HydrophobicContact CB-CB 4.11Å; R108-L193 HydrophobicContact CB-CD2 4.23Å; R108-E285 PolarHBondContact NE-O 3.36Å; R108-E285 PolarHBondContact NH2-O 2.72Å; R108-A286 WeakPolarHBondContact O-CA 3.31Å; R108-D287 WeakPolarHBondContact CA-OD1 3.47Å; R108-D287 PolarHBondContact N-OD1 3Å; R108-D287 PolarHBondContact N-OD2 3.3Å; R108-D287 IonicContact NH2-OD2 3.12Å; R108-D287 PolarHBondContact O-N 3.31Å
109	V	98.8	Very high	97.4	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	123.5	-177.2	-174.2	0	0	0	0	109.9	V111 K191 L193 R194 L288 L290	V109-V111 HydrophobicContact CG1-CG2 4.01Å; V109-K191 HydrophobicContact CG2-CB 4.36Å; V109-K191 PolarHBondContact N-O 3.01Å; V109-L193 WeakPolarHBondContact O-CB 2.84Å; V109-L193 PolarHBondContact O-N 3.45Å; V109-R194 PolarHBondContact O-N 3.06Å; V109-L288 WeakPolarHBondContact CA-O 3.38Å; V109-L288 HydrophobicContact CG1-CB 4.36Å; V109-L288 HydrophobicContact CG1-CD2 4.09Å; V109-L288 HydrophobicContact CG1-CG 4.19Å; V109-L288 HydrophobicContact CG2-CB 4.27Å; V109-L288 HydrophobicContact CG2-CD2 4.07Å; V109-L290 HydrophobicContact CG1-CD1 4.03Å; V109-L290 HydrophobicContact CG1-CG 4.03Å
110	I	98.8	Very high	97.2	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	131.1	164.1	-66.8	-176.4	0	0	0	108.5	L193 R194 Y196 D282 A286 L288 L289 L290 L308	I110-L193 HydrophobicContact CD1-CD2 4.28Å; I110-L193 HydrophobicContact CG1-CB 4.44Å; I110-L193 HydrophobicContact CG1-CD2 3.96Å; I110-L193 HydrophobicContact CG1-CG 4.49Å; I110-R194 WeakPolarHBondContact CA-O 3.32Å; I110-Y196 HydrophobicContact CD1-CE2 4.41Å; I110-Y196 HydrophobicContact CG2-CD2 3.78Å; I110-Y196 HydrophobicContact CG2-CE2 4.13Å; I110-D282 HydrophobicContact CD1-CB 3.99Å; I110-A286 HydrophobicContact CD1-CB 3.57Å; I110-A286 HydrophobicContact CG1-CB 3.86Å; I110-L288 PolarHBondContact N-O 3.21Å; I110-L289 HydrophobicContact CB-CD1 4.01Å; I110-L289 HydrophobicContact CG2-CD1 3.61Å; I110-L289 WeakPolarHBondContact O-CA 3.29Å; I110-L290 PolarHBondContact O-N 2.85Å; I110-L308 HydrophobicContact CD1-CD2 4.02Å
111	V	98.8	Very high	96.9	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	118.9	172.9	-175.3	0	0	0	0	109.4	V109 T113 I183 L186 L192 R194 N195 Y196 L290 I292	V109-V111 HydrophobicContact CG1-CG2 4.01Å; V111-T113 HydrophobicContact CG1-CG2 4Å; V111-I183 HydrophobicContact CG1-CD1 3.86Å; V111-I183 HydrophobicContact CG1-CG1 4.12Å; V111-L186 HydrophobicContact CG2-CD1 4.08Å; V111-L192 HydrophobicContact CB-CD1 4.18Å; V111-L192 HydrophobicContact CG2-CD1 3.6Å; V111-R194 PolarHBondContact N-O 3.47Å; V111-N195 HydrophobicContact CB-CB 4.46Å; V111-N195 CarbonylContact O-C 3.4Å; V111-N195 WeakPolarHBondContact O-CA 3.5Å; V111-N195 PolarHBondContact O-ND2 3.37Å; V111-Y196 PolarHBondContact O-N 3.34Å; V111-L290 CarbonylContact C-O 3.1Å; V111-L290 WeakPolarHBondContact CA-O 3.1Å; V111-L290 HydrophobicContact CG2-CB 4.41Å; V111-L290 HydrophobicContact CG2-CD1 4.35Å; V111-I292 HydrophobicContact CG1-CD1 3.4Å; V111-I292 VanDerWaalsContact CG1-CD1 3.4Å; V111-I292 HydrophobicContact CG1-CG1 4.24Å
112	L	98.7	Very high	96.6	Very high	0 Å²	0	34 Å²	34	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	113	175.3	-168.6	169.7	0	0	0	109.4	Y196 L289 L290 V291 I292 L296 V301 I304	L112-Y196 CarbonylContact C-O 3.37Å; L112-Y196 VanDerWaalsContact CA-O 3.3Å; L112-Y196 WeakPolarHBondContact CA-O 3.47Å; L112-L289 HydrophobicContact CB-CD1 4.4Å; L112-L290 PolarHBondContact N-O 2.76Å; L112-V291 HydrophobicContact CB-CG2 4.36Å; L112-I292 PolarHBondContact O-N 3.24Å; L112-L296 HydrophobicContact CD1-CD2 3.68Å; L112-L296 HydrophobicContact CD2-CD2 3.61Å; L112-L296 HydrophobicContact CG-CD2 4.33Å; L112-V301 HydrophobicContact CD1-CG1 4.12Å; L112-V301 HydrophobicContact CD2-CG1 4.31Å; L112-V301 HydrophobicContact CG-CG1 4.24Å; L112-I304 HydrophobicContact CD1-CB 3.99Å; L112-I304 HydrophobicContact CD1-CD1 3.93Å; L112-I304 HydrophobicContact CD1-CG1 4.48Å; L112-I304 HydrophobicContact CD1-CG2 4.25Å
113	T	98.5	Very high	96.1	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	150	-178.4	46.3	0	0	0	0	112.6	V111 V117 I183 N195 Y196 T197 Q198 I292	V111-T113 HydrophobicContact CG1-CG2 4Å; T113-V117 HydrophobicContact CG2-CG1 3.86Å; T113-V117 HydrophobicContact CG2-CG2 4.31Å; T113-I183 HydrophobicContact CG2-CD1 3.74Å; T113-N195 PolarHBondContact OG1-ND2 2.75Å; T113-N195 VanDerWaalsContact OG1-ND2 3.09Å; T113-Y196 PolarHBondContact N-O 2.85Å; T113-T197 VanDerWaalsContact OG1-CA 3.3Å; T113-T197 WeakPolarHBondContact OG1-CA 3.29Å; T113-T197 WeakPolarHBondContact OG1-CB 3.47Å; T113-T197 PolarHBondContact OG1-OG1 3.49Å; T113-T197 VanDerWaalsContact OG1-OG1 3.06Å; T113-Q198 PolarHBondContact O-N 2.73Å; T113-Q198 PolarHBondContact O-NE2 2.97Å; T113-Q198 VanDerWaalsContact O-NE2 3.08Å; T113-I292 WeakPolarHBondContact CA-O 3.15Å; T113-I292 HydrophobicContact CG2-CB 4.36Å
114	G	96.9	Very high	95.6	Very high	2 Å²	2	36.7 Å²	36.7	2%	0.021	20%	0.204	C	C	.	.			trans	-135.3	-171.2	167.6	0	0	0	0	0	111.3	G116 V117 N199 I292 G293	G114-G116 PolarHBondContact O-N 3.38Å; G114-V117 WeakPolarHBondContact O-CG2 3.4Å; G114-V117 PolarHBondContact O-N 2.6Å; G114-V117 VanDerWaalsContact O-N 3.13Å; G114-N199 PolarHBondContact O-ND2 3.3Å; G114-N199 PolarHBondContact O-OD1 3.3Å; G114-I292 PolarHBondContact N-O 3.28Å; G114-I292 VanDerWaalsContact N-O 3.11Å; G114-G293 CarbonylContact C-O 3.56Å; G114-G293 WeakPolarHBondContact CA-O 3.27Å
115	A	94.2	Very high	95	Very high	21 Å²	21	32.9 Å²	32.9	17%	0.174	19%	0.189	C	C	.	.	G	3₁₀ helix	trans	-55.9	-24.2	-169.8	0	0	0	0	0	114.5	V117 S118 V119 D125 F126 N199 G293	A115-V117 PolarHBondContact O-N 3.03Å; A115-V117 VanDerWaalsContact O-N 3.14Å; A115-S118 PolarHBondContact O-N 3.46Å; A115-V119 PolarHBondContact O-N 2.76Å; A115-D125 HydrophobicContact CB-CB 3.88Å; A115-F126 HydrophobicContact CB-CD2 4.04Å; A115-F126 HydrophobicContact CB-CE2 4.3Å; A115-N199 VanDerWaalsContact CA-OD1 3.25Å; A115-N199 WeakPolarHBondContact CA-OD1 3.42Å; A115-N199 PolarHBondContact N-OD1 3.28Å; A115-G293 PolarHBondContact N-O 3.49Å
116	G	95.2	Very high	94.2	Very high	22 Å²	22	29 Å²	29	23%	0.227	17%	0.17	C	C	.	.	G	3₁₀ helix	trans	-56.9	-27.5	178.7	0	0	0	0	0	114.4	G114 S118 G293	G114-G116 PolarHBondContact O-N 3.38Å; G116-S118 VanDerWaalsContact C-N 3.27Å; G116-S118 PolarHBondContact O-N 3.43Å; G116-G293 WeakPolarHBondContact CA-O 3.47Å; G116-G293 PolarHBondContact N-O 2.85Å
117	V	96.5	Very high	93.2	Very high	1 Å²	1	33.2 Å²	33.2	1%	0.006	19%	0.185	C	C	.	.	G	3₁₀ helix	trans	-74.7	-16.8	178.1	-54.3	0	0	0	0	113.9	T113 G114 A115 S177 T179 H180 N199 I292	T113-V117 HydrophobicContact CG2-CG1 3.86Å; T113-V117 HydrophobicContact CG2-CG2 4.31Å; G114-V117 WeakPolarHBondContact O-CG2 3.4Å; G114-V117 PolarHBondContact O-N 2.6Å; G114-V117 VanDerWaalsContact O-N 3.13Å; A115-V117 PolarHBondContact O-N 3.03Å; A115-V117 VanDerWaalsContact O-N 3.14Å; V117-S177 WeakPolarHBondContact O-CB 3.3Å; V117-S177 PolarHBondContact O-OG 2.75Å; V117-T179 HydrophobicContact CB-CG2 4.1Å; V117-T179 HydrophobicContact CG1-CG2 3.72Å; V117-H180 PolarHBondContact O-CE1 2.98Å; V117-H180 VanDerWaalsContact O-CE1 3.32Å; V117-N199 VanDerWaalsContact CG2-ND2 3.3Å; V117-N199 WeakPolarHBondContact CG2-ND2 3.06Å; V117-I292 HydrophobicContact CG1-CB 4.13Å; V117-I292 HydrophobicContact CG1-CG2 3.58Å
118	S	95.1	Very high	92.4	Very high	2 Å²	2	28.9 Å²	28.9	1%	0.014	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.1	-4.5	-177.9	-57.1	0	0	0	0	113.2	A115 G116 S120 C121 I123 N199 D201	A115-S118 PolarHBondContact O-N 3.46Å; G116-S118 VanDerWaalsContact C-N 3.27Å; G116-S118 PolarHBondContact O-N 3.43Å; S118-S120 VanDerWaalsContact C-N 3.34Å; S118-S120 PolarHBondContact O-N 2.94Å; S118-C121 WeakPolarHBondContact O-CA 3.14Å; S118-C121 WeakPolarHBondContact O-CB 3.42Å; S118-C121 PolarHBondContact O-N 3.02Å; S118-I123 PolarHBondContact O-N 3.13Å; S118-N199 PolarHBondContact OG-ND2 3.48Å; S118-D201 WeakPolarHBondContact CB-OD2 3.19Å; S118-D201 PolarHBondContact OG-OD2 3.16Å
119	V	93.2	Very high	91.5	Very high	37 Å²	37	33.9 Å²	33.9	22%	0.224	20%	0.197	C	C	.	.	G	3₁₀ helix	trans	-60.6	-42.2	-179.5	175.2	0	0	0	0	111.9	A115 C121 G122 I123 D125	A115-V119 PolarHBondContact O-N 2.76Å; V119-C121 PolarHBondContact O-N 3.14Å; V119-G122 PolarHBondContact O-N 2.89Å; V119-I123 WeakPolarHBondContact CA-O 3.45Å; V119-D125 HydrophobicContact CG2-CB 4.02Å
120	S	92.7	Very high	90.6	Very high	63 Å²	63	36 Å²	36	44%	0.441	22%	0.219	S	C	.	.	G	3₁₀ helix	trans	-71.8	-13.2	176.8	59.5	0	0	0	0	113.6	S118 G122 S177 D336	S118-S120 VanDerWaalsContact C-N 3.34Å; S118-S120 PolarHBondContact O-N 2.94Å; S120-G122 VanDerWaalsContact C-N 3.28Å; S120-S177 VanDerWaalsContact OG-CB 3.32Å; S120-S177 WeakPolarHBondContact OG-CB 3.48Å; S120-D336 WeakPolarHBondContact CB-OD2 3.34Å; S120-D336 PolarHBondContact OG-OD2 3.48Å
121	C	92.4	Very high	89.7	Confident	22 Å²	22	36.1 Å²	36.1	15%	0.149	22%	0.22	C	C	.	.	G	3₁₀ helix	trans	-79.4	-13.3	175.2	-56.5	0	0	0	0	112.3	S118 V119 F174 S175 S177 L203	S118-C121 WeakPolarHBondContact O-CA 3.14Å; S118-C121 WeakPolarHBondContact O-CB 3.42Å; S118-C121 PolarHBondContact O-N 3.02Å; V119-C121 PolarHBondContact O-N 3.14Å; C121-F174 VanDerWaalsContact O-CD1 3.26Å; C121-F174 WeakPolarHBondContact O-CD1 3.21Å; C121-S175 PolarHBondContact SG-O 2.94Å; C121-S177 PolarHBondContact SG-N 2.84Å; C121-L203 HydrophobicContact CB-CD1 3.82Å
122	G	90.8	Very high	88.8	Confident	51 Å²	51	36.6 Å²	36.6	53%	0.526	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	101.1	6.5	-174	0	0	0	0	0	114	V119 S120 P124	V119-G122 PolarHBondContact O-N 2.89Å; S120-G122 VanDerWaalsContact C-N 3.28Å; G122-P124 WeakPolarHBondContact O-CD 3.35Å
123	I	89.5	Confident	88	Confident	15 Å²	15	38.2 Å²	38.2	8%	0.077	23%	0.229	C	C	.	.			trans	-98.9	109	175.3	-55.2	177.9	0	0	0	107.9	S118 V119 I169 F174 D201 L203	S118-I123 PolarHBondContact O-N 3.13Å; V119-I123 WeakPolarHBondContact CA-O 3.45Å; I123-I169 HydrophobicContact CG2-CG2 4.16Å; I123-F174 HydrophobicContact CD1-CB 4.35Å; I123-F174 HydrophobicContact CD1-CD1 4.35Å; I123-F174 HydrophobicContact CD1-CD2 3.66Å; I123-F174 HydrophobicContact CD1-CE2 4.01Å; I123-F174 HydrophobicContact CD1-CG 3.84Å; I123-F174 HydrophobicContact CD1-CZ 4.47Å; I123-F174 HydrophobicContact CG1-CD1 3.74Å; I123-F174 HydrophobicContact CG1-CD2 3.79Å; I123-F174 HydrophobicContact CG1-CE1 3.73Å; I123-F174 HydrophobicContact CG1-CE2 3.8Å; I123-F174 HydrophobicContact CG1-CG 3.75Å; I123-F174 HydrophobicContact CG1-CZ 3.75Å; I123-D201 HydrophobicContact CD1-CB 3.59Å; I123-L203 HydrophobicContact CD1-CD1 4.01Å
124	P	86.3	Confident	87.3	Confident	48 Å²	48	43.5 Å²	43.5	31%	0.312	25%	0.254	S	S	.	.			trans	-59.1	146.1	177.2	-21.3	32.8	0	0	0	110.8	G122 I135	G122-P124 WeakPolarHBondContact O-CD 3.35Å; P124-I135 HydrophobicContact CG-CD1 4.08Å
125	D	85.5	Confident	86.6	Confident	25 Å²	25	46.4 Å²	46.4	13%	0.134	27%	0.268	C	S	.	.			trans	-65.8	167	167.7	75.6	53.1	0	0	0	110.6	A115 V119 R127 S128 G131 L132	A115-D125 HydrophobicContact CB-CB 3.88Å; V119-D125 HydrophobicContact CG2-CB 4.02Å; D125-R127 PolarHBondContact OD1-N 3.43Å; D125-S128 WeakPolarHBondContact OD1-CB 3.47Å; D125-S128 PolarHBondContact OD1-N 2.89Å; D125-S128 PolarHBondContact OD1-OG 2.92Å; D125-S128 WeakPolarHBondContact OD2-CB 3.44Å; D125-S128 PolarHBondContact OD2-OG 3.43Å; D125-G131 CarbonylContact O-C 3.5Å; D125-G131 WeakPolarHBondContact O-CA 3.36Å; D125-L132 PolarHBondContact O-N 3.33Å
126	F	80.4	Confident	86	Confident	53 Å²	53	45.6 Å²	45.6	23%	0.232	26%	0.261	C	S	.	.	S	Bend	trans	-71.6	-39.7	-174.9	-70.9	-86	0	0	0	113.6	A115 L132 Y133 F150 F165	A115-F126 HydrophobicContact CB-CD2 4.04Å; A115-F126 HydrophobicContact CB-CE2 4.3Å; F126-L132 HydrophobicContact CD1-CB 4.34Å; F126-L132 HydrophobicContact CD1-CD2 3.54Å; F126-L132 HydrophobicContact CE1-CD2 3.41Å; F126-L132 VanDerWaalsContact CE1-CD2 3.41Å; F126-L132 HydrophobicContact CZ-CD2 4.41Å; F126-Y133 HydrophobicContact CB-CD1 4.46Å; F126-Y133 HydrophobicContact CB-CD2 4.45Å; F126-Y133 HydrophobicContact CB-CE1 4.07Å; F126-Y133 HydrophobicContact CB-CE2 4.03Å; F126-Y133 HydrophobicContact CD1-CD1 4.26Å; F126-Y133 AromaticContact CD1-CE1 3.59Å; F126-Y133 HydrophobicContact CD1-CE1 3.59Å; F126-Y133 AromaticContact CD1-CZ 3.95Å; F126-Y133 HydrophobicContact CG-CE1 4.29Å; F126-Y133 WeakPolarHBondContact O-CB 3.42Å; F126-Y133 WeakPolarHBondContact O-CD2 3.36Å; F126-Y133 PolarHBondContact O-N 3.32Å; F126-Y133 VanDerWaalsContact O-N 3.16Å; F126-F150 HydrophobicContact CD1-CE2 4.37Å; F126-F150 AromaticContact CE1-CE2 3.79Å; F126-F150 HydrophobicContact CE1-CE2 3.79Å; F126-F150 AromaticContact CE1-CZ 3.81Å; F126-F150 HydrophobicContact CE1-CZ 3.81Å; F126-F150 HydrophobicContact CZ-CZ 4.46Å; F126-F165 HydrophobicContact CE1-CZ 4.41Å
127	R	78.2	Confident	85.5	Confident	96 Å²	96	48.8 Å²	48.8	36%	0.362	27%	0.269	S	S	.	.	S	Bend	trans	-114.9	-19.1	-154.7	-66.9	-178.7	-179.5	124.2	1.1	114.5	D125 Y133 S295	D125-R127 PolarHBondContact OD1-N 3.43Å; R127-Y133 HydrophobicContact CG-CD2 4.13Å; R127-Y133 HydrophobicContact CG-CE2 3.79Å; R127-S295 PolarHBondContact NH1-OG 3.38Å
128	S	80.7	Confident	85	Confident	53 Å²	53	53.1 Å²	53.1	37%	0.371	30%	0.3	S	S	.	.	S	Bend	trans	-69.7	165.6	178.4	-61.8	0	0	0	0	110.9	D125 G130 G131	D125-S128 WeakPolarHBondContact OD1-CB 3.47Å; D125-S128 PolarHBondContact OD1-N 2.89Å; D125-S128 PolarHBondContact OD1-OG 2.92Å; D125-S128 WeakPolarHBondContact OD2-CB 3.44Å; D125-S128 PolarHBondContact OD2-OG 3.43Å; S128-G130 PolarHBondContact O-N 3.02Å; S128-G131 VanDerWaalsContact O-CA 3.3Å; S128-G131 WeakPolarHBondContact O-CA 3.41Å; S128-G131 PolarHBondContact O-N 3.38Å
129	K	80.1	Confident	84.6	Confident	201 Å²	201	57 Å²	57	87%	0.874	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	131.1	170.3	-172.5	179.4	-179.2	-178.7	0	110.3	G131	K129-G131 PolarHBondContact O-N 3.11Å
130	G	79.6	Confident	84.3	Confident	44 Å²	44	55.7 Å²	55.7	45%	0.454	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.8	5.8	-170.6	0	0	0	0	0	114	S128 E134	S128-G130 PolarHBondContact O-N 3.02Å; G130-E134 PolarHBondContact N-OE2 2.79Å
131	G	80.3	Confident	84	Confident	2 Å²	2	57 Å²	57	2%	0.021	32%	0.315	C	S	.	.	S	Bend	trans	-69.8	174.1	175.4	0	0	0	0	0	112.4	D125 S128 K129 Y133 E134 I135	D125-G131 CarbonylContact O-C 3.5Å; D125-G131 WeakPolarHBondContact O-CA 3.36Å; S128-G131 VanDerWaalsContact O-CA 3.3Å; S128-G131 WeakPolarHBondContact O-CA 3.41Å; S128-G131 PolarHBondContact O-N 3.38Å; K129-G131 PolarHBondContact O-N 3.11Å; G131-Y133 PolarHBondContact O-N 2.82Å; G131-E134 PolarHBondContact O-N 2.86Å; G131-E134 VanDerWaalsContact O-N 3.14Å; G131-I135 PolarHBondContact O-N 2.82Å
132	L	79.3	Confident	83.7	Confident	10 Å²	10	61.5 Å²	61.5	5%	0.052	33%	0.334	C	S	.	.	H	α-helix	trans	-57.8	-36.5	-173.7	-172	80.1	0	0	0	113.1	D125 F126 E134 I135 L136 F165	D125-L132 PolarHBondContact O-N 3.33Å; F126-L132 HydrophobicContact CD1-CB 4.34Å; F126-L132 HydrophobicContact CD1-CD2 3.54Å; F126-L132 HydrophobicContact CE1-CD2 3.41Å; F126-L132 VanDerWaalsContact CE1-CD2 3.41Å; F126-L132 HydrophobicContact CZ-CD2 4.41Å; L132-E134 VanDerWaalsContact C-N 3.34Å; L132-E134 PolarHBondContact O-N 3.39Å; L132-I135 PolarHBondContact O-N 3.26Å; L132-L136 HydrophobicContact CD2-CD1 3.89Å; L132-L136 HydrophobicContact CG-CD1 3.8Å; L132-L136 HydrophobicContact CG-CG 4.22Å; L132-L136 WeakPolarHBondContact O-CB 3.47Å; L132-L136 VanDerWaalsContact O-CG 3.28Å; L132-L136 WeakPolarHBondContact O-CG 3.39Å; L132-L136 PolarHBondContact O-N 2.84Å; L132-F165 HydrophobicContact CD1-CD2 3.73Å; L132-F165 HydrophobicContact CD1-CE2 3.64Å; L132-F165 HydrophobicContact CD2-CD2 3.52Å; L132-F165 HydrophobicContact CD2-CE2 3.05Å; L132-F165 HydrophobicContact CD2-CZ 3.78Å; L132-F165 HydrophobicContact CG-CD2 4.04Å; L132-F165 HydrophobicContact CG-CE2 3.88Å
133	Y	82.1	Confident	83.4	Confident	34 Å²	34	59.3 Å²	59.3	13%	0.133	31%	0.31	C	S	.	.	H	α-helix	trans	-63.6	-37.6	179.8	-71.6	-11.8	0	0	0	113.2	F126 R127 G131 L136 H137 P146 Q147	F126-Y133 HydrophobicContact CB-CD1 4.46Å; F126-Y133 HydrophobicContact CB-CD2 4.45Å; F126-Y133 HydrophobicContact CB-CE1 4.07Å; F126-Y133 HydrophobicContact CB-CE2 4.03Å; F126-Y133 HydrophobicContact CD1-CD1 4.26Å; F126-Y133 AromaticContact CD1-CE1 3.59Å; F126-Y133 HydrophobicContact CD1-CE1 3.59Å; F126-Y133 AromaticContact CD1-CZ 3.95Å; F126-Y133 HydrophobicContact CG-CE1 4.29Å; F126-Y133 WeakPolarHBondContact O-CB 3.42Å; F126-Y133 WeakPolarHBondContact O-CD2 3.36Å; F126-Y133 PolarHBondContact O-N 3.32Å; F126-Y133 VanDerWaalsContact O-N 3.16Å; R127-Y133 HydrophobicContact CG-CD2 4.13Å; R127-Y133 HydrophobicContact CG-CE2 3.79Å; G131-Y133 PolarHBondContact O-N 2.82Å; Y133-L136 PolarHBondContact O-N 2.8Å; Y133-H137 WeakPolarHBondContact O-CB 3.43Å; Y133-H137 PolarHBondContact O-N 2.88Å; Y133-P146 HydrophobicContact CD1-CB 3.42Å; Y133-P146 VanDerWaalsContact CD1-CB 3.42Å; Y133-P146 HydrophobicContact CD2-CB 4.34Å; Y133-P146 HydrophobicContact CE1-CB 4.22Å; Y133-P146 HydrophobicContact CG-CB 3.51Å; Y133-P146 HydrophobicContact CG-CG 4.17Å; Y133-P146 WeakPolarHBondContact O-CG 3.39Å; Y133-Q147 HydrophobicContact CE1-CG 4.23Å; Y133-Q147 HydrophobicContact CE2-CG 3.76Å; Y133-Q147 VanDerWaalsContact CZ-CG 3.47Å; Y133-Q147 VanDerWaalsContact OH-CG 3.23Å; Y133-Q147 WeakPolarHBondContact OH-CG 3.25Å
134	E	83.9	Confident	83	Confident	112 Å²	112	64.3 Å²	64.3	52%	0.523	35%	0.346	S	S	.	.	H	α-helix	trans	-68.7	-42.3	175.3	-168.7	174	170.6	0	0	110.9	G130 G131 L132 L136 H137 S138	G130-E134 PolarHBondContact N-OE2 2.79Å; G131-E134 PolarHBondContact O-N 2.86Å; G131-E134 VanDerWaalsContact O-N 3.14Å; L132-E134 VanDerWaalsContact C-N 3.34Å; L132-E134 PolarHBondContact O-N 3.39Å; E134-L136 PolarHBondContact O-N 2.72Å; E134-H137 PolarHBondContact O-N 3.35Å; E134-S138 PolarHBondContact O-N 3.32Å
135	I	82.1	Confident	82.9	Confident	63 Å²	63	65 Å²	65	32%	0.323	35%	0.347	S	S	.	.	H	α-helix	trans	-60.5	-45.1	175.4	-62.1	170.5	0	0	0	110.6	P124 G131 L132 S138 K139	P124-I135 HydrophobicContact CG-CD1 4.08Å; G131-I135 PolarHBondContact O-N 2.82Å; L132-I135 PolarHBondContact O-N 3.26Å; I135-S138 PolarHBondContact O-N 3.35Å; I135-S138 PolarHBondContact O-OG 3.27Å; I135-K139 PolarHBondContact O-N 3.13Å
136	L	83.2	Confident	82.6	Confident	4 Å²	4	64.7 Å²	64.7	2%	0.021	35%	0.347	C	S	.	.	H	α-helix	trans	-67.8	-42	179.6	-73	168.3	0	0	0	112.4	L132 Y133 E134 S138 K139 F140 I149 F165	L132-L136 HydrophobicContact CD2-CD1 3.89Å; L132-L136 HydrophobicContact CG-CD1 3.8Å; L132-L136 HydrophobicContact CG-CG 4.22Å; L132-L136 WeakPolarHBondContact O-CB 3.47Å; L132-L136 VanDerWaalsContact O-CG 3.28Å; L132-L136 WeakPolarHBondContact O-CG 3.39Å; L132-L136 PolarHBondContact O-N 2.84Å; Y133-L136 PolarHBondContact O-N 2.8Å; E134-L136 PolarHBondContact O-N 2.72Å; L136-S138 PolarHBondContact O-N 3.3Å; L136-K139 PolarHBondContact O-N 3.05Å; L136-F140 HydrophobicContact CD2-CD2 4.41Å; L136-F140 HydrophobicContact CD2-CE2 4.45Å; L136-F140 PolarHBondContact O-N 3.24Å; L136-I149 HydrophobicContact CD1-CD1 3.41Å; L136-I149 VanDerWaalsContact CD1-CD1 3.41Å; L136-I149 HydrophobicContact CD1-CG1 4.26Å; L136-I149 HydrophobicContact CD2-CD1 4.38Å; L136-F165 HydrophobicContact CD2-CB 4Å
137	H	84.7	Confident	82.8	Confident	88 Å²	88	64.9 Å²	64.9	41%	0.407	35%	0.348	S	S	.	.	H	α-helix	trans	-60.7	-36	176.3	-171.5	71.3	0	0	0	111.6	Y133 E134 K139 F140 P141 L143 P146	Y133-H137 WeakPolarHBondContact O-CB 3.43Å; Y133-H137 PolarHBondContact O-N 2.88Å; E134-H137 PolarHBondContact O-N 3.35Å; H137-K139 VanDerWaalsContact C-N 3.33Å; H137-K139 PolarHBondContact O-N 3.17Å; H137-F140 CarbonylContact O-C 3.44Å; H137-F140 PolarHBondContact O-N 3.49Å; H137-P141 WeakPolarHBondContact O-CA 3.49Å; H137-P141 VanDerWaalsContact O-N 3.17Å; H137-L143 PolarHBondContact ND1-O 2.93Å; H137-L143 VanDerWaalsContact ND1-O 3.12Å; H137-P146 HydrophobicContact CB-CG 4.32Å
138	S	85.5	Confident	83.3	Confident	93 Å²	93	61.9 Å²	61.9	65%	0.65	34%	0.341	S	S	*	.	H	α-helix	trans	-65.7	-32.5	174.1	79.4	0	0	0	0	113.7	E134 I135 L136	E134-S138 PolarHBondContact O-N 3.32Å; I135-S138 PolarHBondContact O-N 3.35Å; I135-S138 PolarHBondContact O-OG 3.27Å; L136-S138 PolarHBondContact O-N 3.3Å
139	K	86	Confident	83.7	Confident	83 Å²	83	59.4 Å²	59.4	36%	0.361	32%	0.323	S	S	.	.	H	α-helix	trans	-85.1	-27.1	179	-69.6	-178.9	178.1	179.5	0	113.1	I135 L136 H137 V164 E168	I135-K139 PolarHBondContact O-N 3.13Å; L136-K139 PolarHBondContact O-N 3.05Å; H137-K139 VanDerWaalsContact C-N 3.33Å; H137-K139 PolarHBondContact O-N 3.17Å; K139-V164 HydrophobicContact CD-CG1 4.08Å; K139-E168 IonicContact NZ-OE1 3.86Å; K139-E168 PolarHBondContact NZ-OE1 2.61Å
140	F	88	Confident	84.2	Confident	9 Å²	9	50.6 Å²	50.6	4%	0.039	29%	0.285	C	S	.	.			trans	-137.8	70.3	-174.5	-58.8	-74.1	0	0	0	110	L136 H137 E142 L143 P161 V164	L136-F140 HydrophobicContact CD2-CD2 4.41Å; L136-F140 HydrophobicContact CD2-CE2 4.45Å; L136-F140 PolarHBondContact O-N 3.24Å; H137-F140 CarbonylContact O-C 3.44Å; H137-F140 PolarHBondContact O-N 3.49Å; F140-E142 WeakPolarHBondContact CA-OE2 3.32Å; F140-E142 WeakPolarHBondContact CD1-OE1 3.45Å; F140-E142 PolarHBondContact O-N 3.14Å; F140-E142 VanDerWaalsContact O-N 3.11Å; F140-L143 HydrophobicContact CB-CD1 3.65Å; F140-L143 HydrophobicContact CB-CG 3.91Å; F140-L143 HydrophobicContact CG-CD1 4.28Å; F140-L143 WeakPolarHBondContact O-CB 3.34Å; F140-L143 PolarHBondContact O-N 3.34Å; F140-P161 HydrophobicContact CD1-CB 4.19Å; F140-P161 HydrophobicContact CD1-CG 3.83Å; F140-P161 HydrophobicContact CD2-CB 3.99Å; F140-P161 HydrophobicContact CE1-CB 4.12Å; F140-P161 HydrophobicContact CE1-CG 3.83Å; F140-P161 HydrophobicContact CE2-CB 3.92Å; F140-P161 HydrophobicContact CG-CB 4.13Å; F140-P161 HydrophobicContact CG-CG 4.19Å; F140-P161 HydrophobicContact CZ-CB 3.99Å; F140-P161 HydrophobicContact CZ-CG 4.19Å; F140-V164 HydrophobicContact CE2-CB 3.96Å; F140-V164 HydrophobicContact CE2-CG1 3.87Å; F140-V164 HydrophobicContact CZ-CB 3.76Å; F140-V164 HydrophobicContact CZ-CG1 3.95Å; F140-V164 HydrophobicContact CZ-CG2 3.82Å
141	P	85.9	Confident	84.8	Confident	92 Å²	92	51 Å²	51	60%	0.597	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-15.8	-176.5	27.4	-35.9	0	0	0	113.3	H137 L143	H137-P141 WeakPolarHBondContact O-CA 3.49Å; H137-P141 VanDerWaalsContact O-N 3.17Å; P141-L143 PolarHBondContact O-N 3.13Å
142	E	86.3	Confident	85.3	Confident	115 Å²	115	51.3 Å²	51.3	54%	0.537	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70	-17.1	172.8	75	-80.1	-168.7	0	0	113.7	F140 S144	F140-E142 WeakPolarHBondContact CA-OE2 3.32Å; F140-E142 WeakPolarHBondContact CD1-OE1 3.45Å; F140-E142 PolarHBondContact O-N 3.14Å; F140-E142 VanDerWaalsContact O-N 3.11Å; E142-S144 PolarHBondContact O-N 3.2Å
143	L	84	Confident	85.9	Confident	6 Å²	6	58.6 Å²	58.6	3%	0.031	31%	0.309	C	S	.	.			trans	-82.9	106.6	176.6	-65.3	179.3	0	0	0	110	H137 F140 P141 D145 T148 I149 Y154 P161	H137-L143 PolarHBondContact ND1-O 2.93Å; H137-L143 VanDerWaalsContact ND1-O 3.12Å; F140-L143 HydrophobicContact CB-CD1 3.65Å; F140-L143 HydrophobicContact CB-CG 3.91Å; F140-L143 HydrophobicContact CG-CD1 4.28Å; F140-L143 WeakPolarHBondContact O-CB 3.34Å; F140-L143 PolarHBondContact O-N 3.34Å; P141-L143 PolarHBondContact O-N 3.13Å; L143-D145 VanDerWaalsContact C-N 3.32Å; L143-T148 HydrophobicContact CD2-CG2 4.08Å; L143-I149 HydrophobicContact CD1-CG2 3.49Å; L143-I149 VanDerWaalsContact CD1-CG2 3.49Å; L143-Y154 HydrophobicContact CD2-CE1 3.96Å; L143-Y154 HydrophobicContact CD2-CE2 3.78Å; L143-Y154 VanDerWaalsContact CD2-CZ 3.42Å; L143-Y154 WeakPolarHBondContact CD2-OH 3.21Å; L143-P161 HydrophobicContact CD1-CB 4.17Å
144	S	80.9	Confident	86.4	Confident	119 Å²	119	59 Å²	59	83%	0.832	31%	0.311	S	S	*	.	S	Bend	trans	-66.6	-33.5	175.4	58.9	0	0	0	0	113	E142	E142-S144 PolarHBondContact O-N 3.2Å
145	D	84	Confident	86.8	Confident	63 Å²	63	53.7 Å²	53.7	34%	0.337	29%	0.286	S	S	.	.	S	Bend	trans	-126.8	115.7	174.3	178.8	3.8	0	0	0	108.8	L143 Q147 T148	L143-D145 VanDerWaalsContact C-N 3.32Å; D145-Q147 PolarHBondContact O-N 3.42Å; D145-Q147 VanDerWaalsContact O-N 3.13Å; D145-Q147 WeakPolarHBondContact OD1-CB 3.37Å; D145-Q147 WeakPolarHBondContact OD1-CG 3.35Å; D145-Q147 PolarHBondContact OD1-N 3.21Å; D145-Q147 PolarHBondContact OD1-NE2 2.87Å; D145-Q147 VanDerWaalsContact OD1-NE2 3.14Å; D145-Q147 PolarHBondContact OD2-NE2 3.47Å; D145-Q147 VanDerWaalsContact OD2-NE2 3.16Å; D145-T148 WeakPolarHBondContact O-CB 3.49Å; D145-T148 PolarHBondContact O-N 3.05Å; D145-T148 PolarHBondContact O-OG1 3.35Å
146	P	79.7	Confident	87.3	Confident	19 Å²	19	55.3 Å²	55.3	12%	0.123	29%	0.288	C	S	.	.	G	3₁₀ helix	trans	-58.5	-22	177.4	-30.3	40.6	0	0	0	114.3	Y133 H137 T148 I149	Y133-P146 HydrophobicContact CD1-CB 3.42Å; Y133-P146 VanDerWaalsContact CD1-CB 3.42Å; Y133-P146 HydrophobicContact CD2-CB 4.34Å; Y133-P146 HydrophobicContact CE1-CB 4.22Å; Y133-P146 HydrophobicContact CG-CB 3.51Å; Y133-P146 HydrophobicContact CG-CG 4.17Å; Y133-P146 WeakPolarHBondContact O-CG 3.39Å; H137-P146 HydrophobicContact CB-CG 4.32Å; P146-T148 PolarHBondContact O-N 2.91Å; P146-I149 WeakPolarHBondContact O-CG1 3.3Å; P146-I149 PolarHBondContact O-N 2.9Å
147	Q	84.3	Confident	87.7	Confident	56 Å²	56	64.4 Å²	64.4	26%	0.262	32%	0.323	S	S	.	.	G	3₁₀ helix	trans	-61.4	-22.2	172	-70.3	170.1	103.3	0	0	112.9	Y133 D145 I149 F150 F267	Y133-Q147 HydrophobicContact CE1-CG 4.23Å; Y133-Q147 HydrophobicContact CE2-CG 3.76Å; Y133-Q147 VanDerWaalsContact CZ-CG 3.47Å; Y133-Q147 VanDerWaalsContact OH-CG 3.23Å; Y133-Q147 WeakPolarHBondContact OH-CG 3.25Å; D145-Q147 PolarHBondContact O-N 3.42Å; D145-Q147 VanDerWaalsContact O-N 3.13Å; D145-Q147 WeakPolarHBondContact OD1-CB 3.37Å; D145-Q147 WeakPolarHBondContact OD1-CG 3.35Å; D145-Q147 PolarHBondContact OD1-N 3.21Å; D145-Q147 PolarHBondContact OD1-NE2 2.87Å; D145-Q147 VanDerWaalsContact OD1-NE2 3.14Å; D145-Q147 PolarHBondContact OD2-NE2 3.47Å; D145-Q147 VanDerWaalsContact OD2-NE2 3.16Å; Q147-I149 PolarHBondContact O-N 2.74Å; Q147-I149 VanDerWaalsContact O-N 3.1Å; Q147-F150 PolarHBondContact O-N 3.29Å; Q147-F267 HydrophobicContact CB-CE2 3.92Å; Q147-F267 HydrophobicContact CG-CE2 4.35Å
148	T	88.6	Confident	88	Confident	33 Å²	33	62.2 Å²	62.2	20%	0.202	32%	0.315	C	S	.	.	G	3₁₀ helix	trans	-57.8	-24.9	179.6	-56	0	0	0	0	112.7	L143 D145 P146 F150 D151 Y154	L143-T148 HydrophobicContact CD2-CG2 4.08Å; D145-T148 WeakPolarHBondContact O-CB 3.49Å; D145-T148 PolarHBondContact O-N 3.05Å; D145-T148 PolarHBondContact O-OG1 3.35Å; P146-T148 PolarHBondContact O-N 2.91Å; T148-F150 PolarHBondContact O-N 3.29Å; T148-F150 VanDerWaalsContact O-N 3.17Å; T148-D151 WeakPolarHBondContact O-CB 3.45Å; T148-D151 PolarHBondContact O-N 2.93Å; T148-Y154 HydrophobicContact CG2-CD1 3.95Å; T148-Y154 HydrophobicContact CG2-CD2 3.43Å; T148-Y154 VanDerWaalsContact CG2-CD2 3.43Å; T148-Y154 HydrophobicContact CG2-CE2 4.04Å; T148-Y154 HydrophobicContact CG2-CG 3.39Å; T148-Y154 WeakPolarHBondContact O-CB 3.03Å; T148-Y154 WeakPolarHBondContact O-CD1 3.45Å
149	I	90.1	Very high	88.3	Confident	1 Å²	1	58.4 Å²	58.4	1%	0.005	29%	0.288	C	S	.	.	G	3₁₀ helix	trans	-63	-22.4	175.2	73.2	159.8	0	0	0	112.8	L136 L143 P146 Q147 P161 F165 F266	L136-I149 HydrophobicContact CD1-CD1 3.41Å; L136-I149 VanDerWaalsContact CD1-CD1 3.41Å; L136-I149 HydrophobicContact CD1-CG1 4.26Å; L136-I149 HydrophobicContact CD2-CD1 4.38Å; L143-I149 HydrophobicContact CD1-CG2 3.49Å; L143-I149 VanDerWaalsContact CD1-CG2 3.49Å; P146-I149 WeakPolarHBondContact O-CG1 3.3Å; P146-I149 PolarHBondContact O-N 2.9Å; Q147-I149 PolarHBondContact O-N 2.74Å; Q147-I149 VanDerWaalsContact O-N 3.1Å; I149-P161 HydrophobicContact CG2-CB 3.8Å; I149-F165 HydrophobicContact CD1-CB 3.74Å; I149-F165 HydrophobicContact CD1-CD1 3.79Å; I149-F165 HydrophobicContact CD1-CD2 4.3Å; I149-F165 HydrophobicContact CD1-CG 3.63Å; I149-F266 WeakPolarHBondContact O-CE2 3.26Å
150	F	90.2	Very high	88.6	Confident	16 Å²	16	61.7 Å²	61.7	7%	0.07	30%	0.298	C	S	.	.	G	3₁₀ helix	trans	-101.2	12.3	176.2	-57.5	-73.1	0	0	0	112.1	F126 Q147 T148 F162 F165 I200 F266 F267	F126-F150 HydrophobicContact CD1-CE2 4.37Å; F126-F150 AromaticContact CE1-CE2 3.79Å; F126-F150 HydrophobicContact CE1-CE2 3.79Å; F126-F150 AromaticContact CE1-CZ 3.81Å; F126-F150 HydrophobicContact CE1-CZ 3.81Å; F126-F150 HydrophobicContact CZ-CZ 4.46Å; Q147-F150 PolarHBondContact O-N 3.29Å; T148-F150 PolarHBondContact O-N 3.29Å; T148-F150 VanDerWaalsContact O-N 3.17Å; F150-F162 HydrophobicContact CD1-CD2 4.34Å; F150-F162 HydrophobicContact CD1-CE2 4.29Å; F150-F162 HydrophobicContact CE1-CD2 4.28Å; F150-F162 HydrophobicContact CE1-CE2 4.09Å; F150-F165 HydrophobicContact CE1-CD1 4.03Å; F150-F165 AromaticContact CE1-CE1 3.5Å; F150-F165 HydrophobicContact CE1-CE1 3.5Å; F150-F165 HydrophobicContact CE1-CZ 4.23Å; F150-F165 AromaticContact CZ-CD1 3.91Å; F150-F165 HydrophobicContact CZ-CD1 3.91Å; F150-F165 AromaticContact CZ-CE1 3.34Å; F150-F165 HydrophobicContact CZ-CE1 3.34Å; F150-F165 AromaticContact CZ-CZ 3.66Å; F150-F165 HydrophobicContact CZ-CZ 3.66Å; F150-I200 HydrophobicContact CE1-CD1 4.14Å; F150-F266 VanDerWaalsContact C-CD2 3.4Å; F150-F266 HydrophobicContact CD1-CE1 4.33Å; F150-F266 CarbonylContact O-C 3.6Å; F150-F266 WeakPolarHBondContact O-CA 3.41Å; F150-F266 WeakPolarHBondContact O-CB 3.47Å; F150-F266 WeakPolarHBondContact O-CD2 3.27Å; F150-F266 VanDerWaalsContact O-CG 3.26Å; F150-F266 WeakPolarHBondContact O-CG 3.47Å; F150-F267 HydrophobicContact CB-CD2 3.99Å; F150-F267 HydrophobicContact CB-CE2 4.14Å; F150-F267 PolarHBondContact O-N 3.19Å
151	D	91.5	Very high	88.8	Confident	52 Å²	52	61.3 Å²	61.3	28%	0.278	30%	0.296	S	S	.	.	B	Isolated β-bridge	trans	-87.6	125.8	172.7	-179.9	-68.3	0	0	0	110	T148 K153 Y154 F155	T148-D151 WeakPolarHBondContact O-CB 3.45Å; T148-D151 PolarHBondContact O-N 2.93Å; D151-K153 VanDerWaalsContact C-N 3.28Å; D151-K153 PolarHBondContact O-N 3.07Å; D151-K153 VanDerWaalsContact OD1-CA 3.28Å; D151-K153 WeakPolarHBondContact OD1-CA 3.4Å; D151-K153 WeakPolarHBondContact OD1-CB 3.46Å; D151-K153 PolarHBondContact OD1-N 2.66Å; D151-Y154 PolarHBondContact O-N 2.72Å; D151-Y154 PolarHBondContact OD1-N 3.39Å; D151-F155 WeakPolarHBondContact O-CB 3.37Å; D151-F155 PolarHBondContact O-N 3.06Å
152	I	91.6	Very high	89.1	Confident	10 Å²	10	57 Å²	57	5%	0.051	27%	0.268	C	S	.	.	H	α-helix	trans	-66.7	-28	-175	-169.1	58.3	0	0	0	113.2	F155 R156 K261 F266 F267 E269	I152-F155 HydrophobicContact CD1-CD1 4.49Å; I152-R156 VanDerWaalsContact O-CG 3.29Å; I152-R156 WeakPolarHBondContact O-CG 3.43Å; I152-R156 PolarHBondContact O-N 3.06Å; I152-K261 HydrophobicContact CD1-CD 3.95Å; I152-F266 HydrophobicContact CB-CB 4.02Å; I152-F266 HydrophobicContact CD1-CD2 4.38Å; I152-F267 WeakPolarHBondContact CG2-O 3.43Å; I152-F267 PolarHBondContact N-O 3.16Å; I152-E269 HydrophobicContact CB-CG 4.22Å; I152-E269 WeakPolarHBondContact CD1-OE1 3.37Å; I152-E269 HydrophobicContact CG1-CG 4.24Å; I152-E269 HydrophobicContact CG2-CG 4.48Å
153	K	91.7	Very high	89.4	Confident	162 Å²	162	51.7 Å²	51.7	70%	0.704	24%	0.243	S	C	*	.	H	α-helix	trans	-73.3	-43.3	174.8	-58.3	178.3	179.6	176.4	0	109.9	D151 R156 Y157	D151-K153 VanDerWaalsContact C-N 3.28Å; D151-K153 PolarHBondContact O-N 3.07Å; D151-K153 VanDerWaalsContact OD1-CA 3.28Å; D151-K153 WeakPolarHBondContact OD1-CA 3.4Å; D151-K153 WeakPolarHBondContact OD1-CB 3.46Å; D151-K153 PolarHBondContact OD1-N 2.66Å; K153-R156 PolarHBondContact O-N 3.29Å; K153-Y157 PolarHBondContact O-N 3.26Å
154	Y	92.2	Very high	89.6	Confident	42 Å²	42	53.1 Å²	53.1	17%	0.165	25%	0.252	C	S	.	.	H	α-helix	trans	-63	-45.1	175.2	-173.9	-93.1	0	0	0	111.5	L143 T148 D151 R156 Y157 N158 P161	L143-Y154 HydrophobicContact CD2-CE1 3.96Å; L143-Y154 HydrophobicContact CD2-CE2 3.78Å; L143-Y154 VanDerWaalsContact CD2-CZ 3.42Å; L143-Y154 WeakPolarHBondContact CD2-OH 3.21Å; T148-Y154 HydrophobicContact CG2-CD1 3.95Å; T148-Y154 HydrophobicContact CG2-CD2 3.43Å; T148-Y154 VanDerWaalsContact CG2-CD2 3.43Å; T148-Y154 HydrophobicContact CG2-CE2 4.04Å; T148-Y154 HydrophobicContact CG2-CG 3.39Å; T148-Y154 WeakPolarHBondContact O-CB 3.03Å; T148-Y154 WeakPolarHBondContact O-CD1 3.45Å; D151-Y154 PolarHBondContact O-N 2.72Å; D151-Y154 PolarHBondContact OD1-N 3.39Å; Y154-R156 VanDerWaalsContact C-N 3.27Å; Y154-R156 PolarHBondContact O-N 2.94Å; Y154-Y157 HydrophobicContact CE2-CD1 4.42Å; Y154-Y157 CarbonylContact O-C 3.59Å; Y154-Y157 WeakPolarHBondContact O-CA 3.21Å; Y154-Y157 WeakPolarHBondContact O-CB 3.21Å; Y154-Y157 PolarHBondContact O-N 3.49Å; Y154-N158 HydrophobicContact CE1-CB 4.21Å; Y154-N158 WeakPolarHBondContact CE1-O 3.33Å; Y154-N158 PolarHBondContact O-N 3.45Å; Y154-N158 PolarHBondContact OH-ND2 3.45Å; Y154-P161 HydrophobicContact CE1-CG 4.01Å
155	F	93.4	Very high	89.9	Confident	1 Å²	1	47.5 Å²	47.5	0%	0.004	21%	0.213	C	C	.	.	H	α-helix	trans	-56.6	-39.4	176.5	-175.5	-95.7	0	0	0	113.1	D151 I152 Y157 N158 P159 F162 F163 I225 I259 K261 F266	D151-F155 WeakPolarHBondContact O-CB 3.37Å; D151-F155 PolarHBondContact O-N 3.06Å; I152-F155 HydrophobicContact CD1-CD1 4.49Å; F155-Y157 PolarHBondContact O-N 3.14Å; F155-N158 CarbonylContact O-C 3.58Å; F155-P159 HydrophobicContact CD2-CB 3.9Å; F155-P159 HydrophobicContact CE1-CB 4.31Å; F155-P159 HydrophobicContact CE2-CB 3.6Å; F155-P159 HydrophobicContact CG-CB 4.38Å; F155-P159 HydrophobicContact CZ-CB 3.84Å; F155-P159 WeakPolarHBondContact O-CD 3.28Å; F155-F162 HydrophobicContact CD2-CB 3.89Å; F155-F162 HydrophobicContact CD2-CD1 4.25Å; F155-F162 HydrophobicContact CD2-CG 4.12Å; F155-F162 HydrophobicContact CE2-CB 3.98Å; F155-F162 AromaticContact CE2-CD1 3.6Å; F155-F162 HydrophobicContact CE2-CD1 3.6Å; F155-F162 HydrophobicContact CE2-CE1 4.37Å; F155-F162 AromaticContact CE2-CG 3.94Å; F155-F162 HydrophobicContact CE2-CG 3.94Å; F155-F163 HydrophobicContact CE2-CD2 4.42Å; F155-F163 AromaticContact CE2-CE2 3.82Å; F155-F163 HydrophobicContact CE2-CE2 3.82Å; F155-F163 HydrophobicContact CE2-CZ 4.34Å; F155-F163 AromaticContact CZ-CE2 3.73Å; F155-F163 HydrophobicContact CZ-CE2 3.73Å; F155-F163 HydrophobicContact CZ-CZ 4.07Å; F155-I225 HydrophobicContact CE1-CD1 4.36Å; F155-I225 HydrophobicContact CE1-CG2 4.02Å; F155-I259 HydrophobicContact CE1-CG2 4.04Å; F155-I259 HydrophobicContact CZ-CG2 3.84Å; F155-K261 HydrophobicContact CD1-CD 4.21Å; F155-K261 HydrophobicContact CD1-CG 4.42Å; F155-K261 HydrophobicContact CE1-CB 3.79Å; F155-K261 HydrophobicContact CE1-CD 4.03Å; F155-K261 HydrophobicContact CE1-CG 3.81Å; F155-K261 HydrophobicContact CE2-CG 4.41Å; F155-K261 HydrophobicContact CZ-CB 3.87Å; F155-K261 HydrophobicContact CZ-CD 4.46Å; F155-K261 HydrophobicContact CZ-CG 3.8Å; F155-F266 HydrophobicContact CB-CD2 4.04Å; F155-F266 HydrophobicContact CB-CE2 3.64Å; F155-F266 AromaticContact CD2-CE2 3.57Å; F155-F266 HydrophobicContact CD2-CE2 3.57Å; F155-F266 AromaticContact CD2-CZ 3.95Å; F155-F266 HydrophobicContact CD2-CZ 3.95Å; F155-F266 HydrophobicContact CE2-CE2 4.4Å; F155-F266 HydrophobicContact CE2-CZ 4.37Å; F155-F266 HydrophobicContact CG-CD2 4.41Å; F155-F266 AromaticContact CG-CE2 3.68Å; F155-F266 HydrophobicContact CG-CE2 3.68Å; F155-F266 HydrophobicContact CG-CZ 4.38Å
156	R	91.8	Very high	90.2	Very high	97 Å²	97	44.5 Å²	44.5	37%	0.366	20%	0.197	S	C	.	.	H	α-helix	trans	-68.6	-18.9	175.1	-77.6	179.4	179.8	119.6	-0.2	113.9	I152 K153 Y154 I225 K257	I152-R156 VanDerWaalsContact O-CG 3.29Å; I152-R156 WeakPolarHBondContact O-CG 3.43Å; I152-R156 PolarHBondContact O-N 3.06Å; K153-R156 PolarHBondContact O-N 3.29Å; Y154-R156 VanDerWaalsContact C-N 3.27Å; Y154-R156 PolarHBondContact O-N 2.94Å; R156-I225 HydrophobicContact CG-CD1 4.29Å; R156-K257 WeakPolarHBondContact O-CE 3.35Å; R156-K257 PolarHBondContact O-NZ 2.76Å
157	Y	90.9	Very high	90.7	Very high	195 Å²	195	47.9 Å²	47.9	77%	0.765	21%	0.209	S	C	*	.	H	α-helix	trans	-91.6	-51.3	175.8	172	-105	0	0	0	110.8	K153 Y154 F155	K153-Y157 PolarHBondContact O-N 3.26Å; Y154-Y157 HydrophobicContact CE2-CD1 4.42Å; Y154-Y157 CarbonylContact O-C 3.59Å; Y154-Y157 WeakPolarHBondContact O-CA 3.21Å; Y154-Y157 WeakPolarHBondContact O-CB 3.21Å; Y154-Y157 PolarHBondContact O-N 3.49Å; F155-Y157 PolarHBondContact O-N 3.14Å
158	N	91.3	Very high	90.6	Very high	42 Å²	42	50 Å²	50	23%	0.225	22%	0.219	C	C	.	.			trans	-142.4	97.8	179.9	-176.7	14.5	0	0	0	110.8	Y154 F155 R160 P161	Y154-N158 HydrophobicContact CE1-CB 4.21Å; Y154-N158 WeakPolarHBondContact CE1-O 3.33Å; Y154-N158 PolarHBondContact O-N 3.45Å; Y154-N158 PolarHBondContact OH-ND2 3.45Å; F155-N158 CarbonylContact O-C 3.58Å; N158-R160 VanDerWaalsContact C-N 3.3Å; N158-R160 PolarHBondContact O-N 3.18Å; N158-R160 WeakPolarHBondContact OD1-CB 3.41Å; N158-R160 PolarHBondContact OD1-N 3.16Å; N158-P161 WeakPolarHBondContact O-CD 3.02Å
159	P	92.9	Very high	90.3	Very high	14 Å²	14	48.9 Å²	48.9	9%	0.091	21%	0.212	C	C	.	.			trans	-79.9	-11.5	179.7	35	-40.3	0	0	0	113.2	F155 F162 F163 I245 I259	F155-P159 HydrophobicContact CD2-CB 3.9Å; F155-P159 HydrophobicContact CE1-CB 4.31Å; F155-P159 HydrophobicContact CE2-CB 3.6Å; F155-P159 HydrophobicContact CG-CB 4.38Å; F155-P159 HydrophobicContact CZ-CB 3.84Å; F155-P159 WeakPolarHBondContact O-CD 3.28Å; P159-F162 PolarHBondContact O-N 2.82Å; P159-F163 HydrophobicContact CB-CD2 4.05Å; P159-F163 HydrophobicContact CB-CE2 3.96Å; P159-F163 WeakPolarHBondContact O-CD2 3.28Å; P159-F163 PolarHBondContact O-N 3.15Å; P159-F163 VanDerWaalsContact O-N 3.17Å; P159-I245 HydrophobicContact CG-CD1 3.71Å; P159-I245 HydrophobicContact CG-CG1 4.25Å; P159-I245 HydrophobicContact CG-CG2 4.23Å; P159-I259 HydrophobicContact CB-CD1 4.2Å; P159-I259 HydrophobicContact CG-CD1 3.77Å
160	R	91.8	Very high	90.1	Very high	152 Å²	152	48.9 Å²	48.9	57%	0.574	21%	0.212	S	C	*	.	H	α-helix	trans	-58.3	-45.3	-172.3	171.4	-175.6	153.4	103.5	0.2	112.8	N158 F162 F163 V164	N158-R160 VanDerWaalsContact C-N 3.3Å; N158-R160 PolarHBondContact O-N 3.18Å; N158-R160 WeakPolarHBondContact OD1-CB 3.41Å; N158-R160 PolarHBondContact OD1-N 3.16Å; R160-F162 VanDerWaalsContact C-N 3.28Å; R160-F162 PolarHBondContact O-N 2.75Å; R160-F163 PolarHBondContact O-N 3.16Å; R160-F163 VanDerWaalsContact O-N 3.14Å; R160-V164 HydrophobicContact CG-CG2 4.39Å; R160-V164 PolarHBondContact O-N 2.99Å
161	P	91.1	Very high	89.3	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-58.2	-40	178.5	-28.1	37.9	0	0	0	113.4	F140 L143 I149 Y154 N158 V164 F165	F140-P161 HydrophobicContact CD1-CB 4.19Å; F140-P161 HydrophobicContact CD1-CG 3.83Å; F140-P161 HydrophobicContact CD2-CB 3.99Å; F140-P161 HydrophobicContact CE1-CB 4.12Å; F140-P161 HydrophobicContact CE1-CG 3.83Å; F140-P161 HydrophobicContact CE2-CB 3.92Å; F140-P161 HydrophobicContact CG-CB 4.13Å; F140-P161 HydrophobicContact CG-CG 4.19Å; F140-P161 HydrophobicContact CZ-CB 3.99Å; F140-P161 HydrophobicContact CZ-CG 4.19Å; L143-P161 HydrophobicContact CD1-CB 4.17Å; I149-P161 HydrophobicContact CG2-CB 3.8Å; Y154-P161 HydrophobicContact CE1-CG 4.01Å; N158-P161 WeakPolarHBondContact O-CD 3.02Å; P161-V164 PolarHBondContact O-N 3.31Å; P161-F165 WeakPolarHBondContact O-CB 3.37Å; P161-F165 PolarHBondContact O-N 3.09Å
162	F	92.5	Very high	88.9	Confident	2 Å²	2	51.4 Å²	51.4	1%	0.009	23%	0.228	C	C	.	.	H	α-helix	trans	-64.8	-41.3	175.3	174.6	-92.2	0	0	0	112.5	F150 F155 P159 R160 F165 A166 F219 P262 F266	F150-F162 HydrophobicContact CD1-CD2 4.34Å; F150-F162 HydrophobicContact CD1-CE2 4.29Å; F150-F162 HydrophobicContact CE1-CD2 4.28Å; F150-F162 HydrophobicContact CE1-CE2 4.09Å; F155-F162 HydrophobicContact CD2-CB 3.89Å; F155-F162 HydrophobicContact CD2-CD1 4.25Å; F155-F162 HydrophobicContact CD2-CG 4.12Å; F155-F162 HydrophobicContact CE2-CB 3.98Å; F155-F162 AromaticContact CE2-CD1 3.6Å; F155-F162 HydrophobicContact CE2-CD1 3.6Å; F155-F162 HydrophobicContact CE2-CE1 4.37Å; F155-F162 AromaticContact CE2-CG 3.94Å; F155-F162 HydrophobicContact CE2-CG 3.94Å; P159-F162 PolarHBondContact O-N 2.82Å; R160-F162 VanDerWaalsContact C-N 3.28Å; R160-F162 PolarHBondContact O-N 2.75Å; F162-F165 HydrophobicContact CD2-CD1 4.11Å; F162-F165 HydrophobicContact CE2-CD1 4.19Å; F162-F165 HydrophobicContact CE2-CE1 4.44Å; F162-F165 CarbonylContact O-C 3.41Å; F162-F165 VanDerWaalsContact O-CB 3.3Å; F162-F165 WeakPolarHBondContact O-CB 3.25Å; F162-F165 PolarHBondContact O-N 3.08Å; F162-A166 HydrophobicContact CE1-CB 4.16Å; F162-A166 HydrophobicContact CZ-CB 4.45Å; F162-A166 WeakPolarHBondContact O-CB 3.3Å; F162-A166 PolarHBondContact O-N 3.06Å; F162-F219 HydrophobicContact CZ-CE1 4.21Å; F162-F219 AromaticContact CZ-CZ 3.94Å; F162-F219 HydrophobicContact CZ-CZ 3.94Å; F162-P262 HydrophobicContact CE1-CG 3.8Å; F162-P262 HydrophobicContact CZ-CB 4.31Å; F162-P262 HydrophobicContact CZ-CG 4.03Å; F162-F266 HydrophobicContact CD1-CZ 4.31Å; F162-F266 HydrophobicContact CD2-CE1 4.02Å; F162-F266 HydrophobicContact CD2-CE2 4.24Å; F162-F266 AromaticContact CD2-CZ 3.36Å; F162-F266 HydrophobicContact CD2-CZ 3.36Å; F162-F266 HydrophobicContact CE1-CZ 4.38Å; F162-F266 AromaticContact CE2-CE1 3.63Å; F162-F266 HydrophobicContact CE2-CE1 3.63Å; F162-F266 AromaticContact CE2-CZ 3.43Å; F162-F266 HydrophobicContact CE2-CZ 3.43Å; F162-F266 VanDerWaalsContact CE2-CZ 3.43Å; F162-F266 AromaticContact CG-CZ 3.82Å; F162-F266 HydrophobicContact CG-CZ 3.82Å; F162-F266 HydrophobicContact CZ-CE1 4.1Å; F162-F266 AromaticContact CZ-CZ 3.96Å; F162-F266 HydrophobicContact CZ-CZ 3.96Å
163	F	92.3	Very high	88.5	Confident	3 Å²	3	56 Å²	56	1%	0.013	25%	0.252	C	S	.	.	H	α-helix	trans	-73.4	-30.8	179.7	-76.5	-68.8	0	0	0	113.4	F155 P159 R160 F165 A166 K167 I240 I245 P246 I259 M260	F155-F163 HydrophobicContact CE2-CD2 4.42Å; F155-F163 AromaticContact CE2-CE2 3.82Å; F155-F163 HydrophobicContact CE2-CE2 3.82Å; F155-F163 HydrophobicContact CE2-CZ 4.34Å; F155-F163 AromaticContact CZ-CE2 3.73Å; F155-F163 HydrophobicContact CZ-CE2 3.73Å; F155-F163 HydrophobicContact CZ-CZ 4.07Å; P159-F163 HydrophobicContact CB-CD2 4.05Å; P159-F163 HydrophobicContact CB-CE2 3.96Å; P159-F163 WeakPolarHBondContact O-CD2 3.28Å; P159-F163 PolarHBondContact O-N 3.15Å; P159-F163 VanDerWaalsContact O-N 3.17Å; R160-F163 PolarHBondContact O-N 3.16Å; R160-F163 VanDerWaalsContact O-N 3.14Å; F163-F165 VanDerWaalsContact C-N 3.29Å; F163-A166 PolarHBondContact O-N 2.78Å; F163-K167 PolarHBondContact O-N 2.83Å; F163-K167 VanDerWaalsContact O-N 3.15Å; F163-I240 HydrophobicContact CD1-CG1 4.14Å; F163-I240 HydrophobicContact CE1-CG1 4.26Å; F163-I245 HydrophobicContact CD2-CB 4.38Å; F163-I245 HydrophobicContact CD2-CG1 3.92Å; F163-I245 HydrophobicContact CD2-CG2 4.19Å; F163-I245 HydrophobicContact CE2-CG1 4.46Å; F163-I245 HydrophobicContact CE2-CG2 3.87Å; F163-P246 HydrophobicContact CD1-CG 4.43Å; F163-P246 HydrophobicContact CE1-CG 3.55Å; F163-P246 VanDerWaalsContact CZ-CD 3.43Å; F163-P246 HydrophobicContact CZ-CG 3.64Å; F163-I259 HydrophobicContact CE2-CG2 3.85Å; F163-I259 HydrophobicContact CZ-CG2 4.04Å; F163-M260 WeakPolarHBondContact CZ-O 3.49Å
164	V	89	Confident	88.3	Confident	36 Å²	36	50.1 Å²	50.1	22%	0.218	23%	0.226	C	C	.	.	H	α-helix	trans	-63.8	-40	168.5	170.3	0	0	0	0	110.5	K139 F140 R160 P161 E168	K139-V164 HydrophobicContact CD-CG1 4.08Å; F140-V164 HydrophobicContact CE2-CB 3.96Å; F140-V164 HydrophobicContact CE2-CG1 3.87Å; F140-V164 HydrophobicContact CZ-CB 3.76Å; F140-V164 HydrophobicContact CZ-CG1 3.95Å; F140-V164 HydrophobicContact CZ-CG2 3.82Å; R160-V164 HydrophobicContact CG-CG2 4.39Å; R160-V164 PolarHBondContact O-N 2.99Å; P161-V164 PolarHBondContact O-N 3.31Å; V164-E168 WeakPolarHBondContact O-CG 3.36Å
165	F	88	Confident	88.3	Confident	2 Å²	2	52.2 Å²	52.2	1%	0.009	25%	0.247	C	C	.	.	H	α-helix	trans	-63.7	-51.5	172.5	163.5	-111	0	0	0	112.6	F126 L132 L136 I149 F150 P161 F162 F163 K167 E168 I169 I200	F126-F165 HydrophobicContact CE1-CZ 4.41Å; L132-F165 HydrophobicContact CD1-CD2 3.73Å; L132-F165 HydrophobicContact CD1-CE2 3.64Å; L132-F165 HydrophobicContact CD2-CD2 3.52Å; L132-F165 HydrophobicContact CD2-CE2 3.05Å; L132-F165 HydrophobicContact CD2-CZ 3.78Å; L132-F165 HydrophobicContact CG-CD2 4.04Å; L132-F165 HydrophobicContact CG-CE2 3.88Å; L136-F165 HydrophobicContact CD2-CB 4Å; I149-F165 HydrophobicContact CD1-CB 3.74Å; I149-F165 HydrophobicContact CD1-CD1 3.79Å; I149-F165 HydrophobicContact CD1-CD2 4.3Å; I149-F165 HydrophobicContact CD1-CG 3.63Å; F150-F165 HydrophobicContact CE1-CD1 4.03Å; F150-F165 AromaticContact CE1-CE1 3.5Å; F150-F165 HydrophobicContact CE1-CE1 3.5Å; F150-F165 HydrophobicContact CE1-CZ 4.23Å; F150-F165 AromaticContact CZ-CD1 3.91Å; F150-F165 HydrophobicContact CZ-CD1 3.91Å; F150-F165 AromaticContact CZ-CE1 3.34Å; F150-F165 HydrophobicContact CZ-CE1 3.34Å; F150-F165 AromaticContact CZ-CZ 3.66Å; F150-F165 HydrophobicContact CZ-CZ 3.66Å; P161-F165 WeakPolarHBondContact O-CB 3.37Å; P161-F165 PolarHBondContact O-N 3.09Å; F162-F165 HydrophobicContact CD2-CD1 4.11Å; F162-F165 HydrophobicContact CE2-CD1 4.19Å; F162-F165 HydrophobicContact CE2-CE1 4.44Å; F162-F165 CarbonylContact O-C 3.41Å; F162-F165 VanDerWaalsContact O-CB 3.3Å; F162-F165 WeakPolarHBondContact O-CB 3.25Å; F162-F165 PolarHBondContact O-N 3.08Å; F163-F165 VanDerWaalsContact C-N 3.29Å; F165-K167 PolarHBondContact O-N 3.03Å; F165-K167 VanDerWaalsContact O-N 3.16Å; F165-E168 WeakPolarHBondContact O-CB 3.44Å; F165-E168 PolarHBondContact O-N 2.95Å; F165-I169 HydrophobicContact CD2-CG1 4.35Å; F165-I169 HydrophobicContact CD2-CG2 4.33Å; F165-I169 HydrophobicContact CE1-CD1 3.54Å; F165-I169 HydrophobicContact CE1-CG1 4Å; F165-I169 HydrophobicContact CE2-CB 4.28Å; F165-I169 HydrophobicContact CE2-CD1 3.79Å; F165-I169 HydrophobicContact CE2-CG1 3.71Å; F165-I169 HydrophobicContact CE2-CG2 3.57Å; F165-I169 HydrophobicContact CZ-CB 4.46Å; F165-I169 HydrophobicContact CZ-CD1 3.14Å; F165-I169 HydrophobicContact CZ-CG1 3.58Å; F165-I169 HydrophobicContact CZ-CG2 4.15Å; F165-I169 PolarHBondContact O-N 3.22Å; F165-I200 HydrophobicContact CE1-CD1 3.97Å; F165-I200 HydrophobicContact CZ-CD1 4.11Å
166	A	89.8	Confident	88.3	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-56.8	-33.9	-176.9	0	0	0	0	0	112.6	F162 F163 Y170 F219 I240	F162-A166 HydrophobicContact CE1-CB 4.16Å; F162-A166 HydrophobicContact CZ-CB 4.45Å; F162-A166 WeakPolarHBondContact O-CB 3.3Å; F162-A166 PolarHBondContact O-N 3.06Å; F163-A166 PolarHBondContact O-N 2.78Å; A166-Y170 PolarHBondContact O-N 2.57Å; A166-F219 HydrophobicContact CB-CE1 3.64Å; A166-F219 HydrophobicContact CB-CZ 3.81Å; A166-I240 HydrophobicContact CB-CG2 4.08Å
167	K	88.9	Confident	88.4	Confident	89 Å²	89	48.6 Å²	48.6	39%	0.387	24%	0.236	S	C	.	.	H	α-helix	trans	-63.3	-40.1	174.2	177.1	173.5	171.7	159.9	0	112.9	F163 F165 I169 I240 L241	F163-K167 PolarHBondContact O-N 2.83Å; F163-K167 VanDerWaalsContact O-N 3.15Å; F165-K167 PolarHBondContact O-N 3.03Å; F165-K167 VanDerWaalsContact O-N 3.16Å; K167-I169 VanDerWaalsContact C-N 3.34Å; K167-I240 HydrophobicContact CB-CG2 4.39Å; K167-L241 WeakPolarHBondContact CD-O 3.45Å; K167-L241 WeakPolarHBondContact CE-O 3.41Å; K167-L241 PolarHBondContact NZ-O 2.95Å
168	E	83.1	Confident	88.6	Confident	100 Å²	100	40.1 Å²	40.1	47%	0.467	20%	0.204	S	C	.	.	H	α-helix	trans	-72.3	-28.8	-176.6	-64.9	-75.6	-178.6	0	0	112.4	K139 V164 F165 F174	K139-E168 IonicContact NZ-OE1 3.86Å; K139-E168 PolarHBondContact NZ-OE1 2.61Å; V164-E168 WeakPolarHBondContact O-CG 3.36Å; F165-E168 WeakPolarHBondContact O-CB 3.44Å; F165-E168 PolarHBondContact O-N 2.95Å; E168-F174 WeakPolarHBondContact O-CZ 3.44Å
169	I	83.1	Confident	88.8	Confident	10 Å²	10	38.1 Å²	38.1	5%	0.051	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109	19.3	-178	64.3	143.8	0	0	0	113.2	I123 F165 K167 I200 F219	I123-I169 HydrophobicContact CG2-CG2 4.16Å; F165-I169 HydrophobicContact CD2-CG1 4.35Å; F165-I169 HydrophobicContact CD2-CG2 4.33Å; F165-I169 HydrophobicContact CE1-CD1 3.54Å; F165-I169 HydrophobicContact CE1-CG1 4Å; F165-I169 HydrophobicContact CE2-CB 4.28Å; F165-I169 HydrophobicContact CE2-CD1 3.79Å; F165-I169 HydrophobicContact CE2-CG1 3.71Å; F165-I169 HydrophobicContact CE2-CG2 3.57Å; F165-I169 HydrophobicContact CZ-CB 4.46Å; F165-I169 HydrophobicContact CZ-CD1 3.14Å; F165-I169 HydrophobicContact CZ-CG1 3.58Å; F165-I169 HydrophobicContact CZ-CG2 4.15Å; F165-I169 PolarHBondContact O-N 3.22Å; K167-I169 VanDerWaalsContact C-N 3.34Å; I169-I200 HydrophobicContact CD1-CD1 3.87Å; I169-I200 HydrophobicContact CD1-CG1 3.92Å; I169-F219 HydrophobicContact CD1-CD2 4.39Å; I169-F219 HydrophobicContact CD1-CE2 3.53Å; I169-F219 HydrophobicContact CD1-CZ 4.05Å; I169-F219 HydrophobicContact CG1-CE2 4.38Å
170	Y	84.4	Confident	89	Confident	2 Å²	2	37.5 Å²	37.5	1%	0.008	19%	0.189	C	C	.	.			trans	-61.6	131.1	-177	-157.3	-90.1	0	0	0	110.2	A166 D172 L173 I233 K237 I240 L241	A166-Y170 PolarHBondContact O-N 2.57Å; Y170-D172 VanDerWaalsContact C-N 3.29Å; Y170-D172 HydrophobicContact CD1-CB 4.25Å; Y170-D172 PolarHBondContact O-N 3.06Å; Y170-D172 VanDerWaalsContact O-N 3.1Å; Y170-L173 WeakPolarHBondContact O-CB 3.16Å; Y170-L173 WeakPolarHBondContact O-CG 3.14Å; Y170-L173 PolarHBondContact O-N 3.07Å; Y170-L173 VanDerWaalsContact O-N 3.14Å; Y170-I233 HydrophobicContact CE2-CG1 4.3Å; Y170-I233 WeakPolarHBondContact OH-CG1 3.06Å; Y170-K237 HydrophobicContact CE1-CD 3.83Å; Y170-K237 HydrophobicContact CE1-CG 3.88Å; Y170-K237 HydrophobicContact CE2-CG 4.42Å; Y170-K237 VanDerWaalsContact OH-CB 3.27Å; Y170-K237 WeakPolarHBondContact OH-CB 3.18Å; Y170-K237 WeakPolarHBondContact OH-CG 3.3Å; Y170-I240 HydrophobicContact CD2-CB 4.43Å; Y170-I240 HydrophobicContact CD2-CG2 3.78Å; Y170-I240 HydrophobicContact CE2-CB 4.35Å; Y170-I240 HydrophobicContact CE2-CD1 3.98Å; Y170-I240 HydrophobicContact CE2-CG2 4.16Å; Y170-L241 HydrophobicContact CD1-CD2 4.2Å; Y170-L241 HydrophobicContact CD2-CD2 4.4Å; Y170-L241 HydrophobicContact CG-CD2 3.95Å
171	P	74.9	Confident	89.2	Confident	22 Å²	22	35.8 Å²	35.8	14%	0.143	18%	0.183	C	C	.	.	G	3₁₀ helix	trans	-53.1	-39.1	-166.7	-31	35.4	0	0	0	115.6	L173 F174 D201 T202 F219	P171-L173 PolarHBondContact O-N 3.09Å; P171-F174 PolarHBondContact O-N 2.8Å; P171-D201 WeakPolarHBondContact CB-O 3.31Å; P171-D201 WeakPolarHBondContact CG-O 3.32Å; P171-T202 WeakPolarHBondContact CB-OG1 3.3Å; P171-T202 WeakPolarHBondContact CG-OG1 3.4Å; P171-F219 HydrophobicContact CG-CB 4.23Å
172	D	81.7	Confident	89.4	Confident	99 Å²	99	35.8 Å²	35.8	53%	0.529	18%	0.183	S	C	.	.	G	3₁₀ helix	trans	-61.9	-14.3	-175.9	-65	-3.6	0	0	0	114.9	Y170 F174 K237	Y170-D172 VanDerWaalsContact C-N 3.29Å; Y170-D172 HydrophobicContact CD1-CB 4.25Å; Y170-D172 PolarHBondContact O-N 3.06Å; Y170-D172 VanDerWaalsContact O-N 3.1Å; D172-F174 VanDerWaalsContact C-N 3.3Å; D172-K237 WeakPolarHBondContact OD2-CE 3.32Å; D172-K237 IonicContact OD2-NZ 3.99Å; D172-K237 PolarHBondContact OD2-NZ 3.19Å
173	L	82.8	Confident	89.7	Confident	106 Å²	106	35.7 Å²	35.7	56%	0.555	18%	0.182	S	C	*	.	G	3₁₀ helix	trans	-83.2	-9.7	-177.8	-57.7	177	0	0	0	112.7	Y170 P171	Y170-L173 WeakPolarHBondContact O-CB 3.16Å; Y170-L173 WeakPolarHBondContact O-CG 3.14Å; Y170-L173 PolarHBondContact O-N 3.07Å; Y170-L173 VanDerWaalsContact O-N 3.14Å; P171-L173 PolarHBondContact O-N 3.09Å
174	F	89.6	Confident	89.9	Confident	39 Å²	39	37.3 Å²	37.3	17%	0.171	19%	0.189	C	C	.	.			trans	-130.7	155.4	-167.1	-54	-72.8	0	0	0	112.7	C121 I123 E168 P171 D172 L203	C121-F174 VanDerWaalsContact O-CD1 3.26Å; C121-F174 WeakPolarHBondContact O-CD1 3.21Å; I123-F174 HydrophobicContact CD1-CB 4.35Å; I123-F174 HydrophobicContact CD1-CD1 4.35Å; I123-F174 HydrophobicContact CD1-CD2 3.66Å; I123-F174 HydrophobicContact CD1-CE2 4.01Å; I123-F174 HydrophobicContact CD1-CG 3.84Å; I123-F174 HydrophobicContact CD1-CZ 4.47Å; I123-F174 HydrophobicContact CG1-CD1 3.74Å; I123-F174 HydrophobicContact CG1-CD2 3.79Å; I123-F174 HydrophobicContact CG1-CE1 3.73Å; I123-F174 HydrophobicContact CG1-CE2 3.8Å; I123-F174 HydrophobicContact CG1-CG 3.75Å; I123-F174 HydrophobicContact CG1-CZ 3.75Å; E168-F174 WeakPolarHBondContact O-CZ 3.44Å; P171-F174 PolarHBondContact O-N 2.8Å; D172-F174 VanDerWaalsContact C-N 3.3Å; F174-L203 HydrophobicContact CB-CD1 4.45Å; F174-L203 HydrophobicContact CB-CD2 4.03Å
175	S	90.9	Very high	90.2	Very high	85 Å²	85	38.4 Å²	38.4	59%	0.594	19%	0.19	S	C	*	.			trans	-117.1	141.3	175	-73.6	0	0	0	0	110.3	C121	C121-S175 PolarHBondContact SG-O 2.94Å
176	P	93.4	Very high	90.6	Very high	14 Å²	14	38.3 Å²	38.3	9%	0.091	19%	0.19	C	C	.	.			trans	-59.6	140.2	-179.3	-23.3	31.2	0	0	0	113.5	H180 L203 A206 A207	P176-H180 HydrophobicContact CB-CB 3.74Å; P176-L203 HydrophobicContact CG-CD2 4.31Å; P176-A206 HydrophobicContact CG-CB 3.77Å; P176-A207 HydrophobicContact CB-CB 3.82Å; P176-A207 HydrophobicContact CG-CB 3.95Å
177	S	94.4	Very high	91	Very high	8 Å²	8	39.2 Å²	39.2	6%	0.056	19%	0.194	C	C	.	.			trans	-67.5	172.7	177.1	67.8	0	0	0	0	113.1	V117 S120 C121 T179 H180 R181 D336	V117-S177 WeakPolarHBondContact O-CB 3.3Å; V117-S177 PolarHBondContact O-OG 2.75Å; S120-S177 VanDerWaalsContact OG-CB 3.32Å; S120-S177 WeakPolarHBondContact OG-CB 3.48Å; C121-S177 PolarHBondContact SG-N 2.84Å; S177-T179 PolarHBondContact O-N 2.99Å; S177-T179 PolarHBondContact OG-N 2.81Å; S177-H180 PolarHBondContact N-ND1 2.87Å; S177-H180 PolarHBondContact O-N 3.42Å; S177-H180 PolarHBondContact OG-N 2.71Å; S177-H180 PolarHBondContact OG-ND1 3.21Å; S177-R181 PolarHBondContact O-N 3.09Å; S177-D336 WeakPolarHBondContact CB-OD1 3.28Å; S177-D336 WeakPolarHBondContact CB-OD2 3.41Å
178	L	94.8	Very high	91.3	Very high	18 Å²	18	40.1 Å²	40.1	9%	0.094	20%	0.202	C	C	.	.	H	α-helix	trans	-60.1	-40.8	172.2	-176.2	153.4	0	0	0	110.1	H180 R181 F182 D336 F339 N340	L178-H180 PolarHBondContact O-N 3.14Å; L178-R181 PolarHBondContact O-N 3.11Å; L178-R181 VanDerWaalsContact O-N 3.15Å; L178-F182 PolarHBondContact O-N 3.1Å; L178-D336 HydrophobicContact CB-CB 4.31Å; L178-D336 PolarHBondContact N-OD1 2.9Å; L178-F339 HydrophobicContact CD2-CB 3.43Å; L178-F339 VanDerWaalsContact CD2-CB 3.43Å; L178-N340 HydrophobicContact CD1-CB 3.91Å
179	T	96.4	Very high	91.9	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-57.1	-46.2	176.9	-56.8	0	0	0	0	112.3	V117 S177 R181 F182 I183 I292 D336 F339	V117-T179 HydrophobicContact CB-CG2 4.1Å; V117-T179 HydrophobicContact CG1-CG2 3.72Å; S177-T179 PolarHBondContact O-N 2.99Å; S177-T179 PolarHBondContact OG-N 2.81Å; T179-R181 VanDerWaalsContact C-N 3.34Å; T179-R181 PolarHBondContact O-N 3.26Å; T179-F182 WeakPolarHBondContact O-CB 3.37Å; T179-F182 PolarHBondContact O-N 3.39Å; T179-I183 HydrophobicContact CG2-CD1 4.4Å; T179-I183 WeakPolarHBondContact O-CG1 3.46Å; T179-I183 PolarHBondContact O-N 3.23Å; T179-I183 VanDerWaalsContact O-N 3.08Å; T179-I292 HydrophobicContact CG2-CD1 4.43Å; T179-I292 HydrophobicContact CG2-CG2 3.95Å; T179-D336 WeakPolarHBondContact CB-OD1 3.46Å; T179-D336 PolarHBondContact N-OD1 3.25Å; T179-D336 PolarHBondContact OG1-OD1 3.36Å; T179-F339 HydrophobicContact CG2-CD2 3.64Å; T179-F339 HydrophobicContact CG2-CE2 3.68Å; T179-F339 HydrophobicContact CG2-CG 4.42Å; T179-F339 HydrophobicContact CG2-CZ 4.46Å; T179-F339 WeakPolarHBondContact OG1-CD2 3.43Å
180	H	96.4	Very high	92.6	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-59.7	-44.3	175.6	-67.7	98.1	0	0	0	111.9	V117 P176 S177 L178 F182 I183 K184 A207	V117-H180 PolarHBondContact O-CE1 2.98Å; V117-H180 VanDerWaalsContact O-CE1 3.32Å; P176-H180 HydrophobicContact CB-CB 3.74Å; S177-H180 PolarHBondContact N-ND1 2.87Å; S177-H180 PolarHBondContact O-N 3.42Å; S177-H180 PolarHBondContact OG-N 2.71Å; S177-H180 PolarHBondContact OG-ND1 3.21Å; L178-H180 PolarHBondContact O-N 3.14Å; H180-F182 VanDerWaalsContact C-N 3.33Å; H180-F182 PolarHBondContact O-N 2.76Å; H180-I183 PolarHBondContact O-N 3.22Å; H180-K184 PolarHBondContact O-N 2.96Å; H180-A207 HydrophobicContact CB-CB 3.84Å
181	R	95.1	Very high	93.2	Very high	116 Å²	116	42.8 Å²	42.8	44%	0.438	23%	0.227	S	C	.	.	H	α-helix	trans	-64.8	-37.8	178.1	-65.5	174.8	-169.3	-91.3	-3.2	111.8	S177 L178 T179 I183 K184 Y185 C353	S177-R181 PolarHBondContact O-N 3.09Å; L178-R181 PolarHBondContact O-N 3.11Å; L178-R181 VanDerWaalsContact O-N 3.15Å; T179-R181 VanDerWaalsContact C-N 3.34Å; T179-R181 PolarHBondContact O-N 3.26Å; R181-I183 VanDerWaalsContact C-N 3.33Å; R181-I183 PolarHBondContact O-N 3.36Å; R181-K184 WeakPolarHBondContact O-CB 3.48Å; R181-K184 PolarHBondContact O-N 3.45Å; R181-Y185 VanDerWaalsContact O-CD2 3.23Å; R181-Y185 WeakPolarHBondContact O-CD2 3.46Å; R181-Y185 PolarHBondContact O-N 2.88Å; R181-C353 HydrophobicContact CB-CB 4.03Å
182	F	96.6	Very high	94.4	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-60	-44.2	174.6	-174.6	-83.9	0	0	0	111.6	I103 L178 T179 H180 K184 Y185 L186 F339 A343 L346 Y350	I103-F182 HydrophobicContact CD1-CZ 4.36Å; L178-F182 PolarHBondContact O-N 3.1Å; T179-F182 WeakPolarHBondContact O-CB 3.37Å; T179-F182 PolarHBondContact O-N 3.39Å; H180-F182 VanDerWaalsContact C-N 3.33Å; H180-F182 PolarHBondContact O-N 2.76Å; F182-K184 VanDerWaalsContact C-N 3.29Å; F182-K184 PolarHBondContact O-N 3.01Å; F182-Y185 WeakPolarHBondContact O-CB 3.48Å; F182-Y185 PolarHBondContact O-N 3.17Å; F182-L186 HydrophobicContact CD1-CD1 4.18Å; F182-L186 HydrophobicContact CD1-CG 4.24Å; F182-L186 HydrophobicContact CE1-CD1 3.89Å; F182-L186 HydrophobicContact CE1-CD2 4.16Å; F182-L186 HydrophobicContact CE1-CG 3.91Å; F182-L186 PolarHBondContact O-N 2.9Å; F182-F339 HydrophobicContact CB-CD1 4.01Å; F182-F339 AromaticContact CD1-CD1 3.42Å; F182-F339 HydrophobicContact CD1-CD1 3.42Å; F182-F339 VanDerWaalsContact CD1-CD1 3.42Å; F182-F339 AromaticContact CD1-CE1 3.37Å; F182-F339 HydrophobicContact CD1-CE1 3.37Å; F182-F339 HydrophobicContact CD1-CZ 4.49Å; F182-F339 AromaticContact CD2-CD1 3.8Å; F182-F339 HydrophobicContact CD2-CD1 3.8Å; F182-F339 AromaticContact CE1-CD1 3.76Å; F182-F339 HydrophobicContact CE1-CD1 3.76Å; F182-F339 AromaticContact CE1-CE1 3.5Å; F182-F339 HydrophobicContact CE1-CE1 3.5Å; F182-F339 VanDerWaalsContact CE1-CE1 3.5Å; F182-F339 HydrophobicContact CE2-CD1 4.09Å; F182-F339 AromaticContact CG-CD1 3.45Å; F182-F339 HydrophobicContact CG-CD1 3.45Å; F182-F339 VanDerWaalsContact CG-CD1 3.45Å; F182-F339 AromaticContact CG-CE1 3.93Å; F182-F339 HydrophobicContact CG-CE1 3.93Å; F182-F339 HydrophobicContact CG-CG 4.35Å; F182-F339 HydrophobicContact CZ-CD1 4.08Å; F182-F339 HydrophobicContact CZ-CE1 4.14Å; F182-A343 HydrophobicContact CD2-CB 4.11Å; F182-A343 HydrophobicContact CE2-CB 4.17Å; F182-L346 HydrophobicContact CE2-CD1 3.64Å; F182-L346 HydrophobicContact CZ-CD1 3.48Å; F182-L346 VanDerWaalsContact CZ-CD1 3.48Å; F182-Y350 HydrophobicContact CD2-CD1 4.12Å; F182-Y350 AromaticContact CE2-CD1 3.62Å; F182-Y350 HydrophobicContact CE2-CD1 3.62Å; F182-Y350 HydrophobicContact CE2-CE1 4.41Å; F182-Y350 HydrophobicContact CE2-CG 4.23Å; F182-Y350 AromaticContact CZ-CD1 3.88Å; F182-Y350 HydrophobicContact CZ-CD1 3.88Å; F182-Y350 HydrophobicContact CZ-CE1 4.24Å
183	I	97.5	Very high	95.2	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-61.7	-39.2	175.5	-61.4	165.8	0	0	0	110.6	V111 T113 T179 H180 R181 Y185 L186 E187 L192 N195 I209 I292	V111-I183 HydrophobicContact CG1-CD1 3.86Å; V111-I183 HydrophobicContact CG1-CG1 4.12Å; T113-I183 HydrophobicContact CG2-CD1 3.74Å; T179-I183 HydrophobicContact CG2-CD1 4.4Å; T179-I183 WeakPolarHBondContact O-CG1 3.46Å; T179-I183 PolarHBondContact O-N 3.23Å; T179-I183 VanDerWaalsContact O-N 3.08Å; H180-I183 PolarHBondContact O-N 3.22Å; R181-I183 VanDerWaalsContact C-N 3.33Å; R181-I183 PolarHBondContact O-N 3.36Å; I183-Y185 VanDerWaalsContact C-N 3.32Å; I183-Y185 PolarHBondContact O-N 3.22Å; I183-L186 WeakPolarHBondContact O-CB 3.18Å; I183-L186 PolarHBondContact O-N 2.7Å; I183-E187 PolarHBondContact O-N 2.99Å; I183-E187 VanDerWaalsContact O-N 3.13Å; I183-L192 HydrophobicContact CG2-CD1 4.2Å; I183-L192 HydrophobicContact CG2-CD2 3.9Å; I183-N195 HydrophobicContact CG2-CB 4.19Å; I183-I209 HydrophobicContact CB-CD1 3.83Å; I183-I209 HydrophobicContact CG2-CD1 3.66Å; I183-I209 HydrophobicContact CG2-CG1 4.35Å; I183-I209 HydrophobicContact CG2-CG2 4.44Å; I183-I292 HydrophobicContact CD1-CD1 4.4Å
184	K	96.5	Very high	95.9	Very high	37 Å²	37	34.9 Å²	34.9	16%	0.161	18%	0.18	C	C	.	.	H	α-helix	trans	-60.5	-39.6	172.2	179.7	59.5	-177.7	-179.8	0	112.3	H180 R181 F182 E187 L188 G208 I209	H180-K184 PolarHBondContact O-N 2.96Å; R181-K184 WeakPolarHBondContact O-CB 3.48Å; R181-K184 PolarHBondContact O-N 3.45Å; F182-K184 VanDerWaalsContact C-N 3.29Å; F182-K184 PolarHBondContact O-N 3.01Å; K184-E187 WeakPolarHBondContact CD-OE2 3.48Å; K184-E187 IonicContact NZ-OE2 3.58Å; K184-E187 PolarHBondContact NZ-OE2 3.21Å; K184-E187 WeakPolarHBondContact O-CB 3.38Å; K184-E187 PolarHBondContact O-N 3.35Å; K184-E187 VanDerWaalsContact O-N 3.14Å; K184-L188 HydrophobicContact CD-CG 4.36Å; K184-L188 HydrophobicContact CG-CD1 4.24Å; K184-L188 HydrophobicContact CG-CG 4.39Å; K184-L188 WeakPolarHBondContact O-CG 3.41Å; K184-L188 PolarHBondContact O-N 3.1Å; K184-G208 WeakPolarHBondContact CD-O 3.48Å; K184-G208 VanDerWaalsContact CE-O 3.27Å; K184-G208 WeakPolarHBondContact CE-O 3.49Å; K184-G208 PolarHBondContact NZ-O 3.12Å; K184-I209 HydrophobicContact CB-CG1 4.02Å; K184-I209 HydrophobicContact CD-CG1 4.47Å
185	Y	95.4	Very high	96.4	Very high	59 Å²	59	33 Å²	33	23%	0.231	17%	0.172	C	C	.	.	H	α-helix	trans	-65.3	-37.1	175	-82.8	-73.5	0	0	0	112.9	R181 F182 I183 E187 L188 E189 P349 A352 C353	R181-Y185 VanDerWaalsContact O-CD2 3.23Å; R181-Y185 WeakPolarHBondContact O-CD2 3.46Å; R181-Y185 PolarHBondContact O-N 2.88Å; F182-Y185 WeakPolarHBondContact O-CB 3.48Å; F182-Y185 PolarHBondContact O-N 3.17Å; I183-Y185 VanDerWaalsContact C-N 3.32Å; I183-Y185 PolarHBondContact O-N 3.22Å; Y185-E187 PolarHBondContact O-N 3.22Å; Y185-L188 HydrophobicContact CD1-CD1 4.22Å; Y185-L188 HydrophobicContact CE1-CD1 4.37Å; Y185-L188 PolarHBondContact O-N 2.94Å; Y185-E189 WeakPolarHBondContact O-CB 3.49Å; Y185-E189 VanDerWaalsContact O-CG 3.29Å; Y185-E189 WeakPolarHBondContact O-CG 3.37Å; Y185-E189 PolarHBondContact O-N 2.7Å; Y185-P349 HydrophobicContact CD1-CB 4.01Å; Y185-P349 HydrophobicContact CD1-CG 4.24Å; Y185-P349 HydrophobicContact CE1-CB 3.99Å; Y185-P349 WeakPolarHBondContact CE1-O 3.15Å; Y185-A352 WeakPolarHBondContact OH-CB 3.26Å; Y185-C353 HydrophobicContact CD2-CB 4.08Å; Y185-C353 HydrophobicContact CE2-CB 3.77Å
186	L	97.2	Very high	96.7	Very high	1 Å²	1	29 Å²	29	1%	0.005	14%	0.144	C	C	.	.	H	α-helix	trans	-58.8	-37.5	170.8	-68.3	173.8	0	0	0	111.9	I103 V111 F182 I183 G190 K191 L192 L290 Y350	I103-L186 HydrophobicContact CG2-CD2 3.87Å; V111-L186 HydrophobicContact CG2-CD1 4.08Å; F182-L186 HydrophobicContact CD1-CD1 4.18Å; F182-L186 HydrophobicContact CD1-CG 4.24Å; F182-L186 HydrophobicContact CE1-CD1 3.89Å; F182-L186 HydrophobicContact CE1-CD2 4.16Å; F182-L186 HydrophobicContact CE1-CG 3.91Å; F182-L186 PolarHBondContact O-N 2.9Å; I183-L186 WeakPolarHBondContact O-CB 3.18Å; I183-L186 PolarHBondContact O-N 2.7Å; L186-G190 PolarHBondContact O-N 2.75Å; L186-K191 WeakPolarHBondContact O-CA 3.49Å; L186-K191 WeakPolarHBondContact O-CB 3.31Å; L186-K191 PolarHBondContact O-N 3.14Å; L186-L192 HydrophobicContact CB-CB 4.13Å; L186-L192 PolarHBondContact O-N 3.26Å; L186-L290 HydrophobicContact CD1-CD1 4.44Å; L186-Y350 HydrophobicContact CD2-CE1 3.83Å; L186-Y350 HydrophobicContact CG-CE1 4.35Å
187	E	97.1	Very high	97	Very high	18 Å²	18	28.3 Å²	28.3	8%	0.084	14%	0.139	C	C	.	.	H	α-helix	trans	-69.2	-46	176.1	-174.3	177.5	-110.6	0	0	112.5	I183 K184 Y185 E189 G190 L192 E210 R211	I183-E187 PolarHBondContact O-N 2.99Å; I183-E187 VanDerWaalsContact O-N 3.13Å; K184-E187 WeakPolarHBondContact CD-OE2 3.48Å; K184-E187 IonicContact NZ-OE2 3.58Å; K184-E187 PolarHBondContact NZ-OE2 3.21Å; K184-E187 WeakPolarHBondContact O-CB 3.38Å; K184-E187 PolarHBondContact O-N 3.35Å; K184-E187 VanDerWaalsContact O-N 3.14Å; Y185-E187 PolarHBondContact O-N 3.22Å; E187-E189 PolarHBondContact O-N 3.04Å; E187-G190 WeakPolarHBondContact O-CA 3.37Å; E187-G190 PolarHBondContact O-N 3.12Å; E187-L192 HydrophobicContact CB-CB 4.02Å; E187-L192 HydrophobicContact CB-CD2 3.86Å; E187-L192 HydrophobicContact CG-CD2 4.41Å; E187-E210 PolarHBondContact OE1-N 2.79Å; E187-E210 PolarHBondContact OE2-N 2.79Å; E187-R211 WeakPolarHBondContact OE1-CB 3.45Å; E187-R211 WeakPolarHBondContact OE1-CG 3.32Å; E187-R211 PolarHBondContact OE1-N 2.96Å
188	L	95.6	Very high	97	Very high	108 Å²	108	29 Å²	29	57%	0.565	14%	0.142	S	C	*	.	H	α-helix	trans	-60.9	-35.7	178	-70.2	174.2	0	0	0	112.1	K184 Y185 G190	K184-L188 HydrophobicContact CD-CG 4.36Å; K184-L188 HydrophobicContact CG-CD1 4.24Å; K184-L188 HydrophobicContact CG-CG 4.39Å; K184-L188 WeakPolarHBondContact O-CG 3.41Å; K184-L188 PolarHBondContact O-N 3.1Å; Y185-L188 HydrophobicContact CD1-CD1 4.22Å; Y185-L188 HydrophobicContact CE1-CD1 4.37Å; Y185-L188 PolarHBondContact O-N 2.94Å; L188-G190 PolarHBondContact O-N 2.94Å
189	E	96.2	Very high	97	Very high	93 Å²	93	28.4 Å²	28.4	44%	0.435	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.8	3.3	175	-68.3	-70.2	104.5	0	0	113.2	Y185 E187 K191 P349 Y350	Y185-E189 WeakPolarHBondContact O-CB 3.49Å; Y185-E189 VanDerWaalsContact O-CG 3.29Å; Y185-E189 WeakPolarHBondContact O-CG 3.37Å; Y185-E189 PolarHBondContact O-N 2.7Å; E187-E189 PolarHBondContact O-N 3.04Å; E189-K191 HydrophobicContact CB-CD 4.27Å; E189-K191 HydrophobicContact CB-CG 4.22Å; E189-K191 PolarHBondContact O-N 3.16Å; E189-P349 HydrophobicContact CG-CG 3.88Å; E189-P349 WeakPolarHBondContact OE1-CG 3.26Å; E189-Y350 HydrophobicContact CG-CE2 4.37Å
190	G	97.5	Very high	96.8	Very high	46 Å²	46	28.9 Å²	28.9	47%	0.474	14%	0.141	S	C	.	.	T	Hydrogen-bonded Turn	trans	69.4	17	178.9	0	0	0	0	0	114.5	L186 E187 L188	L186-G190 PolarHBondContact O-N 2.75Å; E187-G190 WeakPolarHBondContact O-CA 3.37Å; E187-G190 PolarHBondContact O-N 3.12Å; L188-G190 PolarHBondContact O-N 2.94Å
191	K	98.4	Very high	96.6	Very high	30 Å²	30	29.3 Å²	29.3	13%	0.13	14%	0.143	C	C	.	.			trans	-95.9	-28.7	-175.5	-64.8	179.8	171	-64	0	113.9	I103 K104 S106 K107 V109 L186 E189 L193 Y350	I103-K191 PolarHBondContact O-NZ 2.78Å; K104-K191 PolarHBondContact O-NZ 3.15Å; S106-K191 PolarHBondContact O-NZ 3Å; K107-K191 CarbonylContact C-O 3.56Å; K107-K191 VanDerWaalsContact O-O 3.14Å; V109-K191 HydrophobicContact CG2-CB 4.36Å; V109-K191 PolarHBondContact N-O 3.01Å; L186-K191 WeakPolarHBondContact O-CA 3.49Å; L186-K191 WeakPolarHBondContact O-CB 3.31Å; L186-K191 PolarHBondContact O-N 3.14Å; E189-K191 HydrophobicContact CB-CD 4.27Å; E189-K191 HydrophobicContact CB-CG 4.22Å; E189-K191 PolarHBondContact O-N 3.16Å; K191-L193 PolarHBondContact O-N 3.02Å; K191-Y350 WeakPolarHBondContact CD-OH 3.2Å
192	L	98.6	Very high	96.4	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	112.2	179.6	-174.6	67.6	0	0	0	109.9	V111 I183 L186 E187 N195 I209 R211	V111-L192 HydrophobicContact CB-CD1 4.18Å; V111-L192 HydrophobicContact CG2-CD1 3.6Å; I183-L192 HydrophobicContact CG2-CD1 4.2Å; I183-L192 HydrophobicContact CG2-CD2 3.9Å; L186-L192 HydrophobicContact CB-CB 4.13Å; L186-L192 PolarHBondContact O-N 3.26Å; E187-L192 HydrophobicContact CB-CB 4.02Å; E187-L192 HydrophobicContact CB-CD2 3.86Å; E187-L192 HydrophobicContact CG-CD2 4.41Å; L192-N195 HydrophobicContact CD1-CB 4.44Å; L192-N195 HydrophobicContact CD2-CB 4.36Å; L192-I209 HydrophobicContact CD2-CG2 3.99Å; L192-R211 HydrophobicContact CD2-CB 4.23Å; L192-R211 WeakPolarHBondContact O-CD 3.34Å; L192-R211 PolarHBondContact O-NH1 3.27Å
193	L	98.6	Very high	96.3	Very high	16 Å²	16	24.6 Å²	24.6	8%	0.084	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	-52.6	167.9	178.4	60.7	0	0	0	109.5	R108 V109 I110 K191 D282 E285 A286	R108-L193 HydrophobicContact CB-CB 4.11Å; R108-L193 HydrophobicContact CB-CD2 4.23Å; V109-L193 WeakPolarHBondContact O-CB 2.84Å; V109-L193 PolarHBondContact O-N 3.45Å; I110-L193 HydrophobicContact CD1-CD2 4.28Å; I110-L193 HydrophobicContact CG1-CB 4.44Å; I110-L193 HydrophobicContact CG1-CD2 3.96Å; I110-L193 HydrophobicContact CG1-CG 4.49Å; K191-L193 PolarHBondContact O-N 3.02Å; L193-D282 HydrophobicContact CD2-CB 3.8Å; L193-D282 HydrophobicContact CG-CB 4.28Å; L193-E285 HydrophobicContact CD2-CB 4.05Å; L193-A286 HydrophobicContact CD2-CB 4.29Å
194	R	98.6	Very high	96.2	Very high	45 Å²	45	24.6 Å²	24.6	17%	0.17	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.9	145.8	178.2	-153.5	72.1	64.8	173.3	-1.5	112.5	V109 I110 V111 Y196 R211 V213 N278 D282	V109-R194 PolarHBondContact O-N 3.06Å; I110-R194 WeakPolarHBondContact CA-O 3.32Å; V111-R194 PolarHBondContact N-O 3.47Å; R194-Y196 HydrophobicContact CB-CD2 3.96Å; R194-Y196 HydrophobicContact CB-CE2 3.5Å; R194-Y196 HydrophobicContact CG-CD2 3.95Å; R194-Y196 HydrophobicContact CG-CE2 3.54Å; R194-R211 CarbonylContact C-O 3.57Å; R194-R211 WeakPolarHBondContact CA-O 3.32Å; R194-R211 VanDerWaalsContact CD-O 3.28Å; R194-R211 WeakPolarHBondContact CD-O 3.18Å; R194-V213 HydrophobicContact CG-CG2 3.85Å; R194-N278 PolarHBondContact NH1-OD1 3.44Å; R194-N278 PolarHBondContact NH2-OD1 3.29Å; R194-D282 WeakPolarHBondContact CB-OD2 3.39Å; R194-D282 IonicContact CZ-OD1 3.66Å; R194-D282 IonicContact CZ-OD2 3.3Å; R194-D282 IonicContact NE-OD1 3.54Å; R194-D282 IonicContact NE-OD2 2.75Å; R194-D282 PolarHBondContact NE-OD2 2.83Å; R194-D282 IonicContact NH2-OD1 2.74Å; R194-D282 PolarHBondContact NH2-OD1 3.43Å; R194-D282 VanDerWaalsContact NH2-OD1 3.12Å; R194-D282 IonicContact NH2-OD2 3.19Å
195	N	98.7	Very high	96	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	109.9	160.7	175.7	-147.4	0	0	0	110.6	V111 T113 I183 L192 E204 R211 V212 V213	V111-N195 HydrophobicContact CB-CB 4.46Å; V111-N195 CarbonylContact O-C 3.4Å; V111-N195 WeakPolarHBondContact O-CA 3.5Å; V111-N195 PolarHBondContact O-ND2 3.37Å; T113-N195 PolarHBondContact OG1-ND2 2.75Å; T113-N195 VanDerWaalsContact OG1-ND2 3.09Å; I183-N195 HydrophobicContact CG2-CB 4.19Å; L192-N195 HydrophobicContact CD1-CB 4.44Å; L192-N195 HydrophobicContact CD2-CB 4.36Å; N195-E204 WeakPolarHBondContact OD1-CG 3.19Å; N195-R211 PolarHBondContact N-O 3.06Å; N195-V212 CarbonylContact O-C 3.58Å; N195-V212 WeakPolarHBondContact O-CA 3.23Å; N195-V213 PolarHBondContact O-N 3.15Å
196	Y	98.6	Very high	95.8	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	103.1	170.9	-70.6	-91.3	0	0	0	108.8	I110 V111 L112 T113 R194 V213 F275 N278 L279 D282 I304	I110-Y196 HydrophobicContact CD1-CE2 4.41Å; I110-Y196 HydrophobicContact CG2-CD2 3.78Å; I110-Y196 HydrophobicContact CG2-CE2 4.13Å; V111-Y196 PolarHBondContact O-N 3.34Å; L112-Y196 CarbonylContact C-O 3.37Å; L112-Y196 VanDerWaalsContact CA-O 3.3Å; L112-Y196 WeakPolarHBondContact CA-O 3.47Å; T113-Y196 PolarHBondContact N-O 2.85Å; R194-Y196 HydrophobicContact CB-CD2 3.96Å; R194-Y196 HydrophobicContact CB-CE2 3.5Å; R194-Y196 HydrophobicContact CG-CD2 3.95Å; R194-Y196 HydrophobicContact CG-CE2 3.54Å; Y196-V213 HydrophobicContact CD1-CB 3.83Å; Y196-V213 HydrophobicContact CD1-CG1 3.86Å; Y196-V213 HydrophobicContact CD1-CG2 4.37Å; Y196-V213 HydrophobicContact CE1-CB 4.02Å; Y196-V213 HydrophobicContact CE1-CG1 4.02Å; Y196-V213 HydrophobicContact CE1-CG2 4.08Å; Y196-V213 HydrophobicContact CG-CB 4.49Å; Y196-F275 HydrophobicContact CD1-CD2 4.12Å; Y196-F275 HydrophobicContact CD1-CE2 4.27Å; Y196-F275 HydrophobicContact CE1-CD2 4.35Å; Y196-N278 WeakPolarHBondContact OH-CB 3.45Å; Y196-N278 PolarHBondContact OH-O 3.1Å; Y196-L279 HydrophobicContact CE1-CB 4.27Å; Y196-L279 VanDerWaalsContact OH-CA 3.29Å; Y196-L279 WeakPolarHBondContact OH-CA 3.11Å; Y196-L279 PolarHBondContact OH-N 2.85Å; Y196-L279 VanDerWaalsContact OH-N 3.1Å; Y196-D282 PolarHBondContact OH-OD2 3.22Å; Y196-I304 HydrophobicContact CD1-CD1 4.17Å; Y196-I304 HydrophobicContact CG-CD1 4.04Å
197	T	97.9	Very high	95.5	Very high	0 Å²	0	27 Å²	27	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	136.6	179.9	-171.3	0	0	0	0	111.4	T113 N199 E204 V212 V213 Y214 C215	T113-T197 VanDerWaalsContact OG1-CA 3.3Å; T113-T197 WeakPolarHBondContact OG1-CA 3.29Å; T113-T197 WeakPolarHBondContact OG1-CB 3.47Å; T113-T197 PolarHBondContact OG1-OG1 3.49Å; T113-T197 VanDerWaalsContact OG1-OG1 3.06Å; T197-N199 VanDerWaalsContact C-N 3.33Å; T197-N199 WeakPolarHBondContact OG1-CB 3.27Å; T197-N199 PolarHBondContact OG1-N 3.18Å; T197-N199 VanDerWaalsContact OG1-N 3.07Å; T197-E204 WeakPolarHBondContact CB-OE1 3.32Å; T197-E204 HydrophobicContact CG2-CG 4.27Å; T197-E204 PolarHBondContact OG1-OE1 3.09Å; T197-V212 HydrophobicContact CG2-CG2 3.71Å; T197-V213 PolarHBondContact N-O 2.95Å; T197-Y214 HydrophobicContact CG2-CD1 3.4Å; T197-Y214 HydrophobicContact CG2-CE1 3.75Å; T197-Y214 HydrophobicContact CG2-CG 4.15Å; T197-C215 VanDerWaalsContact O-CB 3.31Å; T197-C215 WeakPolarHBondContact O-CB 3.36Å; T197-C215 PolarHBondContact O-N 3.24Å; T197-C215 PolarHBondContact O-SG 2.6Å
198	Q	95.6	Very high	95.4	Very high	22 Å²	22	27.5 Å²	27.5	10%	0.103	17%	0.173	C	C	.	.			trans	-86.7	-9.9	167.3	-66.5	164.6	95.9	0	0	112	T113 H216 S294 V301	T113-Q198 PolarHBondContact O-N 2.73Å; T113-Q198 PolarHBondContact O-NE2 2.97Å; T113-Q198 VanDerWaalsContact O-NE2 3.08Å; Q198-H216 PolarHBondContact O-ND1 3.31Å; Q198-S294 PolarHBondContact NE2-OG 3.3Å; Q198-V301 HydrophobicContact CG-CB 4.24Å; Q198-V301 HydrophobicContact CG-CG1 3.75Å; Q198-V301 HydrophobicContact CG-CG2 4.34Å
199	N	94.5	Very high	95.4	Very high	5 Å²	5	22.6 Å²	22.6	3%	0.027	15%	0.147	C	C	.	.			trans	-74.1	151.3	-178.3	-62.4	-14.8	0	0	0	110.3	G114 A115 V117 S118 T197	G114-N199 PolarHBondContact O-ND2 3.3Å; G114-N199 PolarHBondContact O-OD1 3.3Å; A115-N199 VanDerWaalsContact CA-OD1 3.25Å; A115-N199 WeakPolarHBondContact CA-OD1 3.42Å; A115-N199 PolarHBondContact N-OD1 3.28Å; V117-N199 VanDerWaalsContact CG2-ND2 3.3Å; V117-N199 WeakPolarHBondContact CG2-ND2 3.06Å; S118-N199 PolarHBondContact OG-ND2 3.48Å; T197-N199 VanDerWaalsContact C-N 3.33Å; T197-N199 WeakPolarHBondContact OG1-CB 3.27Å; T197-N199 PolarHBondContact OG1-N 3.18Å; T197-N199 VanDerWaalsContact OG1-N 3.07Å
200	I	92.7	Very high	95.4	Very high	11 Å²	11	26 Å²	26	6%	0.056	16%	0.163	C	C	.	.			trans	-113.2	-6.3	177.9	63.2	-178.8	0	0	0	111.7	F150 F165 I169 T202 H216 F219 V264	F150-I200 HydrophobicContact CE1-CD1 4.14Å; F165-I200 HydrophobicContact CE1-CD1 3.97Å; F165-I200 HydrophobicContact CZ-CD1 4.11Å; I169-I200 HydrophobicContact CD1-CD1 3.87Å; I169-I200 HydrophobicContact CD1-CG1 3.92Å; I200-T202 PolarHBondContact O-N 3.14Å; I200-H216 HydrophobicContact CG2-CB 4.24Å; I200-F219 HydrophobicContact CB-CD2 4.36Å; I200-F219 HydrophobicContact CB-CE2 4.34Å; I200-F219 HydrophobicContact CD1-CE2 3.77Å; I200-F219 HydrophobicContact CG1-CD2 4.36Å; I200-F219 HydrophobicContact CG1-CE2 3.95Å; I200-F219 WeakPolarHBondContact O-CD2 3.35Å; I200-V264 HydrophobicContact CB-CG2 4.01Å; I200-V264 HydrophobicContact CD1-CG1 4.09Å; I200-V264 HydrophobicContact CD1-CG2 4.17Å; I200-V264 HydrophobicContact CG2-CG1 3.89Å; I200-V264 HydrophobicContact CG2-CG2 4.08Å
201	D	91.4	Very high	95.4	Very high	9 Å²	9	29 Å²	29	5%	0.048	16%	0.16	C	C	.	.	S	Bend	trans	-70.7	-11	-174.2	57.9	38.6	0	0	0	114.4	S118 I123 P171 L203	S118-D201 WeakPolarHBondContact CB-OD2 3.19Å; S118-D201 PolarHBondContact OG-OD2 3.16Å; I123-D201 HydrophobicContact CD1-CB 3.59Å; P171-D201 WeakPolarHBondContact CB-O 3.31Å; P171-D201 WeakPolarHBondContact CG-O 3.32Å; D201-L203 HydrophobicContact CB-CG 4.33Å; D201-L203 PolarHBondContact O-N 3.34Å; D201-L203 WeakPolarHBondContact OD1-CB 3.34Å; D201-L203 PolarHBondContact OD1-N 2.93Å
202	T	91.2	Very high	95.4	Very high	15 Å²	15	28.9 Å²	28.9	9%	0.092	16%	0.162	C	C	.	.			trans	60.5	20.4	179.3	64.1	0	0	0	0	114.9	P171 I200 E204 S205 A206 Y214 T220	P171-T202 WeakPolarHBondContact CB-OG1 3.3Å; P171-T202 WeakPolarHBondContact CG-OG1 3.4Å; I200-T202 PolarHBondContact O-N 3.14Å; T202-E204 PolarHBondContact O-N 3.22Å; T202-S205 WeakPolarHBondContact O-CB 3.49Å; T202-S205 PolarHBondContact O-N 3.15Å; T202-S205 VanDerWaalsContact O-N 3.11Å; T202-A206 PolarHBondContact O-N 3.24Å; T202-A206 VanDerWaalsContact O-N 3.09Å; T202-Y214 HydrophobicContact CG2-CE1 4.42Å; T202-T220 HydrophobicContact CG2-CG2 4.09Å
203	L	93.5	Very high	95.3	Very high	2 Å²	2	29.2 Å²	29.2	1%	0.01	16%	0.164	C	C	.	.	H	α-helix	trans	-66.2	-21.6	176.8	-72.3	179.5	0	0	0	112.6	C121 I123 F174 P176 D201 A206 A207	C121-L203 HydrophobicContact CB-CD1 3.82Å; I123-L203 HydrophobicContact CD1-CD1 4.01Å; F174-L203 HydrophobicContact CB-CD1 4.45Å; F174-L203 HydrophobicContact CB-CD2 4.03Å; P176-L203 HydrophobicContact CG-CD2 4.31Å; D201-L203 HydrophobicContact CB-CG 4.33Å; D201-L203 PolarHBondContact O-N 3.34Å; D201-L203 WeakPolarHBondContact OD1-CB 3.34Å; D201-L203 PolarHBondContact OD1-N 2.93Å; L203-A206 HydrophobicContact CD2-CB 4.41Å; L203-A206 PolarHBondContact O-N 3.16Å; L203-A207 WeakPolarHBondContact O-CB 3.38Å; L203-A207 PolarHBondContact O-N 2.86Å
204	E	95.6	Very high	95.2	Very high	0 Å²	0	30 Å²	30	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-61.8	-47.8	169.7	-62.5	80.7	177.9	0	0	111.4	N195 T197 T202 A207 G208 I209 V212 Y214	N195-E204 WeakPolarHBondContact OD1-CG 3.19Å; T197-E204 WeakPolarHBondContact CB-OE1 3.32Å; T197-E204 HydrophobicContact CG2-CG 4.27Å; T197-E204 PolarHBondContact OG1-OE1 3.09Å; T202-E204 PolarHBondContact O-N 3.22Å; E204-A207 PolarHBondContact O-N 2.79Å; E204-G208 PolarHBondContact O-N 2.62Å; E204-I209 HydrophobicContact CB-CB 4.39Å; E204-I209 HydrophobicContact CB-CD1 4.09Å; E204-I209 HydrophobicContact CG-CD1 4.32Å; E204-I209 WeakPolarHBondContact O-CB 3.16Å; E204-I209 PolarHBondContact O-N 2.95Å; E204-V212 HydrophobicContact CB-CB 4.44Å; E204-V212 HydrophobicContact CB-CG2 3.95Å; E204-V212 HydrophobicContact CG-CG2 4.08Å; E204-Y214 HydrophobicContact CB-CE1 4.48Å; E204-Y214 WeakPolarHBondContact OE2-CE1 3.29Å
205	S	92.6	Very high	95.1	Very high	59 Å²	59	27.8 Å²	27.8	41%	0.413	16%	0.158	S	C	.	.	H	α-helix	trans	-63.6	-40.8	174.3	-70.4	0	0	0	0	111.6	T202 A207 G208 Y214	T202-S205 WeakPolarHBondContact O-CB 3.49Å; T202-S205 PolarHBondContact O-N 3.15Å; T202-S205 VanDerWaalsContact O-N 3.11Å; S205-A207 VanDerWaalsContact C-N 3.25Å; S205-A207 PolarHBondContact O-N 3.45Å; S205-G208 WeakPolarHBondContact O-CA 2.87Å; S205-G208 PolarHBondContact O-N 2.92Å; S205-Y214 WeakPolarHBondContact CB-OH 3.44Å; S205-Y214 PolarHBondContact N-OH 2.77Å; S205-Y214 VanDerWaalsContact N-OH 3.15Å; S205-Y214 PolarHBondContact OG-OH 2.87Å
206	A	90.9	Very high	94.8	Very high	68 Å²	68	29.3 Å²	29.3	56%	0.562	17%	0.165	S	C	*	.	H	α-helix	trans	-66.2	-27.1	176.6	0	0	0	0	0	112.8	P176 T202 L203	P176-A206 HydrophobicContact CG-CB 3.77Å; T202-A206 PolarHBondContact O-N 3.24Å; T202-A206 VanDerWaalsContact O-N 3.09Å; L203-A206 HydrophobicContact CD2-CB 4.41Å; L203-A206 PolarHBondContact O-N 3.16Å
207	A	92.1	Very high	94.6	Very high	19 Å²	19	29.6 Å²	29.6	16%	0.157	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-6.2	169.8	0	0	0	0	0	113.2	P176 H180 L203 E204 S205 I209	P176-A207 HydrophobicContact CB-CB 3.82Å; P176-A207 HydrophobicContact CG-CB 3.95Å; H180-A207 HydrophobicContact CB-CB 3.84Å; L203-A207 WeakPolarHBondContact O-CB 3.38Å; L203-A207 PolarHBondContact O-N 2.86Å; E204-A207 PolarHBondContact O-N 2.79Å; S205-A207 VanDerWaalsContact C-N 3.25Å; S205-A207 PolarHBondContact O-N 3.45Å; A207-I209 HydrophobicContact CB-CD1 4.28Å; A207-I209 HydrophobicContact CB-CG1 4.25Å
208	G	93.9	Very high	94.3	Very high	30 Å²	30	30 Å²	30	31%	0.309	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	79.3	18.4	-178.9	0	0	0	0	0	114.2	K184 E204 S205 E210	K184-G208 WeakPolarHBondContact CD-O 3.48Å; K184-G208 VanDerWaalsContact CE-O 3.27Å; K184-G208 WeakPolarHBondContact CE-O 3.49Å; K184-G208 PolarHBondContact NZ-O 3.12Å; E204-G208 PolarHBondContact O-N 2.62Å; S205-G208 WeakPolarHBondContact O-CA 2.87Å; S205-G208 PolarHBondContact O-N 2.92Å; G208-E210 PolarHBondContact O-N 3.23Å
209	I	96.2	Very high	94	Very high	5 Å²	5	29 Å²	29	3%	0.026	17%	0.166	C	C	.	.			trans	-73.6	122.1	177.8	-57.4	165.6	0	0	0	108.6	I183 K184 L192 E204 A207 V212	I183-I209 HydrophobicContact CB-CD1 3.83Å; I183-I209 HydrophobicContact CG2-CD1 3.66Å; I183-I209 HydrophobicContact CG2-CG1 4.35Å; I183-I209 HydrophobicContact CG2-CG2 4.44Å; K184-I209 HydrophobicContact CB-CG1 4.02Å; K184-I209 HydrophobicContact CD-CG1 4.47Å; L192-I209 HydrophobicContact CD2-CG2 3.99Å; E204-I209 HydrophobicContact CB-CB 4.39Å; E204-I209 HydrophobicContact CB-CD1 4.09Å; E204-I209 HydrophobicContact CG-CD1 4.32Å; E204-I209 WeakPolarHBondContact O-CB 3.16Å; E204-I209 PolarHBondContact O-N 2.95Å; A207-I209 HydrophobicContact CB-CD1 4.28Å; A207-I209 HydrophobicContact CB-CG1 4.25Å; I209-V212 HydrophobicContact CG2-CB 4.32Å
210	E	96.6	Very high	93.7	Very high	164 Å²	164	31.6 Å²	31.6	77%	0.766	18%	0.182	S	C	*	.			trans	-96.1	-36	-176.5	-65.8	176.9	-168.6	0	0	112.1	E187 G208 V212	E187-E210 PolarHBondContact OE1-N 2.79Å; E187-E210 PolarHBondContact OE2-N 2.79Å; G208-E210 PolarHBondContact O-N 3.23Å; E210-V212 PolarHBondContact O-N 2.71Å
211	R	97.5	Very high	93.8	Very high	110 Å²	110	32.3 Å²	32.3	42%	0.415	19%	0.187	S	C	.	.	S	Bend	trans	-81.3	45.9	-179.6	-63.5	-179.6	178.7	-167.3	-1.2	112.3	E187 L192 R194 N195	E187-R211 WeakPolarHBondContact OE1-CB 3.45Å; E187-R211 WeakPolarHBondContact OE1-CG 3.32Å; E187-R211 PolarHBondContact OE1-N 2.96Å; L192-R211 HydrophobicContact CD2-CB 4.23Å; L192-R211 WeakPolarHBondContact O-CD 3.34Å; L192-R211 PolarHBondContact O-NH1 3.27Å; R194-R211 CarbonylContact C-O 3.57Å; R194-R211 WeakPolarHBondContact CA-O 3.32Å; R194-R211 VanDerWaalsContact CD-O 3.28Å; R194-R211 WeakPolarHBondContact CD-O 3.18Å; N195-R211 PolarHBondContact N-O 3.06Å
212	V	97.5	Very high	94	Very high	26 Å²	26	31.9 Å²	31.9	16%	0.158	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	141.5	-179.6	62.4	0	0	0	0	111.8	N195 T197 E204 I209 E210 Y214	N195-V212 CarbonylContact O-C 3.58Å; N195-V212 WeakPolarHBondContact O-CA 3.23Å; T197-V212 HydrophobicContact CG2-CG2 3.71Å; E204-V212 HydrophobicContact CB-CB 4.44Å; E204-V212 HydrophobicContact CB-CG2 3.95Å; E204-V212 HydrophobicContact CG-CG2 4.08Å; I209-V212 HydrophobicContact CG2-CB 4.32Å; E210-V212 PolarHBondContact O-N 2.71Å; V212-Y214 HydrophobicContact CB-CE2 4.47Å; V212-Y214 HydrophobicContact CG1-CD2 4.22Å; V212-Y214 HydrophobicContact CG1-CE2 3.56Å; V212-Y214 HydrophobicContact CG2-CD1 4.45Å; V212-Y214 HydrophobicContact CG2-CD2 4.31Å; V212-Y214 HydrophobicContact CG2-CE1 4.18Å; V212-Y214 HydrophobicContact CG2-CE2 4.06Å
213	V	97.3	Very high	94.3	Very high	8 Å²	8	32.3 Å²	32.3	5%	0.048	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	111	166.6	172.8	0	0	0	0	107.7	R194 N195 Y196 T197 C215 F275 N278	R194-V213 HydrophobicContact CG-CG2 3.85Å; N195-V213 PolarHBondContact O-N 3.15Å; Y196-V213 HydrophobicContact CD1-CB 3.83Å; Y196-V213 HydrophobicContact CD1-CG1 3.86Å; Y196-V213 HydrophobicContact CD1-CG2 4.37Å; Y196-V213 HydrophobicContact CE1-CB 4.02Å; Y196-V213 HydrophobicContact CE1-CG1 4.02Å; Y196-V213 HydrophobicContact CE1-CG2 4.08Å; Y196-V213 HydrophobicContact CG-CB 4.49Å; T197-V213 PolarHBondContact N-O 2.95Å; V213-C215 PolarHBondContact O-N 3.28Å; V213-C215 VanDerWaalsContact O-N 3.09Å; V213-F275 HydrophobicContact CG1-CB 4.27Å; V213-F275 HydrophobicContact CG1-CD2 4.44Å; V213-N278 HydrophobicContact CG2-CB 4.21Å
214	Y	96.8	Very high	94.4	Very high	31 Å²	31	32.3 Å²	32.3	12%	0.122	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	88.8	173.5	-68.3	-75.5	0	0	0	109.9	T197 T202 E204 S205 V212 H216 G217	T197-Y214 HydrophobicContact CG2-CD1 3.4Å; T197-Y214 HydrophobicContact CG2-CE1 3.75Å; T197-Y214 HydrophobicContact CG2-CG 4.15Å; T202-Y214 HydrophobicContact CG2-CE1 4.42Å; E204-Y214 HydrophobicContact CB-CE1 4.48Å; E204-Y214 WeakPolarHBondContact OE2-CE1 3.29Å; S205-Y214 WeakPolarHBondContact CB-OH 3.44Å; S205-Y214 PolarHBondContact N-OH 2.77Å; S205-Y214 VanDerWaalsContact N-OH 3.15Å; S205-Y214 PolarHBondContact OG-OH 2.87Å; V212-Y214 HydrophobicContact CB-CE2 4.47Å; V212-Y214 HydrophobicContact CG1-CD2 4.22Å; V212-Y214 HydrophobicContact CG1-CE2 3.56Å; V212-Y214 HydrophobicContact CG2-CD1 4.45Å; V212-Y214 HydrophobicContact CG2-CD2 4.31Å; V212-Y214 HydrophobicContact CG2-CE1 4.18Å; V212-Y214 HydrophobicContact CG2-CE2 4.06Å; Y214-H216 VanDerWaalsContact C-N 3.26Å; Y214-H216 PolarHBondContact O-N 3.02Å; Y214-G217 WeakPolarHBondContact CB-O 3.28Å; Y214-G217 PolarHBondContact O-N 3.32Å
215	C	95.4	Very high	94.3	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-38.3	-170.9	-55.4	0	0	0	0	111.7	T197 V213 L271 P272 F275 V301	T197-C215 VanDerWaalsContact O-CB 3.31Å; T197-C215 WeakPolarHBondContact O-CB 3.36Å; T197-C215 PolarHBondContact O-N 3.24Å; T197-C215 PolarHBondContact O-SG 2.6Å; V213-C215 PolarHBondContact O-N 3.28Å; V213-C215 VanDerWaalsContact O-N 3.09Å; C215-L271 HydrophobicContact CB-CD2 4.45Å; C215-L271 WeakPolarHBondContact O-CD2 3.28Å; C215-L271 WeakPolarHBondContact O-CG 3.42Å; C215-P272 VanDerWaalsContact O-CD 3.31Å; C215-P272 WeakPolarHBondContact O-CD 3.37Å; C215-F275 HydrophobicContact CB-CD2 4.05Å; C215-F275 HydrophobicContact CB-CE2 4.37Å; C215-V301 HydrophobicContact CB-CG2 3.48Å; C215-V301 VanDerWaalsContact CB-CG2 3.48Å
216	H	93.7	Very high	94.2	Very high	32 Å²	32	34 Å²	34	15%	0.148	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.7	26	176.9	-56.6	151	0	0	0	112.4	Q198 I200 Y214 V264 V265	Q198-H216 PolarHBondContact O-ND1 3.31Å; I200-H216 HydrophobicContact CG2-CB 4.24Å; Y214-H216 VanDerWaalsContact C-N 3.26Å; Y214-H216 PolarHBondContact O-N 3.02Å; H216-V264 CarbonylContact O-C 3.43Å; H216-V264 WeakPolarHBondContact O-CA 3.47Å; H216-V265 VanDerWaalsContact C-CG2 3.44Å; H216-V265 PolarHBondContact O-N 3.28Å
217	G	93	Very high	94.4	Very high	6 Å²	6	33.2 Å²	33.2	6%	0.062	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	68.3	-167.8	-176.4	0	0	0	0	0	112.6	Y214 D263	Y214-G217 WeakPolarHBondContact CB-O 3.28Å; Y214-G217 PolarHBondContact O-N 3.32Å; G217-D263 CarbonylContact C-O 3.5Å; G217-D263 WeakPolarHBondContact CA-O 3.08Å
218	S	91.7	Very high	94.5	Very high	8 Å²	8	38.7 Å²	38.7	6%	0.056	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.8	169.3	-173.4	59.3	0	0	0	0	112.6	T220 D263	S218-T220 PolarHBondContact O-N 3.36Å; S218-T220 WeakPolarHBondContact OG-CG2 3.39Å; S218-T220 PolarHBondContact OG-N 3.44Å; S218-T220 PolarHBondContact OG-OG1 3.37Å; S218-D263 PolarHBondContact N-O 2.89Å; S218-D263 CarbonylContact O-C 3.55Å
219	F	89.2	Confident	94.6	Very high	2 Å²	2	40 Å²	40	1%	0.009	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	25.1	168.2	-75.6	-92.1	0	0	0	113.4	F162 A166 I169 P171 I200 I233 P262 V264	F162-F219 HydrophobicContact CZ-CE1 4.21Å; F162-F219 AromaticContact CZ-CZ 3.94Å; F162-F219 HydrophobicContact CZ-CZ 3.94Å; A166-F219 HydrophobicContact CB-CE1 3.64Å; A166-F219 HydrophobicContact CB-CZ 3.81Å; I169-F219 HydrophobicContact CD1-CD2 4.39Å; I169-F219 HydrophobicContact CD1-CE2 3.53Å; I169-F219 HydrophobicContact CD1-CZ 4.05Å; I169-F219 HydrophobicContact CG1-CE2 4.38Å; P171-F219 HydrophobicContact CG-CB 4.23Å; I200-F219 HydrophobicContact CB-CD2 4.36Å; I200-F219 HydrophobicContact CB-CE2 4.34Å; I200-F219 HydrophobicContact CD1-CE2 3.77Å; I200-F219 HydrophobicContact CG1-CD2 4.36Å; I200-F219 HydrophobicContact CG1-CE2 3.95Å; I200-F219 WeakPolarHBondContact O-CD2 3.35Å; F219-I233 HydrophobicContact CB-CD1 4.37Å; F219-I233 HydrophobicContact CB-CG1 4.47Å; F219-I233 HydrophobicContact CD1-CD1 4.11Å; F219-I233 WeakPolarHBondContact O-CB 3.24Å; F219-I233 WeakPolarHBondContact O-CG1 3.12Å; F219-I233 WeakPolarHBondContact O-CG2 3.46Å; F219-P262 HydrophobicContact CD1-CB 3.77Å; F219-P262 HydrophobicContact CD1-CG 3.89Å; F219-P262 HydrophobicContact CE1-CB 3.8Å; F219-P262 HydrophobicContact CE1-CG 3.66Å; F219-P262 HydrophobicContact CG-CB 4.49Å; F219-V264 HydrophobicContact CD2-CG2 4.09Å; F219-V264 HydrophobicContact CE2-CG2 3.91Å; F219-V264 HydrophobicContact CZ-CG2 4.37Å
220	T	90.1	Very high	94.6	Very high	58 Å²	58	45.1 Å²	45.1	36%	0.356	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	-35	177.9	51.2	0	0	0	0	112.9	T202 S218 I233	T202-T220 HydrophobicContact CG2-CG2 4.09Å; S218-T220 PolarHBondContact O-N 3.36Å; S218-T220 WeakPolarHBondContact OG-CG2 3.39Å; S218-T220 PolarHBondContact OG-N 3.44Å; S218-T220 PolarHBondContact OG-OG1 3.37Å; T220-I233 PolarHBondContact O-N 2.84Å
221	T	93.9	Very high	94.6	Very high	27 Å²	27	37.8 Å²	37.8	17%	0.166	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	165.4	-176.6	51.3	0	0	0	0	110.3	K230 V231 D263	T221-K230 WeakPolarHBondContact OG1-CE 3.5Å; T221-K230 PolarHBondContact OG1-NZ 2.87Å; T221-V231 CarbonylContact C-O 3.57Å; T221-V231 VanDerWaalsContact CA-O 3.28Å; T221-V231 WeakPolarHBondContact CA-O 3.41Å; T221-V231 VanDerWaalsContact CB-O 3.28Å; T221-V231 WeakPolarHBondContact CB-O 3.08Å; T221-D263 PolarHBondContact O-N 3.4Å; T221-D263 PolarHBondContact OG1-OD2 2.93Å
222	A	95.7	Very high	94.5	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	144.6	175.4	0	0	0	0	0	111.3	K230 V231 I236 K261	A222-K230 CarbonylContact O-C 3.16Å; A222-K230 WeakPolarHBondContact O-CA 3.36Å; A222-V231 HydrophobicContact CB-CG2 4.04Å; A222-V231 PolarHBondContact N-O 3.38Å; A222-V231 PolarHBondContact O-N 2.96Å; A222-I236 HydrophobicContact CB-CD1 3.41Å; A222-I236 VanDerWaalsContact CB-CD1 3.41Å; A222-I236 HydrophobicContact CB-CG1 4.3Å; A222-K261 CarbonylContact C-O 3.58Å; A222-K261 VanDerWaalsContact CA-O 3.25Å; A222-K261 WeakPolarHBondContact CA-O 3.28Å; A222-K261 WeakPolarHBondContact CB-O 3.29Å
223	S	96.5	Very high	94.3	Very high	24 Å²	24	35.8 Å²	35.8	17%	0.168	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	139.5	-178.7	-58.9	0	0	0	0	111.5	I225 F229 K261 D263	S223-I225 PolarHBondContact O-N 3.45Å; S223-F229 CarbonylContact C-O 3.48Å; S223-F229 WeakPolarHBondContact CA-O 3.3Å; S223-K261 PolarHBondContact N-O 3.26Å; S223-K261 PolarHBondContact O-N 3.47Å; S223-D263 WeakPolarHBondContact CB-OD1 3.27Å; S223-D263 PolarHBondContact N-OD1 3.01Å; S223-D263 VanDerWaalsContact N-OD1 3.16Å; S223-D263 PolarHBondContact OG-OD1 3.49Å; S223-D263 PolarHBondContact OG-OD2 3.1Å
224	C	95.9	Very high	94	Very high	1 Å²	1	39.9 Å²	39.9	1%	0.007	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.1	126.2	172.1	178.8	0	0	0	0	110	T226 C227 K228 F229 C248 I259 M260	C224-T226 PolarHBondContact O-N 3.28Å; C224-T226 VanDerWaalsContact O-N 3.14Å; C224-T226 PolarHBondContact SG-N 3.31Å; C224-T226 VanDerWaalsContact SG-N 3.38Å; C224-C227 VanDerWaalsContact CB-SG 3.56Å; C224-C227 PolarHBondContact SG-N 3.49Å; C224-C227 VanDerWaalsContact SG-N 3.39Å; C224-K228 WeakPolarHBondContact O-CA 3.25Å; C224-K228 PolarHBondContact O-N 3.34Å; C224-F229 HydrophobicContact CB-CB 4.24Å; C224-F229 PolarHBondContact N-O 3.12Å; C224-C248 HydrophobicContact CB-CB 3.88Å; C224-C248 VanDerWaalsContact CB-SG 3.57Å; C224-C248 WeakPolarHBondContact SG-CB 3.16Å; C224-I259 WeakPolarHBondContact CA-O 3.42Å; C224-M260 HydrophobicContact CB-SD 3.73Å
225	I	93.1	Very high	94	Very high	19 Å²	19	45.5 Å²	45.5	10%	0.097	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-15.1	179.3	64.8	175.4	0	0	0	113.6	F155 R156 S223 K257 I259 K261	F155-I225 HydrophobicContact CE1-CD1 4.36Å; F155-I225 HydrophobicContact CE1-CG2 4.02Å; R156-I225 HydrophobicContact CG-CD1 4.29Å; S223-I225 PolarHBondContact O-N 3.45Å; I225-K257 HydrophobicContact CD1-CB 4.13Å; I225-K257 WeakPolarHBondContact CD1-O 3.43Å; I225-K257 WeakPolarHBondContact CG1-O 3.27Å; I225-I259 HydrophobicContact CD1-CB 4.05Å; I225-I259 HydrophobicContact CD1-CD1 4.2Å; I225-I259 HydrophobicContact CG1-CB 4.35Å; I225-I259 PolarHBondContact N-O 2.94Å; I225-K261 HydrophobicContact CG2-CB 3.55Å; I225-K261 HydrophobicContact CG2-CD 4.01Å; I225-K261 HydrophobicContact CG2-CG 4.37Å
226	T	91.9	Very high	93.9	Very high	75 Å²	75	45.9 Å²	45.9	46%	0.46	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.1	-64.4	178.9	-62.3	0	0	0	0	112	C224 K257	C224-T226 PolarHBondContact O-N 3.28Å; C224-T226 VanDerWaalsContact O-N 3.14Å; C224-T226 PolarHBondContact SG-N 3.31Å; C224-T226 VanDerWaalsContact SG-N 3.38Å; T226-K257 PolarHBondContact OG1-O 2.86Å
227	C	93.7	Very high	93.9	Very high	52 Å²	52	46.4 Å²	46.4	35%	0.351	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.3	-1.4	-174.4	69.6	0	0	0	0	114.8	C224 F229 C248	C224-C227 VanDerWaalsContact CB-SG 3.56Å; C224-C227 PolarHBondContact SG-N 3.49Å; C224-C227 VanDerWaalsContact SG-N 3.39Å; C227-F229 PolarHBondContact O-N 3.11Å; C227-F229 VanDerWaalsContact O-N 3.1Å; C227-F229 WeakPolarHBondContact SG-CB 3.02Å; C227-C248 VanDerWaalsContact SG-SG 3.61Å
228	K	94.7	Very high	94	Very high	135 Å²	135	49.2 Å²	49.2	59%	0.587	25%	0.252	S	S	*	.			trans	61.2	11.9	-176.3	-51.5	-59.2	-174.7	175.3	0	115.4	C224 K230	C224-K228 WeakPolarHBondContact O-CA 3.25Å; C224-K228 PolarHBondContact O-N 3.34Å; K228-K230 PolarHBondContact O-N 2.88Å
229	F	95.8	Very high	94.1	Very high	57 Å²	57	50.7 Å²	50.7	25%	0.25	26%	0.259	C	S	.	.			trans	-55.8	124.6	171.8	-178.2	-114.1	0	0	0	110.5	S223 C224 C227 V231 P249 Q250 M260	S223-F229 CarbonylContact C-O 3.48Å; S223-F229 WeakPolarHBondContact CA-O 3.3Å; C224-F229 HydrophobicContact CB-CB 4.24Å; C224-F229 PolarHBondContact N-O 3.12Å; C227-F229 PolarHBondContact O-N 3.11Å; C227-F229 VanDerWaalsContact O-N 3.1Å; C227-F229 WeakPolarHBondContact SG-CB 3.02Å; F229-V231 HydrophobicContact CD1-CG1 3.89Å; F229-V231 HydrophobicContact CE1-CG1 3.4Å; F229-V231 VanDerWaalsContact CE1-CG1 3.4Å; F229-V231 HydrophobicContact CZ-CG1 4.17Å; F229-P249 HydrophobicContact CD1-CG 4.01Å; F229-P249 HydrophobicContact CE1-CG 3.62Å; F229-Q250 HydrophobicContact CB-CG 4.33Å; F229-Q250 HydrophobicContact CD1-CG 3.98Å; F229-Q250 HydrophobicContact CD2-CG 3.89Å; F229-Q250 VanDerWaalsContact CD2-OE1 3.27Å; F229-Q250 HydrophobicContact CE1-CG 4.24Å; F229-Q250 HydrophobicContact CE2-CG 4.15Å; F229-Q250 VanDerWaalsContact CE2-NE2 3.32Å; F229-Q250 VanDerWaalsContact CG-CD 3.46Å; F229-Q250 HydrophobicContact CG-CG 3.79Å; F229-Q250 HydrophobicContact CZ-CG 4.31Å; F229-M260 HydrophobicContact CD1-CE 4.47Å; F229-M260 WeakPolarHBondContact O-CE 3.35Å
230	K	97.3	Very high	94.3	Very high	113 Å²	113	50.6 Å²	50.6	49%	0.491	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	138.5	-173.6	-174.3	165.4	177.3	139.6	0	111.1	T221 A222 K228 D263	T221-K230 WeakPolarHBondContact OG1-CE 3.5Å; T221-K230 PolarHBondContact OG1-NZ 2.87Å; A222-K230 CarbonylContact O-C 3.16Å; A222-K230 WeakPolarHBondContact O-CA 3.36Å; K228-K230 PolarHBondContact O-N 2.88Å; K230-D263 WeakPolarHBondContact CE-OD2 3.18Å; K230-D263 IonicContact NZ-OD2 2.74Å; K230-D263 PolarHBondContact NZ-OD2 3.2Å
231	V	96.6	Very high	94.4	Very high	9 Å²	9	51 Å²	51	6%	0.055	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	155.9	176.3	-60.6	0	0	0	0	111.1	T221 A222 F229 K235 I236 M260	T221-V231 CarbonylContact C-O 3.57Å; T221-V231 VanDerWaalsContact CA-O 3.28Å; T221-V231 WeakPolarHBondContact CA-O 3.41Å; T221-V231 VanDerWaalsContact CB-O 3.28Å; T221-V231 WeakPolarHBondContact CB-O 3.08Å; A222-V231 HydrophobicContact CB-CG2 4.04Å; A222-V231 PolarHBondContact N-O 3.38Å; A222-V231 PolarHBondContact O-N 2.96Å; F229-V231 HydrophobicContact CD1-CG1 3.89Å; F229-V231 HydrophobicContact CE1-CG1 3.4Å; F229-V231 VanDerWaalsContact CE1-CG1 3.4Å; F229-V231 HydrophobicContact CZ-CG1 4.17Å; V231-K235 HydrophobicContact CB-CB 4.33Å; V231-K235 HydrophobicContact CB-CD 4.07Å; V231-K235 HydrophobicContact CG1-CD 4.23Å; V231-K235 HydrophobicContact CG2-CB 4.47Å; V231-I236 HydrophobicContact CG2-CG2 4.04Å; V231-M260 HydrophobicContact CB-CE 4.17Å; V231-M260 HydrophobicContact CG1-CE 3.81Å; V231-M260 HydrophobicContact CG2-CE 3.4Å; V231-M260 VanDerWaalsContact CG2-CE 3.4Å
232	D	95.3	Very high	94.3	Very high	82 Å²	82	55.2 Å²	55.2	44%	0.439	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.9	144.2	163.2	-169.8	-79.5	0	0	0	110.4	E234 K235	D232-E234 PolarHBondContact O-N 3.42Å; D232-E234 WeakPolarHBondContact OD1-CB 3.49Å; D232-E234 WeakPolarHBondContact OD1-CG 3.04Å; D232-E234 PolarHBondContact OD1-N 2.93Å; D232-K235 WeakPolarHBondContact O-CB 3.48Å; D232-K235 PolarHBondContact O-N 3.38Å; D232-K235 VanDerWaalsContact O-N 3.12Å
233	I	92.1	Very high	93.9	Very high	13 Å²	13	57.2 Å²	57.2	7%	0.067	30%	0.296	C	S	.	.	G	3₁₀ helix	trans	-59	-32	-178.1	-162.2	74.4	0	0	0	112.6	Y170 F219 T220 K235 I236 K237 I240 P262	Y170-I233 HydrophobicContact CE2-CG1 4.3Å; Y170-I233 WeakPolarHBondContact OH-CG1 3.06Å; F219-I233 HydrophobicContact CB-CD1 4.37Å; F219-I233 HydrophobicContact CB-CG1 4.47Å; F219-I233 HydrophobicContact CD1-CD1 4.11Å; F219-I233 WeakPolarHBondContact O-CB 3.24Å; F219-I233 WeakPolarHBondContact O-CG1 3.12Å; F219-I233 WeakPolarHBondContact O-CG2 3.46Å; T220-I233 PolarHBondContact O-N 2.84Å; I233-K235 PolarHBondContact O-N 3Å; I233-I236 HydrophobicContact CD1-CD1 3.84Å; I233-I236 HydrophobicContact CD1-CG1 3.93Å; I233-I236 HydrophobicContact CG1-CG1 4.44Å; I233-I236 WeakPolarHBondContact O-CG1 3.49Å; I233-I236 PolarHBondContact O-N 2.68Å; I233-K237 PolarHBondContact O-N 3.36Å; I233-I240 HydrophobicContact CD1-CD1 4.21Å; I233-P262 HydrophobicContact CD1-CB 4.41Å; I233-P262 HydrophobicContact CD1-CG 4.36Å
234	E	92.8	Very high	93.6	Very high	93 Å²	93	61.4 Å²	61.4	44%	0.435	31%	0.309	S	S	.	.	G	3₁₀ helix	trans	-60.6	-24	-179.3	-68.7	-57.2	106.9	0	0	112	D232 I236 K237	D232-E234 PolarHBondContact O-N 3.42Å; D232-E234 WeakPolarHBondContact OD1-CB 3.49Å; D232-E234 WeakPolarHBondContact OD1-CG 3.04Å; D232-E234 PolarHBondContact OD1-N 2.93Å; E234-I236 VanDerWaalsContact C-N 3.34Å; E234-I236 PolarHBondContact O-N 3.13Å; E234-K237 WeakPolarHBondContact OE1-CD 3.44Å; E234-K237 IonicContact OE1-NZ 3.87Å; E234-K237 VanDerWaalsContact OE2-CD 3.23Å; E234-K237 WeakPolarHBondContact OE2-CD 3.4Å; E234-K237 IonicContact OE2-NZ 3.92Å; E234-K237 PolarHBondContact OE2-NZ 2.93Å
235	K	95.2	Very high	93.6	Very high	149 Å²	149	64.4 Å²	64.4	65%	0.648	32%	0.324	S	S	*	.	G	3₁₀ helix	trans	-71.8	-25.1	176.2	-64.7	-168.7	-178.2	174.1	0	113.8	V231 D232 I233	V231-K235 HydrophobicContact CB-CB 4.33Å; V231-K235 HydrophobicContact CB-CD 4.07Å; V231-K235 HydrophobicContact CG1-CD 4.23Å; V231-K235 HydrophobicContact CG2-CB 4.47Å; D232-K235 WeakPolarHBondContact O-CB 3.48Å; D232-K235 PolarHBondContact O-N 3.38Å; D232-K235 VanDerWaalsContact O-N 3.12Å; I233-K235 PolarHBondContact O-N 3Å
236	I	94.1	Very high	93.7	Very high	9 Å²	9	63.5 Å²	63.5	5%	0.046	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.7	-5.1	-179.7	65.8	163.4	0	0	0	113.1	A222 V231 I233 E234 P238 D239 I240 P246 M260 P262	A222-I236 HydrophobicContact CB-CD1 3.41Å; A222-I236 VanDerWaalsContact CB-CD1 3.41Å; A222-I236 HydrophobicContact CB-CG1 4.3Å; V231-I236 HydrophobicContact CG2-CG2 4.04Å; I233-I236 HydrophobicContact CD1-CD1 3.84Å; I233-I236 HydrophobicContact CD1-CG1 3.93Å; I233-I236 HydrophobicContact CG1-CG1 4.44Å; I233-I236 WeakPolarHBondContact O-CG1 3.49Å; I233-I236 PolarHBondContact O-N 2.68Å; E234-I236 VanDerWaalsContact C-N 3.34Å; E234-I236 PolarHBondContact O-N 3.13Å; I236-P238 VanDerWaalsContact C-CD 3.49Å; I236-D239 WeakPolarHBondContact O-CB 3.43Å; I236-D239 PolarHBondContact O-N 3.25Å; I236-D239 VanDerWaalsContact O-N 3.11Å; I236-I240 HydrophobicContact CD1-CD1 3.75Å; I236-I240 HydrophobicContact CD1-CG1 4.49Å; I236-I240 HydrophobicContact CG1-CD1 3.91Å; I236-I240 PolarHBondContact O-N 3.22Å; I236-I240 VanDerWaalsContact O-N 3.1Å; I236-P246 HydrophobicContact CB-CB 3.79Å; I236-P246 HydrophobicContact CB-CG 4.24Å; I236-P246 HydrophobicContact CD1-CG 4.09Å; I236-P246 HydrophobicContact CG2-CB 3.83Å; I236-M260 HydrophobicContact CD1-CB 4.46Å; I236-M260 HydrophobicContact CG2-CB 4.04Å; I236-M260 HydrophobicContact CG2-CG 4.27Å; I236-P262 HydrophobicContact CD1-CG 4.43Å
237	K	93.6	Very high	93.8	Very high	43 Å²	43	63.4 Å²	63.4	19%	0.187	32%	0.315	C	S	.	.	H	α-helix	trans	-49.3	-47.4	176.6	175.9	173.3	172.4	175.2	0	114.2	Y170 D172 I233 E234 D239 I240 L241	Y170-K237 HydrophobicContact CE1-CD 3.83Å; Y170-K237 HydrophobicContact CE1-CG 3.88Å; Y170-K237 HydrophobicContact CE2-CG 4.42Å; Y170-K237 VanDerWaalsContact OH-CB 3.27Å; Y170-K237 WeakPolarHBondContact OH-CB 3.18Å; Y170-K237 WeakPolarHBondContact OH-CG 3.3Å; D172-K237 WeakPolarHBondContact OD2-CE 3.32Å; D172-K237 IonicContact OD2-NZ 3.99Å; D172-K237 PolarHBondContact OD2-NZ 3.19Å; I233-K237 PolarHBondContact O-N 3.36Å; E234-K237 WeakPolarHBondContact OE1-CD 3.44Å; E234-K237 IonicContact OE1-NZ 3.87Å; E234-K237 VanDerWaalsContact OE2-CD 3.23Å; E234-K237 WeakPolarHBondContact OE2-CD 3.4Å; E234-K237 IonicContact OE2-NZ 3.92Å; E234-K237 PolarHBondContact OE2-NZ 2.93Å; K237-D239 VanDerWaalsContact C-N 3.26Å; K237-D239 PolarHBondContact O-N 3.1Å; K237-I240 PolarHBondContact O-N 3.33Å; K237-L241 HydrophobicContact CD-CD1 4.49Å; K237-L241 HydrophobicContact CG-CD1 3.72Å; K237-L241 HydrophobicContact CG-CG 4.15Å; K237-L241 WeakPolarHBondContact O-CG 3.43Å; K237-L241 PolarHBondContact O-N 3Å
238	P	94.4	Very high	93.9	Very high	64 Å²	64	60.9 Å²	60.9	42%	0.416	30%	0.298	S	S	.	.	H	α-helix	trans	-58.5	-40.1	179	-24.4	35.5	0	0	0	112.4	I236 E242	I236-P238 VanDerWaalsContact C-CD 3.49Å; P238-E242 VanDerWaalsContact O-CB 3.29Å; P238-E242 WeakPolarHBondContact O-CB 3.45Å; P238-E242 VanDerWaalsContact O-CG 3.28Å; P238-E242 WeakPolarHBondContact O-CG 3.34Å; P238-E242 PolarHBondContact O-N 2.99Å
239	D	94.8	Very high	93.8	Very high	39 Å²	39	59 Å²	59	21%	0.209	30%	0.3	C	S	.	.	H	α-helix	trans	-65.8	-45.9	177.6	-69.3	-32.7	0	0	0	111.6	I236 K237 L241 E242 G243 R244 P246	I236-D239 WeakPolarHBondContact O-CB 3.43Å; I236-D239 PolarHBondContact O-N 3.25Å; I236-D239 VanDerWaalsContact O-N 3.11Å; K237-D239 VanDerWaalsContact C-N 3.26Å; K237-D239 PolarHBondContact O-N 3.1Å; D239-L241 PolarHBondContact O-N 3.29Å; D239-E242 PolarHBondContact O-N 3.37Å; D239-G243 PolarHBondContact O-N 3.15Å; D239-R244 CarbonylContact C-O 3.32Å; D239-R244 HydrophobicContact CB-CB 4.04Å; D239-R244 PolarHBondContact O-N 3.36Å; D239-R244 VanDerWaalsContact O-O 3.13Å; D239-R244 IonicContact OD1-CZ 3.15Å; D239-R244 VanDerWaalsContact OD1-CZ 3.29Å; D239-R244 IonicContact OD1-NE 3.43Å; D239-R244 PolarHBondContact OD1-NE 2.96Å; D239-R244 IonicContact OD1-NH2 3.53Å; D239-R244 PolarHBondContact OD1-NH2 3.15Å; D239-P246 HydrophobicContact CB-CB 3.91Å
240	I	93.2	Very high	93.6	Very high	0 Å²	0	62.3 Å²	62.3	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-60.8	-48.4	178.8	-63.8	171.6	0	0	0	110.8	F163 A166 K167 Y170 I233 I236 K237 E242 G243	F163-I240 HydrophobicContact CD1-CG1 4.14Å; F163-I240 HydrophobicContact CE1-CG1 4.26Å; A166-I240 HydrophobicContact CB-CG2 4.08Å; K167-I240 HydrophobicContact CB-CG2 4.39Å; Y170-I240 HydrophobicContact CD2-CB 4.43Å; Y170-I240 HydrophobicContact CD2-CG2 3.78Å; Y170-I240 HydrophobicContact CE2-CB 4.35Å; Y170-I240 HydrophobicContact CE2-CD1 3.98Å; Y170-I240 HydrophobicContact CE2-CG2 4.16Å; I233-I240 HydrophobicContact CD1-CD1 4.21Å; I236-I240 HydrophobicContact CD1-CD1 3.75Å; I236-I240 HydrophobicContact CD1-CG1 4.49Å; I236-I240 HydrophobicContact CG1-CD1 3.91Å; I236-I240 PolarHBondContact O-N 3.22Å; I236-I240 VanDerWaalsContact O-N 3.1Å; K237-I240 PolarHBondContact O-N 3.33Å; I240-E242 VanDerWaalsContact C-N 3.34Å; I240-E242 PolarHBondContact O-N 3.49Å; I240-G243 PolarHBondContact O-N 3.39Å
241	L	91.5	Very high	93.4	Very high	66 Å²	66	58.5 Å²	58.5	35%	0.346	30%	0.303	S	S	.	.	H	α-helix	trans	-67.6	-33.2	-177.6	-64.8	-179.2	0	0	0	112.6	K167 Y170 K237 D239 G243	K167-L241 WeakPolarHBondContact CD-O 3.45Å; K167-L241 WeakPolarHBondContact CE-O 3.41Å; K167-L241 PolarHBondContact NZ-O 2.95Å; Y170-L241 HydrophobicContact CD1-CD2 4.2Å; Y170-L241 HydrophobicContact CD2-CD2 4.4Å; Y170-L241 HydrophobicContact CG-CD2 3.95Å; K237-L241 HydrophobicContact CD-CD1 4.49Å; K237-L241 HydrophobicContact CG-CD1 3.72Å; K237-L241 HydrophobicContact CG-CG 4.15Å; K237-L241 WeakPolarHBondContact O-CG 3.43Å; K237-L241 PolarHBondContact O-N 3Å; D239-L241 PolarHBondContact O-N 3.29Å; L241-G243 VanDerWaalsContact C-N 3.26Å; L241-G243 PolarHBondContact O-N 3.06Å
242	E	91.9	Very high	92.7	Very high	117 Å²	117	59.4 Å²	59.4	55%	0.547	32%	0.315	S	S	.	.	H	α-helix	trans	-79	-8	172.7	-69.2	179.7	-130.5	0	0	113.1	P238 D239 I240 R244	P238-E242 VanDerWaalsContact O-CB 3.29Å; P238-E242 WeakPolarHBondContact O-CB 3.45Å; P238-E242 VanDerWaalsContact O-CG 3.28Å; P238-E242 WeakPolarHBondContact O-CG 3.34Å; P238-E242 PolarHBondContact O-N 2.99Å; D239-E242 PolarHBondContact O-N 3.37Å; I240-E242 VanDerWaalsContact C-N 3.34Å; I240-E242 PolarHBondContact O-N 3.49Å; E242-R244 VanDerWaalsContact C-N 3.32Å; E242-R244 HydrophobicContact CB-CG 4.29Å; E242-R244 IonicContact OE1-CZ 3.46Å; E242-R244 IonicContact OE1-NH1 2.78Å; E242-R244 IonicContact OE1-NH2 2.61Å; E242-R244 PolarHBondContact OE1-NH2 3.47Å; E242-R244 IonicContact OE2-CZ 3.71Å; E242-R244 IonicContact OE2-NE 2.98Å; E242-R244 IonicContact OE2-NH1 2.8Å; E242-R244 PolarHBondContact OE2-NH1 3.1Å; E242-R244 IonicContact OE2-NH2 2.99Å; E242-R244 PolarHBondContact OE2-NH2 3.25Å
243	G	86.8	Confident	91.8	Very high	41 Å²	41	61.4 Å²	61.4	42%	0.423	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.9	19.7	-176.8	0	0	0	0	0	113.9	D239 I240 L241	D239-G243 PolarHBondContact O-N 3.15Å; I240-G243 PolarHBondContact O-N 3.39Å; L241-G243 VanDerWaalsContact C-N 3.26Å; L241-G243 PolarHBondContact O-N 3.06Å
244	R	92.1	Very high	90.6	Very high	112 Å²	112	69.7 Å²	69.7	42%	0.423	37%	0.368	S	S	.	.			trans	-83.3	151.6	171	-61.8	-165.5	-64.6	-116	-16.7	110.5	D239 E242 P246	D239-R244 CarbonylContact C-O 3.32Å; D239-R244 HydrophobicContact CB-CB 4.04Å; D239-R244 PolarHBondContact O-N 3.36Å; D239-R244 VanDerWaalsContact O-O 3.13Å; D239-R244 IonicContact OD1-CZ 3.15Å; D239-R244 VanDerWaalsContact OD1-CZ 3.29Å; D239-R244 IonicContact OD1-NE 3.43Å; D239-R244 PolarHBondContact OD1-NE 2.96Å; D239-R244 IonicContact OD1-NH2 3.53Å; D239-R244 PolarHBondContact OD1-NH2 3.15Å; E242-R244 VanDerWaalsContact C-N 3.32Å; E242-R244 HydrophobicContact CB-CG 4.29Å; E242-R244 IonicContact OE1-CZ 3.46Å; E242-R244 IonicContact OE1-NH1 2.78Å; E242-R244 IonicContact OE1-NH2 2.61Å; E242-R244 PolarHBondContact OE1-NH2 3.47Å; E242-R244 IonicContact OE2-CZ 3.71Å; E242-R244 IonicContact OE2-NE 2.98Å; E242-R244 IonicContact OE2-NH1 2.8Å; E242-R244 PolarHBondContact OE2-NH1 3.1Å; E242-R244 IonicContact OE2-NH2 2.99Å; E242-R244 PolarHBondContact OE2-NH2 3.25Å; R244-P246 WeakPolarHBondContact O-CD 3.31Å
245	I	94.1	Very high	89.3	Confident	64 Å²	64	66.8 Å²	66.8	33%	0.328	36%	0.36	S	S	.	.			trans	-84.7	115.1	172.1	-63.9	159.9	0	0	0	107.8	P159 F163 I247 I259	P159-I245 HydrophobicContact CG-CD1 3.71Å; P159-I245 HydrophobicContact CG-CG1 4.25Å; P159-I245 HydrophobicContact CG-CG2 4.23Å; F163-I245 HydrophobicContact CD2-CB 4.38Å; F163-I245 HydrophobicContact CD2-CG1 3.92Å; F163-I245 HydrophobicContact CD2-CG2 4.19Å; F163-I245 HydrophobicContact CE2-CG1 4.46Å; F163-I245 HydrophobicContact CE2-CG2 3.87Å; I245-I247 PolarHBondContact O-N 3.14Å; I245-I259 HydrophobicContact CG2-CB 4.45Å; I245-I259 HydrophobicContact CG2-CD1 4.4Å; I245-I259 HydrophobicContact CG2-CG1 3.93Å; I245-I259 HydrophobicContact CG2-CG2 3.75Å
246	P	95.1	Very high	88	Confident	0 Å²	0	69.9 Å²	69.9	0%	0	37%	0.374	C	S	.	.	P	Polyproline II helix	trans	-68.6	130.1	-178.5	28.2	-35.6	0	0	0	111.3	F163 I236 D239 R244 M260	F163-P246 HydrophobicContact CD1-CG 4.43Å; F163-P246 HydrophobicContact CE1-CG 3.55Å; F163-P246 VanDerWaalsContact CZ-CD 3.43Å; F163-P246 HydrophobicContact CZ-CG 3.64Å; I236-P246 HydrophobicContact CB-CB 3.79Å; I236-P246 HydrophobicContact CB-CG 4.24Å; I236-P246 HydrophobicContact CD1-CG 4.09Å; I236-P246 HydrophobicContact CG2-CB 3.83Å; D239-P246 HydrophobicContact CB-CB 3.91Å; R244-P246 WeakPolarHBondContact O-CD 3.31Å; P246-M260 HydrophobicContact CB-CB 4.04Å; P246-M260 HydrophobicContact CG-CB 4.08Å; P246-M260 WeakPolarHBondContact CG-O 3.22Å; P246-M260 PolarHBondContact O-N 2.8Å
247	I	94.7	Very high	87.3	Confident	73 Å²	73	74 Å²	74	37%	0.374	39%	0.392	S	S	.	.	B	Isolated β-bridge	trans	-101.3	144	-177.4	-58.7	-58.5	0	0	0	110.4	I245 P249 T253 S258	I245-I247 PolarHBondContact O-N 3.14Å; I247-P249 WeakPolarHBondContact O-CD 3.26Å; I247-T253 HydrophobicContact CG2-CG2 4.43Å; I247-S258 CarbonylContact C-O 3.58Å; I247-S258 VanDerWaalsContact CA-O 3.32Å; I247-S258 WeakPolarHBondContact CA-O 3.45Å
248	C	96	Very high	87.1	Confident	0 Å²	0	72.2 Å²	72.2	0%	0	38%	0.384	C	S	.	.	P	Polyproline II helix	trans	-67.1	123.5	179.3	179.2	0	0	0	0	110.8	C224 C227 Q250 C251 G252 S258 M260	C224-C248 HydrophobicContact CB-CB 3.88Å; C224-C248 VanDerWaalsContact CB-SG 3.57Å; C224-C248 WeakPolarHBondContact SG-CB 3.16Å; C227-C248 VanDerWaalsContact SG-SG 3.61Å; C248-Q250 VanDerWaalsContact C-N 3.26Å; C248-Q250 PolarHBondContact O-N 3.05Å; C248-Q250 PolarHBondContact SG-N 2.79Å; C248-C251 HydrophobicContact CB-CB 4.16Å; C248-C251 PolarHBondContact O-N 3.17Å; C248-G252 PolarHBondContact O-N 2.76Å; C248-S258 PolarHBondContact N-O 3.03Å; C248-M260 WeakPolarHBondContact CA-SD 3.33Å; C248-M260 HydrophobicContact CB-CG 4.35Å; C248-M260 HydrophobicContact CB-SD 3.59Å; C248-M260 VanDerWaalsContact CB-SD 3.59Å
249	P	92.3	Very high	87.1	Confident	94 Å²	94	70 Å²	70	61%	0.61	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-24.2	-179.2	27.8	-35.5	0	0	0	113	F229 I247	F229-P249 HydrophobicContact CD1-CG 4.01Å; F229-P249 HydrophobicContact CE1-CG 3.62Å; I247-P249 WeakPolarHBondContact O-CD 3.26Å
250	Q	92.5	Very high	87.2	Confident	128 Å²	128	68.2 Å²	68.2	60%	0.598	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-35.7	178.4	-69.5	-165	-25.9	0	0	113.4	F229 C248	F229-Q250 HydrophobicContact CB-CG 4.33Å; F229-Q250 HydrophobicContact CD1-CG 3.98Å; F229-Q250 HydrophobicContact CD2-CG 3.89Å; F229-Q250 VanDerWaalsContact CD2-OE1 3.27Å; F229-Q250 HydrophobicContact CE1-CG 4.24Å; F229-Q250 HydrophobicContact CE2-CG 4.15Å; F229-Q250 VanDerWaalsContact CE2-NE2 3.32Å; F229-Q250 VanDerWaalsContact CG-CD 3.46Å; F229-Q250 HydrophobicContact CG-CG 3.79Å; F229-Q250 HydrophobicContact CZ-CG 4.31Å; C248-Q250 VanDerWaalsContact C-N 3.26Å; C248-Q250 PolarHBondContact O-N 3.05Å; C248-Q250 PolarHBondContact SG-N 2.79Å
251	C	92.7	Very high	87.3	Confident	32 Å²	32	68.7 Å²	68.7	22%	0.216	36%	0.361	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.6	-25.9	177.9	-62.9	0	0	0	0	112.7	C248 A255 S258	C248-C251 HydrophobicContact CB-CB 4.16Å; C248-C251 PolarHBondContact O-N 3.17Å; C251-A255 HydrophobicContact CB-CB 4.18Å; C251-S258 VanDerWaalsContact CB-CB 3.47Å
252	G	82	Confident	87.5	Confident	29 Å²	29	65.6 Å²	65.6	30%	0.299	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.1	-160.7	-168.9	0	0	0	0	0	112.3	C248 Q254 S258	C248-G252 PolarHBondContact O-N 2.76Å; G252-Q254 VanDerWaalsContact C-N 3.32Å; G252-S258 WeakPolarHBondContact O-CB 3.29Å; G252-S258 PolarHBondContact O-OG 3Å
253	T	76.7	Confident	87.6	Confident	124 Å²	124	61.9 Å²	61.9	76%	0.761	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.4	-4.5	-179.7	52.2	0	0	0	0	113.9	I247	I247-T253 HydrophobicContact CG2-CG2 4.43Å
254	Q	67	Low	87.9	Confident	187 Å²	187	60 Å²	60	87%	0.874	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.8	-31	-174.2	-64.9	-171.2	-1.2	0	0	113.1	G252	G252-Q254 VanDerWaalsContact C-N 3.32Å
255	A	65.7	Low	88	Confident	32 Å²	32	56 Å²	56	26%	0.264	30%	0.297	S	S	.	.	S	Bend	trans	-81.8	122.4	173	0	0	0	0	0	109.5	C251 K257 S258	C251-A255 HydrophobicContact CB-CB 4.18Å; A255-K257 PolarHBondContact O-N 2.99Å; A255-S258 PolarHBondContact O-N 3.14Å; A255-S258 PolarHBondContact O-OG 3.49Å; A255-S258 VanDerWaalsContact O-OG 3.1Å
256	K	66.2	Low	87.9	Confident	213 Å²	213	53 Å²	53	93%	0.926	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.7	-11.6	-178.5	-74.3	-176.8	176.7	178.8	0	115.3
257	K	79.3	Confident	87.4	Confident	97 Å²	97	57.2 Å²	57.2	42%	0.422	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-143	38.6	-174.7	-62.7	-169.5	179.3	-171.1	0	112.8	R156 I225 T226 A255 I259	R156-K257 WeakPolarHBondContact O-CE 3.35Å; R156-K257 PolarHBondContact O-NZ 2.76Å; I225-K257 HydrophobicContact CD1-CB 4.13Å; I225-K257 WeakPolarHBondContact CD1-O 3.43Å; I225-K257 WeakPolarHBondContact CG1-O 3.27Å; T226-K257 PolarHBondContact OG1-O 2.86Å; A255-K257 PolarHBondContact O-N 2.99Å; K257-I259 PolarHBondContact O-N 3.19Å
258	S	90.2	Very high	86.8	Confident	5 Å²	5	57.5 Å²	57.5	4%	0.035	32%	0.321	C	S	.	.			trans	-79.8	53.9	175.9	49.5	0	0	0	0	112.8	I247 C248 C251 G252 A255	I247-S258 CarbonylContact C-O 3.58Å; I247-S258 VanDerWaalsContact CA-O 3.32Å; I247-S258 WeakPolarHBondContact CA-O 3.45Å; C248-S258 PolarHBondContact N-O 3.03Å; C251-S258 VanDerWaalsContact CB-CB 3.47Å; G252-S258 WeakPolarHBondContact O-CB 3.29Å; G252-S258 PolarHBondContact O-OG 3Å; A255-S258 PolarHBondContact O-N 3.14Å; A255-S258 PolarHBondContact O-OG 3.49Å; A255-S258 VanDerWaalsContact O-OG 3.1Å
259	I	94.7	Very high	86.4	Confident	18 Å²	18	60.4 Å²	60.4	9%	0.092	34%	0.335	C	S	.	.	B	Isolated β-bridge	trans	-95.4	136.3	-177.1	-61.5	157.2	0	0	0	110.2	F155 P159 F163 C224 I225 I245 K257 K261	F155-I259 HydrophobicContact CE1-CG2 4.04Å; F155-I259 HydrophobicContact CZ-CG2 3.84Å; P159-I259 HydrophobicContact CB-CD1 4.2Å; P159-I259 HydrophobicContact CG-CD1 3.77Å; F163-I259 HydrophobicContact CE2-CG2 3.85Å; F163-I259 HydrophobicContact CZ-CG2 4.04Å; C224-I259 WeakPolarHBondContact CA-O 3.42Å; I225-I259 HydrophobicContact CD1-CB 4.05Å; I225-I259 HydrophobicContact CD1-CD1 4.2Å; I225-I259 HydrophobicContact CG1-CB 4.35Å; I225-I259 PolarHBondContact N-O 2.94Å; I245-I259 HydrophobicContact CG2-CB 4.45Å; I245-I259 HydrophobicContact CG2-CD1 4.4Å; I245-I259 HydrophobicContact CG2-CG1 3.93Å; I245-I259 HydrophobicContact CG2-CG2 3.75Å; K257-I259 PolarHBondContact O-N 3.19Å; I259-K261 PolarHBondContact O-N 3.43Å
260	M	96.2	Very high	86.2	Confident	1 Å²	1	63.2 Å²	63.2	1%	0.005	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	102.6	170.6	-61.4	-56.3	-66.3	0	0	109.5	F163 C224 F229 V231 I236 P246 C248	F163-M260 WeakPolarHBondContact CZ-O 3.49Å; C224-M260 HydrophobicContact CB-SD 3.73Å; F229-M260 HydrophobicContact CD1-CE 4.47Å; F229-M260 WeakPolarHBondContact O-CE 3.35Å; V231-M260 HydrophobicContact CB-CE 4.17Å; V231-M260 HydrophobicContact CG1-CE 3.81Å; V231-M260 HydrophobicContact CG2-CE 3.4Å; V231-M260 VanDerWaalsContact CG2-CE 3.4Å; I236-M260 HydrophobicContact CD1-CB 4.46Å; I236-M260 HydrophobicContact CG2-CB 4.04Å; I236-M260 HydrophobicContact CG2-CG 4.27Å; P246-M260 HydrophobicContact CB-CB 4.04Å; P246-M260 HydrophobicContact CG-CB 4.08Å; P246-M260 WeakPolarHBondContact CG-O 3.22Å; P246-M260 PolarHBondContact O-N 2.8Å; C248-M260 WeakPolarHBondContact CA-SD 3.33Å; C248-M260 HydrophobicContact CB-CG 4.35Å; C248-M260 HydrophobicContact CB-SD 3.59Å; C248-M260 VanDerWaalsContact CB-SD 3.59Å
261	K	95.4	Very high	86.1	Confident	10 Å²	10	58.4 Å²	58.4	4%	0.043	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	127.3	179.2	-178.6	-168	151.9	-66.6	0	108.8	I152 F155 A222 S223 I225 I259 V264 F266 E269	I152-K261 HydrophobicContact CD1-CD 3.95Å; F155-K261 HydrophobicContact CD1-CD 4.21Å; F155-K261 HydrophobicContact CD1-CG 4.42Å; F155-K261 HydrophobicContact CE1-CB 3.79Å; F155-K261 HydrophobicContact CE1-CD 4.03Å; F155-K261 HydrophobicContact CE1-CG 3.81Å; F155-K261 HydrophobicContact CE2-CG 4.41Å; F155-K261 HydrophobicContact CZ-CB 3.87Å; F155-K261 HydrophobicContact CZ-CD 4.46Å; F155-K261 HydrophobicContact CZ-CG 3.8Å; A222-K261 CarbonylContact C-O 3.58Å; A222-K261 VanDerWaalsContact CA-O 3.25Å; A222-K261 WeakPolarHBondContact CA-O 3.28Å; A222-K261 WeakPolarHBondContact CB-O 3.29Å; S223-K261 PolarHBondContact N-O 3.26Å; S223-K261 PolarHBondContact O-N 3.47Å; I225-K261 HydrophobicContact CG2-CB 3.55Å; I225-K261 HydrophobicContact CG2-CD 4.01Å; I225-K261 HydrophobicContact CG2-CG 4.37Å; I259-K261 PolarHBondContact O-N 3.43Å; K261-V264 PolarHBondContact NZ-O 2.63Å; K261-F266 HydrophobicContact CD-CE1 4.47Å; K261-F266 HydrophobicContact CD-CZ 4.45Å; K261-F266 VanDerWaalsContact CE-CE1 3.49Å; K261-F266 HydrophobicContact CG-CZ 4.46Å; K261-E269 WeakPolarHBondContact CE-OE2 3.23Å; K261-E269 IonicContact NZ-OE2 3.84Å; K261-E269 PolarHBondContact NZ-OE2 2.94Å
262	P	95.1	Very high	86	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-50	142.9	166.9	-27.7	36.3	0	0	0	111.6	F162 F219 I233 I236 V264	F162-P262 HydrophobicContact CE1-CG 3.8Å; F162-P262 HydrophobicContact CZ-CB 4.31Å; F162-P262 HydrophobicContact CZ-CG 4.03Å; F219-P262 HydrophobicContact CD1-CB 3.77Å; F219-P262 HydrophobicContact CD1-CG 3.89Å; F219-P262 HydrophobicContact CE1-CB 3.8Å; F219-P262 HydrophobicContact CE1-CG 3.66Å; F219-P262 HydrophobicContact CG-CB 4.49Å; I233-P262 HydrophobicContact CD1-CB 4.41Å; I233-P262 HydrophobicContact CD1-CG 4.36Å; I236-P262 HydrophobicContact CD1-CG 4.43Å; P262-V264 HydrophobicContact CB-CG2 4.42Å; P262-V264 PolarHBondContact O-N 3.19Å
263	D	94.7	Very high	86.4	Confident	39 Å²	39	62.3 Å²	62.3	21%	0.209	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	46.1	-177.3	-73.4	-4	0	0	0	111.6	G217 S218 T221 S223 K230	G217-D263 CarbonylContact C-O 3.5Å; G217-D263 WeakPolarHBondContact CA-O 3.08Å; S218-D263 PolarHBondContact N-O 2.89Å; S218-D263 CarbonylContact O-C 3.55Å; T221-D263 PolarHBondContact O-N 3.4Å; T221-D263 PolarHBondContact OG1-OD2 2.93Å; S223-D263 WeakPolarHBondContact CB-OD1 3.27Å; S223-D263 PolarHBondContact N-OD1 3.01Å; S223-D263 VanDerWaalsContact N-OD1 3.16Å; S223-D263 PolarHBondContact OG-OD1 3.49Å; S223-D263 PolarHBondContact OG-OD2 3.1Å; K230-D263 WeakPolarHBondContact CE-OD2 3.18Å; K230-D263 IonicContact NZ-OD2 2.74Å; K230-D263 PolarHBondContact NZ-OD2 3.2Å
264	V	93.7	Very high	87.2	Confident	3 Å²	3	58.5 Å²	58.5	2%	0.018	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	136.6	164.6	171.3	0	0	0	0	108.5	I200 H216 F219 K261 P262 F266	I200-V264 HydrophobicContact CB-CG2 4.01Å; I200-V264 HydrophobicContact CD1-CG1 4.09Å; I200-V264 HydrophobicContact CD1-CG2 4.17Å; I200-V264 HydrophobicContact CG2-CG1 3.89Å; I200-V264 HydrophobicContact CG2-CG2 4.08Å; H216-V264 CarbonylContact O-C 3.43Å; H216-V264 WeakPolarHBondContact O-CA 3.47Å; F219-V264 HydrophobicContact CD2-CG2 4.09Å; F219-V264 HydrophobicContact CE2-CG2 3.91Å; F219-V264 HydrophobicContact CZ-CG2 4.37Å; K261-V264 PolarHBondContact NZ-O 2.63Å; P262-V264 HydrophobicContact CB-CG2 4.42Å; P262-V264 PolarHBondContact O-N 3.19Å; V264-F266 HydrophobicContact CB-CE1 4.21Å; V264-F266 HydrophobicContact CG1-CD1 4.24Å; V264-F266 HydrophobicContact CG1-CE1 4.13Å; V264-F266 WeakPolarHBondContact O-CD1 3.03Å; V264-F266 PolarHBondContact O-N 3.3Å
265	V	92.8	Very high	88.4	Confident	26 Å²	26	49.8 Å²	49.8	16%	0.158	29%	0.286	C	S	.	.	P	Polyproline II helix	trans	-74.4	119.2	179.2	179.7	0	0	0	0	109.2	H216 E269 L271 P272	H216-V265 VanDerWaalsContact C-CG2 3.44Å; H216-V265 PolarHBondContact O-N 3.28Å; V265-E269 HydrophobicContact CG1-CB 4.28Å; V265-L271 HydrophobicContact CG1-CD1 4.43Å; V265-P272 HydrophobicContact CG2-CG 4.15Å
266	F	92.1	Very high	89.6	Confident	3 Å²	3	52.9 Å²	52.9	1%	0.013	29%	0.294	C	S	.	.	P	Polyproline II helix	trans	-91	157.1	175.1	-82.1	37.3	0	0	0	110	I149 F150 I152 F155 F162 K261 V264 G268 E269	I149-F266 WeakPolarHBondContact O-CE2 3.26Å; F150-F266 VanDerWaalsContact C-CD2 3.4Å; F150-F266 HydrophobicContact CD1-CE1 4.33Å; F150-F266 CarbonylContact O-C 3.6Å; F150-F266 WeakPolarHBondContact O-CA 3.41Å; F150-F266 WeakPolarHBondContact O-CB 3.47Å; F150-F266 WeakPolarHBondContact O-CD2 3.27Å; F150-F266 VanDerWaalsContact O-CG 3.26Å; F150-F266 WeakPolarHBondContact O-CG 3.47Å; I152-F266 HydrophobicContact CB-CB 4.02Å; I152-F266 HydrophobicContact CD1-CD2 4.38Å; F155-F266 HydrophobicContact CB-CD2 4.04Å; F155-F266 HydrophobicContact CB-CE2 3.64Å; F155-F266 AromaticContact CD2-CE2 3.57Å; F155-F266 HydrophobicContact CD2-CE2 3.57Å; F155-F266 AromaticContact CD2-CZ 3.95Å; F155-F266 HydrophobicContact CD2-CZ 3.95Å; F155-F266 HydrophobicContact CE2-CE2 4.4Å; F155-F266 HydrophobicContact CE2-CZ 4.37Å; F155-F266 HydrophobicContact CG-CD2 4.41Å; F155-F266 AromaticContact CG-CE2 3.68Å; F155-F266 HydrophobicContact CG-CE2 3.68Å; F155-F266 HydrophobicContact CG-CZ 4.38Å; F162-F266 HydrophobicContact CD1-CZ 4.31Å; F162-F266 HydrophobicContact CD2-CE1 4.02Å; F162-F266 HydrophobicContact CD2-CE2 4.24Å; F162-F266 AromaticContact CD2-CZ 3.36Å; F162-F266 HydrophobicContact CD2-CZ 3.36Å; F162-F266 HydrophobicContact CE1-CZ 4.38Å; F162-F266 AromaticContact CE2-CE1 3.63Å; F162-F266 HydrophobicContact CE2-CE1 3.63Å; F162-F266 AromaticContact CE2-CZ 3.43Å; F162-F266 HydrophobicContact CE2-CZ 3.43Å; F162-F266 VanDerWaalsContact CE2-CZ 3.43Å; F162-F266 AromaticContact CG-CZ 3.82Å; F162-F266 HydrophobicContact CG-CZ 3.82Å; F162-F266 HydrophobicContact CZ-CE1 4.1Å; F162-F266 AromaticContact CZ-CZ 3.96Å; F162-F266 HydrophobicContact CZ-CZ 3.96Å; K261-F266 HydrophobicContact CD-CE1 4.47Å; K261-F266 HydrophobicContact CD-CZ 4.45Å; K261-F266 VanDerWaalsContact CE-CE1 3.49Å; K261-F266 HydrophobicContact CG-CZ 4.46Å; V264-F266 HydrophobicContact CB-CE1 4.21Å; V264-F266 HydrophobicContact CG1-CD1 4.24Å; V264-F266 HydrophobicContact CG1-CE1 4.13Å; V264-F266 WeakPolarHBondContact O-CD1 3.03Å; V264-F266 PolarHBondContact O-N 3.3Å; F266-G268 PolarHBondContact O-N 3Å; F266-E269 HydrophobicContact CB-CG 4.18Å; F266-E269 WeakPolarHBondContact CB-OE2 3.1Å; F266-E269 PolarHBondContact N-OE2 3.21Å; F266-E269 WeakPolarHBondContact O-CB 3.35Å; F266-E269 PolarHBondContact O-N 3.05Å
267	F	85	Confident	90.8	Very high	87 Å²	87	47.4 Å²	47.4	38%	0.382	28%	0.279	S	S	.	.	B	Isolated β-bridge	trans	-56.9	127.5	170	-67.3	-69.1	0	0	0	109.9	Q147 F150 I152	Q147-F267 HydrophobicContact CB-CE2 3.92Å; Q147-F267 HydrophobicContact CG-CE2 4.35Å; F150-F267 HydrophobicContact CB-CD2 3.99Å; F150-F267 HydrophobicContact CB-CE2 4.14Å; F150-F267 PolarHBondContact O-N 3.19Å; I152-F267 WeakPolarHBondContact CG2-O 3.43Å; I152-F267 PolarHBondContact N-O 3.16Å
268	G	81.6	Confident	91.6	Very high	80 Å²	80	44.6 Å²	44.6	83%	0.825	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.7	4.3	-173.6	0	0	0	0	0	114.8	F266	F266-G268 PolarHBondContact O-N 3Å
269	E	89	Confident	91.7	Very high	60 Å²	60	44.5 Å²	44.5	28%	0.28	27%	0.268	S	S	.	.	S	Bend	trans	-104.3	152.5	166.6	-58.2	-171.9	132.7	0	0	110.6	I152 K261 V265 F266	I152-E269 HydrophobicContact CB-CG 4.22Å; I152-E269 WeakPolarHBondContact CD1-OE1 3.37Å; I152-E269 HydrophobicContact CG1-CG 4.24Å; I152-E269 HydrophobicContact CG2-CG 4.48Å; K261-E269 WeakPolarHBondContact CE-OE2 3.23Å; K261-E269 IonicContact NZ-OE2 3.84Å; K261-E269 PolarHBondContact NZ-OE2 2.94Å; V265-E269 HydrophobicContact CG1-CB 4.28Å; F266-E269 HydrophobicContact CB-CG 4.18Å; F266-E269 WeakPolarHBondContact CB-OE2 3.1Å; F266-E269 PolarHBondContact N-OE2 3.21Å; F266-E269 WeakPolarHBondContact O-CB 3.35Å; F266-E269 PolarHBondContact O-N 3.05Å
270	D	87.8	Confident	91.6	Very high	154 Å²	154	47.8 Å²	47.8	82%	0.824	29%	0.289	S	S	*	.	P	Polyproline II helix	trans	-72.3	148.6	173.7	-60.9	-41.4	0	0	0	110.7
271	L	89.4	Confident	91.5	Very high	27 Å²	27	53.2 Å²	53.2	14%	0.141	31%	0.312	C	S	.	.	P	Polyproline II helix	trans	-65.2	156	169.7	-86.6	73	0	0	0	110.3	C215 V265 S273 F275 P300 V301	C215-L271 HydrophobicContact CB-CD2 4.45Å; C215-L271 WeakPolarHBondContact O-CD2 3.28Å; C215-L271 WeakPolarHBondContact O-CG 3.42Å; V265-L271 HydrophobicContact CG1-CD1 4.43Å; L271-S273 PolarHBondContact O-N 2.89Å; L271-F275 HydrophobicContact CB-CB 4.39Å; L271-F275 HydrophobicContact CB-CD1 4.43Å; L271-F275 HydrophobicContact CD2-CB 4.38Å; L271-F275 HydrophobicContact CD2-CD1 3.79Å; L271-F275 HydrophobicContact CD2-CD2 4.02Å; L271-F275 HydrophobicContact CD2-CE1 4.04Å; L271-F275 HydrophobicContact CD2-CE2 4.23Å; L271-F275 HydrophobicContact CD2-CG 3.79Å; L271-F275 HydrophobicContact CD2-CZ 4.25Å; L271-P300 VanDerWaalsContact CD1-CD 3.46Å; L271-P300 HydrophobicContact CD1-CG 3.97Å; L271-P300 HydrophobicContact CD2-CG 3.59Å; L271-P300 HydrophobicContact CG-CG 4.36Å; L271-V301 HydrophobicContact CD2-CG2 4.19Å
272	P	90.9	Very high	91.5	Very high	48 Å²	48	52.8 Å²	52.8	31%	0.312	31%	0.31	S	S	.	.	P	Polyproline II helix	trans	-58.5	141.1	177.3	-21.4	34.1	0	0	0	110.3	C215 V265 A274 F275	C215-P272 VanDerWaalsContact O-CD 3.31Å; C215-P272 WeakPolarHBondContact O-CD 3.37Å; V265-P272 HydrophobicContact CG2-CG 4.15Å; P272-A274 PolarHBondContact O-N 2.59Å; P272-F275 VanDerWaalsContact O-CB 3.26Å; P272-F275 WeakPolarHBondContact O-CB 3.44Å; P272-F275 PolarHBondContact O-N 2.85Å
273	S	91.3	Very high	91.4	Very high	94 Å²	94	54.8 Å²	54.8	66%	0.657	32%	0.32	S	S	*	.	H	α-helix	trans	-53.7	-32.3	178.2	56.2	0	0	0	0	112.9	L271 F275 H276 T277	L271-S273 PolarHBondContact O-N 2.89Å; S273-F275 PolarHBondContact O-N 3.48Å; S273-H276 PolarHBondContact O-N 2.78Å; S273-H276 VanDerWaalsContact O-N 3.09Å; S273-T277 PolarHBondContact O-N 2.92Å; S273-T277 PolarHBondContact O-OG1 3.38Å; S273-T277 VanDerWaalsContact O-OG1 3.11Å
274	A	92.2	Very high	91.3	Very high	45 Å²	45	58.7 Å²	58.7	37%	0.372	34%	0.34	S	S	.	.	H	α-helix	trans	-54.8	-32	174.5	0	0	0	0	0	113.3	P272 N278	P272-A274 PolarHBondContact O-N 2.59Å; A274-N278 WeakPolarHBondContact O-CB 3.32Å; A274-N278 PolarHBondContact O-N 3.47Å; A274-N278 VanDerWaalsContact O-N 3.14Å; A274-N278 PolarHBondContact O-ND2 2.83Å
275	F	93.2	Very high	91.5	Very high	4 Å²	4	61.8 Å²	61.8	2%	0.018	35%	0.354	C	S	.	.	H	α-helix	trans	-60.6	-56.3	173.1	174.7	-97.2	0	0	0	110.8	Y196 V213 C215 L271 P272 S273 L279 P300 V301 I304	Y196-F275 HydrophobicContact CD1-CD2 4.12Å; Y196-F275 HydrophobicContact CD1-CE2 4.27Å; Y196-F275 HydrophobicContact CE1-CD2 4.35Å; V213-F275 HydrophobicContact CG1-CB 4.27Å; V213-F275 HydrophobicContact CG1-CD2 4.44Å; C215-F275 HydrophobicContact CB-CD2 4.05Å; C215-F275 HydrophobicContact CB-CE2 4.37Å; L271-F275 HydrophobicContact CB-CB 4.39Å; L271-F275 HydrophobicContact CB-CD1 4.43Å; L271-F275 HydrophobicContact CD2-CB 4.38Å; L271-F275 HydrophobicContact CD2-CD1 3.79Å; L271-F275 HydrophobicContact CD2-CD2 4.02Å; L271-F275 HydrophobicContact CD2-CE1 4.04Å; L271-F275 HydrophobicContact CD2-CE2 4.23Å; L271-F275 HydrophobicContact CD2-CG 3.79Å; L271-F275 HydrophobicContact CD2-CZ 4.25Å; P272-F275 VanDerWaalsContact O-CB 3.26Å; P272-F275 WeakPolarHBondContact O-CB 3.44Å; P272-F275 PolarHBondContact O-N 2.85Å; S273-F275 PolarHBondContact O-N 3.48Å; F275-L279 HydrophobicContact CE1-CD2 3.97Å; F275-L279 HydrophobicContact CE2-CD2 4.32Å; F275-L279 HydrophobicContact CZ-CD2 3.71Å; F275-L279 WeakPolarHBondContact O-CB 3.49Å; F275-L279 PolarHBondContact O-N 2.85Å; F275-P300 HydrophobicContact CE1-CB 4.32Å; F275-P300 HydrophobicContact CE1-CG 3.76Å; F275-P300 HydrophobicContact CZ-CG 4.1Å; F275-V301 HydrophobicContact CE2-CG2 3.99Å; F275-V301 HydrophobicContact CZ-CG2 4.41Å; F275-I304 HydrophobicContact CE2-CD1 4.02Å; F275-I304 HydrophobicContact CZ-CD1 4.42Å; F275-I304 HydrophobicContact CZ-CG1 4.49Å
276	H	90.5	Very high	91.8	Very high	96 Å²	96	60.5 Å²	60.5	44%	0.444	35%	0.346	S	S	.	.	H	α-helix	trans	-65.5	-47.6	-177.5	-60.3	-77.2	0	0	0	111.8	S273 N278 L279 T280	S273-H276 PolarHBondContact O-N 2.78Å; S273-H276 VanDerWaalsContact O-N 3.09Å; H276-N278 PolarHBondContact O-N 2.65Å; H276-L279 PolarHBondContact O-N 3.43Å; H276-T280 PolarHBondContact O-N 3.21Å; H276-T280 PolarHBondContact O-OG1 3.04Å
277	T	92.6	Very high	92.1	Very high	99 Å²	99	61.9 Å²	61.9	61%	0.607	35%	0.354	S	S	*	.	H	α-helix	trans	-61.7	-43.9	-177.6	-55.9	0	0	0	0	112.3	S273	S273-T277 PolarHBondContact O-N 2.92Å; S273-T277 PolarHBondContact O-OG1 3.38Å; S273-T277 VanDerWaalsContact O-OG1 3.11Å
278	N	95.2	Very high	92.7	Very high	37 Å²	37	57.7 Å²	57.7	20%	0.198	34%	0.336	C	S	.	.	H	α-helix	trans	-73.8	-41.1	178.8	-70.9	-74.2	0	0	0	111.2	R194 Y196 V213 A274 H276 T280 K281 D282	R194-N278 PolarHBondContact NH1-OD1 3.44Å; R194-N278 PolarHBondContact NH2-OD1 3.29Å; Y196-N278 WeakPolarHBondContact OH-CB 3.45Å; Y196-N278 PolarHBondContact OH-O 3.1Å; V213-N278 HydrophobicContact CG2-CB 4.21Å; A274-N278 WeakPolarHBondContact O-CB 3.32Å; A274-N278 PolarHBondContact O-N 3.47Å; A274-N278 VanDerWaalsContact O-N 3.14Å; A274-N278 PolarHBondContact O-ND2 2.83Å; H276-N278 PolarHBondContact O-N 2.65Å; N278-T280 VanDerWaalsContact C-N 3.35Å; N278-T280 PolarHBondContact O-N 3.39Å; N278-K281 PolarHBondContact O-N 2.89Å; N278-K281 VanDerWaalsContact O-N 3.15Å; N278-D282 VanDerWaalsContact O-CB 3.29Å; N278-D282 WeakPolarHBondContact O-CB 3.18Å; N278-D282 PolarHBondContact O-N 3.08Å
279	L	93.2	Very high	93.5	Very high	4 Å²	4	53.9 Å²	53.9	2%	0.021	30%	0.296	C	S	.	.	H	α-helix	trans	-64.1	-39.6	-176.6	-175	59.1	0	0	0	112.2	Y196 F275 H276 K281 D282 Q283 I304 M307	Y196-L279 HydrophobicContact CE1-CB 4.27Å; Y196-L279 VanDerWaalsContact OH-CA 3.29Å; Y196-L279 WeakPolarHBondContact OH-CA 3.11Å; Y196-L279 PolarHBondContact OH-N 2.85Å; Y196-L279 VanDerWaalsContact OH-N 3.1Å; F275-L279 HydrophobicContact CE1-CD2 3.97Å; F275-L279 HydrophobicContact CE2-CD2 4.32Å; F275-L279 HydrophobicContact CZ-CD2 3.71Å; F275-L279 WeakPolarHBondContact O-CB 3.49Å; F275-L279 PolarHBondContact O-N 2.85Å; H276-L279 PolarHBondContact O-N 3.43Å; L279-K281 PolarHBondContact O-N 3.12Å; L279-D282 PolarHBondContact O-N 2.81Å; L279-Q283 VanDerWaalsContact O-CB 3.32Å; L279-Q283 WeakPolarHBondContact O-CB 3.39Å; L279-Q283 VanDerWaalsContact O-CG 3.27Å; L279-Q283 WeakPolarHBondContact O-CG 3.3Å; L279-Q283 PolarHBondContact O-N 2.75Å; L279-I304 HydrophobicContact CD1-CD1 4.48Å; L279-I304 HydrophobicContact CD1-CG1 4.04Å; L279-I304 HydrophobicContact CD1-CG2 4.33Å; L279-I304 HydrophobicContact CD2-CG1 3.92Å; L279-M307 HydrophobicContact CD2-CE 3.64Å; L279-M307 HydrophobicContact CD2-SD 3.72Å; L279-M307 HydrophobicContact CG-CE 3.97Å; L279-M307 HydrophobicContact CG-SD 4.48Å
280	T	90.8	Very high	94	Very high	87 Å²	87	51 Å²	51	53%	0.534	28%	0.283	S	S	.	.	H	α-helix	trans	-56.7	-37	176.1	-62.6	0	0	0	0	112.7	H276 N278 Q283	H276-T280 PolarHBondContact O-N 3.21Å; H276-T280 PolarHBondContact O-OG1 3.04Å; N278-T280 VanDerWaalsContact C-N 3.35Å; N278-T280 PolarHBondContact O-N 3.39Å; T280-Q283 WeakPolarHBondContact O-CG 3.36Å; T280-Q283 PolarHBondContact O-NE2 2.76Å
281	K	94.1	Very high	94.5	Very high	115 Å²	115	43.7 Å²	43.7	50%	0.5	24%	0.244	S	C	.	.	H	α-helix	trans	-81	-51.6	176.6	-179.8	-176.9	173.3	-176.9	0	111.4	N278 L279 Q283 L284 E285	N278-K281 PolarHBondContact O-N 2.89Å; N278-K281 VanDerWaalsContact O-N 3.15Å; L279-K281 PolarHBondContact O-N 3.12Å; K281-Q283 VanDerWaalsContact C-N 3.27Å; K281-Q283 PolarHBondContact O-N 3.41Å; K281-L284 PolarHBondContact O-N 3.23Å; K281-L284 VanDerWaalsContact O-N 3.15Å; K281-E285 WeakPolarHBondContact CE-OE1 3.22Å; K281-E285 IonicContact NZ-OE1 3.29Å
282	D	97.1	Very high	94.9	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-65.1	-31.4	-169.8	-66.1	-9.1	0	0	0	111.4	I110 L193 R194 Y196 N278 L279 L284 E285 A286	I110-D282 HydrophobicContact CD1-CB 3.99Å; L193-D282 HydrophobicContact CD2-CB 3.8Å; L193-D282 HydrophobicContact CG-CB 4.28Å; R194-D282 WeakPolarHBondContact CB-OD2 3.39Å; R194-D282 IonicContact CZ-OD1 3.66Å; R194-D282 IonicContact CZ-OD2 3.3Å; R194-D282 IonicContact NE-OD1 3.54Å; R194-D282 IonicContact NE-OD2 2.75Å; R194-D282 PolarHBondContact NE-OD2 2.83Å; R194-D282 IonicContact NH2-OD1 2.74Å; R194-D282 PolarHBondContact NH2-OD1 3.43Å; R194-D282 VanDerWaalsContact NH2-OD1 3.12Å; R194-D282 IonicContact NH2-OD2 3.19Å; Y196-D282 PolarHBondContact OH-OD2 3.22Å; N278-D282 VanDerWaalsContact O-CB 3.29Å; N278-D282 WeakPolarHBondContact O-CB 3.18Å; N278-D282 PolarHBondContact O-N 3.08Å; L279-D282 PolarHBondContact O-N 2.81Å; D282-L284 PolarHBondContact O-N 2.76Å; D282-E285 PolarHBondContact O-N 3.04Å; D282-E285 VanDerWaalsContact O-N 3.14Å; D282-A286 WeakPolarHBondContact O-CB 3.37Å; D282-A286 PolarHBondContact O-N 3.36Å
283	Q	93	Very high	95.2	Very high	43 Å²	43	40.4 Å²	40.4	20%	0.201	23%	0.225	C	C	.	.	H	α-helix	trans	-60.8	-26.9	177.4	71	-174.3	-13.3	0	0	113.9	L279 T280 K281 L308	L279-Q283 VanDerWaalsContact O-CB 3.32Å; L279-Q283 WeakPolarHBondContact O-CB 3.39Å; L279-Q283 VanDerWaalsContact O-CG 3.27Å; L279-Q283 WeakPolarHBondContact O-CG 3.3Å; L279-Q283 PolarHBondContact O-N 2.75Å; T280-Q283 WeakPolarHBondContact O-CG 3.36Å; T280-Q283 PolarHBondContact O-NE2 2.76Å; K281-Q283 VanDerWaalsContact C-N 3.27Å; K281-Q283 PolarHBondContact O-N 3.41Å; Q283-L308 HydrophobicContact CB-CD2 3.95Å
284	L	92.8	Very high	95.4	Very high	120 Å²	120	36.1 Å²	36.1	63%	0.628	20%	0.195	S	C	*	.	H	α-helix	trans	-84.7	-29.7	178.3	-60	177.1	0	0	0	112	K281 D282	K281-L284 PolarHBondContact O-N 3.23Å; K281-L284 VanDerWaalsContact O-N 3.15Å; D282-L284 PolarHBondContact O-N 2.76Å
285	E	97.1	Very high	95.5	Very high	68 Å²	68	35.9 Å²	35.9	32%	0.318	19%	0.191	S	C	.	.	H	α-helix	trans	-93.3	-29	-172.4	-68.3	-174.2	-167.5	0	0	113.1	R108 L193 K281 D282	R108-E285 PolarHBondContact NE-O 3.36Å; R108-E285 PolarHBondContact NH2-O 2.72Å; L193-E285 HydrophobicContact CD2-CB 4.05Å; K281-E285 WeakPolarHBondContact CE-OE1 3.22Å; K281-E285 IonicContact NZ-OE1 3.29Å; D282-E285 PolarHBondContact O-N 3.04Å; D282-E285 VanDerWaalsContact O-N 3.14Å
286	A	98.1	Very high	95.4	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	19%	0.191	C	C	.	.			trans	-53.2	139.4	-173.1	0	0	0	0	0	113.4	R108 I110 L193 D282 L308 R309 V312	R108-A286 WeakPolarHBondContact O-CA 3.31Å; I110-A286 HydrophobicContact CD1-CB 3.57Å; I110-A286 HydrophobicContact CG1-CB 3.86Å; L193-A286 HydrophobicContact CD2-CB 4.29Å; D282-A286 WeakPolarHBondContact O-CB 3.37Å; D282-A286 PolarHBondContact O-N 3.36Å; A286-L308 HydrophobicContact CB-CD1 4.49Å; A286-L308 HydrophobicContact CB-CD2 4.27Å; A286-R309 PolarHBondContact O-NH2 3.2Å; A286-V312 VanDerWaalsContact O-CG2 3.28Å; A286-V312 WeakPolarHBondContact O-CG2 3.49Å
287	D	98.4	Very high	95.3	Very high	31 Å²	31	38 Å²	38	17%	0.166	20%	0.198	C	C	.	.	S	Bend	trans	-124.4	0.2	175.5	67	8.2	0	0	0	114	S106 K107 R108 P313	S106-D287 VanDerWaalsContact CB-OD1 3.25Å; S106-D287 WeakPolarHBondContact CB-OD1 3.43Å; K107-D287 PolarHBondContact N-OD1 3.17Å; K107-D287 PolarHBondContact N-OD2 3.43Å; R108-D287 WeakPolarHBondContact CA-OD1 3.47Å; R108-D287 PolarHBondContact N-OD1 3Å; R108-D287 PolarHBondContact N-OD2 3.3Å; R108-D287 IonicContact NH2-OD2 3.12Å; R108-D287 PolarHBondContact O-N 3.31Å; D287-P313 WeakPolarHBondContact O-CD 3.36Å; D287-P313 WeakPolarHBondContact O-CG 3.47Å
288	L	98.8	Very high	94.9	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.7	136.8	170.4	174.4	63.6	0	0	0	109.6	L102 I103 S106 V109 I110 L290 P313 V315	L102-L288 HydrophobicContact CB-CD1 4.21Å; L102-L288 HydrophobicContact CB-CD2 4.22Å; L102-L288 HydrophobicContact CD1-CD1 4.22Å; I103-L288 HydrophobicContact CG1-CD2 4.1Å; S106-L288 WeakPolarHBondContact OG-CB 3.4Å; V109-L288 WeakPolarHBondContact CA-O 3.38Å; V109-L288 HydrophobicContact CG1-CB 4.36Å; V109-L288 HydrophobicContact CG1-CD2 4.09Å; V109-L288 HydrophobicContact CG1-CG 4.19Å; V109-L288 HydrophobicContact CG2-CB 4.27Å; V109-L288 HydrophobicContact CG2-CD2 4.07Å; I110-L288 PolarHBondContact N-O 3.21Å; L288-L290 HydrophobicContact CD1-CD2 4.09Å; L288-L290 HydrophobicContact CD2-CD2 4.03Å; L288-L290 HydrophobicContact CD2-CG 4.36Å; L288-L290 HydrophobicContact CG-CD2 4Å; L288-L290 HydrophobicContact CG-CG 4.31Å; L288-P313 HydrophobicContact CD1-CB 4.2Å; L288-P313 HydrophobicContact CD1-CG 3.98Å; L288-V315 HydrophobicContact CD1-CG2 4.26Å
289	L	98.7	Very high	94.3	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	125.9	169.6	176	64.4	0	0	0	110.6	I110 L112 V291 P305 L308 P313 Q314 V315	I110-L289 HydrophobicContact CB-CD1 4.01Å; I110-L289 HydrophobicContact CG2-CD1 3.61Å; I110-L289 WeakPolarHBondContact O-CA 3.29Å; L112-L289 HydrophobicContact CB-CD1 4.4Å; L289-V291 HydrophobicContact CD1-CG2 4.39Å; L289-V291 HydrophobicContact CD2-CG2 4.05Å; L289-V291 HydrophobicContact CG-CG2 4.07Å; L289-P305 HydrophobicContact CD2-CB 4Å; L289-P305 HydrophobicContact CD2-CG 4.12Å; L289-L308 HydrophobicContact CB-CD1 3.71Å; L289-L308 HydrophobicContact CD1-CD1 4.32Å; L289-L308 HydrophobicContact CD2-CD1 3.82Å; L289-L308 HydrophobicContact CG-CD1 4.15Å; L289-P313 PolarHBondContact N-O 2.98Å; L289-Q314 HydrophobicContact CB-CB 4.48Å; L289-Q314 HydrophobicContact CB-CG 4.16Å; L289-Q314 HydrophobicContact CD2-CG 4.22Å; L289-Q314 WeakPolarHBondContact O-CA 3.46Å; L289-V315 PolarHBondContact O-N 2.98Å
290	L	98.7	Very high	94	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	115.3	169.2	-55	-177.5	0	0	0	109.3	V109 I110 V111 L112 L186 L288 I292 V315	V109-L290 HydrophobicContact CG1-CD1 4.03Å; V109-L290 HydrophobicContact CG1-CG 4.03Å; I110-L290 PolarHBondContact O-N 2.85Å; V111-L290 CarbonylContact C-O 3.1Å; V111-L290 WeakPolarHBondContact CA-O 3.1Å; V111-L290 HydrophobicContact CG2-CB 4.41Å; V111-L290 HydrophobicContact CG2-CD1 4.35Å; L112-L290 PolarHBondContact N-O 2.76Å; L186-L290 HydrophobicContact CD1-CD1 4.44Å; L288-L290 HydrophobicContact CD1-CD2 4.09Å; L288-L290 HydrophobicContact CD2-CD2 4.03Å; L288-L290 HydrophobicContact CD2-CG 4.36Å; L288-L290 HydrophobicContact CG-CD2 4Å; L288-L290 HydrophobicContact CG-CG 4.31Å; L290-I292 HydrophobicContact CB-CD1 4.38Å; L290-I292 HydrophobicContact CB-CG1 4.28Å; L290-V315 HydrophobicContact CD2-CB 3.74Å; L290-V315 HydrophobicContact CD2-CG1 4.41Å; L290-V315 HydrophobicContact CD2-CG2 4.1Å
291	V	98.6	Very high	94	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	118	171.4	178.7	0	0	0	0	108.5	L112 L289 L296 P305 V315 L316 I317 F327	L112-V291 HydrophobicContact CB-CG2 4.36Å; L289-V291 HydrophobicContact CD1-CG2 4.39Å; L289-V291 HydrophobicContact CD2-CG2 4.05Å; L289-V291 HydrophobicContact CG-CG2 4.07Å; V291-L296 HydrophobicContact CG1-CD1 3.97Å; V291-L296 HydrophobicContact CG1-CD2 4.27Å; V291-L296 HydrophobicContact CG1-CG 4.13Å; V291-L296 HydrophobicContact CG2-CD1 4.43Å; V291-P305 HydrophobicContact CG2-CG 4.48Å; V291-V315 PolarHBondContact N-O 2.99Å; V291-L316 HydrophobicContact CB-CD1 4.06Å; V291-L316 HydrophobicContact CG1-CD1 3.85Å; V291-I317 PolarHBondContact O-N 3.11Å; V291-F327 HydrophobicContact CB-CE1 4.01Å; V291-F327 HydrophobicContact CB-CZ 4.15Å; V291-F327 HydrophobicContact CG1-CZ 4.46Å; V291-F327 HydrophobicContact CG2-CE1 3.63Å; V291-F327 HydrophobicContact CG2-CZ 3.96Å
292	I	98.5	Very high	93.9	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	125.3	-170.7	-47.8	167.5	0	0	0	111.1	V111 L112 T113 G114 V117 T179 I183 L290 S294 I317 C335 F339	V111-I292 HydrophobicContact CG1-CD1 3.4Å; V111-I292 VanDerWaalsContact CG1-CD1 3.4Å; V111-I292 HydrophobicContact CG1-CG1 4.24Å; L112-I292 PolarHBondContact O-N 3.24Å; T113-I292 WeakPolarHBondContact CA-O 3.15Å; T113-I292 HydrophobicContact CG2-CB 4.36Å; G114-I292 PolarHBondContact N-O 3.28Å; G114-I292 VanDerWaalsContact N-O 3.11Å; V117-I292 HydrophobicContact CG1-CB 4.13Å; V117-I292 HydrophobicContact CG1-CG2 3.58Å; T179-I292 HydrophobicContact CG2-CD1 4.43Å; T179-I292 HydrophobicContact CG2-CG2 3.95Å; I183-I292 HydrophobicContact CD1-CD1 4.4Å; L290-I292 HydrophobicContact CB-CD1 4.38Å; L290-I292 HydrophobicContact CB-CG1 4.28Å; I292-S294 PolarHBondContact O-N 3Å; I292-S294 VanDerWaalsContact O-N 3.16Å; I292-I317 CarbonylContact C-O 3.57Å; I292-I317 VanDerWaalsContact CA-O 3.29Å; I292-I317 WeakPolarHBondContact CA-O 3.39Å; I292-I317 HydrophobicContact CG1-CB 4.4Å; I292-I317 HydrophobicContact CG1-CD1 4.45Å; I292-I317 HydrophobicContact CG2-CB 4.31Å; I292-I317 HydrophobicContact CG2-CG2 4.33Å; I292-C335 HydrophobicContact CG2-CB 4.27Å; I292-F339 HydrophobicContact CD1-CE1 4.44Å; I292-F339 HydrophobicContact CD1-CE2 3.67Å; I292-F339 HydrophobicContact CD1-CZ 3.34Å; I292-F339 HydrophobicContact CG1-CE2 4.05Å; I292-F339 HydrophobicContact CG1-CZ 3.96Å; I292-F339 HydrophobicContact CG2-CE2 3.64Å; I292-F339 HydrophobicContact CG2-CZ 4.4Å
293	G	97.1	Very high	93.6	Very high	6 Å²	6	29.1 Å²	29.1	6%	0.062	16%	0.164	C	C	.	.	S	Bend	trans	59.3	31.3	170.3	0	0	0	0	0	113.8	G114 A115 G116 I317 N318	G114-G293 CarbonylContact C-O 3.56Å; G114-G293 WeakPolarHBondContact CA-O 3.27Å; A115-G293 PolarHBondContact N-O 3.49Å; G116-G293 WeakPolarHBondContact CA-O 3.47Å; G116-G293 PolarHBondContact N-O 2.85Å; G293-I317 PolarHBondContact N-O 3.49Å; G293-N318 WeakPolarHBondContact CA-OD1 3.33Å
294	S	95.7	Very high	93.7	Very high	4 Å²	4	27 Å²	27	3%	0.028	15%	0.154	C	C	.	.			trans	-128.5	136.7	-176.2	176.3	0	0	0	0	110.6	Q198 I292 L296 N318	Q198-S294 PolarHBondContact NE2-OG 3.3Å; I292-S294 PolarHBondContact O-N 3Å; I292-S294 VanDerWaalsContact O-N 3.16Å; S294-L296 VanDerWaalsContact C-N 3.35Å; S294-L296 WeakPolarHBondContact OG-CD2 3.34Å; S294-L296 PolarHBondContact OG-N 3.46Å; S294-L296 VanDerWaalsContact OG-N 3.09Å; S294-N318 PolarHBondContact N-OD1 3.12Å
295	S	92.6	Very high	93.7	Very high	40 Å²	40	21.5 Å²	21.5	28%	0.28	13%	0.125	S	C	.	.			trans	-87.3	-4.4	171.1	52.3	0	0	0	0	113.7	R127 K297	R127-S295 PolarHBondContact NH1-OG 3.38Å; S295-K297 PolarHBondContact O-N 3.43Å; S295-K297 VanDerWaalsContact O-N 3.07Å
296	L	92.4	Very high	93.5	Very high	4 Å²	4	19.4 Å²	19.4	2%	0.021	12%	0.122	C	C	.	.			trans	47.2	37	-177.8	-61	178.3	0	0	0	114	L112 V291 S294 N302 P305 L322 Y325 F327	L112-L296 HydrophobicContact CD1-CD2 3.68Å; L112-L296 HydrophobicContact CD2-CD2 3.61Å; L112-L296 HydrophobicContact CG-CD2 4.33Å; V291-L296 HydrophobicContact CG1-CD1 3.97Å; V291-L296 HydrophobicContact CG1-CD2 4.27Å; V291-L296 HydrophobicContact CG1-CG 4.13Å; V291-L296 HydrophobicContact CG2-CD1 4.43Å; S294-L296 VanDerWaalsContact C-N 3.35Å; S294-L296 WeakPolarHBondContact OG-CD2 3.34Å; S294-L296 PolarHBondContact OG-N 3.46Å; S294-L296 VanDerWaalsContact OG-N 3.09Å; L296-N302 HydrophobicContact CB-CB 4.14Å; L296-N302 WeakPolarHBondContact O-CB 3.43Å; L296-P305 HydrophobicContact CD1-CG 3.81Å; L296-L322 HydrophobicContact CB-CD1 4.28Å; L296-L322 HydrophobicContact CD1-CD1 3.76Å; L296-L322 HydrophobicContact CG-CD1 3.98Å; L296-Y325 HydrophobicContact CB-CE2 3.9Å; L296-Y325 HydrophobicContact CD1-CD1 4.13Å; L296-Y325 HydrophobicContact CD1-CD2 4.4Å; L296-Y325 HydrophobicContact CD1-CE1 3.81Å; L296-Y325 HydrophobicContact CD1-CE2 4.09Å; L296-Y325 HydrophobicContact CD1-CG 4.42Å; L296-F327 HydrophobicContact CD1-CZ 4.29Å
297	K	87.1	Confident	93.1	Very high	139 Å²	139	23.1 Å²	23.1	60%	0.604	14%	0.14	S	C	*	.			trans	-86.3	-11.4	179.9	-64.9	-180	176.1	178.4	0	114	S295	S295-K297 PolarHBondContact O-N 3.43Å; S295-K297 VanDerWaalsContact O-N 3.07Å
298	V	84.3	Confident	92.8	Very high	27 Å²	27	22 Å²	22	16%	0.164	13%	0.134	C	C	.	.	S	Bend	trans	-114.2	118.8	-172.5	-174.7	0	0	0	0	110.1	N302	V298-N302 WeakPolarHBondContact O-CB 3.48Å; V298-N302 PolarHBondContact O-N 3.02Å; V298-N302 VanDerWaalsContact O-N 3.1Å
299	G	83.2	Confident	92.5	Very high	42 Å²	42	26.8 Å²	26.8	43%	0.433	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.7	157.5	172.5	0	0	0	0	0	112.5	N302	G299-N302 WeakPolarHBondContact CA-OD1 3.44Å
300	P	87.8	Confident	92.2	Very high	46 Å²	46	31.3 Å²	31.3	30%	0.299	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	cis	-84.3	-2.7	2.3	34.9	-36.9	0	0	0	114.2	L271 F275 N302 A303	L271-P300 VanDerWaalsContact CD1-CD 3.46Å; L271-P300 HydrophobicContact CD1-CG 3.97Å; L271-P300 HydrophobicContact CD2-CG 3.59Å; L271-P300 HydrophobicContact CG-CG 4.36Å; F275-P300 HydrophobicContact CE1-CB 4.32Å; F275-P300 HydrophobicContact CE1-CG 3.76Å; F275-P300 HydrophobicContact CZ-CG 4.1Å; P300-N302 PolarHBondContact O-N 2.79Å; P300-A303 VanDerWaalsContact O-CB 3.27Å; P300-A303 WeakPolarHBondContact O-CB 3.45Å; P300-A303 PolarHBondContact O-N 2.68Å
301	V	90.8	Very high	92	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	20%	0.199	C	C	.	.	G	3₁₀ helix	trans	-59.8	-33.8	-177.2	-174.3	0	0	0	0	112.2	L112 Q198 C215 L271 F275 A303 I304	L112-V301 HydrophobicContact CD1-CG1 4.12Å; L112-V301 HydrophobicContact CD2-CG1 4.31Å; L112-V301 HydrophobicContact CG-CG1 4.24Å; Q198-V301 HydrophobicContact CG-CB 4.24Å; Q198-V301 HydrophobicContact CG-CG1 3.75Å; Q198-V301 HydrophobicContact CG-CG2 4.34Å; C215-V301 HydrophobicContact CB-CG2 3.48Å; C215-V301 VanDerWaalsContact CB-CG2 3.48Å; L271-V301 HydrophobicContact CD2-CG2 4.19Å; F275-V301 HydrophobicContact CE2-CG2 3.99Å; F275-V301 HydrophobicContact CZ-CG2 4.41Å; V301-A303 PolarHBondContact O-N 3.04Å; V301-A303 VanDerWaalsContact O-N 3.15Å; V301-I304 HydrophobicContact CG1-CD1 3.97Å; V301-I304 WeakPolarHBondContact O-CG1 3.43Å; V301-I304 PolarHBondContact O-N 3.09Å
302	N	91.8	Very high	92	Very high	37 Å²	37	35.7 Å²	35.7	20%	0.198	20%	0.2	C	C	.	.	G	3₁₀ helix	trans	-62.3	-15.8	176.1	73.4	-13.5	0	0	0	115.2	L296 V298 G299 P300 P305 Y325	L296-N302 HydrophobicContact CB-CB 4.14Å; L296-N302 WeakPolarHBondContact O-CB 3.43Å; V298-N302 WeakPolarHBondContact O-CB 3.48Å; V298-N302 PolarHBondContact O-N 3.02Å; V298-N302 VanDerWaalsContact O-N 3.1Å; G299-N302 WeakPolarHBondContact CA-OD1 3.44Å; P300-N302 PolarHBondContact O-N 2.79Å; N302-P305 WeakPolarHBondContact O-CD 3.48Å; N302-Y325 WeakPolarHBondContact CB-OH 3.4Å; N302-Y325 PolarHBondContact O-OH 3.32Å
303	A	90.8	Very high	92	Very high	4 Å²	4	36 Å²	36	3%	0.033	20%	0.202	C	C	.	.	G	3₁₀ helix	trans	-81.6	-22.5	179.6	0	0	0	0	0	112.7	P82 P300 V301 P305 G306 M307	P82-A303 HydrophobicContact CB-CB 3.52Å; P82-A303 HydrophobicContact CG-CB 4.07Å; P300-A303 VanDerWaalsContact O-CB 3.27Å; P300-A303 WeakPolarHBondContact O-CB 3.45Å; P300-A303 PolarHBondContact O-N 2.68Å; V301-A303 PolarHBondContact O-N 3.04Å; V301-A303 VanDerWaalsContact O-N 3.15Å; A303-P305 VanDerWaalsContact C-CD 3.44Å; A303-P305 VanDerWaalsContact C-N 3.32Å; A303-P305 VanDerWaalsContact O-N 3.14Å; A303-G306 PolarHBondContact O-N 2.77Å; A303-M307 HydrophobicContact CB-CG 4.46Å; A303-M307 HydrophobicContact CB-SD 4.11Å; A303-M307 WeakPolarHBondContact O-CG 3.34Å; A303-M307 PolarHBondContact O-N 3.11Å
304	I	93.6	Very high	92	Very high	0 Å²	0	36 Å²	36	0%	0	20%	0.201	C	C	.	.	G	3₁₀ helix	trans	-46.4	-48.6	-174.8	-67.4	174.7	0	0	0	112.5	L112 Y196 F275 L279 V301 G306 M307 L308	L112-I304 HydrophobicContact CD1-CB 3.99Å; L112-I304 HydrophobicContact CD1-CD1 3.93Å; L112-I304 HydrophobicContact CD1-CG1 4.48Å; L112-I304 HydrophobicContact CD1-CG2 4.25Å; Y196-I304 HydrophobicContact CD1-CD1 4.17Å; Y196-I304 HydrophobicContact CG-CD1 4.04Å; F275-I304 HydrophobicContact CE2-CD1 4.02Å; F275-I304 HydrophobicContact CZ-CD1 4.42Å; F275-I304 HydrophobicContact CZ-CG1 4.49Å; L279-I304 HydrophobicContact CD1-CD1 4.48Å; L279-I304 HydrophobicContact CD1-CG1 4.04Å; L279-I304 HydrophobicContact CD1-CG2 4.33Å; L279-I304 HydrophobicContact CD2-CG1 3.92Å; V301-I304 HydrophobicContact CG1-CD1 3.97Å; V301-I304 WeakPolarHBondContact O-CG1 3.43Å; V301-I304 PolarHBondContact O-N 3.09Å; I304-G306 VanDerWaalsContact C-N 3.27Å; I304-G306 PolarHBondContact O-N 2.83Å; I304-G306 VanDerWaalsContact O-N 3.16Å; I304-M307 PolarHBondContact O-N 3.01Å; I304-L308 PolarHBondContact O-N 2.89Å
305	P	94.5	Very high	92.2	Very high	3 Å²	3	35.9 Å²	35.9	2%	0.019	20%	0.2	C	C	.	.	G	3₁₀ helix	trans	-54	-37.4	-177.7	-28.6	36.8	0	0	0	115	L289 V291 L296 N302 A303 Q314 Y325	L289-P305 HydrophobicContact CD2-CB 4Å; L289-P305 HydrophobicContact CD2-CG 4.12Å; V291-P305 HydrophobicContact CG2-CG 4.48Å; L296-P305 HydrophobicContact CD1-CG 3.81Å; N302-P305 WeakPolarHBondContact O-CD 3.48Å; A303-P305 VanDerWaalsContact C-CD 3.44Å; A303-P305 VanDerWaalsContact C-N 3.32Å; A303-P305 VanDerWaalsContact O-N 3.14Å; P305-Q314 PolarHBondContact O-NE2 2.8Å; P305-Y325 HydrophobicContact CB-CD1 4.05Å; P305-Y325 HydrophobicContact CB-CE1 4.1Å; P305-Y325 HydrophobicContact CG-CD1 4.12Å; P305-Y325 HydrophobicContact CG-CE1 3.87Å
306	G	90.8	Very high	92.5	Very high	24 Å²	24	34 Å²	34	25%	0.247	19%	0.186	C	C	.	.	G	3₁₀ helix	trans	-104.6	14.7	178.1	0	0	0	0	0	115.1	A303 I304	A303-G306 PolarHBondContact O-N 2.77Å; I304-G306 VanDerWaalsContact C-N 3.27Å; I304-G306 PolarHBondContact O-N 2.83Å; I304-G306 VanDerWaalsContact O-N 3.16Å
307	M	90.3	Very high	92.7	Very high	79 Å²	79	33.9 Å²	33.9	39%	0.389	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87	-20.9	161.4	-66.7	176.4	66.8	0	0	111.8	L279 A303 I304	L279-M307 HydrophobicContact CD2-CE 3.64Å; L279-M307 HydrophobicContact CD2-SD 3.72Å; L279-M307 HydrophobicContact CG-CE 3.97Å; L279-M307 HydrophobicContact CG-SD 4.48Å; A303-M307 HydrophobicContact CB-CG 4.46Å; A303-M307 HydrophobicContact CB-SD 4.11Å; A303-M307 WeakPolarHBondContact O-CG 3.34Å; A303-M307 PolarHBondContact O-N 3.11Å; I304-M307 PolarHBondContact O-N 3.01Å
308	L	93	Very high	93.2	Very high	8 Å²	8	28 Å²	28	4%	0.042	16%	0.161	C	C	.	.	S	Bend	trans	-73.8	158.7	176.7	-55.2	-173	0	0	0	111.5	I110 Q283 A286 L289 I304 V312	I110-L308 HydrophobicContact CD1-CD2 4.02Å; Q283-L308 HydrophobicContact CB-CD2 3.95Å; A286-L308 HydrophobicContact CB-CD1 4.49Å; A286-L308 HydrophobicContact CB-CD2 4.27Å; L289-L308 HydrophobicContact CB-CD1 3.71Å; L289-L308 HydrophobicContact CD1-CD1 4.32Å; L289-L308 HydrophobicContact CD2-CD1 3.82Å; L289-L308 HydrophobicContact CG-CD1 4.15Å; I304-L308 PolarHBondContact O-N 2.89Å; L308-V312 HydrophobicContact CB-CB 4.49Å; L308-V312 HydrophobicContact CD1-CG1 4.16Å
309	R	92.8	Very high	93.6	Very high	99 Å²	99	32.7 Å²	32.7	37%	0.374	18%	0.176	S	C	.	.			trans	-61.3	143.5	174.5	-51	178.6	-67.8	123.8	8.9	110.6	A286 D311 V312	A286-R309 PolarHBondContact O-NH2 3.2Å; R309-D311 WeakPolarHBondContact CB-OD1 3.03Å; R309-D311 IonicContact CZ-OD1 2.87Å; R309-D311 IonicContact CZ-OD2 3.01Å; R309-D311 IonicContact NE-OD1 3.95Å; R309-D311 IonicContact NH1-OD1 3.56Å; R309-D311 PolarHBondContact NH1-OD1 3.16Å; R309-D311 VanDerWaalsContact NH1-OD1 3.15Å; R309-D311 IonicContact NH1-OD2 2.6Å; R309-D311 PolarHBondContact NH1-OD2 2.86Å; R309-D311 IonicContact NH2-OD1 3.86Å; R309-D311 IonicContact NH2-OD2 2.63Å; R309-D311 PolarHBondContact O-N 2.71Å; R309-D311 VanDerWaalsContact O-N 3.16Å; R309-V312 HydrophobicContact CB-CG2 4.1Å; R309-V312 WeakPolarHBondContact O-CB 3.17Å; R309-V312 PolarHBondContact O-N 2.88Å
310	D	92.1	Very high	94.1	Very high	96 Å²	96	36.8 Å²	36.8	51%	0.513	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-26.5	-176.1	-73.5	-31.9	0	0	0	113.3	R87 V312	R87-D310 PolarHBondContact NE-O 3.21Å; D310-V312 VanDerWaalsContact C-N 3.29Å; D310-V312 PolarHBondContact O-N 2.74Å
311	D	94.8	Very high	94.4	Very high	90 Å²	90	37.8 Å²	37.8	48%	0.481	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-10.5	177.6	67.2	-50.4	0	0	0	113.9	L90 R309 P313	L90-D311 WeakPolarHBondContact CD1-O 3.26Å; R309-D311 WeakPolarHBondContact CB-OD1 3.03Å; R309-D311 IonicContact CZ-OD1 2.87Å; R309-D311 IonicContact CZ-OD2 3.01Å; R309-D311 IonicContact NE-OD1 3.95Å; R309-D311 IonicContact NH1-OD1 3.56Å; R309-D311 PolarHBondContact NH1-OD1 3.16Å; R309-D311 VanDerWaalsContact NH1-OD1 3.15Å; R309-D311 IonicContact NH1-OD2 2.6Å; R309-D311 PolarHBondContact NH1-OD2 2.86Å; R309-D311 IonicContact NH2-OD1 3.86Å; R309-D311 IonicContact NH2-OD2 2.63Å; R309-D311 PolarHBondContact O-N 2.71Å; R309-D311 VanDerWaalsContact O-N 3.16Å; D311-P313 WeakPolarHBondContact O-CD 3.35Å
312	V	97.7	Very high	94.5	Very high	1 Å²	1	38.5 Å²	38.5	1%	0.006	19%	0.194	C	C	.	.	S	Bend	trans	-75.7	119.9	179.1	177.6	0	0	0	0	109.4	R87 A286 L308 R309 D310 Q314	R87-V312 PolarHBondContact NE-O 2.79Å; R87-V312 PolarHBondContact NH2-O 2.8Å; A286-V312 VanDerWaalsContact O-CG2 3.28Å; A286-V312 WeakPolarHBondContact O-CG2 3.49Å; L308-V312 HydrophobicContact CB-CB 4.49Å; L308-V312 HydrophobicContact CD1-CG1 4.16Å; R309-V312 HydrophobicContact CB-CG2 4.1Å; R309-V312 WeakPolarHBondContact O-CB 3.17Å; R309-V312 PolarHBondContact O-N 2.88Å; D310-V312 VanDerWaalsContact C-N 3.29Å; D310-V312 PolarHBondContact O-N 2.74Å; V312-Q314 WeakPolarHBondContact O-CG 3.47Å
313	P	98.4	Very high	94.3	Very high	8 Å²	8	42.1 Å²	42.1	5%	0.052	22%	0.219	C	C	.	.			trans	-65	141.1	176.6	23.7	-30.9	0	0	0	111.9	L90 Y93 L102 D287 L288 L289 D311 D328	L90-P313 HydrophobicContact CD1-CB 4.37Å; Y93-P313 HydrophobicContact CD2-CB 3.9Å; Y93-P313 HydrophobicContact CE2-CB 3.79Å; Y93-P313 HydrophobicContact CE2-CG 4.28Å; L102-P313 HydrophobicContact CD1-CB 3.91Å; L102-P313 HydrophobicContact CD1-CG 4.35Å; L102-P313 HydrophobicContact CD2-CB 3.95Å; L102-P313 HydrophobicContact CD2-CG 3.56Å; D287-P313 WeakPolarHBondContact O-CD 3.36Å; D287-P313 WeakPolarHBondContact O-CG 3.47Å; L288-P313 HydrophobicContact CD1-CB 4.2Å; L288-P313 HydrophobicContact CD1-CG 3.98Å; L289-P313 PolarHBondContact N-O 2.98Å; D311-P313 WeakPolarHBondContact O-CD 3.35Å; P313-D328 WeakPolarHBondContact CA-OD2 3.43Å
314	Q	98.3	Very high	94.1	Very high	6 Å²	6	46.9 Å²	46.9	3%	0.028	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	126.2	-177.3	-51.4	-165.6	3.2	0	0	111.2	L289 P305 V312 F327 D328	L289-Q314 HydrophobicContact CB-CB 4.48Å; L289-Q314 HydrophobicContact CB-CG 4.16Å; L289-Q314 HydrophobicContact CD2-CG 4.22Å; L289-Q314 WeakPolarHBondContact O-CA 3.46Å; P305-Q314 PolarHBondContact O-NE2 2.8Å; V312-Q314 WeakPolarHBondContact O-CG 3.47Å; Q314-F327 HydrophobicContact CB-CD1 3.83Å; Q314-F327 HydrophobicContact CB-CE1 4.4Å; Q314-D328 PolarHBondContact N-OD2 3.41Å; Q314-D328 PolarHBondContact O-N 2.82Å
315	V	98.5	Very high	94	Very high	1 Å²	1	49.1 Å²	49.1	1%	0.006	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	129.8	-179.7	-177.4	0	0	0	0	109.7	V99 L102 L288 L289 L290 V291 I317 V329	V99-V315 HydrophobicContact CG1-CG1 4.14Å; V99-V315 HydrophobicContact CG1-CG2 4.4Å; V99-V315 HydrophobicContact CG2-CG1 3.9Å; V99-V315 HydrophobicContact CG2-CG2 3.99Å; L102-V315 HydrophobicContact CD1-CG2 4.42Å; L288-V315 HydrophobicContact CD1-CG2 4.26Å; L289-V315 PolarHBondContact O-N 2.98Å; L290-V315 HydrophobicContact CD2-CB 3.74Å; L290-V315 HydrophobicContact CD2-CG1 4.41Å; L290-V315 HydrophobicContact CD2-CG2 4.1Å; V291-V315 PolarHBondContact N-O 2.99Å; V315-I317 HydrophobicContact CG1-CG1 4.18Å; V315-V329 WeakPolarHBondContact CA-O 3.25Å; V315-V329 HydrophobicContact CG1-CB 4.33Å; V315-V329 HydrophobicContact CG2-CB 4.43Å
316	L	98.5	Very high	93.8	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	131	171.6	179.2	66.6	0	0	0	109.9	V291 N318 L322 F327 V329 E330 L331 L332	V291-L316 HydrophobicContact CB-CD1 4.06Å; V291-L316 HydrophobicContact CG1-CD1 3.85Å; L316-N318 HydrophobicContact CD1-CB 3.79Å; L316-N318 HydrophobicContact CD2-CB 4.46Å; L316-N318 HydrophobicContact CG-CB 4Å; L316-L322 HydrophobicContact CD1-CD1 3.8Å; L316-L322 HydrophobicContact CD1-CG 4.15Å; L316-L322 HydrophobicContact CD2-CB 4.41Å; L316-L322 HydrophobicContact CD2-CD1 4.39Å; L316-L322 HydrophobicContact CD2-CG 3.92Å; L316-F327 HydrophobicContact CB-CB 4.13Å; L316-F327 HydrophobicContact CB-CD1 3.9Å; L316-F327 HydrophobicContact CB-CD2 3.6Å; L316-F327 HydrophobicContact CB-CE1 4.2Å; L316-F327 HydrophobicContact CB-CE2 3.9Å; L316-F327 HydrophobicContact CB-CG 3.6Å; L316-F327 HydrophobicContact CB-CZ 4.2Å; L316-F327 HydrophobicContact CD1-CE2 3.99Å; L316-F327 HydrophobicContact CD1-CZ 4.05Å; L316-F327 HydrophobicContact CD2-CD2 3.88Å; L316-F327 HydrophobicContact CD2-CE2 3.91Å; L316-F327 HydrophobicContact CG-CD2 4.2Å; L316-F327 HydrophobicContact CG-CE2 4.15Å; L316-V329 PolarHBondContact N-O 2.84Å; L316-E330 HydrophobicContact CB-CG 4.19Å; L316-E330 HydrophobicContact CD2-CG 4.23Å; L316-L331 PolarHBondContact O-N 3.39Å; L316-L332 HydrophobicContact CD2-CD2 4.42Å
317	I	98.3	Very high	94.1	Very high	1 Å²	1	51.2 Å²	51.2	1%	0.005	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	94.7	172.2	-58.2	170	0	0	0	107.2	V291 I292 G293 V315 L331 I338 F339 L342	V291-I317 PolarHBondContact O-N 3.11Å; I292-I317 CarbonylContact C-O 3.57Å; I292-I317 VanDerWaalsContact CA-O 3.29Å; I292-I317 WeakPolarHBondContact CA-O 3.39Å; I292-I317 HydrophobicContact CG1-CB 4.4Å; I292-I317 HydrophobicContact CG1-CD1 4.45Å; I292-I317 HydrophobicContact CG2-CB 4.31Å; I292-I317 HydrophobicContact CG2-CG2 4.33Å; G293-I317 PolarHBondContact N-O 3.49Å; V315-I317 HydrophobicContact CG1-CG1 4.18Å; I317-L331 WeakPolarHBondContact CA-O 3.37Å; I317-L331 HydrophobicContact CG1-CB 4.23Å; I317-L331 HydrophobicContact CG1-CD1 4.24Å; I317-I338 HydrophobicContact CG2-CB 4.1Å; I317-I338 HydrophobicContact CG2-CD1 3.86Å; I317-I338 HydrophobicContact CG2-CG2 3.82Å; I317-F339 HydrophobicContact CB-CE2 4.46Å; I317-F339 HydrophobicContact CD1-CE1 4.14Å; I317-F339 HydrophobicContact CD1-CE2 3.75Å; I317-F339 HydrophobicContact CD1-CZ 3.39Å; I317-F339 HydrophobicContact CG2-CD2 4.48Å; I317-F339 HydrophobicContact CG2-CE2 3.96Å; I317-L342 HydrophobicContact CD1-CD1 4.07Å
318	N	96.8	Very high	94.4	Very high	17 Å²	17	47.5 Å²	47.5	9%	0.091	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	161.5	-172.5	-165.5	38.3	0	0	0	111.3	G293 S294 L316 E320 L331 L332 G333	G293-N318 WeakPolarHBondContact CA-OD1 3.33Å; S294-N318 PolarHBondContact N-OD1 3.12Å; L316-N318 HydrophobicContact CD1-CB 3.79Å; L316-N318 HydrophobicContact CD2-CB 4.46Å; L316-N318 HydrophobicContact CG-CB 4Å; N318-E320 VanDerWaalsContact C-N 3.28Å; N318-E320 PolarHBondContact ND2-O 2.93Å; N318-E320 PolarHBondContact O-N 3.23Å; N318-L331 PolarHBondContact N-O 2.79Å; N318-L332 CarbonylContact O-C 3.41Å; N318-L332 WeakPolarHBondContact O-CA 3.11Å; N318-G333 CarbonylContact C-O 3.53Å; N318-G333 PolarHBondContact O-N 3.33Å
319	R	93.7	Very high	94.7	Very high	125 Å²	125	47.4 Å²	47.4	47%	0.472	24%	0.242	S	C	.	.	S	Bend	trans	-65.8	-34	174.8	-74.3	-177.6	171.1	179	-3.4	112.7	G333	R319-G333 WeakPolarHBondContact CA-O 3.47Å; R319-G333 WeakPolarHBondContact CG-O 3.45Å; R319-G333 PolarHBondContact N-O 3.02Å
320	E	91.9	Very high	94.9	Very high	127 Å²	127	46.5 Å²	46.5	59%	0.593	24%	0.242	S	C	*	.	S	Bend	trans	-125.9	147.2	-174.7	-63.6	175.7	178.4	0	0	110.4	N318	N318-E320 VanDerWaalsContact C-N 3.28Å; N318-E320 PolarHBondContact ND2-O 2.93Å; N318-E320 PolarHBondContact O-N 3.23Å
321	P	94.3	Very high	95.1	Very high	68 Å²	68	43 Å²	43	44%	0.442	22%	0.224	S	C	.	.			trans	-66.8	163	172.4	31.1	-35.7	0	0	0	111	P323 L332	P321-P323 WeakPolarHBondContact O-CD 3.36Å; P321-L332 HydrophobicContact CB-CD1 4.3Å; P321-L332 HydrophobicContact CB-CD2 4.47Å
322	L	93	Very high	95.2	Very high	14 Å²	14	43 Å²	43	7%	0.073	22%	0.223	C	C	.	.			trans	-115.8	94.8	177.3	-56.4	-175.5	0	0	0	110.2	L296 L316 N324 Y325 F327	L296-L322 HydrophobicContact CB-CD1 4.28Å; L296-L322 HydrophobicContact CD1-CD1 3.76Å; L296-L322 HydrophobicContact CG-CD1 3.98Å; L316-L322 HydrophobicContact CD1-CD1 3.8Å; L316-L322 HydrophobicContact CD1-CG 4.15Å; L316-L322 HydrophobicContact CD2-CB 4.41Å; L316-L322 HydrophobicContact CD2-CD1 4.39Å; L316-L322 HydrophobicContact CD2-CG 3.92Å; L322-N324 PolarHBondContact O-N 2.85Å; L322-Y325 HydrophobicContact CB-CD2 3.85Å; L322-Y325 HydrophobicContact CB-CG 4.43Å; L322-Y325 HydrophobicContact CD1-CD2 4.29Å; L322-Y325 PolarHBondContact O-N 2.98Å; L322-F327 HydrophobicContact CB-CE2 4.22Å; L322-F327 HydrophobicContact CD1-CE2 3.95Å; L322-F327 HydrophobicContact CD1-CZ 4.21Å; L322-F327 HydrophobicContact CG-CE2 4.41Å
323	P	88.5	Confident	95.1	Very high	114 Å²	114	44.1 Å²	44.1	74%	0.74	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-25.7	-170.9	-27.2	34.7	0	0	0	115.5	P321 Y325	P321-P323 WeakPolarHBondContact O-CD 3.36Å; P323-Y325 VanDerWaalsContact C-N 3.33Å
324	N	85.7	Confident	94.8	Very high	104 Å²	104	45.5 Å²	45.5	56%	0.556	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.9	2.2	-178.3	-72.6	-54.6	0	0	0	114	L322	L322-N324 PolarHBondContact O-N 2.85Å
325	Y	91.1	Very high	94.6	Very high	46 Å²	46	45.5 Å²	45.5	18%	0.18	24%	0.243	C	C	.	.			trans	-125.3	156.4	-178.6	-66.2	-94.3	0	0	0	110.3	L296 N302 P305 L322 P323 F327	L296-Y325 HydrophobicContact CB-CE2 3.9Å; L296-Y325 HydrophobicContact CD1-CD1 4.13Å; L296-Y325 HydrophobicContact CD1-CD2 4.4Å; L296-Y325 HydrophobicContact CD1-CE1 3.81Å; L296-Y325 HydrophobicContact CD1-CE2 4.09Å; L296-Y325 HydrophobicContact CD1-CG 4.42Å; N302-Y325 WeakPolarHBondContact CB-OH 3.4Å; N302-Y325 PolarHBondContact O-OH 3.32Å; P305-Y325 HydrophobicContact CB-CD1 4.05Å; P305-Y325 HydrophobicContact CB-CE1 4.1Å; P305-Y325 HydrophobicContact CG-CD1 4.12Å; P305-Y325 HydrophobicContact CG-CE1 3.87Å; L322-Y325 HydrophobicContact CB-CD2 3.85Å; L322-Y325 HydrophobicContact CB-CG 4.43Å; L322-Y325 HydrophobicContact CD1-CD2 4.29Å; L322-Y325 PolarHBondContact O-N 2.98Å; P323-Y325 VanDerWaalsContact C-N 3.33Å; Y325-F327 VanDerWaalsContact CB-CE2 3.43Å; Y325-F327 HydrophobicContact CG-CE2 4.15Å; Y325-F327 HydrophobicContact CG-CZ 4.38Å
326	T	92.4	Very high	94.4	Very high	68 Å²	68	46.8 Å²	46.8	42%	0.417	25%	0.25	S	C	.	.			trans	-125.5	93	178.3	-54.8	0	0	0	0	109	R89	R89-T326 HydrophobicContact CB-CG2 3.7Å; R89-T326 HydrophobicContact CG-CG2 4.33Å
327	F	96	Very high	94.2	Very high	3 Å²	3	48.8 Å²	48.8	1%	0.013	26%	0.259	C	S	.	.			trans	-86.3	153	176.1	-64.8	-82	0	0	0	111.1	R89 V291 L296 Q314 L316 L322 Y325 E330	R89-F327 WeakPolarHBondContact CD-O 3.29Å; R89-F327 WeakPolarHBondContact CG-O 3.43Å; R89-F327 PolarHBondContact NE-O 3.38Å; V291-F327 HydrophobicContact CB-CE1 4.01Å; V291-F327 HydrophobicContact CB-CZ 4.15Å; V291-F327 HydrophobicContact CG1-CZ 4.46Å; V291-F327 HydrophobicContact CG2-CE1 3.63Å; V291-F327 HydrophobicContact CG2-CZ 3.96Å; L296-F327 HydrophobicContact CD1-CZ 4.29Å; Q314-F327 HydrophobicContact CB-CD1 3.83Å; Q314-F327 HydrophobicContact CB-CE1 4.4Å; L316-F327 HydrophobicContact CB-CB 4.13Å; L316-F327 HydrophobicContact CB-CD1 3.9Å; L316-F327 HydrophobicContact CB-CD2 3.6Å; L316-F327 HydrophobicContact CB-CE1 4.2Å; L316-F327 HydrophobicContact CB-CE2 3.9Å; L316-F327 HydrophobicContact CB-CG 3.6Å; L316-F327 HydrophobicContact CB-CZ 4.2Å; L316-F327 HydrophobicContact CD1-CE2 3.99Å; L316-F327 HydrophobicContact CD1-CZ 4.05Å; L316-F327 HydrophobicContact CD2-CD2 3.88Å; L316-F327 HydrophobicContact CD2-CE2 3.91Å; L316-F327 HydrophobicContact CG-CD2 4.2Å; L316-F327 HydrophobicContact CG-CE2 4.15Å; L322-F327 HydrophobicContact CB-CE2 4.22Å; L322-F327 HydrophobicContact CD1-CE2 3.95Å; L322-F327 HydrophobicContact CD1-CZ 4.21Å; L322-F327 HydrophobicContact CG-CE2 4.41Å; Y325-F327 VanDerWaalsContact CB-CE2 3.43Å; Y325-F327 HydrophobicContact CG-CE2 4.15Å; Y325-F327 HydrophobicContact CG-CZ 4.38Å; F327-E330 HydrophobicContact CB-CG 3.98Å
328	D	97.6	Very high	94	Very high	1 Å²	1	49.9 Å²	49.9	1%	0.005	26%	0.264	C	S	.	.	S	Bend	trans	-76	-41	177.6	-52.2	-37.8	0	0	0	110.6	R87 R89 L90 Y93 P313 Q314	R87-D328 IonicContact CZ-OD1 3.87Å; R87-D328 IonicContact CZ-OD2 3.47Å; R87-D328 IonicContact NH1-OD1 3.67Å; R87-D328 PolarHBondContact NH1-OD1 2.89Å; R87-D328 IonicContact NH1-OD2 2.79Å; R87-D328 IonicContact NH2-OD1 3.51Å; R87-D328 PolarHBondContact NH2-OD1 3.42Å; R87-D328 IonicContact NH2-OD2 3.21Å; R87-D328 PolarHBondContact NH2-OD2 2.92Å; R89-D328 HydrophobicContact CG-CB 4.49Å; R89-D328 VanDerWaalsContact CZ-O 3.29Å; R89-D328 PolarHBondContact NE-O 3.38Å; R89-D328 PolarHBondContact NH2-O 3.28Å; L90-D328 PolarHBondContact N-OD1 2.95Å; Y93-D328 VanDerWaalsContact O-O 3.09Å; P313-D328 WeakPolarHBondContact CA-OD2 3.43Å; Q314-D328 PolarHBondContact N-OD2 3.41Å; Q314-D328 PolarHBondContact O-N 2.82Å
329	V	97.5	Very high	93.9	Very high	7 Å²	7	49 Å²	49	4%	0.042	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	133.7	173.2	-172.6	0	0	0	0	109.9	V99 V315 L316 L331	V99-V329 HydrophobicContact CG2-CB 3.72Å; V99-V329 HydrophobicContact CG2-CG1 3.6Å; V99-V329 HydrophobicContact CG2-CG2 3.9Å; V315-V329 WeakPolarHBondContact CA-O 3.25Å; V315-V329 HydrophobicContact CG1-CB 4.33Å; V315-V329 HydrophobicContact CG2-CB 4.43Å; L316-V329 PolarHBondContact N-O 2.84Å; V329-L331 HydrophobicContact CG1-CD2 3.86Å; V329-L331 HydrophobicContact CG1-CG 4.29Å
330	E	97.7	Very high	93.9	Very high	79 Å²	79	43.5 Å²	43.5	37%	0.369	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	114.2	173.8	-60	-172.8	-170.9	0	0	109.5	L316 F327 L332	L316-E330 HydrophobicContact CB-CG 4.19Å; L316-E330 HydrophobicContact CD2-CG 4.23Å; F327-E330 HydrophobicContact CB-CG 3.98Å; E330-L332 HydrophobicContact CB-CD2 4.24Å; E330-L332 HydrophobicContact CB-CG 4.36Å
331	L	97.3	Very high	94	Very high	23 Å²	23	38.2 Å²	38.2	12%	0.12	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	101.8	172.9	-54.1	-178.2	0	0	0	107.7	I96 V99 L316 I317 N318 V329 I338 L342	I96-L331 HydrophobicContact CB-CD2 4.35Å; I96-L331 HydrophobicContact CG1-CD1 4.49Å; I96-L331 HydrophobicContact CG1-CD2 4.46Å; V99-L331 HydrophobicContact CG1-CD1 4.37Å; V99-L331 HydrophobicContact CG2-CD1 4.4Å; L316-L331 PolarHBondContact O-N 3.39Å; I317-L331 WeakPolarHBondContact CA-O 3.37Å; I317-L331 HydrophobicContact CG1-CB 4.23Å; I317-L331 HydrophobicContact CG1-CD1 4.24Å; N318-L331 PolarHBondContact N-O 2.79Å; V329-L331 HydrophobicContact CG1-CD2 3.86Å; V329-L331 HydrophobicContact CG1-CG 4.29Å; L331-I338 HydrophobicContact CB-CD1 4.05Å; L331-I338 HydrophobicContact CB-CG2 3.98Å; L331-I338 HydrophobicContact CD1-CG2 3.75Å; L331-I338 WeakPolarHBondContact O-CD1 3.21Å; L331-L342 HydrophobicContact CD1-CD1 4.21Å; L331-L342 HydrophobicContact CD1-CD2 4.38Å
332	L	97.1	Very high	94	Very high	89 Å²	89	35 Å²	35	47%	0.466	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	125.1	-172.8	-56.7	-179.6	0	0	0	111.5	L316 N318 P321 E330	L316-L332 HydrophobicContact CD2-CD2 4.42Å; N318-L332 CarbonylContact O-C 3.41Å; N318-L332 WeakPolarHBondContact O-CA 3.11Å; P321-L332 HydrophobicContact CB-CD1 4.3Å; P321-L332 HydrophobicContact CB-CD2 4.47Å; E330-L332 HydrophobicContact CB-CD2 4.24Å; E330-L332 HydrophobicContact CB-CG 4.36Å
333	G	93.9	Very high	94.1	Very high	26 Å²	26	34.3 Å²	34.3	27%	0.268	19%	0.191	S	C	.	.	S	Bend	trans	153.1	-164.2	-178.8	0	0	0	0	0	114.1	N318 R319 C335	N318-G333 CarbonylContact C-O 3.53Å; N318-G333 PolarHBondContact O-N 3.33Å; R319-G333 WeakPolarHBondContact CA-O 3.47Å; R319-G333 WeakPolarHBondContact CG-O 3.45Å; R319-G333 PolarHBondContact N-O 3.02Å; G333-C335 PolarHBondContact O-N 2.97Å
334	N	93.3	Very high	94.3	Very high	36 Å²	36	31.2 Å²	31.2	19%	0.193	17%	0.167	C	C	.	.			trans	-68.4	128.6	173.2	-173.5	-53	0	0	0	110.1	D336 E337 I338	N334-D336 PolarHBondContact O-N 3.34Å; N334-D336 PolarHBondContact OD1-N 2.83Å; N334-E337 HydrophobicContact CB-CB 4.2Å; N334-E337 HydrophobicContact CB-CG 4.06Å; N334-E337 PolarHBondContact O-N 2.95Å; N334-I338 WeakPolarHBondContact O-CG1 3.39Å; N334-I338 PolarHBondContact O-N 3.01Å; N334-I338 VanDerWaalsContact O-N 3.13Å
335	C	93.5	Very high	94.8	Very high	7 Å²	7	30.7 Å²	30.7	5%	0.047	16%	0.158	C	C	.	.	H	α-helix	trans	-58.4	-44.3	-176.4	-57.1	0	0	0	0	112.5	I292 G333 E337 I338 F339	I292-C335 HydrophobicContact CG2-CB 4.27Å; G333-C335 PolarHBondContact O-N 2.97Å; C335-E337 VanDerWaalsContact C-N 3.34Å; C335-E337 PolarHBondContact O-N 3.09Å; C335-I338 PolarHBondContact O-N 3.2Å; C335-F339 VanDerWaalsContact O-CD2 3.26Å; C335-F339 WeakPolarHBondContact O-CD2 3.28Å; C335-F339 PolarHBondContact O-N 2.82Å
336	D	93.9	Very high	95	Very high	28 Å²	28	29.3 Å²	29.3	15%	0.15	15%	0.153	C	C	.	.	H	α-helix	trans	-68.9	-32.3	-177	-80.5	-13.2	0	0	0	112.7	S120 S177 L178 T179 N334 N340	S120-D336 WeakPolarHBondContact CB-OD2 3.34Å; S120-D336 PolarHBondContact OG-OD2 3.48Å; S177-D336 WeakPolarHBondContact CB-OD1 3.28Å; S177-D336 WeakPolarHBondContact CB-OD2 3.41Å; L178-D336 HydrophobicContact CB-CB 4.31Å; L178-D336 PolarHBondContact N-OD1 2.9Å; T179-D336 WeakPolarHBondContact CB-OD1 3.46Å; T179-D336 PolarHBondContact N-OD1 3.25Å; T179-D336 PolarHBondContact OG1-OD1 3.36Å; N334-D336 PolarHBondContact O-N 3.34Å; N334-D336 PolarHBondContact OD1-N 2.83Å; D336-N340 VanDerWaalsContact O-CB 3.24Å; D336-N340 WeakPolarHBondContact O-CB 3.24Å; D336-N340 PolarHBondContact O-N 3.26Å
337	E	93.9	Very high	95	Very high	42 Å²	42	27.2 Å²	27.2	20%	0.196	15%	0.145	C	C	.	.	H	α-helix	trans	-67.8	-44.8	174.7	-70.5	170.4	-162.4	0	0	110.8	N334 C335 N340 E341 F359 Y383	N334-E337 HydrophobicContact CB-CB 4.2Å; N334-E337 HydrophobicContact CB-CG 4.06Å; N334-E337 PolarHBondContact O-N 2.95Å; C335-E337 VanDerWaalsContact C-N 3.34Å; C335-E337 PolarHBondContact O-N 3.09Å; E337-N340 PolarHBondContact O-N 3.48Å; E337-E341 PolarHBondContact O-N 3.41Å; E337-E341 VanDerWaalsContact O-N 3.08Å; E337-F359 HydrophobicContact CB-CZ 3.99Å; E337-F359 HydrophobicContact CG-CE2 4.47Å; E337-F359 HydrophobicContact CG-CZ 4.35Å; E337-Y383 PolarHBondContact OE1-OH 3.49Å
338	I	95.6	Very high	94.7	Very high	23 Å²	23	32.8 Å²	32.8	12%	0.118	17%	0.171	C	C	.	.	H	α-helix	trans	-63.2	-44.2	176	-65.3	167.1	0	0	0	110.7	I317 L331 N334 C335 E341 L342	I317-I338 HydrophobicContact CG2-CB 4.1Å; I317-I338 HydrophobicContact CG2-CD1 3.86Å; I317-I338 HydrophobicContact CG2-CG2 3.82Å; L331-I338 HydrophobicContact CB-CD1 4.05Å; L331-I338 HydrophobicContact CB-CG2 3.98Å; L331-I338 HydrophobicContact CD1-CG2 3.75Å; L331-I338 WeakPolarHBondContact O-CD1 3.21Å; N334-I338 WeakPolarHBondContact O-CG1 3.39Å; N334-I338 PolarHBondContact O-N 3.01Å; N334-I338 VanDerWaalsContact O-N 3.13Å; C335-I338 PolarHBondContact O-N 3.2Å; I338-E341 WeakPolarHBondContact O-CB 3.39Å; I338-E341 PolarHBondContact O-N 3.5Å; I338-L342 HydrophobicContact CG2-CD1 4.04Å; I338-L342 HydrophobicContact CG2-CG 4.38Å; I338-L342 WeakPolarHBondContact O-CG 3.39Å; I338-L342 PolarHBondContact O-N 2.97Å
339	F	94.9	Very high	94.3	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-71.2	-31.6	178.6	-85.4	-71.6	0	0	0	113.3	L178 T179 F182 I292 I317 C335 E341 L342 A343	L178-F339 HydrophobicContact CD2-CB 3.43Å; L178-F339 VanDerWaalsContact CD2-CB 3.43Å; T179-F339 HydrophobicContact CG2-CD2 3.64Å; T179-F339 HydrophobicContact CG2-CE2 3.68Å; T179-F339 HydrophobicContact CG2-CG 4.42Å; T179-F339 HydrophobicContact CG2-CZ 4.46Å; T179-F339 WeakPolarHBondContact OG1-CD2 3.43Å; F182-F339 HydrophobicContact CB-CD1 4.01Å; F182-F339 AromaticContact CD1-CD1 3.42Å; F182-F339 HydrophobicContact CD1-CD1 3.42Å; F182-F339 VanDerWaalsContact CD1-CD1 3.42Å; F182-F339 AromaticContact CD1-CE1 3.37Å; F182-F339 HydrophobicContact CD1-CE1 3.37Å; F182-F339 HydrophobicContact CD1-CZ 4.49Å; F182-F339 AromaticContact CD2-CD1 3.8Å; F182-F339 HydrophobicContact CD2-CD1 3.8Å; F182-F339 AromaticContact CE1-CD1 3.76Å; F182-F339 HydrophobicContact CE1-CD1 3.76Å; F182-F339 AromaticContact CE1-CE1 3.5Å; F182-F339 HydrophobicContact CE1-CE1 3.5Å; F182-F339 VanDerWaalsContact CE1-CE1 3.5Å; F182-F339 HydrophobicContact CE2-CD1 4.09Å; F182-F339 AromaticContact CG-CD1 3.45Å; F182-F339 HydrophobicContact CG-CD1 3.45Å; F182-F339 VanDerWaalsContact CG-CD1 3.45Å; F182-F339 AromaticContact CG-CE1 3.93Å; F182-F339 HydrophobicContact CG-CE1 3.93Å; F182-F339 HydrophobicContact CG-CG 4.35Å; F182-F339 HydrophobicContact CZ-CD1 4.08Å; F182-F339 HydrophobicContact CZ-CE1 4.14Å; I292-F339 HydrophobicContact CD1-CE1 4.44Å; I292-F339 HydrophobicContact CD1-CE2 3.67Å; I292-F339 HydrophobicContact CD1-CZ 3.34Å; I292-F339 HydrophobicContact CG1-CE2 4.05Å; I292-F339 HydrophobicContact CG1-CZ 3.96Å; I292-F339 HydrophobicContact CG2-CE2 3.64Å; I292-F339 HydrophobicContact CG2-CZ 4.4Å; I317-F339 HydrophobicContact CB-CE2 4.46Å; I317-F339 HydrophobicContact CD1-CE1 4.14Å; I317-F339 HydrophobicContact CD1-CE2 3.75Å; I317-F339 HydrophobicContact CD1-CZ 3.39Å; I317-F339 HydrophobicContact CG2-CD2 4.48Å; I317-F339 HydrophobicContact CG2-CE2 3.96Å; C335-F339 VanDerWaalsContact O-CD2 3.26Å; C335-F339 WeakPolarHBondContact O-CD2 3.28Å; C335-F339 PolarHBondContact O-N 2.82Å; F339-E341 VanDerWaalsContact C-N 3.28Å; F339-E341 PolarHBondContact O-N 2.85Å; F339-L342 HydrophobicContact CD1-CD1 4.16Å; F339-L342 HydrophobicContact CE1-CD1 4.13Å; F339-L342 PolarHBondContact O-N 3.49Å; F339-A343 WeakPolarHBondContact O-CB 3.29Å; F339-A343 PolarHBondContact O-N 3.05Å
340	N	93.6	Very high	93.9	Very high	9 Å²	9	34.6 Å²	34.6	5%	0.048	18%	0.182	C	C	.	.	H	α-helix	trans	-60.4	-43.2	170.4	-174.3	84.6	0	0	0	110.4	L178 D336 E337 L344 C354 N356 F359	L178-N340 HydrophobicContact CD1-CB 3.91Å; D336-N340 VanDerWaalsContact O-CB 3.24Å; D336-N340 WeakPolarHBondContact O-CB 3.24Å; D336-N340 PolarHBondContact O-N 3.26Å; E337-N340 PolarHBondContact O-N 3.48Å; N340-L344 VanDerWaalsContact O-CG 3.29Å; N340-L344 WeakPolarHBondContact O-CG 3.46Å; N340-L344 PolarHBondContact O-N 2.76Å; N340-L344 VanDerWaalsContact O-N 3.07Å; N340-C354 WeakPolarHBondContact OD1-CB 3.18Å; N340-N356 PolarHBondContact ND2-O 3.35Å; N340-F359 WeakPolarHBondContact ND2-CB 3.22Å; N340-F359 WeakPolarHBondContact ND2-CG 3.37Å
341	E	93.1	Very high	93.5	Very high	16 Å²	16	31.4 Å²	31.4	8%	0.075	17%	0.169	C	C	.	.	H	α-helix	trans	-64.4	-49	176.1	177.1	59.9	-173	0	0	113.1	I96 E337 I338 F339 A343 L344 R345 F359 L360	I96-E341 HydrophobicContact CD1-CG 3.91Å; E337-E341 PolarHBondContact O-N 3.41Å; E337-E341 VanDerWaalsContact O-N 3.08Å; I338-E341 WeakPolarHBondContact O-CB 3.39Å; I338-E341 PolarHBondContact O-N 3.5Å; F339-E341 VanDerWaalsContact C-N 3.28Å; F339-E341 PolarHBondContact O-N 2.85Å; E341-A343 VanDerWaalsContact C-N 3.31Å; E341-A343 PolarHBondContact O-N 3.49Å; E341-L344 PolarHBondContact O-N 3.48Å; E341-R345 WeakPolarHBondContact O-CG 3.44Å; E341-R345 PolarHBondContact O-N 3.34Å; E341-R345 IonicContact OE1-CZ 3.13Å; E341-R345 IonicContact OE1-NE 2.66Å; E341-R345 PolarHBondContact OE1-NE 3.01Å; E341-R345 IonicContact OE1-NH2 2.73Å; E341-R345 PolarHBondContact OE1-NH2 2.93Å; E341-F359 HydrophobicContact CB-CD1 4.3Å; E341-F359 HydrophobicContact CB-CE1 4.08Å; E341-L360 VanDerWaalsContact CD-CD1 3.42Å; E341-L360 WeakPolarHBondContact OE1-CD1 3.19Å; E341-L360 WeakPolarHBondContact OE2-CD1 3.47Å; E341-L360 WeakPolarHBondContact OE2-CD2 3.4Å; E341-L360 WeakPolarHBondContact OE2-CG 3.28Å
342	L	95.3	Very high	92.8	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-59.9	-43	177.6	-70.6	174.1	0	0	0	111.3	I96 V99 V100 I103 I317 L331 I338 F339 L344 R345 L346	I96-L342 HydrophobicContact CD1-CD2 4.24Å; I96-L342 HydrophobicContact CG1-CD2 3.91Å; V99-L342 HydrophobicContact CG1-CD1 4.48Å; V99-L342 HydrophobicContact CG1-CD2 4.07Å; V100-L342 HydrophobicContact CG2-CD2 3.9Å; I103-L342 HydrophobicContact CD1-CD1 4.49Å; I317-L342 HydrophobicContact CD1-CD1 4.07Å; L331-L342 HydrophobicContact CD1-CD1 4.21Å; L331-L342 HydrophobicContact CD1-CD2 4.38Å; I338-L342 HydrophobicContact CG2-CD1 4.04Å; I338-L342 HydrophobicContact CG2-CG 4.38Å; I338-L342 WeakPolarHBondContact O-CG 3.39Å; I338-L342 PolarHBondContact O-N 2.97Å; F339-L342 HydrophobicContact CD1-CD1 4.16Å; F339-L342 HydrophobicContact CE1-CD1 4.13Å; F339-L342 PolarHBondContact O-N 3.49Å; L342-L344 PolarHBondContact O-N 2.78Å; L342-R345 PolarHBondContact O-N 3.21Å; L342-L346 WeakPolarHBondContact O-CB 3.3Å; L342-L346 WeakPolarHBondContact O-CD1 3.45Å; L342-L346 VanDerWaalsContact O-CG 3.24Å; L342-L346 WeakPolarHBondContact O-CG 3.29Å; L342-L346 PolarHBondContact O-N 2.77Å
343	A	94.3	Very high	91.9	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-62.1	-40.8	177.5	0	0	0	0	0	112.4	F182 F339 E341 L346 G347 C354	F182-A343 HydrophobicContact CD2-CB 4.11Å; F182-A343 HydrophobicContact CE2-CB 4.17Å; F339-A343 WeakPolarHBondContact O-CB 3.29Å; F339-A343 PolarHBondContact O-N 3.05Å; E341-A343 VanDerWaalsContact C-N 3.31Å; E341-A343 PolarHBondContact O-N 3.49Å; A343-L346 PolarHBondContact O-N 3.28Å; A343-G347 PolarHBondContact O-N 3.34Å; A343-G347 VanDerWaalsContact O-N 3.09Å; A343-C354 WeakPolarHBondContact CB-SG 3.4Å
344	L	93.4	Very high	91.2	Very high	48 Å²	48	28.3 Å²	28.3	25%	0.251	15%	0.154	S	C	.	.	H	α-helix	trans	-64.2	-40.4	174.5	-70.7	173.6	0	0	0	112.3	N340 E341 L342 G347 C354 F359	N340-L344 VanDerWaalsContact O-CG 3.29Å; N340-L344 WeakPolarHBondContact O-CG 3.46Å; N340-L344 PolarHBondContact O-N 2.76Å; N340-L344 VanDerWaalsContact O-N 3.07Å; E341-L344 PolarHBondContact O-N 3.48Å; L342-L344 PolarHBondContact O-N 2.78Å; L344-G347 PolarHBondContact O-N 2.73Å; L344-C354 HydrophobicContact CD2-CB 4.5Å; L344-F359 HydrophobicContact CD1-CB 3.8Å
345	R	95	Very high	89.7	Confident	94 Å²	94	36 Å²	36	36%	0.355	19%	0.186	S	C	.	.	H	α-helix	trans	-71.4	-31.2	177.1	-68.4	-176.4	-175.4	-112.5	-10.2	113.8	N97 V100 E341 L342	N97-R345 PolarHBondContact OD1-NH1 3.42Å; V100-R345 HydrophobicContact CG1-CB 4.3Å; V100-R345 HydrophobicContact CG2-CB 3.71Å; V100-R345 HydrophobicContact CG2-CG 4.42Å; E341-R345 WeakPolarHBondContact O-CG 3.44Å; E341-R345 PolarHBondContact O-N 3.34Å; E341-R345 IonicContact OE1-CZ 3.13Å; E341-R345 IonicContact OE1-NE 2.66Å; E341-R345 PolarHBondContact OE1-NE 3.01Å; E341-R345 IonicContact OE1-NH2 2.73Å; E341-R345 PolarHBondContact OE1-NH2 2.93Å; L342-R345 PolarHBondContact O-N 3.21Å
346	L	95.1	Very high	88	Confident	17 Å²	17	39.4 Å²	39.4	9%	0.089	20%	0.204	C	C	.	.	H	α-helix	trans	-73.4	-31.2	176.8	-75.2	162.5	0	0	0	111.7	V100 I103 K104 F182 L342 A343 Y350	V100-L346 HydrophobicContact CG1-CD2 4Å; V100-L346 HydrophobicContact CG1-CG 4.32Å; I103-L346 HydrophobicContact CB-CD2 4.17Å; I103-L346 HydrophobicContact CD1-CD1 4.37Å; I103-L346 HydrophobicContact CG2-CD1 3.83Å; I103-L346 HydrophobicContact CG2-CD2 3.85Å; K104-L346 HydrophobicContact CD-CD2 4.36Å; K104-L346 HydrophobicContact CG-CD2 3.63Å; F182-L346 HydrophobicContact CE2-CD1 3.64Å; F182-L346 HydrophobicContact CZ-CD1 3.48Å; F182-L346 VanDerWaalsContact CZ-CD1 3.48Å; L342-L346 WeakPolarHBondContact O-CB 3.3Å; L342-L346 WeakPolarHBondContact O-CD1 3.45Å; L342-L346 VanDerWaalsContact O-CG 3.24Å; L342-L346 WeakPolarHBondContact O-CG 3.29Å; L342-L346 PolarHBondContact O-N 2.77Å; A343-L346 PolarHBondContact O-N 3.28Å; L346-Y350 HydrophobicContact CB-CD2 3.65Å; L346-Y350 HydrophobicContact CB-CE2 4.4Å; L346-Y350 HydrophobicContact CB-CG 3.91Å; L346-Y350 HydrophobicContact CD1-CD1 4.15Å; L346-Y350 HydrophobicContact CD1-CD2 4.25Å; L346-Y350 HydrophobicContact CD1-CG 4Å; L346-Y350 HydrophobicContact CG-CD2 4.4Å
347	G	92.8	Very high	86.3	Confident	24 Å²	24	46.2 Å²	46.2	25%	0.247	23%	0.227	C	C	.	.			trans	78.3	-164.3	-176.1	0	0	0	0	0	112.1	A343 L344 Y350 S351	A343-G347 PolarHBondContact O-N 3.34Å; A343-G347 VanDerWaalsContact O-N 3.09Å; L344-G347 PolarHBondContact O-N 2.73Å; G347-Y350 WeakPolarHBondContact O-CA 3.31Å; G347-Y350 WeakPolarHBondContact O-CB 3.45Å; G347-Y350 PolarHBondContact O-N 2.93Å; G347-S351 VanDerWaalsContact C-OG 3.22Å; G347-S351 PolarHBondContact O-N 2.79Å; G347-S351 PolarHBondContact O-OG 3.24Å
348	E	88.9	Confident	84.2	Confident	119 Å²	119	49.6 Å²	49.6	56%	0.556	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.8	141.3	176.4	-67.2	-61.7	146	0	0	110.8	S351	E348-S351 PolarHBondContact N-OG 3.47Å; E348-S351 PolarHBondContact OE1-OG 2.89Å
349	P	89.3	Confident	81.8	Confident	36 Å²	36	51.5 Å²	51.5	23%	0.234	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	cis	-87.3	-3.8	5.6	34.8	-35.7	0	0	0	114.9	Y185 E189 S351 A352	Y185-P349 HydrophobicContact CD1-CB 4.01Å; Y185-P349 HydrophobicContact CD1-CG 4.24Å; Y185-P349 HydrophobicContact CE1-CB 3.99Å; Y185-P349 WeakPolarHBondContact CE1-O 3.15Å; E189-P349 HydrophobicContact CG-CG 3.88Å; E189-P349 WeakPolarHBondContact OE1-CG 3.26Å; P349-S351 PolarHBondContact O-N 3.36Å; P349-A352 VanDerWaalsContact O-CB 3.24Å; P349-A352 WeakPolarHBondContact O-CB 3.47Å; P349-A352 PolarHBondContact O-N 3.42Å
350	Y	90.8	Very high	79.1	Confident	10 Å²	10	53.8 Å²	53.8	4%	0.039	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-64.2	-39.9	-175	-59	-87.7	0	0	0	112.8	F182 L186 E189 K191 L346 G347 A352 C353	F182-Y350 HydrophobicContact CD2-CD1 4.12Å; F182-Y350 AromaticContact CE2-CD1 3.62Å; F182-Y350 HydrophobicContact CE2-CD1 3.62Å; F182-Y350 HydrophobicContact CE2-CE1 4.41Å; F182-Y350 HydrophobicContact CE2-CG 4.23Å; F182-Y350 AromaticContact CZ-CD1 3.88Å; F182-Y350 HydrophobicContact CZ-CD1 3.88Å; F182-Y350 HydrophobicContact CZ-CE1 4.24Å; L186-Y350 HydrophobicContact CD2-CE1 3.83Å; L186-Y350 HydrophobicContact CG-CE1 4.35Å; E189-Y350 HydrophobicContact CG-CE2 4.37Å; K191-Y350 WeakPolarHBondContact CD-OH 3.2Å; L346-Y350 HydrophobicContact CB-CD2 3.65Å; L346-Y350 HydrophobicContact CB-CE2 4.4Å; L346-Y350 HydrophobicContact CB-CG 3.91Å; L346-Y350 HydrophobicContact CD1-CD1 4.15Å; L346-Y350 HydrophobicContact CD1-CD2 4.25Å; L346-Y350 HydrophobicContact CD1-CG 4Å; L346-Y350 HydrophobicContact CG-CD2 4.4Å; G347-Y350 WeakPolarHBondContact O-CA 3.31Å; G347-Y350 WeakPolarHBondContact O-CB 3.45Å; G347-Y350 PolarHBondContact O-N 2.93Å; Y350-A352 PolarHBondContact O-N 2.97Å; Y350-C353 PolarHBondContact O-N 2.85Å; Y350-C353 PolarHBondContact O-SG 2.82Å
351	S	88.5	Confident	76.4	Confident	13 Å²	13	64.3 Å²	64.3	9%	0.091	31%	0.306	C	S	.	.	G	3₁₀ helix	trans	-62.1	-13.9	178.6	51.2	0	0	0	0	114.2	G347 E348 P349 C353 C354	G347-S351 VanDerWaalsContact C-OG 3.22Å; G347-S351 PolarHBondContact O-N 2.79Å; G347-S351 PolarHBondContact O-OG 3.24Å; E348-S351 PolarHBondContact N-OG 3.47Å; E348-S351 PolarHBondContact OE1-OG 2.89Å; P349-S351 PolarHBondContact O-N 3.36Å; S351-C353 VanDerWaalsContact C-N 3.26Å; S351-C353 PolarHBondContact O-N 2.89Å; S351-C354 WeakPolarHBondContact O-CB 3.3Å; S351-C354 PolarHBondContact O-N 3.25Å
352	A	83.4	Confident	73.6	Confident	45 Å²	45	71.2 Å²	71.2	37%	0.372	34%	0.342	S	S	.	.	G	3₁₀ helix	trans	-66.3	-25.1	175.6	0	0	0	0	0	113.2	Y185 P349 Y350 C354	Y185-A352 WeakPolarHBondContact OH-CB 3.26Å; P349-A352 VanDerWaalsContact O-CB 3.24Å; P349-A352 WeakPolarHBondContact O-CB 3.47Å; P349-A352 PolarHBondContact O-N 3.42Å; Y350-A352 PolarHBondContact O-N 2.97Å; A352-C354 VanDerWaalsContact C-N 3.34Å
353	C	78.3	Confident	70.9	Confident	14 Å²	14	76 Å²	76	10%	0.095	37%	0.367	C	S	.	.	G	3₁₀ helix	trans	-79.5	-14.8	175.6	75.3	0	0	0	0	113.8	R181 Y185 Y350 S351 K355	R181-C353 HydrophobicContact CB-CB 4.03Å; Y185-C353 HydrophobicContact CD2-CB 4.08Å; Y185-C353 HydrophobicContact CE2-CB 3.77Å; Y350-C353 PolarHBondContact O-N 2.85Å; Y350-C353 PolarHBondContact O-SG 2.82Å; S351-C353 VanDerWaalsContact C-N 3.26Å; S351-C353 PolarHBondContact O-N 2.89Å; C353-K355 PolarHBondContact O-N 2.69Å
354	C	77.4	Confident	67.9	Low	13 Å²	13	83.1 Å²	83.1	9%	0.088	41%	0.405	C	S	.	.			trans	-69.6	119.6	-176	-61.6	0	0	0	0	110.9	N340 A343 L344 S351 A352 N356	N340-C354 WeakPolarHBondContact OD1-CB 3.18Å; A343-C354 WeakPolarHBondContact CB-SG 3.4Å; L344-C354 HydrophobicContact CD2-CB 4.5Å; S351-C354 WeakPolarHBondContact O-CB 3.3Å; S351-C354 PolarHBondContact O-N 3.25Å; A352-C354 VanDerWaalsContact C-N 3.34Å; C354-N356 VanDerWaalsContact C-N 3.3Å
355	K	63.2	Low	64.8	Low	198 Å²	198	87.6 Å²	87.6	86%	0.861	43%	0.429	S	S	*	.	S	Bend	trans	-72.2	-26.4	169.4	-65.5	-176.4	-178.1	176.8	0	111.9	C353	C353-K355 PolarHBondContact O-N 2.69Å
356	N	57.9	Low	61.5	Low	78 Å²	78	89.7 Å²	89.7	42%	0.417	45%	0.447	S	S	.	.			trans	-125.2	100.1	-177.2	-169.9	-10.7	0	0	0	111.7	N340 C354 N358	N340-N356 PolarHBondContact ND2-O 3.35Å; C354-N356 VanDerWaalsContact C-N 3.3Å; N356-N358 VanDerWaalsContact C-N 3.26Å; N356-N358 PolarHBondContact O-N 3.18Å; N356-N358 PolarHBondContact OD1-N 3.23Å
357	R	57.7	Low	58.3	Low	171 Å²	171	95.7 Å²	95.7	65%	0.645	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-9.1	177.4	-66.2	-175.3	175	-165.8	-6.2	114.2
358	N	49	Very low	55.3	Low	114 Å²	114	99.6 Å²	99.6	61%	0.61	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.7	8.3	-175.8	-73	-32.8	0	0	0	114	N356 L360 R361	N356-N358 VanDerWaalsContact C-N 3.26Å; N356-N358 PolarHBondContact O-N 3.18Å; N356-N358 PolarHBondContact OD1-N 3.23Å; N358-L360 PolarHBondContact O-N 3.37Å; N358-R361 PolarHBondContact O-N 3.48Å
359	F	45.8	Very low	52.4	Low	63 Å²	63	98.7 Å²	98.7	28%	0.276	53%	0.525	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.1	-16.9	-170	-169.2	-109.8	0	0	0	115.4	E337 N340 E341 L344	E337-F359 HydrophobicContact CB-CZ 3.99Å; E337-F359 HydrophobicContact CG-CE2 4.47Å; E337-F359 HydrophobicContact CG-CZ 4.35Å; N340-F359 WeakPolarHBondContact ND2-CB 3.22Å; N340-F359 WeakPolarHBondContact ND2-CG 3.37Å; E341-F359 HydrophobicContact CB-CD1 4.3Å; E341-F359 HydrophobicContact CB-CE1 4.08Å; L344-F359 HydrophobicContact CD1-CB 3.8Å
360	L	38.2	Very low	49.5	Very low	48 Å²	48	101 Å²	101	25%	0.251	56%	0.555	S	S	.	*	T	Hydrogen-bonded Turn	trans	-121.7	3.3	179.4	-62.3	-176.4	0	0	0	117.8	E341 N358 L362 L363 N364	E341-L360 VanDerWaalsContact CD-CD1 3.42Å; E341-L360 WeakPolarHBondContact OE1-CD1 3.19Å; E341-L360 WeakPolarHBondContact OE2-CD1 3.47Å; E341-L360 WeakPolarHBondContact OE2-CD2 3.4Å; E341-L360 WeakPolarHBondContact OE2-CG 3.28Å; N358-L360 PolarHBondContact O-N 3.37Å; L360-L362 PolarHBondContact O-N 3.4Å; L360-L363 HydrophobicContact CB-CB 4.38Å; L360-L363 HydrophobicContact CD2-CB 3.5Å; L360-L363 VanDerWaalsContact CD2-CB 3.5Å; L360-L363 HydrophobicContact CD2-CD1 3.19Å; L360-L363 HydrophobicContact CD2-CG 3.91Å; L360-L363 PolarHBondContact O-N 3.24Å; L360-N364 PolarHBondContact O-N 3.36Å
361	R	37.5	Very low	46.4	Very low	230 Å²	230	103.8 Å²	103.8	87%	0.868	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62	-14.9	171.4	-107.3	-175	-176.9	-176.9	1.7	112.4	N358	N358-R361 PolarHBondContact O-N 3.48Å
362	L	34	Very low	43.4	Very low	161 Å²	161	108.6 Å²	108.6	84%	0.843	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.5	-11.9	175.2	-79.8	153.2	0	0	0	114.8	L360	L360-L362 PolarHBondContact O-N 3.4Å
363	L	38.5	Very low	40.8	Very low	99 Å²	99	116.2 Å²	116.2	52%	0.518	65%	0.645	S	S	.	*	T	Hydrogen-bonded Turn	trans	-98.3	-3.7	179.5	-88.3	159.8	0	0	0	113.2	L360 L365	L360-L363 HydrophobicContact CB-CB 4.38Å; L360-L363 HydrophobicContact CD2-CB 3.5Å; L360-L363 VanDerWaalsContact CD2-CB 3.5Å; L360-L363 HydrophobicContact CD2-CD1 3.19Å; L360-L363 HydrophobicContact CD2-CG 3.91Å; L360-L363 PolarHBondContact O-N 3.24Å; L363-L365 VanDerWaalsContact C-N 3.28Å; L363-L365 PolarHBondContact O-N 2.9Å
364	N	30.1	Very low	38.3	Very low	150 Å²	150	125.8 Å²	125.8	80%	0.802	69%	0.686	S	S	*	*			trans	-89.5	48.8	-178.9	-123.2	4	0	0	0	113.2	L360	L360-N364 PolarHBondContact O-N 3.36Å
365	L	28.8	Very low	35.9	Very low	142 Å²	142	134.1 Å²	134.1	74%	0.743	72%	0.723	S	S	*	*			trans	-117.4	116	167.7	-72.3	168.9	0	0	0	108.8	L363	L363-L365 VanDerWaalsContact C-N 3.28Å; L363-L365 PolarHBondContact O-N 2.9Å
366	N	26.8	Very low	34.2	Very low	139 Å²	139	134.8 Å²	134.8	74%	0.743	73%	0.727	S	S	*	*			trans	80.6	77.7	162.7	-51.2	-24.8	0	0	0	117.9
367	C	26.7	Very low	32.9	Very low	142 Å²	142	140 Å²	140	96%	0.959	75%	0.748	S	S	*	*			trans	-148.9	62.7	137.7	-100.1	0	0	0	0	110
368	S	29.5	Very low	31.5	Very low	107 Å²	107	137.1 Å²	137.1	75%	0.748	76%	0.755	S	S	*	*			trans	-87.5	118.2	157.9	41.5	0	0	0	0	109.2
369	A	28.6	Very low	30.5	Very low	100 Å²	100	138.4 Å²	138.4	83%	0.826	76%	0.76	S	S	*	*	S	Bend	trans	51.8	104.9	148.8	0	0	0	0	0	119.1
370	G	27.8	Very low	29.5	Very low	83 Å²	83	143.1 Å²	143.1	86%	0.856	78%	0.783	S	S	*	*			trans	93.4	131.9	136.7	0	0	0	0	0	116.9
371	G	26.7	Very low	29	Very low	70 Å²	70	145.2 Å²	145.2	72%	0.722	80%	0.797	S	S	*	*			trans	97.7	95.9	154	0	0	0	0	0	115.9
372	S	25.1	Very low	28.5	Very low	113 Å²	113	140.1 Å²	140.1	79%	0.79	79%	0.792	S	S	*	*			trans	30.8	103	137.8	62.7	0	0	0	0	119.1
373	K	29.2	Very low	28.3	Very low	205 Å²	205	140.2 Å²	140.2	89%	0.891	78%	0.782	S	S	*	*				163	123.4	121.8	-94.1	177.7	175.2	-178.4	0	108.4	E375	K373-E375 PolarHBondContact O-N 3.22Å
374	F	25.4	Very low	27.7	Very low	215 Å²	215	144.5 Å²	144.5	94%	0.943	80%	0.799	S	S	*	*			trans	-67.8	115.2	171.7	-93.7	-99.6	0	0	0	109.9
375	E	28	Very low	27.7	Very low	188 Å²	188	145.1 Å²	145.1	88%	0.879	80%	0.803	S	S	*	*			trans	-134.2	124.9	151.5	-92.8	178	172.1	0	0	107.5	K373 E377	K373-E375 PolarHBondContact O-N 3.22Å; E375-E377 PolarHBondContact O-N 3.15Å
376	K	27.8	Very low	27.7	Very low	213 Å²	213	147.5 Å²	147.5	93%	0.926	81%	0.812	S	S	*	*			trans	-73.1	112.8	177.2	-81.4	176.1	170.5	179.1	0	108.4
377	E	29.7	Very low	27.8	Very low	186 Å²	186	144.5 Å²	144.5	87%	0.869	81%	0.814	S	S	*	*			trans	-100.5	122.6	162.4	-79	-174.8	158.5	0	0	110.4	E375	E375-E377 PolarHBondContact O-N 3.15Å
378	S	27.5	Very low	27.7	Very low	112 Å²	112	141.3 Å²	141.3	78%	0.783	81%	0.805	S	S	*	*			trans	-58.7	135.9	169.8	41.1	0	0	0	0	112.2
379	I	28.4	Very low	27.6	Very low	141 Å²	141	143 Å²	143	72%	0.723	82%	0.816	S	S	*	*			trans	-101.4	111.5	172.2	-61.8	175	0	0	0	108.9
380	E	25.9	Very low	27.5	Very low	161 Å²	161	143.6 Å²	143.6	75%	0.752	82%	0.82	S	S	*	*			trans	-80.7	136.1	163.4	-85.9	-176.9	149.9	0	0	110
381	V	27.4	Very low	27.6	Very low	92 Å²	92	143.3 Å²	143.3	56%	0.558	82%	0.818	S	S	*	*			trans	-106.4	117.8	171.6	-179.7	0	0	0	0	109
382	V	27.1	Very low	27.6	Very low	124 Å²	124	149.2 Å²	149.2	75%	0.752	83%	0.827	S	S	*	*			trans	-96.9	123.8	173.9	178.3	0	0	0	0	108.9
383	Y	28.7	Very low	27.8	Very low	163 Å²	163	149 Å²	149	64%	0.639	83%	0.825	S	S	*	*			trans	-78.6	120	173.3	-74.6	-82.2	0	0	0	110.9	E337	E337-Y383 PolarHBondContact OE1-OH 3.49Å
384	E	27.3	Very low	27.9	Very low	188 Å²	188	146.9 Å²	146.9	88%	0.879	82%	0.823	S	S	*	*			trans	-93.1	108.8	155.9	-82.5	-171.8	158.8	0	0	109.5	M386	E384-M386 PolarHBondContact O-N 3.07Å
385	N	28.7	Very low	27.9	Very low	164 Å²	164	143.3 Å²	143.3	88%	0.877	82%	0.819	S	S	*	*			trans	-59.5	122.8	170.6	-97.8	-31.1	0	0	0	110.9
386	M	29.9	Very low	28	Very low	192 Å²	192	140.1 Å²	140.1	95%	0.946	82%	0.815	S	S	*	*			trans	-118.2	107.3	155.6	-77.9	-154.9	-88.5	0	0	109.1	E384	E384-M386 PolarHBondContact O-N 3.07Å
387	G	27.8	Very low	27.9	Very low	76 Å²	76	135 Å²	135	78%	0.784	81%	0.805	S	S	*	*	S	Bend	trans	137.7	76.1	161.8	0	0	0	0	0	116.8
388	G	25.7	Very low	27.8	Very low	75 Å²	75	131.6 Å²	131.6	77%	0.773	80%	0.802	S	S	*	*			trans	40	103.7	141.1	0	0	0	0	0	120.9
389	C	27.4	Very low	28	Very low	142 Å²	142	132 Å²	132	96%	0.959	81%	0.805	S	S	*	*				-172.5	133.9	114.8	-104.7	0	0	0	0	109.7
390	A	26.4	Very low	27.9	Very low	112 Å²	112	128.5 Å²	128.5	93%	0.926	80%	0.803	S	S	*	*			trans	-69.9	137.3	-171.1	0	0	0	0	0	113.2
391	G	29.5	Very low	27.9	Very low	78 Å²	78	129 Å²	129	80%	0.804	81%	0.81	S	S	*	*			trans	178.7	107	169.9	0	0	0	0	0	111.1
392	Q	26.3	Very low	27.8	Very low	194 Å²	194	129.4 Å²	129.4	91%	0.907	82%	0.817	S	S	*	*			trans	-67.9	135.6	-175.5	-63.9	165.5	-14.1	0	0	112.5
393	S	30.4	Very low	27.6	Very low	107 Å²	107	130.3 Å²	130.3	75%	0.748	82%	0.823	S	S	*	*				165	123.6	120	49.3	0	0	0	0	114.1
394	N	31.1	Very low	27.5	Very low	162 Å²	162	126.9 Å²	126.9	87%	0.866	83%	0.828	S	S	*	*			trans	49.9	105.8	146.4	-60.5	-14.5	0	0	0	121.4
395	V	25.1	Very low	27.3	Very low	140 Å²	140	126.7 Å²	126.7	85%	0.848	83%	0.83	S	S	*	*			trans	-108	135.5	158.9	177	0	0	0	0	108.9
396	P	29.1	Very low	27	Very low	121 Å²	121	122.3 Å²	122.3	79%	0.786	82%	0.823	S	S	*	*			trans	-91.9	137.5	156.3	9.7	8.9	0	0	0	111.3
397	S	26.6	Very low	26.8	Very low	104 Å²	104	123 Å²	123	73%	0.727	82%	0.821	S	S	*	*			trans	-68.6	160.1	177	49.7	0	0	0	0	115.2
398	S	28	Very low	26.8	Very low	116 Å²	116	125.1 Å²	125.1	81%	0.811	82%	0.818	S	S	*	*			trans	70.7	113.7	155.4	69.4	0	0	0	0	120.1
399	S	30.7	Very low	27.3	Very low	121 Å²	121	126.8 Å²	126.8	85%	0.846	81%	0.806	S	S	*	*			trans	-164.1	116.6	137.1	57.9	0	0	0	0	109.9
400	G	26.9	Very low	27.6	Very low	66 Å²	66	125.9 Å²	125.9	68%	0.68	80%	0.796	S	S	*	*			trans	-67.5	155.2	-178.4	0	0	0	0	0	114.3	S402	G400-S402 PolarHBondContact O-N 3.06Å
401	L	25.5	Very low	27.9	Very low	171 Å²	171	127.4 Å²	127.4	90%	0.895	78%	0.784	S	S	*	*			trans	-69.8	114.9	173.3	-93.2	121.6	0	0	0	110.8
402	S	25.9	Very low	28.3	Very low	102 Å²	102	130.5 Å²	130.5	71%	0.713	78%	0.778	S	S	*	*			trans	-90.5	133.9	168.4	63.1	0	0	0	0	111.1	G400 A404	G400-S402 PolarHBondContact O-N 3.06Å; S402-A404 PolarHBondContact O-N 3.21Å
403	V	23	Very low	28.7	Very low	142 Å²	142	124.1 Å²	124.1	86%	0.861	75%	0.75	S	S	*	*			trans	-72.4	106	161.6	176.2	0	0	0	0	108
404	A	25.5	Very low	28.8	Very low	92 Å²	92	121.7 Å²	121.7	76%	0.76	74%	0.736	S	S	*	*			trans	-94.7	109.4	171.4	0	0	0	0	0	109.7	S402	S402-A404 PolarHBondContact O-N 3.21Å
405	M	22.9	Very low	29.2	Very low	183 Å²	183	120.3 Å²	120.3	90%	0.901	73%	0.725	S	S	*	*			trans	-91.2	118.1	158.7	-70.6	-174.6	81.5	0	0	108.5
406	G	23.5	Very low	30.1	Very low	72 Å²	72	116.8 Å²	116.8	74%	0.742	71%	0.706	S	S	*	*	S	Bend	trans	99.3	137.3	154	0	0	0	0	0	117.9
407	K	25.3	Very low	30.6	Very low	208 Å²	208	111.8 Å²	111.8	90%	0.904	68%	0.675	S	S	*	*			trans	85.4	61	160.8	-57.4	-173.6	176.5	-177.6	0	118.9
408	V	28.2	Very low	31.5	Very low	120 Å²	120	111.3 Å²	111.3	73%	0.727	66%	0.661	S	S	*	*			trans	-153.1	80.5	152.8	-167.8	0	0	0	0	111
409	E	35.5	Very low	32.4	Very low	109 Å²	109	109.5 Å²	109.5	51%	0.509	65%	0.645	S	S	.	*			trans	-140.2	1.3	170.8	-87.5	-167.1	153	0	0	115.2	N413	E409-N413 PolarHBondContact O-ND2 3.15Å
410	T	34.5	Very low	33.1	Very low	123 Å²	123	110 Å²	110	76%	0.755	63%	0.629	S	S	*	*	H	α-helix	trans	-83	-34.3	179.5	44.4	0	0	0	0	113.6	A414	T410-A414 VanDerWaalsContact O-CB 3.31Å; T410-A414 WeakPolarHBondContact O-CB 3.29Å; T410-A414 PolarHBondContact O-N 2.87Å
411	E	33.2	Very low	34	Very low	145 Å²	145	109.6 Å²	109.6	68%	0.678	61%	0.613	S	S	*	*	H	α-helix	trans	-82.2	-38.4	-172.9	-76.3	-179	158.2	0	0	114.8	A414 Q415	E411-A414 PolarHBondContact O-N 3.28Å; E411-Q415 WeakPolarHBondContact O-CG 3.47Å; E411-Q415 PolarHBondContact O-N 2.76Å
412	Q	36.6	Very low	35.1	Very low	142 Å²	142	105.3 Å²	105.3	66%	0.664	59%	0.592	S	S	*	*	H	α-helix	trans	-72.8	-33.4	178.3	-83	178.9	-14.8	0	0	112.7	S416	Q412-S416 PolarHBondContact O-N 3.21Å; Q412-S416 VanDerWaalsContact O-N 3.1Å; Q412-S416 PolarHBondContact O-OG 2.76Å
413	N	35.5	Very low	36.3	Very low	61 Å²	61	107.3 Å²	107.3	33%	0.326	59%	0.587	S	S	.	*	H	α-helix	trans	-68.3	-37.3	171.7	-75.1	-32.2	0	0	0	111.1	E409 S416 A417	E409-N413 PolarHBondContact O-ND2 3.15Å; N413-S416 PolarHBondContact O-N 3.3Å; N413-A417 VanDerWaalsContact O-CB 3.3Å; N413-A417 WeakPolarHBondContact O-CB 3.32Å; N413-A417 PolarHBondContact O-N 3.12Å
414	A	33	Very low	37.4	Very low	55 Å²	55	104.6 Å²	104.6	46%	0.455	56%	0.562	S	S	.	*	H	α-helix	trans	-65.7	-41.4	174.2	0	0	0	0	0	112.8	T410 E411 A417 Q418	T410-A414 VanDerWaalsContact O-CB 3.31Å; T410-A414 WeakPolarHBondContact O-CB 3.29Å; T410-A414 PolarHBondContact O-N 2.87Å; E411-A414 PolarHBondContact O-N 3.28Å; A414-A417 PolarHBondContact O-N 2.83Å; A414-Q418 WeakPolarHBondContact O-CB 3.38Å; A414-Q418 PolarHBondContact O-N 3.21Å
415	Q	39.3	Very low	38.4	Very low	134 Å²	134	105.9 Å²	105.9	63%	0.626	55%	0.55	S	S	*	*	H	α-helix	trans	-64.9	-42	176.3	-75	177.9	-1	0	0	112.1	E411 Q418 V419	E411-Q415 WeakPolarHBondContact O-CG 3.47Å; E411-Q415 PolarHBondContact O-N 2.76Å; Q415-Q418 PolarHBondContact O-N 3.4Å; Q415-V419 WeakPolarHBondContact O-CG2 3.5Å; Q415-V419 PolarHBondContact O-N 3.04Å; Q415-V419 VanDerWaalsContact O-N 3.12Å
416	S	43.4	Very low	39.6	Very low	66 Å²	66	101.6 Å²	101.6	46%	0.462	54%	0.537	S	S	.	.	H	α-helix	trans	-62.3	-46	175.2	-57.4	0	0	0	0	110.7	Q412 N413 Q418 V419 Y420	Q412-S416 PolarHBondContact O-N 3.21Å; Q412-S416 VanDerWaalsContact O-N 3.1Å; Q412-S416 PolarHBondContact O-OG 2.76Å; N413-S416 PolarHBondContact O-N 3.3Å; S416-Q418 PolarHBondContact O-N 3.5Å; S416-V419 PolarHBondContact O-N 2.97Å; S416-Y420 WeakPolarHBondContact O-CD2 3.42Å; S416-Y420 PolarHBondContact O-N 3.43Å
417	A	39.6	Very low	40.6	Very low	16 Å²	16	103.6 Å²	103.6	13%	0.132	53%	0.525	C	S	.	.	H	α-helix	trans	-59.7	-42.6	175.6	0	0	0	0	0	112.5	N413 A414 V419 Y420 V421 F454	N413-A417 VanDerWaalsContact O-CB 3.3Å; N413-A417 WeakPolarHBondContact O-CB 3.32Å; N413-A417 PolarHBondContact O-N 3.12Å; A414-A417 PolarHBondContact O-N 2.83Å; A417-V419 VanDerWaalsContact C-N 3.34Å; A417-V419 PolarHBondContact O-N 3.31Å; A417-Y420 WeakPolarHBondContact O-CB 3.39Å; A417-Y420 PolarHBondContact O-N 3.49Å; A417-Y420 VanDerWaalsContact O-N 3.12Å; A417-V421 WeakPolarHBondContact O-CG2 3.47Å; A417-V421 PolarHBondContact O-N 3.06Å; A417-F454 HydrophobicContact CB-CE1 3.63Å; A417-F454 HydrophobicContact CB-CE2 4.19Å; A417-F454 HydrophobicContact CB-CZ 3.34Å
418	Q	45.5	Very low	41.3	Very low	94 Å²	94	95.5 Å²	95.5	44%	0.439	50%	0.495	S	S	.	.	H	α-helix	trans	-63	-39.4	179.4	-169.1	61.4	48.7	0	0	111.8	A414 Q415 S416 Y420 V421 D422	A414-Q418 WeakPolarHBondContact O-CB 3.38Å; A414-Q418 PolarHBondContact O-N 3.21Å; Q415-Q418 PolarHBondContact O-N 3.4Å; S416-Q418 PolarHBondContact O-N 3.5Å; Q418-Y420 VanDerWaalsContact C-N 3.29Å; Q418-Y420 PolarHBondContact O-N 3.02Å; Q418-V421 PolarHBondContact O-N 2.99Å; Q418-D422 PolarHBondContact NE2-OD1 2.73Å; Q418-D422 WeakPolarHBondContact O-CB 3.41Å; Q418-D422 VanDerWaalsContact O-CG 3.23Å; Q418-D422 PolarHBondContact O-N 2.74Å
419	V	47.7	Very low	42.2	Very low	77 Å²	77	95.1 Å²	95.1	47%	0.467	49%	0.489	S	S	.	.	H	α-helix	trans	-61.4	-38.1	174.3	172.4	0	0	0	0	111.6	Q415 S416 A417 K423	Q415-V419 WeakPolarHBondContact O-CG2 3.5Å; Q415-V419 PolarHBondContact O-N 3.04Å; Q415-V419 VanDerWaalsContact O-N 3.12Å; S416-V419 PolarHBondContact O-N 2.97Å; A417-V419 VanDerWaalsContact C-N 3.34Å; A417-V419 PolarHBondContact O-N 3.31Å; V419-K423 HydrophobicContact CG1-CD 4.39Å; V419-K423 WeakPolarHBondContact O-CB 3.49Å; V419-K423 WeakPolarHBondContact O-CG 3.43Å; V419-K423 PolarHBondContact O-N 3.06Å; V419-K423 VanDerWaalsContact O-N 3.08Å
420	Y	45.5	Very low	42.7	Very low	132 Å²	132	94 Å²	94	52%	0.518	49%	0.493	S	S	.	.	H	α-helix	trans	-68.5	-43.4	174.3	-75.3	-76.1	0	0	0	111.8	S416 A417 Q418 D422 K423 W424	S416-Y420 WeakPolarHBondContact O-CD2 3.42Å; S416-Y420 PolarHBondContact O-N 3.43Å; A417-Y420 WeakPolarHBondContact O-CB 3.39Å; A417-Y420 PolarHBondContact O-N 3.49Å; A417-Y420 VanDerWaalsContact O-N 3.12Å; Q418-Y420 VanDerWaalsContact C-N 3.29Å; Q418-Y420 PolarHBondContact O-N 3.02Å; Y420-D422 PolarHBondContact O-N 3.18Å; Y420-K423 PolarHBondContact O-N 3.02Å; Y420-W424 WeakPolarHBondContact O-CB 3.3Å; Y420-W424 PolarHBondContact O-N 3.14Å
421	V	44.8	Very low	43	Very low	57 Å²	57	91.6 Å²	91.6	35%	0.345	48%	0.475	S	S	.	.	H	α-helix	trans	-60.1	-44.3	175.9	171.1	0	0	0	0	111.1	A417 Q418 W424 K425	A417-V421 WeakPolarHBondContact O-CG2 3.47Å; A417-V421 PolarHBondContact O-N 3.06Å; Q418-V421 PolarHBondContact O-N 2.99Å; V421-W424 PolarHBondContact O-N 3.41Å; V421-K425 HydrophobicContact CG1-CD 4.17Å; V421-K425 HydrophobicContact CG1-CG 4.39Å; V421-K425 WeakPolarHBondContact O-CB 3.28Å; V421-K425 WeakPolarHBondContact O-CG 3.5Å; V421-K425 PolarHBondContact O-N 3.13Å
422	D	49.5	Very low	43.4	Very low	82 Å²	82	89.8 Å²	89.8	44%	0.439	47%	0.47	S	S	.	.	H	α-helix	trans	-70.6	-40.8	-178.1	-67.8	-18.5	0	0	0	112	Q418 Y420 W424 K425 C426	Q418-D422 PolarHBondContact NE2-OD1 2.73Å; Q418-D422 WeakPolarHBondContact O-CB 3.41Å; Q418-D422 VanDerWaalsContact O-CG 3.23Å; Q418-D422 PolarHBondContact O-N 2.74Å; Y420-D422 PolarHBondContact O-N 3.18Å; D422-W424 VanDerWaalsContact C-N 3.28Å; D422-W424 PolarHBondContact O-N 3.21Å; D422-K425 PolarHBondContact O-N 3.28Å; D422-C426 WeakPolarHBondContact O-CB 3.31Å; D422-C426 PolarHBondContact O-N 2.77Å; D422-C426 VanDerWaalsContact O-N 3.09Å
423	K	50.4	Low	43.6	Very low	144 Å²	144	87.3 Å²	87.3	63%	0.626	47%	0.474	S	S	*	.	H	α-helix	trans	-59.9	-39.5	172.4	-81.1	-180	179.1	176	0	111.5	V419 Y420 K427	V419-K423 HydrophobicContact CG1-CD 4.39Å; V419-K423 WeakPolarHBondContact O-CB 3.49Å; V419-K423 WeakPolarHBondContact O-CG 3.43Å; V419-K423 PolarHBondContact O-N 3.06Å; V419-K423 VanDerWaalsContact O-N 3.08Å; Y420-K423 PolarHBondContact O-N 3.02Å; K423-K427 PolarHBondContact O-N 3.38Å
424	W	45.8	Very low	43.7	Very low	85 Å²	85	92.2 Å²	92.2	32%	0.322	49%	0.492	S	S	.	.	H	α-helix	trans	-81.7	-31	-179.4	-92.8	98.5	0	0	0	114.1	L73 Y420 V421 D422 C426 K427 S428	L73-W424 HydrophobicContact CD1-CH2 4.03Å; L73-W424 HydrophobicContact CD2-CH2 4.13Å; L73-W424 HydrophobicContact CD2-CZ2 4.19Å; L73-W424 HydrophobicContact CG-CH2 4.2Å; L73-W424 HydrophobicContact CG-CZ2 4.46Å; Y420-W424 WeakPolarHBondContact O-CB 3.3Å; Y420-W424 PolarHBondContact O-N 3.14Å; V421-W424 PolarHBondContact O-N 3.41Å; D422-W424 VanDerWaalsContact C-N 3.28Å; D422-W424 PolarHBondContact O-N 3.21Å; W424-C426 VanDerWaalsContact C-N 3.33Å; W424-K427 HydrophobicContact CE3-CB 4.31Å; W424-K427 HydrophobicContact CE3-CD 4.48Å; W424-K427 HydrophobicContact CH2-CD 4.45Å; W424-K427 HydrophobicContact CZ3-CD 4.34Å; W424-K427 CarbonylContact O-C 3.54Å; W424-K427 PolarHBondContact O-N 3.1Å; W424-S428 VanDerWaalsContact O-CB 3.31Å; W424-S428 WeakPolarHBondContact O-CB 3.44Å; W424-S428 PolarHBondContact O-N 2.73Å
425	K	46.6	Very low	43.9	Very low	119 Å²	119	97.7 Å²	97.7	52%	0.517	51%	0.514	S	S	.	.	H	α-helix	trans	-57.4	-48.3	166.9	-82	179.6	178.1	176.6	0	110.6	V421 D422 K427 S428 D429	V421-K425 HydrophobicContact CG1-CD 4.17Å; V421-K425 HydrophobicContact CG1-CG 4.39Å; V421-K425 WeakPolarHBondContact O-CB 3.28Å; V421-K425 WeakPolarHBondContact O-CG 3.5Å; V421-K425 PolarHBondContact O-N 3.13Å; D422-K425 PolarHBondContact O-N 3.28Å; K425-K427 VanDerWaalsContact C-N 3.28Å; K425-K427 PolarHBondContact O-N 3.31Å; K425-S428 PolarHBondContact O-N 3.05Å; K425-S428 VanDerWaalsContact O-N 3.15Å; K425-D429 WeakPolarHBondContact O-CB 3.35Å; K425-D429 PolarHBondContact O-N 2.97Å
426	C	47.9	Very low	43.8	Very low	92 Å²	92	97.1 Å²	97.1	62%	0.622	52%	0.515	S	S	*	.	H	α-helix	trans	-58.8	-38.5	176.3	-169.6	0	0	0	0	112.4	D422 W424 S430	D422-C426 WeakPolarHBondContact O-CB 3.31Å; D422-C426 PolarHBondContact O-N 2.77Å; D422-C426 VanDerWaalsContact O-N 3.09Å; W424-C426 VanDerWaalsContact C-N 3.33Å; C426-S430 PolarHBondContact O-N 2.61Å
427	K	44.3	Very low	43.7	Very low	114 Å²	114	100.3 Å²	100.3	50%	0.496	53%	0.533	S	S	.	.	H	α-helix	trans	-73	-38.5	176.1	-157	167.2	-177.4	-175.1	0	112.4	K423 W424 K425 S430 I431	K423-K427 PolarHBondContact O-N 3.38Å; W424-K427 HydrophobicContact CE3-CB 4.31Å; W424-K427 HydrophobicContact CE3-CD 4.48Å; W424-K427 HydrophobicContact CH2-CD 4.45Å; W424-K427 HydrophobicContact CZ3-CD 4.34Å; W424-K427 CarbonylContact O-C 3.54Å; W424-K427 PolarHBondContact O-N 3.1Å; K425-K427 VanDerWaalsContact C-N 3.28Å; K425-K427 PolarHBondContact O-N 3.31Å; K427-S430 PolarHBondContact O-N 3.22Å; K427-S430 PolarHBondContact O-OG 3.31Å; K427-I431 HydrophobicContact CG-CD1 4.36Å; K427-I431 WeakPolarHBondContact O-CD1 3.09Å; K427-I431 VanDerWaalsContact O-CG1 3.24Å; K427-I431 WeakPolarHBondContact O-CG1 3.49Å; K427-I431 PolarHBondContact O-N 3.49Å
428	S	41	Very low	43.7	Very low	39 Å²	39	101.9 Å²	101.9	27%	0.273	55%	0.551	S	S	.	*	H	α-helix	trans	-65.3	-43.9	175.6	-170.9	0	0	0	0	111.6	W424 K425 S430 I431 N432	W424-S428 VanDerWaalsContact O-CB 3.31Å; W424-S428 WeakPolarHBondContact O-CB 3.44Å; W424-S428 PolarHBondContact O-N 2.73Å; K425-S428 PolarHBondContact O-N 3.05Å; K425-S428 VanDerWaalsContact O-N 3.15Å; S428-S430 VanDerWaalsContact C-N 3.26Å; S428-S430 PolarHBondContact O-N 3.23Å; S428-I431 CarbonylContact O-C 3.55Å; S428-I431 WeakPolarHBondContact O-CA 3.34Å; S428-I431 WeakPolarHBondContact O-CB 3.49Å; S428-I431 PolarHBondContact O-N 3.39Å; S428-N432 PolarHBondContact O-N 3.43Å
429	D	46.3	Very low	43.6	Very low	112 Å²	112	100.7 Å²	100.7	60%	0.599	55%	0.545	S	S	*	.	H	α-helix	trans	-61.8	-35.5	175.9	-67.9	-24.8	0	0	0	111.5	K425 I431 N432	K425-D429 WeakPolarHBondContact O-CB 3.35Å; K425-D429 PolarHBondContact O-N 2.97Å; D429-I431 PolarHBondContact O-N 3.1Å; D429-N432 PolarHBondContact O-N 3.37Å
430	S	46	Very low	43.2	Very low	85 Å²	85	104.6 Å²	104.6	59%	0.594	56%	0.555	S	S	*	*	H	α-helix	trans	-68.6	-22.2	173	81.3	0	0	0	0	113.7	C426 K427 S428	C426-S430 PolarHBondContact O-N 2.61Å; K427-S430 PolarHBondContact O-N 3.22Å; K427-S430 PolarHBondContact O-OG 3.31Å; S428-S430 VanDerWaalsContact C-N 3.26Å; S428-S430 PolarHBondContact O-N 3.23Å
431	I	41.1	Very low	43.2	Very low	72 Å²	72	101.9 Å²	101.9	37%	0.369	55%	0.55	S	S	.	.	H	α-helix	trans	-92.8	-19.6	-178.4	-69.7	167.3	0	0	0	111.5	K427 S428 D429 A433 K439	K427-I431 HydrophobicContact CG-CD1 4.36Å; K427-I431 WeakPolarHBondContact O-CD1 3.09Å; K427-I431 VanDerWaalsContact O-CG1 3.24Å; K427-I431 WeakPolarHBondContact O-CG1 3.49Å; K427-I431 PolarHBondContact O-N 3.49Å; S428-I431 CarbonylContact O-C 3.55Å; S428-I431 WeakPolarHBondContact O-CA 3.34Å; S428-I431 WeakPolarHBondContact O-CB 3.49Å; S428-I431 PolarHBondContact O-N 3.39Å; D429-I431 PolarHBondContact O-N 3.1Å; I431-A433 PolarHBondContact O-N 3.5Å; I431-K439 HydrophobicContact CG2-CD 3.82Å; I431-K439 PolarHBondContact O-NZ 2.94Å
432	N	40.9	Very low	43.4	Very low	107 Å²	107	101.8 Å²	101.8	57%	0.572	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.8	-0.6	180	-88	-25.8	0	0	0	115.2	S428 D429 K434	S428-N432 PolarHBondContact O-N 3.43Å; D429-N432 PolarHBondContact O-N 3.37Å; N432-K434 VanDerWaalsContact C-N 3.29Å; N432-K434 PolarHBondContact O-N 3.2Å
433	A	40.6	Very low	43.3	Very low	91 Å²	91	103.1 Å²	103.1	75%	0.752	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.3	8.7	177.6	0	0	0	0	0	115.2	I431	I431-A433 PolarHBondContact O-N 3.5Å
434	K	38	Very low	43.3	Very low	163 Å²	163	102.3 Å²	102.3	71%	0.709	55%	0.547	S	S	*	.	S	Bend	trans	-139	107.9	178	-67	-174.1	-179.4	-179.3	0	111.2	N432 L436	N432-K434 VanDerWaalsContact C-N 3.29Å; N432-K434 PolarHBondContact O-N 3.2Å; K434-L436 PolarHBondContact O-N 3.49Å; K434-L436 VanDerWaalsContact O-N 3.1Å
435	N	37	Very low	43.6	Very low	170 Å²	170	99.5 Å²	99.5	91%	0.909	54%	0.541	S	S	*	.			trans	-44.2	105	174.1	-74.1	-26.4	0	0	0	112.1
436	L	37.2	Very low	43.9	Very low	123 Å²	123	97.5 Å²	97.5	64%	0.644	53%	0.53	S	S	*	.			trans	-152.3	121.2	167.3	-95.8	128.9	0	0	0	110.5	K434 G438	K434-L436 PolarHBondContact O-N 3.49Å; K434-L436 VanDerWaalsContact O-N 3.1Å; L436-G438 VanDerWaalsContact C-N 3.26Å; L436-G438 PolarHBondContact O-N 2.82Å; L436-G438 VanDerWaalsContact O-N 3.15Å
437	P	41.7	Very low	44.2	Very low	132 Å²	132	96.8 Å²	96.8	86%	0.857	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-10.6	-172	-18.9	30.8	0	0	0	116.6
438	G	39.8	Very low	44.5	Very low	49 Å²	49	95.2 Å²	95.2	51%	0.505	52%	0.516	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.2	-10.3	-175.8	0	0	0	0	0	115.9	L436 F440	L436-G438 VanDerWaalsContact C-N 3.26Å; L436-G438 PolarHBondContact O-N 2.82Å; L436-G438 VanDerWaalsContact O-N 3.15Å; G438-F440 PolarHBondContact O-N 3.45Å
439	K	42.8	Very low	45	Very low	70 Å²	70	96 Å²	96	30%	0.304	52%	0.52	S	S	.	.	H	α-helix	trans	-76.5	-20.8	-174.6	-76.2	176.5	176.8	166.9	0	114.6	I431 L441 F443	I431-K439 HydrophobicContact CG2-CD 3.82Å; I431-K439 PolarHBondContact O-NZ 2.94Å; K439-L441 VanDerWaalsContact C-N 3.31Å; K439-L441 PolarHBondContact O-N 2.99Å; K439-F443 PolarHBondContact O-N 3.32Å
440	F	41.1	Very low	45.2	Very low	158 Å²	158	92.3 Å²	92.3	69%	0.693	50%	0.501	S	S	*	.	H	α-helix	trans	-66.5	-35.7	177.7	-131	-91.7	0	0	0	111.7	G438 F443 E444	G438-F440 PolarHBondContact O-N 3.45Å; F440-F443 PolarHBondContact O-N 3.33Å; F440-E444 PolarHBondContact O-N 2.66Å; F440-E444 VanDerWaalsContact O-N 3.15Å
441	L	45.1	Very low	45.2	Very low	76 Å²	76	91.5 Å²	91.5	40%	0.398	49%	0.493	S	S	.	.	H	α-helix	trans	-67.1	-45	178.3	-136.1	80.5	0	0	0	111.8	L56 V60 K439 F443 E444 C445	L56-L441 HydrophobicContact CD2-CD1 4.31Å; L56-L441 HydrophobicContact CD2-CD2 3.76Å; L56-L441 HydrophobicContact CD2-CG 4.31Å; V60-L441 HydrophobicContact CG2-CD2 4.11Å; K439-L441 VanDerWaalsContact C-N 3.31Å; K439-L441 PolarHBondContact O-N 2.99Å; L441-F443 VanDerWaalsContact C-N 3.27Å; L441-F443 PolarHBondContact O-N 3.37Å; L441-E444 PolarHBondContact O-N 3.29Å; L441-C445 PolarHBondContact O-N 3.41Å; L441-C445 PolarHBondContact O-SG 2.91Å
442	L	49	Very low	45.4	Very low	55 Å²	55	90 Å²	90	29%	0.288	49%	0.487	S	S	.	.	H	α-helix	trans	-60.2	-37.2	176.3	-86.6	154.5	0	0	0	112.5	L70 Y446	L70-L442 HydrophobicContact CD1-CD2 4.1Å; L70-L442 HydrophobicContact CD2-CD2 3.51Å; L70-L442 HydrophobicContact CG-CD2 3.64Å; L442-Y446 VanDerWaalsContact O-CB 3.3Å; L442-Y446 WeakPolarHBondContact O-CB 3.43Å; L442-Y446 PolarHBondContact O-N 3.41Å
443	F	46.8	Very low	45.5	Very low	110 Å²	110	88.2 Å²	88.2	48%	0.482	47%	0.474	S	S	.	.	H	α-helix	trans	-65.7	-44.9	175.7	-178	-103.3	0	0	0	111.8	K439 F440 L441 Y446 L447	K439-F443 PolarHBondContact O-N 3.32Å; F440-F443 PolarHBondContact O-N 3.33Å; L441-F443 VanDerWaalsContact C-N 3.27Å; L441-F443 PolarHBondContact O-N 3.37Å; F443-Y446 PolarHBondContact O-N 3.24Å; F443-L447 HydrophobicContact CD1-CD1 3.77Å; F443-L447 HydrophobicContact CD2-CD1 4.27Å; F443-L447 HydrophobicContact CE1-CD1 3.22Å; F443-L447 HydrophobicContact CE2-CD1 3.77Å; F443-L447 HydrophobicContact CG-CD1 4.28Å; F443-L447 HydrophobicContact CZ-CD1 3.22Å; F443-L447 WeakPolarHBondContact O-CB 3.22Å; F443-L447 PolarHBondContact O-N 2.91Å
444	E	51.1	Low	45.7	Very low	126 Å²	126	88.1 Å²	88.1	59%	0.589	46%	0.457	S	S	*	.	H	α-helix	trans	-67.8	-41.7	176.7	-69.1	-148	165.7	0	0	112.7	F440 L441 Y446 L447 L448	F440-E444 PolarHBondContact O-N 2.66Å; F440-E444 VanDerWaalsContact O-N 3.15Å; L441-E444 PolarHBondContact O-N 3.29Å; E444-Y446 VanDerWaalsContact C-N 3.32Å; E444-Y446 PolarHBondContact O-N 2.96Å; E444-L447 PolarHBondContact O-N 2.86Å; E444-L448 WeakPolarHBondContact O-CB 3.45Å; E444-L448 PolarHBondContact O-N 2.94Å
445	C	51.9	Low	45.7	Very low	27 Å²	27	85.2 Å²	85.2	18%	0.182	46%	0.456	C	S	.	.	H	α-helix	trans	-59.3	-44.8	175.5	-62.3	0	0	0	0	111.2	F53 L441 L448 V449	F53-C445 HydrophobicContact CE1-CB 4.02Å; F53-C445 WeakPolarHBondContact CE1-SG 3.46Å; F53-C445 HydrophobicContact CZ-CB 4.26Å; L441-C445 PolarHBondContact O-N 3.41Å; L441-C445 PolarHBondContact O-SG 2.91Å; C445-L448 PolarHBondContact O-N 2.89Å; C445-V449 VanDerWaalsContact O-CG2 3.29Å; C445-V449 WeakPolarHBondContact O-CG2 3.18Å; C445-V449 PolarHBondContact O-N 3.15Å
446	Y	52.7	Low	45.8	Very low	77 Å²	77	85.4 Å²	85.4	30%	0.302	45%	0.449	S	S	.	.	H	α-helix	trans	-65.3	-45.2	176.5	179.3	-99.4	0	0	0	111.9	L73 L442 F443 E444 L448 V449 V450	L73-Y446 HydrophobicContact CD2-CD2 3.89Å; L73-Y446 HydrophobicContact CD2-CE2 3.97Å; L442-Y446 VanDerWaalsContact O-CB 3.3Å; L442-Y446 WeakPolarHBondContact O-CB 3.43Å; L442-Y446 PolarHBondContact O-N 3.41Å; F443-Y446 PolarHBondContact O-N 3.24Å; E444-Y446 VanDerWaalsContact C-N 3.32Å; E444-Y446 PolarHBondContact O-N 2.96Å; Y446-L448 VanDerWaalsContact C-N 3.27Å; Y446-L448 PolarHBondContact O-N 3.49Å; Y446-V449 PolarHBondContact O-N 3.36Å; Y446-V450 HydrophobicContact CD1-CG2 4.05Å; Y446-V450 HydrophobicContact CD2-CG2 4.12Å; Y446-V450 HydrophobicContact CE1-CG2 3.68Å; Y446-V450 HydrophobicContact CE2-CG2 3.76Å; Y446-V450 HydrophobicContact CG-CG2 4.26Å; Y446-V450 VanDerWaalsContact O-CB 3.31Å; Y446-V450 WeakPolarHBondContact O-CB 3.44Å; Y446-V450 VanDerWaalsContact O-CG2 3.22Å; Y446-V450 WeakPolarHBondContact O-CG2 3.41Å; Y446-V450 PolarHBondContact O-N 2.82Å
447	L	54.8	Low	45.6	Very low	77 Å²	77	88.5 Å²	88.5	40%	0.403	45%	0.452	S	S	.	.	H	α-helix	trans	-60.7	-38.7	176	-116.7	128	0	0	0	111.4	F443 E444 T451	F443-L447 HydrophobicContact CD1-CD1 3.77Å; F443-L447 HydrophobicContact CD2-CD1 4.27Å; F443-L447 HydrophobicContact CE1-CD1 3.22Å; F443-L447 HydrophobicContact CE2-CD1 3.77Å; F443-L447 HydrophobicContact CG-CD1 4.28Å; F443-L447 HydrophobicContact CZ-CD1 3.22Å; F443-L447 WeakPolarHBondContact O-CB 3.22Å; F443-L447 PolarHBondContact O-N 2.91Å; E444-L447 PolarHBondContact O-N 2.86Å; L447-T451 WeakPolarHBondContact O-CA 3.38Å; L447-T451 WeakPolarHBondContact O-CB 3.24Å; L447-T451 PolarHBondContact O-N 2.88Å; L447-T451 PolarHBondContact O-OG1 2.81Å
448	L	50.6	Low	45.8	Very low	80 Å²	80	86.4 Å²	86.4	42%	0.419	43%	0.432	S	S	.	.	H	α-helix	trans	-68.7	-44.1	178.7	-145.5	91.2	0	0	0	111.4	F53 E444 C445 Y446 T451 T452	F53-L448 HydrophobicContact CE2-CD2 3.56Å; F53-L448 HydrophobicContact CZ-CD2 4.15Å; E444-L448 WeakPolarHBondContact O-CB 3.45Å; E444-L448 PolarHBondContact O-N 2.94Å; C445-L448 PolarHBondContact O-N 2.89Å; Y446-L448 VanDerWaalsContact C-N 3.27Å; Y446-L448 PolarHBondContact O-N 3.49Å; L448-T451 PolarHBondContact O-N 3.27Å; L448-T452 WeakPolarHBondContact O-CB 3.41Å; L448-T452 PolarHBondContact O-N 2.69Å; L448-T452 PolarHBondContact O-OG1 3.37Å
449	V	51.2	Low	46.1	Very low	57 Å²	57	88.3 Å²	88.3	35%	0.345	43%	0.428	S	S	.	.	H	α-helix	trans	-61.4	-48.4	175.8	170.9	0	0	0	0	110.3	M77 C445 Y446 F453	M77-V449 HydrophobicContact CE-CG1 4Å; M77-V449 HydrophobicContact SD-CG1 3.83Å; C445-V449 VanDerWaalsContact O-CG2 3.29Å; C445-V449 WeakPolarHBondContact O-CG2 3.18Å; C445-V449 PolarHBondContact O-N 3.15Å; Y446-V449 PolarHBondContact O-N 3.36Å; V449-F453 WeakPolarHBondContact O-CB 3.26Å; V449-F453 PolarHBondContact O-N 2.93Å
450	V	50.3	Low	46.3	Very low	33 Å²	33	89.3 Å²	89.3	20%	0.2	44%	0.435	C	S	.	.	H	α-helix	trans	-65	-44.9	179.1	172.4	0	0	0	0	111.4	Y446 F453 F454	Y446-V450 HydrophobicContact CD1-CG2 4.05Å; Y446-V450 HydrophobicContact CD2-CG2 4.12Å; Y446-V450 HydrophobicContact CE1-CG2 3.68Å; Y446-V450 HydrophobicContact CE2-CG2 3.76Å; Y446-V450 HydrophobicContact CG-CG2 4.26Å; Y446-V450 VanDerWaalsContact O-CB 3.31Å; Y446-V450 WeakPolarHBondContact O-CB 3.44Å; Y446-V450 VanDerWaalsContact O-CG2 3.22Å; Y446-V450 WeakPolarHBondContact O-CG2 3.41Å; Y446-V450 PolarHBondContact O-N 2.82Å; V450-F453 PolarHBondContact O-N 3.38Å; V450-F454 HydrophobicContact CG1-CD2 3.63Å; V450-F454 HydrophobicContact CG1-CE2 3.78Å; V450-F454 VanDerWaalsContact O-CD2 3.25Å; V450-F454 WeakPolarHBondContact O-CD2 3.14Å; V450-F454 PolarHBondContact O-N 2.89Å
451	T	45.7	Very low	46.6	Very low	69 Å²	69	85.3 Å²	85.3	42%	0.423	42%	0.42	S	S	.	.	H	α-helix	trans	-69.8	-42.4	-178.3	-52.3	0	0	0	0	111.3	L447 L448 F453 F454 C455	L447-T451 WeakPolarHBondContact O-CA 3.38Å; L447-T451 WeakPolarHBondContact O-CB 3.24Å; L447-T451 PolarHBondContact O-N 2.88Å; L447-T451 PolarHBondContact O-OG1 2.81Å; L448-T451 PolarHBondContact O-N 3.27Å; T451-F453 VanDerWaalsContact C-N 3.29Å; T451-F453 PolarHBondContact O-N 3.34Å; T451-F454 PolarHBondContact O-N 3.1Å; T451-C455 VanDerWaalsContact O-CB 3.28Å; T451-C455 WeakPolarHBondContact O-CB 3.12Å; T451-C455 PolarHBondContact O-N 2.92Å; T451-C455 PolarHBondContact O-SG 3.38Å
452	T	45.2	Very low	46.7	Very low	41 Å²	41	85.9 Å²	85.9	25%	0.252	42%	0.421	S	S	.	.	H	α-helix	trans	-61	-43.5	174.9	-53.7	0	0	0	0	109.9	L448 C455 F456	L448-T452 WeakPolarHBondContact O-CB 3.41Å; L448-T452 PolarHBondContact O-N 2.69Å; L448-T452 PolarHBondContact O-OG1 3.37Å; T452-C455 PolarHBondContact O-N 3.14Å; T452-F456 HydrophobicContact CG2-CD2 3.84Å; T452-F456 HydrophobicContact CG2-CE2 3.97Å; T452-F456 WeakPolarHBondContact O-CB 3.46Å; T452-F456 WeakPolarHBondContact O-CD2 3.43Å; T452-F456 PolarHBondContact O-N 2.94Å
453	F	43.4	Very low	46.5	Very low	69 Å²	69	87.9 Å²	87.9	30%	0.303	43%	0.43	S	S	.	.	H	α-helix	trans	-65.6	-39	178.4	179	-97.5	0	0	0	113.9	M81 F83 V449 V450 T451	M81-F453 HydrophobicContact CE-CE2 4.43Å; M81-F453 HydrophobicContact CG-CZ 4.49Å; M81-F453 HydrophobicContact SD-CD2 4.1Å; M81-F453 HydrophobicContact SD-CE2 3.24Å; M81-F453 WeakPolarHBondContact SD-CE2 3.36Å; M81-F453 HydrophobicContact SD-CZ 3.48Å; M81-F453 WeakPolarHBondContact SD-CZ 3.25Å; F83-F453 HydrophobicContact CD2-CE2 4.47Å; F83-F453 AromaticContact CE2-CE2 3.48Å; F83-F453 HydrophobicContact CE2-CE2 3.48Å; F83-F453 VanDerWaalsContact CE2-CE2 3.48Å; F83-F453 AromaticContact CE2-CZ 3.36Å; F83-F453 HydrophobicContact CE2-CZ 3.36Å; F83-F453 AromaticContact CZ-CE2 3.94Å; F83-F453 HydrophobicContact CZ-CE2 3.94Å; F83-F453 AromaticContact CZ-CZ 3.48Å; F83-F453 HydrophobicContact CZ-CZ 3.48Å; F83-F453 VanDerWaalsContact CZ-CZ 3.48Å; V449-F453 WeakPolarHBondContact O-CB 3.26Å; V449-F453 PolarHBondContact O-N 2.93Å; V450-F453 PolarHBondContact O-N 3.38Å; T451-F453 VanDerWaalsContact C-N 3.29Å; T451-F453 PolarHBondContact O-N 3.34Å
454	F	44.4	Very low	46.5	Very low	88 Å²	88	86.4 Å²	86.4	39%	0.386	43%	0.426	S	S	.	.	H	α-helix	trans	-76.1	-25.9	174.3	-86.3	-74.5	0	0	0	113.5	A417 V450 T451	A417-F454 HydrophobicContact CB-CE1 3.63Å; A417-F454 HydrophobicContact CB-CE2 4.19Å; A417-F454 HydrophobicContact CB-CZ 3.34Å; V450-F454 HydrophobicContact CG1-CD2 3.63Å; V450-F454 HydrophobicContact CG1-CE2 3.78Å; V450-F454 VanDerWaalsContact O-CD2 3.25Å; V450-F454 WeakPolarHBondContact O-CD2 3.14Å; V450-F454 PolarHBondContact O-N 2.89Å; T451-F454 PolarHBondContact O-N 3.1Å
455	C	38.6	Very low	46.2	Very low	102 Å²	102	83.3 Å²	83.3	69%	0.689	41%	0.414	S	S	*	.	H	α-helix	trans	-79.3	-24.1	174.9	-75.2	0	0	0	0	113.4	T451 T452	T451-C455 VanDerWaalsContact O-CB 3.28Å; T451-C455 WeakPolarHBondContact O-CB 3.12Å; T451-C455 PolarHBondContact O-N 2.92Å; T451-C455 PolarHBondContact O-SG 3.38Å; T452-C455 PolarHBondContact O-N 3.14Å
456	F	39	Very low	45.7	Very low	175 Å²	175	88 Å²	88	77%	0.768	43%	0.433	S	S	*	.			trans	-83.9	-9.6	176.7	-99.1	-86.2	0	0	0	114.2	T452	T452-F456 HydrophobicContact CG2-CD2 3.84Å; T452-F456 HydrophobicContact CG2-CE2 3.97Å; T452-F456 WeakPolarHBondContact O-CB 3.46Å; T452-F456 WeakPolarHBondContact O-CD2 3.43Å; T452-F456 PolarHBondContact O-N 2.94Å
457	R	32.4	Very low	45	Very low	188 Å²	188	89 Å²	89	71%	0.709	45%	0.445	S	S	*	.			trans	-103	0	179.4	-157.2	-177.3	-174.4	177.8	1.8	110.4

Retrieved 457 of 457 residues in 376.7 ms (Link to these results)

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