A0A096MVD1_PAPAN Loading...

Gamma-aminobutyric acid type A receptor subunit gamma2

AlphaFold DB (A0A1W2PQR9), UniProt , Accession A0A096MVD1, Species PAPAN (Papio anubis, Olive baboon), Gene GABRG2, Length 446 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	34.5	Very low	32.4	Very low	244 Å²	244	152.2 Å²	152.2	100%	1.202	85%	0.854	S	S	*	*				0	93.5	0	-85.6	167.1	163.6	0	0	106.3
2	D	40.4	Very low	32	Very low	161 Å²	161	153.9 Å²	153.9	86%	0.861	85%	0.846	S	S	*	*			trans	-75.8	154.8	147.8	-86.1	-31.5	0	0	0	107
3	P	46.6	Very low	31.6	Very low	130 Å²	130	151 Å²	151	84%	0.844	84%	0.843	S	S	*	*			cis	-140.9	-176.2	48	33.2	-9.6	0	0	0	112.7
4	G	32.2	Very low	31.5	Very low	68 Å²	68	148.4 Å²	148.4	70%	0.701	83%	0.827	S	S	*	*			cis	173.3	172.1	5.9	0	0	0	0	0	109.4
5	E	32.4	Very low	31.5	Very low	189 Å²	189	148.5 Å²	148.5	88%	0.883	83%	0.825	S	S	*	*			trans	49.4	124.9	159.1	-73.4	-178.5	144.2	0	0	121.6
6	N	30.4	Very low	31.5	Very low	169 Å²	169	148.8 Å²	148.8	90%	0.904	83%	0.825	S	S	*	*				-156.1	125.1	128.6	-98.3	-31.6	0	0	0	111.9
7	A	30.1	Very low	31.5	Very low	89 Å²	89	153.1 Å²	153.1	74%	0.736	83%	0.827	S	S	*	*			trans	-77	147.1	169.1	0	0	0	0	0	110.9
8	F	28.3	Very low	31.6	Very low	206 Å²	206	155.2 Å²	155.2	90%	0.904	83%	0.831	S	S	*	*			trans	-150.1	109.8	156.1	-128.5	-89.5	0	0	0	110.5
9	T	25.8	Very low	31.5	Very low	136 Å²	136	155.5 Å²	155.5	83%	0.834	83%	0.832	S	S	*	*			trans	-82.5	133.7	164.3	38.4	0	0	0	0	109.7
10	S	26.9	Very low	31.6	Very low	91 Å²	91	158.8 Å²	158.8	64%	0.636	83%	0.834	S	S	*	*			trans	-157.3	122.9	148.6	-164.1	0	0	0	0	113
11	Q	28.4	Very low	31.8	Very low	191 Å²	191	155.6 Å²	155.6	89%	0.893	83%	0.83	S	S	*	*			trans	76.6	124.4	141.2	-77.2	166.6	-22.2	0	0	122.1
12	K	27.8	Very low	31.9	Very low	173 Å²	173	148.4 Å²	148.4	75%	0.752	80%	0.804	S	S	*	*			trans	-91.9	137.3	176.2	-164.2	-175	-172.5	-164.2	0	108.2	D14	K12-D14 IonicContact NZ-OD2 3.61Å
13	S	27.2	Very low	31.8	Very low	116 Å²	116	148.4 Å²	148.4	81%	0.811	80%	0.804	S	S	*	*			trans	-142.1	108.3	156.5	57.2	0	0	0	0	108
14	D	30.5	Very low	31.4	Very low	115 Å²	115	149.5 Å²	149.5	62%	0.615	80%	0.796	S	S	*	*			trans	-66.3	136	171	-63.5	-42.9	0	0	0	109.2	K12	K12-D14 IonicContact NZ-OD2 3.61Å
15	D	30.6	Very low	31.6	Very low	149 Å²	149	152.7 Å²	152.7	80%	0.797	80%	0.802	S	S	*	*			trans	-151.1	97.1	156	-92.3	-33.4	0	0	0	108.2
16	D	32.3	Very low	31.9	Very low	154 Å²	154	153.4 Å²	153.4	82%	0.824	80%	0.797	S	S	*	*			trans	-70.1	127.2	169.6	-76.5	-44.3	0	0	0	110.2
17	Y	31.9	Very low	32.4	Very low	222 Å²	222	151.9 Å²	151.9	87%	0.871	79%	0.793	S	S	*	*			trans	-135.8	127.7	159.2	-90	-82.7	0	0	0	111
18	E	32.1	Very low	33.2	Very low	190 Å²	190	154.9 Å²	154.9	89%	0.888	80%	0.796	S	S	*	*			trans	-62.6	145.1	-167.6	-60.2	-175.6	144.1	0	0	115.4	Y20	E18-Y20 PolarHBondContact O-N 3.28Å
19	D	30.7	Very low	34.1	Very low	161 Å²	161	150.8 Å²	150.8	86%	0.861	79%	0.788	S	S	*	*			trans	-77.6	109.9	178.8	-164.8	12	0	0	0	111	A21	D19-A21 PolarHBondContact O-N 2.84Å
20	Y	32.9	Very low	35.3	Very low	222 Å²	222	149.7 Å²	149.7	87%	0.871	78%	0.783	S	S	*	*			trans	-80.2	103.7	172.5	-130.3	-91.5	0	0	0	109.3	E18 S22	E18-Y20 PolarHBondContact O-N 3.28Å; Y20-S22 PolarHBondContact O-N 2.84Å
21	A	36.9	Very low	36.3	Very low	91 Å²	91	155.2 Å²	155.2	75%	0.752	80%	0.796	S	S	*	*			trans	-59.2	94.7	174.9	0	0	0	0	0	112.1	D19	D19-A21 PolarHBondContact O-N 2.84Å
22	S	36.6	Very low	37.6	Very low	93 Å²	93	149.1 Å²	149.1	65%	0.65	77%	0.771	S	S	*	*			trans	-89.4	108	165.3	168	0	0	0	0	109.6	Y20 K24	Y20-S22 PolarHBondContact O-N 2.84Å; S22-K24 PolarHBondContact O-N 2.88Å
23	N	38.1	Very low	39.2	Very low	161 Å²	161	144.7 Å²	144.7	86%	0.861	76%	0.76	S	S	*	*			trans	-44.8	95.3	167.8	-74.4	-36.5	0	0	0	112.3
24	K	37.9	Very low	40.6	Very low	154 Å²	154	147.2 Å²	147.2	67%	0.67	76%	0.759	S	S	*	*			trans	-96.2	101	162.1	-74.1	-179.2	-178.7	173.1	0	107.3	S22 W26	S22-K24 PolarHBondContact O-N 2.88Å; K24-W26 VanDerWaalsContact O-CD1 3.29Å; K24-W26 PolarHBondContact O-N 3.46Å
25	T	35.8	Very low	42.2	Very low	135 Å²	135	144.1 Å²	144.1	83%	0.828	75%	0.754	S	S	*	*			trans	-62.7	88.9	162.9	44.7	0	0	0	0	108.2	V27	T25-V27 PolarHBondContact O-N 3.12Å; T25-V27 VanDerWaalsContact O-N 3.15Å
26	W	39.8	Very low	44.6	Very low	204 Å²	204	141 Å²	141	77%	0.773	74%	0.738	S	S	*	*			trans	-62	112.8	163.9	-66.4	99.3	0	0	0	107.2	K24 L28	K24-W26 VanDerWaalsContact O-CD1 3.29Å; K24-W26 PolarHBondContact O-N 3.46Å; W26-L28 PolarHBondContact O-N 3.15Å
27	V	39.8	Very low	47.2	Very low	137 Å²	137	135.8 Å²	135.8	83%	0.83	71%	0.711	S	S	*	*			trans	-63.6	93.6	165	178.1	0	0	0	0	105.9	T25 T29	T25-V27 PolarHBondContact O-N 3.12Å; T25-V27 VanDerWaalsContact O-N 3.15Å; V27-T29 PolarHBondContact O-N 2.84Å
28	L	46.8	Very low	49.9	Very low	151 Å²	151	129.1 Å²	129.1	79%	0.791	69%	0.694	S	S	*	*			trans	-62.9	103.2	174.8	-70.3	167.9	0	0	0	107.5	W26	W26-L28 PolarHBondContact O-N 3.15Å
29	T	47.5	Very low	52.7	Low	120 Å²	120	123.9 Å²	123.9	74%	0.736	68%	0.675	S	S	*	*			trans	-54.9	124.6	155.5	40.8	0	0	0	0	106.9	V27 K31	V27-T29 PolarHBondContact O-N 2.84Å; T29-K31 PolarHBondContact O-N 3.46Å; T29-K31 VanDerWaalsContact O-N 3.12Å
30	P	50.9	Low	55.6	Low	114 Å²	114	117.3 Å²	117.3	74%	0.74	64%	0.639	S	S	*	*			trans	-57.8	124.5	-179.1	21.2	-30	0	0	0	108.7	V32	P30-V32 VanDerWaalsContact C-N 3.32Å; P30-V32 PolarHBondContact O-N 3.37Å
31	K	47.6	Very low	58.3	Low	206 Å²	206	108.6 Å²	108.6	90%	0.896	61%	0.608	S	S	*	*			trans	-61.4	97.5	168.9	-83.4	-176.5	173.3	-179.3	0	107.2	T29	T29-K31 PolarHBondContact O-N 3.46Å; T29-K31 VanDerWaalsContact O-N 3.12Å
32	V	57.1	Low	61	Low	63 Å²	63	108.9 Å²	108.9	38%	0.382	60%	0.596	S	S	.	*			trans	-64.8	132.7	164.4	177.9	0	0	0	0	106.5	P30 E34 V37 I103	P30-V32 VanDerWaalsContact C-N 3.32Å; P30-V32 PolarHBondContact O-N 3.37Å; V32-E34 PolarHBondContact O-N 3.03Å; V32-V37 HydrophobicContact CG1-CG2 3.8Å; V32-I103 HydrophobicContact CG1-CD1 3.47Å; V32-I103 VanDerWaalsContact CG1-CD1 3.47Å; V32-I103 HydrophobicContact CG1-CG1 4.01Å; V32-I103 HydrophobicContact CG2-CG1 4.46Å
33	P	59.5	Low	63.6	Low	80 Å²	80	109.2 Å²	109.2	52%	0.519	59%	0.591	S	S	.	*			trans	-59.1	113.4	173	-17.3	29.6	0	0	0	108.8	G35 D36	P33-G35 PolarHBondContact O-N 2.98Å; P33-D36 PolarHBondContact O-N 2.9Å
34	E	56.6	Low	66.3	Low	170 Å²	170	102.3 Å²	102.3	79%	0.794	55%	0.554	S	S	*	*	H	α-helix	trans	-58.2	-23.8	-177.6	-71.2	-179	158.7	0	0	112.8	V32 T38	V32-E34 PolarHBondContact O-N 3.03Å; E34-T38 PolarHBondContact O-OG1 3.03Å
35	G	64.6	Low	68.9	Low	49 Å²	49	96.7 Å²	96.7	51%	0.505	53%	0.531	S	S	.	.	H	α-helix	trans	-62.5	-39.3	174	0	0	0	0	0	113.6	P33 V37 V39	P33-G35 PolarHBondContact O-N 2.98Å; G35-V37 PolarHBondContact O-N 3.14Å; G35-V39 WeakPolarHBondContact O-CG2 3.45Å; G35-V39 PolarHBondContact O-N 3.46Å
36	D	80.9	Confident	71.7	Confident	85 Å²	85	97.7 Å²	97.7	46%	0.455	53%	0.526	S	S	.	.	H	α-helix	trans	-70.5	-36.9	-175.1	-68.8	-21	0	0	0	111.7	P33 T38 V39 I40	P33-D36 PolarHBondContact O-N 2.9Å; D36-T38 PolarHBondContact O-N 3.07Å; D36-V39 PolarHBondContact O-N 3.49Å; D36-I40 WeakPolarHBondContact O-CB 3.47Å; D36-I40 WeakPolarHBondContact O-CD1 3.16Å; D36-I40 WeakPolarHBondContact O-CG1 3.29Å; D36-I40 PolarHBondContact O-N 2.94Å
37	V	86.4	Confident	74.2	Confident	43 Å²	43	92 Å²	92	26%	0.261	53%	0.531	S	S	.	.	H	α-helix	trans	-66.8	-39.8	-178.6	-177.4	0	0	0	0	111.4	V32 G35 I40 L41 I103 L106	V32-V37 HydrophobicContact CG1-CG2 3.8Å; G35-V37 PolarHBondContact O-N 3.14Å; V37-I40 PolarHBondContact O-N 3.41Å; V37-L41 WeakPolarHBondContact O-CB 3.47Å; V37-L41 PolarHBondContact O-N 3.49Å; V37-I103 HydrophobicContact CG2-CD1 3.59Å; V37-L106 HydrophobicContact CG1-CD2 4.06Å
38	T	89.1	Confident	76.9	Confident	82 Å²	82	86.8 Å²	86.8	50%	0.503	50%	0.496	S	S	.	.	H	α-helix	trans	-67.6	-41.4	179.6	-54	0	0	0	0	111	E34 D36 L41 N42	E34-T38 PolarHBondContact O-OG1 3.03Å; D36-T38 PolarHBondContact O-N 3.07Å; T38-L41 PolarHBondContact O-N 3.42Å; T38-N42 VanDerWaalsContact O-CG 3.3Å; T38-N42 PolarHBondContact O-N 3.48Å; T38-N42 PolarHBondContact O-ND2 3.05Å
39	V	90.9	Very high	79.2	Confident	81 Å²	81	82.6 Å²	82.6	49%	0.491	48%	0.475	S	S	.	.	H	α-helix	trans	-63	-45.4	174.5	174.5	0	0	0	0	110.9	G35 D36 L41 N42 N43	G35-V39 WeakPolarHBondContact O-CG2 3.45Å; G35-V39 PolarHBondContact O-N 3.46Å; D36-V39 PolarHBondContact O-N 3.49Å; V39-L41 VanDerWaalsContact C-N 3.31Å; V39-L41 PolarHBondContact O-N 3.29Å; V39-N42 PolarHBondContact O-N 3.31Å; V39-N43 WeakPolarHBondContact O-CB 3.36Å; V39-N43 PolarHBondContact O-N 2.79Å; V39-N43 PolarHBondContact O-ND2 3Å; V39-N43 PolarHBondContact O-OD1 3.45Å
40	I	91.1	Very high	81.3	Confident	23 Å²	23	80.2 Å²	80.2	12%	0.118	46%	0.457	C	S	.	.	H	α-helix	trans	-57.7	-45.7	175.5	-68.9	161.7	0	0	0	110.6	D36 V37 N43 L44 F99 S101 I103 L106	D36-I40 WeakPolarHBondContact O-CB 3.47Å; D36-I40 WeakPolarHBondContact O-CD1 3.16Å; D36-I40 WeakPolarHBondContact O-CG1 3.29Å; D36-I40 PolarHBondContact O-N 2.94Å; V37-I40 PolarHBondContact O-N 3.41Å; I40-N43 PolarHBondContact O-N 2.92Å; I40-L44 HydrophobicContact CG2-CD1 3.79Å; I40-L44 HydrophobicContact CG2-CG 4.35Å; I40-L44 VanDerWaalsContact O-CG 3.24Å; I40-L44 WeakPolarHBondContact O-CG 3.49Å; I40-L44 PolarHBondContact O-N 3.4Å; I40-F99 HydrophobicContact CG2-CB 3.85Å; I40-F99 HydrophobicContact CG2-CD2 3.99Å; I40-F99 HydrophobicContact CG2-CG 3.92Å; I40-S101 WeakPolarHBondContact CD1-OG 3.3Å; I40-I103 HydrophobicContact CD1-CD1 4.48Å; I40-L106 HydrophobicContact CG2-CD1 4.19Å
41	L	91.4	Very high	83.4	Confident	39 Å²	39	82.6 Å²	82.6	20%	0.204	46%	0.456	C	S	.	.	H	α-helix	trans	-65.7	-40.8	-178.4	-164.7	68.4	0	0	0	112.4	V37 T38 V39 L44 L45 L108 M112	V37-L41 WeakPolarHBondContact O-CB 3.47Å; V37-L41 PolarHBondContact O-N 3.49Å; T38-L41 PolarHBondContact O-N 3.42Å; V39-L41 VanDerWaalsContact C-N 3.31Å; V39-L41 PolarHBondContact O-N 3.29Å; L41-L44 PolarHBondContact O-N 2.89Å; L41-L45 HydrophobicContact CG-CD1 4.35Å; L41-L45 WeakPolarHBondContact O-CB 3.39Å; L41-L45 WeakPolarHBondContact O-CG 3.27Å; L41-L45 PolarHBondContact O-N 3.04Å; L41-L45 VanDerWaalsContact O-N 3.09Å; L41-L108 HydrophobicContact CD1-CD1 4.15Å; L41-L108 HydrophobicContact CD1-CD2 4.3Å; L41-M112 HydrophobicContact CD1-CE 3.39Å; L41-M112 HydrophobicContact CD1-SD 4.06Å; L41-M112 HydrophobicContact CD2-SD 4.29Å; L41-M112 HydrophobicContact CG-CE 4.11Å; L41-M112 HydrophobicContact CG-SD 4.44Å
42	N	91.9	Very high	85.6	Confident	96 Å²	96	76.7 Å²	76.7	51%	0.513	43%	0.434	S	S	.	.	H	α-helix	trans	-63.6	-44.6	176.1	-72	-20	0	0	0	111	T38 V39 L44 L45 E46	T38-N42 VanDerWaalsContact O-CG 3.3Å; T38-N42 PolarHBondContact O-N 3.48Å; T38-N42 PolarHBondContact O-ND2 3.05Å; V39-N42 PolarHBondContact O-N 3.31Å; N42-L44 VanDerWaalsContact C-N 3.3Å; N42-L44 PolarHBondContact O-N 3.04Å; N42-L45 PolarHBondContact O-N 2.83Å; N42-E46 PolarHBondContact O-N 2.96Å
43	N	92.4	Very high	87.4	Confident	101 Å²	101	74.4 Å²	74.4	54%	0.54	42%	0.418	S	S	.	.	H	α-helix	trans	-63.6	-34.9	177.1	-66	-8	0	0	0	112.4	V39 I40 L45	V39-N43 WeakPolarHBondContact O-CB 3.36Å; V39-N43 PolarHBondContact O-N 2.79Å; V39-N43 PolarHBondContact O-ND2 3Å; V39-N43 PolarHBondContact O-OD1 3.45Å; I40-N43 PolarHBondContact O-N 2.92Å; N43-L45 VanDerWaalsContact C-N 3.34Å
44	L	93.4	Very high	89.1	Confident	15 Å²	15	70.6 Å²	70.6	8%	0.079	39%	0.394	C	S	.	.	H	α-helix	trans	-71.9	-29.3	176.8	-72.3	169	0	0	0	113.1	I40 L41 N42 L97 F99 L106	I40-L44 HydrophobicContact CG2-CD1 3.79Å; I40-L44 HydrophobicContact CG2-CG 4.35Å; I40-L44 VanDerWaalsContact O-CG 3.24Å; I40-L44 WeakPolarHBondContact O-CG 3.49Å; I40-L44 PolarHBondContact O-N 3.4Å; L41-L44 PolarHBondContact O-N 2.89Å; N42-L44 VanDerWaalsContact C-N 3.3Å; N42-L44 PolarHBondContact O-N 3.04Å; L44-L97 HydrophobicContact CB-CD2 4.49Å; L44-F99 HydrophobicContact CD1-CB 4.18Å; L44-F99 HydrophobicContact CD1-CD1 3.98Å; L44-F99 HydrophobicContact CD1-CG 4.31Å; L44-F99 HydrophobicContact CD2-CB 4.01Å; L44-F99 HydrophobicContact CG-CB 4.37Å; L44-L106 HydrophobicContact CD1-CD1 4.4Å
45	L	93.7	Very high	90.9	Very high	37 Å²	37	64.7 Å²	64.7	19%	0.194	37%	0.368	C	S	.	.	H	α-helix	trans	-90.2	-17.5	179.9	-72.7	178.2	0	0	0	113.1	L41 N42 N43 G47 Y48 M112 K115	L41-L45 HydrophobicContact CG-CD1 4.35Å; L41-L45 WeakPolarHBondContact O-CB 3.39Å; L41-L45 WeakPolarHBondContact O-CG 3.27Å; L41-L45 PolarHBondContact O-N 3.04Å; L41-L45 VanDerWaalsContact O-N 3.09Å; N42-L45 PolarHBondContact O-N 2.83Å; N43-L45 VanDerWaalsContact C-N 3.34Å; L45-G47 PolarHBondContact O-N 2.99Å; L45-Y48 PolarHBondContact O-N 3.39Å; L45-Y48 VanDerWaalsContact O-N 3.15Å; L45-M112 HydrophobicContact CD1-CE 3.74Å; L45-M112 HydrophobicContact CD1-SD 4.07Å; L45-M112 HydrophobicContact CD2-CE 3.52Å; L45-M112 HydrophobicContact CG-CE 3.74Å; L45-K115 HydrophobicContact CD1-CD 3.79Å; L45-K115 HydrophobicContact CD2-CB 4.03Å
46	E	94.7	Very high	92.2	Very high	155 Å²	155	66.8 Å²	66.8	72%	0.724	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	117.6	177	-170.8	174	-163.6	0	0	110.2	N42 Y48	N42-E46 PolarHBondContact O-N 2.96Å; E46-Y48 PolarHBondContact O-N 3.35Å
47	G	92.9	Very high	92.6	Very high	84 Å²	84	66.5 Å²	66.5	87%	0.866	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.6	10.8	-177.5	0	0	0	0	0	115.2	L45 D49	L45-G47 PolarHBondContact O-N 2.99Å; G47-D49 PolarHBondContact O-N 2.97Å
48	Y	95.6	Very high	92.9	Very high	29 Å²	29	69.2 Å²	69.2	11%	0.114	40%	0.4	C	S	.	.			trans	-78.8	114.9	176	-170.5	-82.9	0	0	0	111.2	L45 E46 N50 D94 R96 L97 I116 W117	L45-Y48 PolarHBondContact O-N 3.39Å; L45-Y48 VanDerWaalsContact O-N 3.15Å; E46-Y48 PolarHBondContact O-N 3.35Å; Y48-N50 HydrophobicContact CD1-CB 4.46Å; Y48-N50 HydrophobicContact CE1-CB 4.22Å; Y48-D94 PolarHBondContact OH-OD2 2.83Å; Y48-R96 HydrophobicContact CD2-CB 3.93Å; Y48-R96 HydrophobicContact CE2-CB 3.88Å; Y48-R96 PolarHBondContact OH-NH2 2.91Å; Y48-R96 VanDerWaalsContact OH-NH2 3.1Å; Y48-L97 HydrophobicContact CD2-CD2 4.11Å; Y48-L97 HydrophobicContact CE2-CD1 4.39Å; Y48-L97 HydrophobicContact CE2-CD2 3.86Å; Y48-L97 HydrophobicContact CE2-CG 3.93Å; Y48-I116 HydrophobicContact CE1-CB 4.27Å; Y48-I116 HydrophobicContact CE1-CG2 4.48Å; Y48-W117 PolarHBondContact OH-N 3.37Å; Y48-W117 VanDerWaalsContact OH-N 3.08Å
49	D	94.5	Very high	93.2	Very high	62 Å²	62	72.5 Å²	72.5	33%	0.332	41%	0.407	S	S	.	.			trans	-90.8	114.7	170.3	-168.5	-13.6	0	0	0	110.8	G47 K51 L52 R96	G47-D49 PolarHBondContact O-N 2.97Å; D49-K51 VanDerWaalsContact C-N 3.3Å; D49-K51 PolarHBondContact O-N 3.36Å; D49-K51 VanDerWaalsContact OD1-CB 3.3Å; D49-K51 WeakPolarHBondContact OD1-CB 3.32Å; D49-K51 WeakPolarHBondContact OD1-CG 3.35Å; D49-K51 PolarHBondContact OD1-N 3.33Å; D49-L52 HydrophobicContact CB-CD1 4.19Å; D49-L52 HydrophobicContact CB-CG 4.38Å; D49-R96 PolarHBondContact O-NH1 2.82Å
50	N	93	Very high	93.4	Very high	70 Å²	70	71.6 Å²	71.6	37%	0.374	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-13.9	-179.9	66.6	-12.8	0	0	0	114.1	Y48 L52 G114	Y48-N50 HydrophobicContact CD1-CB 4.46Å; Y48-N50 HydrophobicContact CE1-CB 4.22Å; N50-L52 VanDerWaalsContact C-N 3.32Å; N50-G114 PolarHBondContact ND2-O 2.92Å
51	K	93.2	Very high	93.7	Very high	165 Å²	165	70.9 Å²	70.9	72%	0.717	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.9	-23.4	177.9	-57.3	169.3	-170.3	171.4	0	111.9	D49	D49-K51 VanDerWaalsContact C-N 3.3Å; D49-K51 PolarHBondContact O-N 3.36Å; D49-K51 VanDerWaalsContact OD1-CB 3.3Å; D49-K51 WeakPolarHBondContact OD1-CB 3.32Å; D49-K51 WeakPolarHBondContact OD1-CG 3.35Å; D49-K51 PolarHBondContact OD1-N 3.33Å
52	L	94.5	Very high	93.9	Very high	81 Å²	81	72.4 Å²	72.4	42%	0.424	41%	0.408	S	S	.	.	S	Bend	trans	-97.3	127.8	-176.1	-61	176.7	0	0	0	110.9	D49 N50 R96	D49-L52 HydrophobicContact CB-CD1 4.19Å; D49-L52 HydrophobicContact CB-CG 4.38Å; N50-L52 VanDerWaalsContact C-N 3.32Å; L52-R96 PolarHBondContact O-NH1 3Å; L52-R96 PolarHBondContact O-NH2 2.84Å
53	R	95.1	Very high	94.2	Very high	15 Å²	15	67.9 Å²	67.9	6%	0.057	38%	0.383	C	S	.	.	P	Polyproline II helix	trans	-63.9	153.9	170	71.5	168.4	-178.2	85.1	-7.1	110.9	D55 I56 K59 W117 Y184 E188	R53-D55 PolarHBondContact NH1-O 3.39Å; R53-D55 VanDerWaalsContact NH1-O 3.12Å; R53-I56 HydrophobicContact CG-CB 4.44Å; R53-I56 HydrophobicContact CG-CD1 4.03Å; R53-K59 PolarHBondContact NH1-O 2.99Å; R53-K59 VanDerWaalsContact NH1-O 3.16Å; R53-W117 HydrophobicContact CB-CD2 4.21Å; R53-W117 HydrophobicContact CB-CH2 4.41Å; R53-W117 HydrophobicContact CB-CZ2 3.68Å; R53-Y184 HydrophobicContact CB-CE1 4.43Å; R53-Y184 HydrophobicContact CG-CE1 4.44Å; R53-E188 IonicContact CZ-OE2 3.84Å; R53-E188 IonicContact NE-OE2 3.55Å; R53-E188 PolarHBondContact NE-OE2 2.96Å; R53-E188 IonicContact NH2-OE2 3.04Å
54	P	95.3	Very high	94.4	Very high	1 Å²	1	65.4 Å²	65.4	1%	0.006	37%	0.369	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	149.2	172.2	24.9	-32.8	0	0	0	111.3	I56 T61 D94 W117	P54-I56 VanDerWaalsContact C-N 3.26Å; P54-I56 PolarHBondContact O-N 3.43Å; P54-T61 HydrophobicContact CG-CG2 3.81Å; P54-T61 PolarHBondContact O-OG1 3.04Å; P54-D94 HydrophobicContact CB-CB 4.15Å; P54-D94 HydrophobicContact CG-CB 4.49Å; P54-W117 HydrophobicContact CG-CE3 4.14Å; P54-W117 HydrophobicContact CG-CZ3 4.1Å
55	D	93.3	Very high	94.6	Very high	46 Å²	46	64.7 Å²	64.7	25%	0.246	37%	0.365	C	S	.	.	T	Hydrogen-bonded Turn	trans	52.4	39.1	177.3	-66.4	-46.4	0	0	0	114.3	R53 G57 V58 R95	R53-D55 PolarHBondContact NH1-O 3.39Å; R53-D55 VanDerWaalsContact NH1-O 3.12Å; D55-G57 PolarHBondContact O-N 3.31Å; D55-V58 HydrophobicContact CB-CG2 4.24Å; D55-V58 PolarHBondContact O-N 2.74Å; D55-R95 IonicContact OD1-CZ 4Å; D55-R95 VanDerWaalsContact OD1-CZ 3.29Å; D55-R95 IonicContact OD1-NE 2.74Å; D55-R95 IonicContact OD1-NH1 3.96Å; D55-R95 PolarHBondContact OD1-NH1 3.19Å; D55-R95 IonicContact OD1-NH2 3.29Å; D55-R95 IonicContact OD2-CZ 3.97Å; D55-R95 IonicContact OD2-NE 3.82Å; D55-R95 IonicContact OD2-NH1 3.8Å; D55-R95 IonicContact OD2-NH2 3.64Å
56	I	93.1	Very high	94.6	Very high	92 Å²	92	64.9 Å²	64.9	47%	0.472	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.2	131.7	173.3	-169.3	65.1	0	0	0	110.8	R53 P54 V58	R53-I56 HydrophobicContact CG-CB 4.44Å; R53-I56 HydrophobicContact CG-CD1 4.03Å; P54-I56 VanDerWaalsContact C-N 3.26Å; P54-I56 PolarHBondContact O-N 3.43Å; I56-V58 VanDerWaalsContact C-N 3.3Å; I56-V58 WeakPolarHBondContact O-CG2 3.19Å; I56-V58 PolarHBondContact O-N 2.86Å
57	G	89.6	Confident	94.6	Very high	79 Å²	79	57.5 Å²	57.5	81%	0.814	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.6	0.6	-179.8	0	0	0	0	0	116.3	D55	D55-G57 PolarHBondContact O-N 3.31Å
58	V	92.8	Very high	94.7	Very high	101 Å²	101	57.7 Å²	57.7	61%	0.612	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113	-68	-175.8	-139.6	0	0	0	0	112.9	D55 I56	D55-V58 HydrophobicContact CB-CG2 4.24Å; D55-V58 PolarHBondContact O-N 2.74Å; I56-V58 VanDerWaalsContact C-N 3.3Å; I56-V58 WeakPolarHBondContact O-CG2 3.19Å; I56-V58 PolarHBondContact O-N 2.86Å
59	K	94.5	Very high	94.7	Very high	150 Å²	150	56.3 Å²	56.3	65%	0.652	30%	0.301	S	S	*	.	S	Bend	trans	-142.2	155.9	-178.9	-69.4	-173.7	-178.9	-177.8	0	109	R53	R53-K59 PolarHBondContact NH1-O 2.99Å; R53-K59 VanDerWaalsContact NH1-O 3.16Å
60	P	95.8	Very high	94.6	Very high	62 Å²	62	55.8 Å²	55.8	40%	0.403	30%	0.298	S	S	.	.	P	Polyproline II helix	trans	-64.3	143.7	171.5	24.4	-32.2	0	0	0	110.7	L62 E187 E188 V190	P60-L62 PolarHBondContact O-N 3.08Å; P60-E187 WeakPolarHBondContact CB-O 3.19Å; P60-E188 CarbonylContact C-O 3.56Å; P60-E188 WeakPolarHBondContact CA-O 3.37Å; P60-V190 HydrophobicContact CB-CG2 4.15Å; P60-V190 HydrophobicContact CG-CG2 4.39Å
61	T	96.4	Very high	94.6	Very high	8 Å²	8	54.1 Å²	54.1	5%	0.049	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	118.5	173.8	-53	0	0	0	0	108.9	P54 I63 W92 E188 V190	P54-T61 HydrophobicContact CG-CG2 3.81Å; P54-T61 PolarHBondContact O-OG1 3.04Å; T61-I63 HydrophobicContact CG2-CG1 4.42Å; T61-W92 HydrophobicContact CG2-CB 4.1Å; T61-E188 PolarHBondContact N-O 3.25Å; T61-V190 PolarHBondContact O-N 3.27Å; T61-V190 VanDerWaalsContact O-N 3.09Å
62	L	96.8	Very high	94.6	Very high	72 Å²	72	46.3 Å²	46.3	38%	0.377	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	119.3	174.7	-175	66	0	0	0	109.8	P60 V190 Q192	P60-L62 PolarHBondContact O-N 3.08Å; L62-V190 HydrophobicContact CD1-CB 4.22Å; L62-V190 HydrophobicContact CD1-CG1 4.11Å; L62-Q192 HydrophobicContact CD1-CB 3.99Å
63	I	97.6	Very high	94.4	Very high	0 Å²	0	43 Å²	43	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	113.7	178.9	-55.5	177	0	0	0	108.6	T61 Q90 W92 P119 I189 V190 Y191 Q192	T61-I63 HydrophobicContact CG2-CG1 4.42Å; I63-Q90 HydrophobicContact CG2-CB 4.05Å; I63-Q90 HydrophobicContact CG2-CG 4.48Å; I63-W92 HydrophobicContact CG1-CB 4.34Å; I63-P119 HydrophobicContact CD1-CB 3.47Å; I63-P119 VanDerWaalsContact CD1-CB 3.47Å; I63-P119 HydrophobicContact CD1-CG 4.02Å; I63-I189 HydrophobicContact CD1-CD1 4.32Å; I63-I189 HydrophobicContact CD1-CG2 3.44Å; I63-I189 VanDerWaalsContact CD1-CG2 3.44Å; I63-I189 HydrophobicContact CG1-CG2 4.08Å; I63-V190 PolarHBondContact N-O 3.44Å; I63-Y191 HydrophobicContact CB-CD1 3.86Å; I63-Y191 HydrophobicContact CB-CE1 4.09Å; I63-Y191 HydrophobicContact CD1-CD1 4.4Å; I63-Y191 HydrophobicContact CD1-CE1 3.82Å; I63-Y191 HydrophobicContact CG2-CD1 3.93Å; I63-Y191 HydrophobicContact CG2-CE1 3.97Å; I63-Y191 CarbonylContact O-C 3.49Å; I63-Y191 WeakPolarHBondContact O-CA 3.43Å; I63-Q192 PolarHBondContact O-N 2.61Å
64	H	97.1	Very high	94.2	Very high	50 Å²	50	46.6 Å²	46.6	23%	0.231	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	121.7	170.9	-64.2	-65	0	0	0	110.2	Q90 T91 Q192 K194	H64-Q90 CarbonylContact O-C 3.47Å; H64-Q90 WeakPolarHBondContact O-CA 3.42Å; H64-T91 PolarHBondContact N-O 2.83Å; H64-T91 PolarHBondContact O-N 2.91Å; H64-Q192 CarbonylContact C-O 3.6Å; H64-Q192 VanDerWaalsContact CA-O 3.28Å; H64-Q192 WeakPolarHBondContact CA-O 3.48Å; H64-Q192 PolarHBondContact CE1-OE1 3.34Å; H64-Q192 VanDerWaalsContact CE1-OE1 3.26Å; H64-K194 HydrophobicContact CB-CG 4.06Å
65	T	96.4	Very high	94	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	143.3	-178.3	-48.9	0	0	0	0	111.2	F88 A89 F179 Q192 K194	T65-F88 HydrophobicContact CG2-CD2 4.27Å; T65-F88 HydrophobicContact CG2-CE2 3.37Å; T65-F88 HydrophobicContact CG2-CZ 3.52Å; T65-A89 WeakPolarHBondContact CA-O 3.48Å; T65-F179 HydrophobicContact CG2-CE2 3.76Å; T65-F179 HydrophobicContact CG2-CZ 3.61Å; T65-Q192 PolarHBondContact N-O 2.97Å; T65-K194 PolarHBondContact O-N 3.36Å
66	D	94.8	Very high	93.9	Very high	40 Å²	40	47.7 Å²	47.7	21%	0.214	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	147	177.2	-172.7	6.1	0	0	0	108.6	A89 K194 S197	D66-A89 HydrophobicContact CB-CB 4.23Å; D66-A89 PolarHBondContact N-O 3.17Å; D66-A89 WeakPolarHBondContact O-CA 3.1Å; D66-A89 PolarHBondContact O-N 3.04Å; D66-K194 HydrophobicContact CB-CD 4.28Å; D66-S197 CarbonylContact C-O 3.56Å; D66-S197 WeakPolarHBondContact CA-O 3.43Å; D66-S197 VanDerWaalsContact OD1-C 3.23Å; D66-S197 WeakPolarHBondContact OD1-CA 3.28Å
67	M	94.9	Very high	93.6	Very high	1 Å²	1	43.8 Å²	43.8	1%	0.005	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	130.4	-175	-178.5	174	67.3	0	0	109.8	V69 I86 F87 L177 S197 V198 E199 V235 F237	M67-V69 HydrophobicContact CE-CG2 4.1Å; M67-V69 HydrophobicContact CG-CG2 4.47Å; M67-I86 HydrophobicContact CG-CB 4.17Å; M67-I86 HydrophobicContact CG-CD1 4.21Å; M67-I86 HydrophobicContact CG-CG2 4.31Å; M67-I86 HydrophobicContact SD-CB 4.39Å; M67-I86 HydrophobicContact SD-CD1 3.74Å; M67-I86 HydrophobicContact SD-CG2 4.08Å; M67-F87 WeakPolarHBondContact CA-O 3.44Å; M67-L177 HydrophobicContact SD-CD2 3.92Å; M67-S197 PolarHBondContact N-O 3.15Å; M67-V198 HydrophobicContact CE-CG1 3.66Å; M67-V198 HydrophobicContact CE-CG2 4.13Å; M67-V198 VanDerWaalsContact O-CA 3.3Å; M67-V198 WeakPolarHBondContact O-CA 3.46Å; M67-E199 PolarHBondContact O-N 2.76Å; M67-V235 HydrophobicContact CE-CB 4.19Å; M67-V235 HydrophobicContact CE-CG1 4.03Å; M67-V235 HydrophobicContact CE-CG2 3.87Å; M67-F237 HydrophobicContact CE-CZ 3.97Å
68	Y	95.1	Very high	93.5	Very high	88 Å²	88	44.7 Å²	44.7	35%	0.345	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	119.2	169.5	178	-84.7	0	0	0	109.4	N70 I86 F87 E199 G201	Y68-N70 HydrophobicContact CE1-CB 4.36Å; Y68-N70 PolarHBondContact O-N 2.83Å; Y68-I86 CarbonylContact O-C 3.56Å; Y68-I86 WeakPolarHBondContact O-CA 3.48Å; Y68-F87 AromaticContact CD1-CD2 3.84Å; Y68-F87 HydrophobicContact CD1-CD2 3.84Å; Y68-F87 HydrophobicContact CD1-CE2 4.48Å; Y68-F87 HydrophobicContact CE1-CD2 4.5Å; Y68-F87 PolarHBondContact N-O 3.28Å; Y68-F87 PolarHBondContact O-N 2.9Å; Y68-E199 CarbonylContact C-O 3.57Å; Y68-E199 WeakPolarHBondContact CA-O 3.27Å; Y68-E199 HydrophobicContact CD2-CB 3.84Å; Y68-E199 HydrophobicContact CE2-CB 4.48Å; Y68-G201 VanDerWaalsContact OH-CA 3.23Å; Y68-G201 WeakPolarHBondContact OH-CA 3.49Å
69	V	95	Very high	93.4	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	109.7	178.4	-178.3	0	0	0	0	108.7	M67 I72 I84 I86 V198 E199 V200 G201 W206 F237	M67-V69 HydrophobicContact CE-CG2 4.1Å; M67-V69 HydrophobicContact CG-CG2 4.47Å; V69-I72 HydrophobicContact CG1-CG1 4.01Å; V69-I84 HydrophobicContact CG1-CD1 3.97Å; V69-I84 HydrophobicContact CG1-CG1 4.14Å; V69-I84 HydrophobicContact CG2-CD1 4.32Å; V69-I86 HydrophobicContact CG2-CG2 4.19Å; V69-V198 HydrophobicContact CG2-CG1 4.42Å; V69-E199 PolarHBondContact N-O 2.67Å; V69-V200 HydrophobicContact CB-CG1 4.27Å; V69-V200 HydrophobicContact CG2-CG1 4.49Å; V69-G201 PolarHBondContact O-N 3.29Å; V69-W206 HydrophobicContact CG1-CH2 4.29Å; V69-W206 HydrophobicContact CG1-CZ2 3.98Å; V69-F237 HydrophobicContact CG2-CE1 3.92Å; V69-F237 HydrophobicContact CG2-CZ 4.05Å
70	N	93.1	Very high	93.3	Very high	50 Å²	50	38.9 Å²	38.9	27%	0.267	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	-52.4	179	-173.3	39.5	0	0	0	110.6	Y68 D85 F87 W206	Y68-N70 HydrophobicContact CE1-CB 4.36Å; Y68-N70 PolarHBondContact O-N 2.83Å; N70-D85 HydrophobicContact CB-CB 4.49Å; N70-D85 WeakPolarHBondContact CB-O 3.44Å; N70-D85 PolarHBondContact N-O 3.39Å; N70-D85 PolarHBondContact ND2-OD2 3.26Å; N70-F87 HydrophobicContact CB-CD2 4.32Å; N70-F87 HydrophobicContact CB-CE2 4.09Å; N70-W206 PolarHBondContact O-NE1 2.85Å; N70-W206 VanDerWaalsContact O-NE1 3.12Å
71	S	92.6	Very high	93.2	Very high	35 Å²	35	37.9 Å²	37.9	25%	0.245	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	149.1	175.6	67.4	0	0	0	0	112.1	D85	S71-D85 PolarHBondContact N-O 3.12Å; S71-D85 PolarHBondContact O-N 3.23Å
72	I	93.4	Very high	93.2	Very high	1 Å²	1	37.6 Å²	37.6	1%	0.005	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	125.9	165.1	-51.2	-177.8	0	0	0	107.2	V69 Y82 I84 W206 L208 F213 F237	V69-I72 HydrophobicContact CG1-CG1 4.01Å; I72-Y82 HydrophobicContact CG2-CD2 4.27Å; I72-I84 HydrophobicContact CG1-CD1 4.38Å; I72-I84 HydrophobicContact CG1-CG1 4.24Å; I72-W206 HydrophobicContact CB-CE3 4.26Å; I72-W206 HydrophobicContact CD1-CE3 3.98Å; I72-W206 HydrophobicContact CD1-CH2 3.96Å; I72-W206 HydrophobicContact CD1-CZ3 3.48Å; I72-W206 VanDerWaalsContact CD1-CZ3 3.48Å; I72-W206 HydrophobicContact CG1-CD2 4.38Å; I72-W206 HydrophobicContact CG1-CE3 3.97Å; I72-W206 HydrophobicContact CG1-CH2 4.17Å; I72-W206 HydrophobicContact CG1-CZ3 3.86Å; I72-L208 HydrophobicContact CB-CD1 4.24Å; I72-L208 HydrophobicContact CB-CD2 4.25Å; I72-L208 HydrophobicContact CB-CG 4.39Å; I72-L208 HydrophobicContact CG2-CD2 3.89Å; I72-F213 HydrophobicContact CD1-CD2 4.47Å; I72-F237 HydrophobicContact CD1-CD1 3.99Å; I72-F237 HydrophobicContact CD1-CE1 4.49Å; I72-F237 HydrophobicContact CD1-CG 4.39Å
73	G	89.9	Confident	93.1	Very high	12 Å²	12	36 Å²	36	12%	0.124	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	-169.5	178.6	0	0	0	0	0	112.8	T83 L208	G73-T83 WeakPolarHBondContact CA-O 3.4Å; G73-T83 PolarHBondContact N-O 3.2Å; G73-L208 VanDerWaalsContact O-CD2 3.28Å; G73-L208 WeakPolarHBondContact O-CD2 3.33Å
74	P	89.9	Confident	93	Very high	91 Å²	91	36 Å²	36	59%	0.591	20%	0.196	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-65.2	142.2	177.3	28.9	-34	0	0	0	110.9
75	V	91.9	Very high	92.9	Very high	15 Å²	15	34.3 Å²	34.3	9%	0.091	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	122.5	170.6	-179.2	0	0	0	0	107.9	L163 L208 F211 L239	V75-L163 HydrophobicContact CG1-CD1 4.48Å; V75-L163 HydrophobicContact CG1-CD2 4.49Å; V75-L208 HydrophobicContact CG2-CD2 4.22Å; V75-F211 HydrophobicContact CB-CD2 3.83Å; V75-F211 HydrophobicContact CB-CE2 3.59Å; V75-F211 HydrophobicContact CB-CZ 4.43Å; V75-F211 HydrophobicContact CG1-CD2 4.43Å; V75-F211 HydrophobicContact CG1-CE2 3.8Å; V75-F211 HydrophobicContact CG1-CZ 4.17Å; V75-F211 HydrophobicContact CG2-CD2 4Å; V75-F211 HydrophobicContact CG2-CE2 4.21Å; V75-L239 HydrophobicContact CG2-CD1 3.79Å
76	N	90.3	Very high	92.8	Very high	55 Å²	55	34.3 Å²	34.3	29%	0.294	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	107.6	179.1	-174.6	-11.6	0	0	0	110.1	I78 N79 M80 E81	N76-I78 VanDerWaalsContact C-N 3.3Å; N76-I78 PolarHBondContact O-N 3.09Å; N76-I78 WeakPolarHBondContact OD1-CB 3.45Å; N76-I78 PolarHBondContact OD1-N 2.92Å; N76-N79 HydrophobicContact CB-CB 4.38Å; N76-N79 VanDerWaalsContact ND2-CG 3.29Å; N76-N79 PolarHBondContact ND2-ND2 3.19Å; N76-N79 PolarHBondContact OD1-N 2.95Å; N76-M80 WeakPolarHBondContact O-CA 3.48Å; N76-M80 PolarHBondContact O-N 3.2Å; N76-E81 HydrophobicContact CB-CG 4.14Å; N76-E81 PolarHBondContact N-O 3.38Å; N76-E81 PolarHBondContact O-N 3.37Å
77	A	87.7	Confident	92.9	Very high	10 Å²	10	36 Å²	36	8%	0.083	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-27.3	179.4	0	0	0	0	0	113.6	L163 P298	A77-L163 HydrophobicContact CB-CD1 3.92Å; A77-P298 WeakPolarHBondContact O-CD 3.35Å; A77-P298 WeakPolarHBondContact O-CG 3.21Å
78	I	88	Confident	93	Very high	97 Å²	97	36.2 Å²	36.2	50%	0.497	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-45.7	-178.8	-61.7	174.2	0	0	0	110.4	N76 M80	N76-I78 VanDerWaalsContact C-N 3.3Å; N76-I78 PolarHBondContact O-N 3.09Å; N76-I78 WeakPolarHBondContact OD1-CB 3.45Å; N76-I78 PolarHBondContact OD1-N 2.92Å; I78-M80 VanDerWaalsContact C-N 3.34Å
79	N	90.7	Very high	93.1	Very high	79 Å²	79	32.7 Å²	32.7	42%	0.422	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.5	-4.1	-178.3	-66.4	-3.5	0	0	0	113.6	N76 E81 K127	N76-N79 HydrophobicContact CB-CB 4.38Å; N76-N79 VanDerWaalsContact ND2-CG 3.29Å; N76-N79 PolarHBondContact ND2-ND2 3.19Å; N76-N79 PolarHBondContact OD1-N 2.95Å; N79-E81 VanDerWaalsContact C-N 3.34Å; N79-E81 HydrophobicContact CB-CG 3.76Å; N79-E81 VanDerWaalsContact CB-OE1 3.23Å; N79-E81 WeakPolarHBondContact CB-OE1 3.24Å; N79-E81 PolarHBondContact ND2-OE1 3.09Å; N79-E81 PolarHBondContact O-N 3.26Å; N79-K127 PolarHBondContact O-NZ 3.3Å
80	M	91.7	Very high	93.2	Very high	50 Å²	50	32.9 Å²	32.9	25%	0.246	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.9	50.1	-176	-62	-175.5	176.3	0	0	112.2	N76 I78 C161 Q162 P298	N76-M80 WeakPolarHBondContact O-CA 3.48Å; N76-M80 PolarHBondContact O-N 3.2Å; I78-M80 VanDerWaalsContact C-N 3.34Å; M80-C161 CarbonylContact C-O 3.59Å; M80-C161 PolarHBondContact O-N 2.9Å; M80-Q162 PolarHBondContact SD-NE2 2.88Å; M80-Q162 VanDerWaalsContact SD-NE2 3.37Å; M80-P298 HydrophobicContact CE-CB 4.46Å
81	E	94.5	Very high	93.4	Very high	42 Å²	42	30.8 Å²	30.8	20%	0.196	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	159.2	-176.1	71.6	-161.8	177.4	0	0	111.7	N76 N79 K127 A159	N76-E81 HydrophobicContact CB-CG 4.14Å; N76-E81 PolarHBondContact N-O 3.38Å; N76-E81 PolarHBondContact O-N 3.37Å; N79-E81 VanDerWaalsContact C-N 3.34Å; N79-E81 HydrophobicContact CB-CG 3.76Å; N79-E81 VanDerWaalsContact CB-OE1 3.23Å; N79-E81 WeakPolarHBondContact CB-OE1 3.24Å; N79-E81 PolarHBondContact ND2-OE1 3.09Å; N79-E81 PolarHBondContact O-N 3.26Å; E81-K127 WeakPolarHBondContact OE2-CD 3.49Å; E81-K127 IonicContact OE2-NZ 2.87Å; E81-K127 PolarHBondContact OE2-NZ 2.76Å; E81-A159 VanDerWaalsContact CA-O 3.29Å; E81-A159 WeakPolarHBondContact CA-O 3.42Å
82	Y	95	Very high	93.6	Very high	1 Å²	1	29.1 Å²	29.1	0%	0.004	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	150	174.1	72.9	-74.2	0	0	0	110.2	I72 I84 D158 A159 C161 C175 P176 F237	I72-Y82 HydrophobicContact CG2-CD2 4.27Å; Y82-I84 HydrophobicContact CD2-CB 4.44Å; Y82-I84 HydrophobicContact CE2-CB 4.12Å; Y82-I84 HydrophobicContact CE2-CG2 4.32Å; Y82-D158 WeakPolarHBondContact O-CA 3.46Å; Y82-A159 HydrophobicContact CD1-CB 4.22Å; Y82-A159 VanDerWaalsContact CD1-O 3.32Å; Y82-A159 WeakPolarHBondContact CD1-O 3.42Å; Y82-A159 HydrophobicContact CE1-CB 3.57Å; Y82-A159 PolarHBondContact N-O 3.11Å; Y82-A159 PolarHBondContact O-N 3.26Å; Y82-C161 HydrophobicContact CD1-CB 3.54Å; Y82-C161 HydrophobicContact CE1-CB 3.89Å; Y82-C175 HydrophobicContact CD1-CB 4Å; Y82-C175 HydrophobicContact CE1-CB 3.67Å; Y82-P176 PolarHBondContact OH-O 3.22Å; Y82-F237 HydrophobicContact CE2-CD2 4.5Å
83	T	94.9	Very high	93.7	Very high	40 Å²	40	33.7 Å²	33.7	25%	0.245	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	140.1	175.8	-53.3	0	0	0	0	110	G73 T156 I157 D158	G73-T83 WeakPolarHBondContact CA-O 3.4Å; G73-T83 PolarHBondContact N-O 3.2Å; T83-T156 HydrophobicContact CG2-CG2 3.65Å; T83-I157 CarbonylContact C-O 3.38Å; T83-I157 WeakPolarHBondContact CA-O 3.27Å; T83-D158 VanDerWaalsContact CB-OD1 3.29Å; T83-D158 WeakPolarHBondContact CB-OD1 3.35Å; T83-D158 VanDerWaalsContact CG2-OD1 3.26Å; T83-D158 WeakPolarHBondContact CG2-OD1 3.49Å; T83-D158 PolarHBondContact OG1-OD1 3.09Å
84	I	95.3	Very high	94	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	139.5	174.5	-165.6	175.7	0	0	0	111	V69 I72 Y82 I86 T156 I157 L177 F237	V69-I84 HydrophobicContact CG1-CD1 3.97Å; V69-I84 HydrophobicContact CG1-CG1 4.14Å; V69-I84 HydrophobicContact CG2-CD1 4.32Å; I72-I84 HydrophobicContact CG1-CD1 4.38Å; I72-I84 HydrophobicContact CG1-CG1 4.24Å; Y82-I84 HydrophobicContact CD2-CB 4.44Å; Y82-I84 HydrophobicContact CE2-CB 4.12Å; Y82-I84 HydrophobicContact CE2-CG2 4.32Å; I84-I86 HydrophobicContact CD1-CG2 3.67Å; I84-I86 HydrophobicContact CG1-CG2 3.67Å; I84-I86 HydrophobicContact CG2-CG2 4.41Å; I84-T156 CarbonylContact O-C 3.54Å; I84-T156 VanDerWaalsContact O-CA 3.29Å; I84-T156 WeakPolarHBondContact O-CA 3.43Å; I84-I157 HydrophobicContact CG2-CB 3.96Å; I84-I157 PolarHBondContact N-O 2.87Å; I84-I157 PolarHBondContact O-N 3.16Å; I84-L177 HydrophobicContact CD1-CD2 4.49Å; I84-L177 HydrophobicContact CG2-CD2 4.47Å; I84-F237 HydrophobicContact CD1-CE1 4.15Å; I84-F237 HydrophobicContact CD1-CE2 3.75Å; I84-F237 HydrophobicContact CD1-CZ 3.53Å
85	D	95.1	Very high	94.2	Very high	13 Å²	13	37 Å²	37	7%	0.07	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	116.4	173.1	178.1	23.3	0	0	0	109.1	N70 S71 H132 R154 L155	N70-D85 HydrophobicContact CB-CB 4.49Å; N70-D85 WeakPolarHBondContact CB-O 3.44Å; N70-D85 PolarHBondContact N-O 3.39Å; N70-D85 PolarHBondContact ND2-OD2 3.26Å; S71-D85 PolarHBondContact N-O 3.12Å; S71-D85 PolarHBondContact O-N 3.23Å; D85-H132 IonicContact OD1-NE2 2.87Å; D85-R154 IonicContact OD1-CZ 2.91Å; D85-R154 IonicContact OD1-NE 3.83Å; D85-R154 PolarHBondContact OD1-NE 2.88Å; D85-R154 IonicContact OD1-NH2 3.38Å; D85-R154 IonicContact OD2-CZ 3.07Å; D85-R154 IonicContact OD2-NE 3.72Å; D85-R154 PolarHBondContact OD2-NE 2.89Å; D85-R154 IonicContact OD2-NH2 3.47Å; D85-R154 PolarHBondContact OD2-NH2 2.88Å; D85-L155 WeakPolarHBondContact CA-O 3.21Å
86	I	96	Very high	94.3	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	152	-174.3	66.1	174.3	0	0	0	111.5	M67 Y68 V69 I84 F88 F123 R154 L155 I157 L177	M67-I86 HydrophobicContact CG-CB 4.17Å; M67-I86 HydrophobicContact CG-CD1 4.21Å; M67-I86 HydrophobicContact CG-CG2 4.31Å; M67-I86 HydrophobicContact SD-CB 4.39Å; M67-I86 HydrophobicContact SD-CD1 3.74Å; M67-I86 HydrophobicContact SD-CG2 4.08Å; Y68-I86 CarbonylContact O-C 3.56Å; Y68-I86 WeakPolarHBondContact O-CA 3.48Å; V69-I86 HydrophobicContact CG2-CG2 4.19Å; I84-I86 HydrophobicContact CD1-CG2 3.67Å; I84-I86 HydrophobicContact CG1-CG2 3.67Å; I84-I86 HydrophobicContact CG2-CG2 4.41Å; I86-F88 HydrophobicContact CD1-CB 4.37Å; I86-F88 HydrophobicContact CD1-CD2 4.49Å; I86-F123 HydrophobicContact CD1-CE1 4.28Å; I86-F123 HydrophobicContact CD1-CZ 3.96Å; I86-R154 WeakPolarHBondContact O-CA 3.3Å; I86-L155 HydrophobicContact CG1-CB 4.16Å; I86-L155 PolarHBondContact N-O 2.79Å; I86-L155 PolarHBondContact O-N 2.91Å; I86-I157 HydrophobicContact CD1-CD1 3.72Å; I86-I157 HydrophobicContact CG1-CD1 4.25Å; I86-L177 HydrophobicContact CD1-CD2 4.23Å
87	F	96.3	Very high	94.6	Very high	77 Å²	77	37.7 Å²	37.7	34%	0.338	17%	0.174	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	114	157.3	-65.8	-94.9	0	0	0	107.7	M67 Y68 N70 R154	M67-F87 WeakPolarHBondContact CA-O 3.44Å; Y68-F87 AromaticContact CD1-CD2 3.84Å; Y68-F87 HydrophobicContact CD1-CD2 3.84Å; Y68-F87 HydrophobicContact CD1-CE2 4.48Å; Y68-F87 HydrophobicContact CE1-CD2 4.5Å; Y68-F87 PolarHBondContact N-O 3.28Å; Y68-F87 PolarHBondContact O-N 2.9Å; N70-F87 HydrophobicContact CB-CD2 4.32Å; N70-F87 HydrophobicContact CB-CE2 4.09Å; F87-R154 HydrophobicContact CD1-CB 3.93Å; F87-R154 HydrophobicContact CD1-CG 4.2Å; F87-R154 HydrophobicContact CE1-CB 3.84Å; F87-R154 HydrophobicContact CE1-CG 3.94Å; F87-R154 HydrophobicContact CE2-CG 4.48Å; F87-R154 HydrophobicContact CZ-CB 4.5Å; F87-R154 HydrophobicContact CZ-CG 4.1Å
88	F	97	Very high	94.9	Very high	4 Å²	4	44 Å²	44	2%	0.018	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	131.9	177.8	-168.8	-115.6	0	0	0	108.8	T65 I86 Q90 T121 F123 T152 L153 L155 F179	T65-F88 HydrophobicContact CG2-CD2 4.27Å; T65-F88 HydrophobicContact CG2-CE2 3.37Å; T65-F88 HydrophobicContact CG2-CZ 3.52Å; I86-F88 HydrophobicContact CD1-CB 4.37Å; I86-F88 HydrophobicContact CD1-CD2 4.49Å; F88-Q90 HydrophobicContact CD1-CG 3.96Å; F88-Q90 HydrophobicContact CE1-CG 3.52Å; F88-Q90 HydrophobicContact CZ-CG 4.12Å; F88-T121 HydrophobicContact CE1-CG2 3.9Å; F88-T121 HydrophobicContact CZ-CG2 3.88Å; F88-F123 HydrophobicContact CD2-CZ 4.28Å; F88-F123 HydrophobicContact CE2-CZ 4.4Å; F88-F123 HydrophobicContact CG-CZ 4.5Å; F88-T152 CarbonylContact O-C 3.55Å; F88-T152 WeakPolarHBondContact O-CA 3.36Å; F88-T152 WeakPolarHBondContact O-CB 3.34Å; F88-T152 PolarHBondContact O-OG1 2.84Å; F88-L153 HydrophobicContact CB-CD2 4.1Å; F88-L153 HydrophobicContact CD1-CD2 3.99Å; F88-L153 PolarHBondContact N-O 3.19Å; F88-L153 PolarHBondContact O-N 2.89Å; F88-L155 HydrophobicContact CB-CD1 4.24Å; F88-F179 HydrophobicContact CE2-CD1 4.28Å; F88-F179 HydrophobicContact CE2-CD2 4.24Å; F88-F179 HydrophobicContact CE2-CE1 4.05Å; F88-F179 HydrophobicContact CE2-CE2 4.01Å; F88-F179 HydrophobicContact CE2-CG 4.37Å; F88-F179 AromaticContact CE2-CZ 3.92Å; F88-F179 HydrophobicContact CE2-CZ 3.92Å; F88-F179 AromaticContact CZ-CD2 3.87Å; F88-F179 HydrophobicContact CZ-CD2 3.87Å; F88-F179 AromaticContact CZ-CE2 3.82Å; F88-F179 HydrophobicContact CZ-CE2 3.82Å; F88-F179 HydrophobicContact CZ-CG 4.29Å; F88-F179 HydrophobicContact CZ-CZ 4.21Å
89	A	96.1	Very high	95.1	Very high	14 Å²	14	40.2 Å²	40.2	12%	0.116	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	134.3	-176.6	0	0	0	0	0	111	T65 D66 L150 Y151	T65-A89 WeakPolarHBondContact CA-O 3.48Å; D66-A89 HydrophobicContact CB-CB 4.23Å; D66-A89 PolarHBondContact N-O 3.17Å; D66-A89 WeakPolarHBondContact O-CA 3.1Å; D66-A89 PolarHBondContact O-N 3.04Å; A89-L150 HydrophobicContact CB-CD1 4.31Å; A89-Y151 WeakPolarHBondContact CA-O 3.3Å
90	Q	97.1	Very high	95.1	Very high	4 Å²	4	44.6 Å²	44.6	2%	0.019	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	135.2	-176.4	-58.8	-175.7	-68.5	0	0	109.2	I63 H64 F88 W92 T121 L150 Y151	I63-Q90 HydrophobicContact CG2-CB 4.05Å; I63-Q90 HydrophobicContact CG2-CG 4.48Å; H64-Q90 CarbonylContact O-C 3.47Å; H64-Q90 WeakPolarHBondContact O-CA 3.42Å; F88-Q90 HydrophobicContact CD1-CG 3.96Å; F88-Q90 HydrophobicContact CE1-CG 3.52Å; F88-Q90 HydrophobicContact CZ-CG 4.12Å; Q90-W92 HydrophobicContact CB-CE3 4.36Å; Q90-W92 HydrophobicContact CB-CZ3 4.13Å; Q90-T121 PolarHBondContact NE2-OG1 2.9Å; Q90-L150 WeakPolarHBondContact O-CA 3.38Å; Q90-Y151 PolarHBondContact N-O 2.79Å; Q90-Y151 PolarHBondContact O-N 2.81Å
91	T	97.3	Very high	94.8	Very high	7 Å²	7	43.8 Å²	43.8	4%	0.043	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	126.2	178.9	-48.1	0	0	0	0	109.7	H64 R148 V149 L150 K194	H64-T91 PolarHBondContact N-O 2.83Å; H64-T91 PolarHBondContact O-N 2.91Å; T91-R148 HydrophobicContact CG2-CG 3.53Å; T91-V149 WeakPolarHBondContact CA-O 3.48Å; T91-V149 WeakPolarHBondContact CG2-O 3.13Å; T91-L150 WeakPolarHBondContact OG1-CD1 3.48Å; T91-K194 PolarHBondContact OG1-NZ 2.72Å
92	W	97.1	Very high	94.5	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	174.1	173.8	66.4	95.9	0	0	0	110.4	T61 I63 Q90 W117 I118 P119 R148 V149 Y151	T61-W92 HydrophobicContact CG2-CB 4.1Å; I63-W92 HydrophobicContact CG1-CB 4.34Å; Q90-W92 HydrophobicContact CB-CE3 4.36Å; Q90-W92 HydrophobicContact CB-CZ3 4.13Å; W92-W117 HydrophobicContact CD2-CZ3 4.39Å; W92-W117 HydrophobicContact CG-CZ3 4.39Å; W92-W117 HydrophobicContact CZ2-CE3 4.48Å; W92-W117 WeakPolarHBondContact CZ2-O 3.38Å; W92-W117 AromaticContact NE1-CE3 3.88Å; W92-W117 AromaticContact NE1-CZ3 3.87Å; W92-I118 HydrophobicContact CH2-CG2 4.43Å; W92-P119 HydrophobicContact CE3-CG 4.44Å; W92-P119 HydrophobicContact CZ3-CG 4.14Å; W92-R148 CarbonylContact O-C 3.59Å; W92-R148 WeakPolarHBondContact O-CA 3.34Å; W92-V149 HydrophobicContact CD2-CB 4.22Å; W92-V149 HydrophobicContact CH2-CG1 3.89Å; W92-V149 HydrophobicContact CZ2-CB 3.97Å; W92-V149 HydrophobicContact CZ2-CG1 3.59Å; W92-V149 PolarHBondContact N-O 3.42Å; W92-V149 VanDerWaalsContact N-O 3.08Å; W92-V149 PolarHBondContact O-N 3.02Å; W92-Y151 HydrophobicContact CH2-CG 4.36Å
93	Y	96.7	Very high	94.1	Very high	96 Å²	96	49.4 Å²	49.4	38%	0.376	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	128.5	174.7	-84.9	-86.3	0	0	0	109.9	D146 R148	Y93-D146 VanDerWaalsContact CE1-OD2 3.27Å; Y93-D146 WeakPolarHBondContact CE1-OD2 3.35Å; Y93-D146 PolarHBondContact OH-OD2 2.74Å; Y93-R148 HydrophobicContact CD1-CB 4.16Å; Y93-R148 HydrophobicContact CE1-CB 3.75Å; Y93-R148 HydrophobicContact CE2-CG 4.41Å; Y93-R148 VanDerWaalsContact OH-CZ 3.31Å; Y93-R148 PolarHBondContact OH-NE 3.1Å; Y93-R148 PolarHBondContact OH-NH2 3.48Å
94	D	96.5	Very high	93.8	Very high	2 Å²	2	55 Å²	55	1%	0.011	26%	0.259	C	S	.	.			trans	-124.7	111.4	170	-169.9	-19.9	0	0	0	109	Y48 P54 R96 L97 G147 V149	Y48-D94 PolarHBondContact OH-OD2 2.83Å; P54-D94 HydrophobicContact CB-CB 4.15Å; P54-D94 HydrophobicContact CG-CB 4.49Å; D94-R96 PolarHBondContact O-N 3.49Å; D94-R96 VanDerWaalsContact OD1-CB 3.3Å; D94-R96 WeakPolarHBondContact OD1-CB 3.3Å; D94-R96 IonicContact OD1-CZ 3.55Å; D94-R96 PolarHBondContact OD1-N 3.41Å; D94-R96 IonicContact OD1-NE 2.7Å; D94-R96 PolarHBondContact OD1-NE 3.38Å; D94-R96 IonicContact OD1-NH2 2.84Å; D94-R96 IonicContact OD2-CZ 3.95Å; D94-R96 IonicContact OD2-NE 3.89Å; D94-R96 PolarHBondContact OD2-NE 3.15Å; D94-R96 IonicContact OD2-NH2 3.77Å; D94-R96 PolarHBondContact OD2-NH2 2.97Å; D94-L97 HydrophobicContact CB-CB 4.4Å; D94-L97 HydrophobicContact CB-CD1 4.07Å; D94-L97 HydrophobicContact CB-CG 4.27Å; D94-L97 PolarHBondContact O-N 2.83Å; D94-L97 VanDerWaalsContact O-N 3.17Å; D94-G147 PolarHBondContact N-O 3.03Å; D94-G147 WeakPolarHBondContact O-CA 3.47Å; D94-V149 HydrophobicContact CB-CG2 4.46Å
95	R	93.5	Very high	93.8	Very high	171 Å²	171	56.8 Å²	56.8	65%	0.645	27%	0.27	S	S	*	.	G	3₁₀ helix	trans	-63.6	-26.2	-178.5	-65.7	-173.8	-178.3	136.1	11.5	113.1	D55 L97 K98	D55-R95 IonicContact OD1-CZ 4Å; D55-R95 VanDerWaalsContact OD1-CZ 3.29Å; D55-R95 IonicContact OD1-NE 2.74Å; D55-R95 IonicContact OD1-NH1 3.96Å; D55-R95 PolarHBondContact OD1-NH1 3.19Å; D55-R95 IonicContact OD1-NH2 3.29Å; D55-R95 IonicContact OD2-CZ 3.97Å; D55-R95 IonicContact OD2-NE 3.82Å; D55-R95 IonicContact OD2-NH1 3.8Å; D55-R95 IonicContact OD2-NH2 3.64Å; R95-L97 PolarHBondContact O-N 3.08Å; R95-K98 WeakPolarHBondContact O-CB 3.28Å; R95-K98 PolarHBondContact O-N 3.04Å
96	R	94.6	Very high	93.6	Very high	83 Å²	83	56.5 Å²	56.5	31%	0.313	27%	0.268	S	S	.	.	G	3₁₀ helix	trans	-70.8	-24.4	179.6	-57.7	171.7	-68.3	-180	-0	111.9	Y48 D49 L52 D94 K98	Y48-R96 HydrophobicContact CD2-CB 3.93Å; Y48-R96 HydrophobicContact CE2-CB 3.88Å; Y48-R96 PolarHBondContact OH-NH2 2.91Å; Y48-R96 VanDerWaalsContact OH-NH2 3.1Å; D49-R96 PolarHBondContact O-NH1 2.82Å; L52-R96 PolarHBondContact O-NH1 3Å; L52-R96 PolarHBondContact O-NH2 2.84Å; D94-R96 PolarHBondContact O-N 3.49Å; D94-R96 VanDerWaalsContact OD1-CB 3.3Å; D94-R96 WeakPolarHBondContact OD1-CB 3.3Å; D94-R96 IonicContact OD1-CZ 3.55Å; D94-R96 PolarHBondContact OD1-N 3.41Å; D94-R96 IonicContact OD1-NE 2.7Å; D94-R96 PolarHBondContact OD1-NE 3.38Å; D94-R96 IonicContact OD1-NH2 2.84Å; D94-R96 IonicContact OD2-CZ 3.95Å; D94-R96 IonicContact OD2-NE 3.89Å; D94-R96 PolarHBondContact OD2-NE 3.15Å; D94-R96 IonicContact OD2-NH2 3.77Å; D94-R96 PolarHBondContact OD2-NH2 2.97Å; R96-K98 VanDerWaalsContact C-N 3.31Å
97	L	94.7	Very high	93.5	Very high	1 Å²	1	65.3 Å²	65.3	1%	0.005	30%	0.302	C	S	.	.	G	3₁₀ helix	trans	-93.9	15.6	179.9	-62.9	175.4	0	0	0	112.9	L44 Y48 D94 R95 I116 I143 V149	L44-L97 HydrophobicContact CB-CD2 4.49Å; Y48-L97 HydrophobicContact CD2-CD2 4.11Å; Y48-L97 HydrophobicContact CE2-CD1 4.39Å; Y48-L97 HydrophobicContact CE2-CD2 3.86Å; Y48-L97 HydrophobicContact CE2-CG 3.93Å; D94-L97 HydrophobicContact CB-CB 4.4Å; D94-L97 HydrophobicContact CB-CD1 4.07Å; D94-L97 HydrophobicContact CB-CG 4.27Å; D94-L97 PolarHBondContact O-N 2.83Å; D94-L97 VanDerWaalsContact O-N 3.17Å; R95-L97 PolarHBondContact O-N 3.08Å; L97-I116 HydrophobicContact CD1-CG2 4.21Å; L97-I116 HydrophobicContact CD2-CG2 4.29Å; L97-I143 HydrophobicContact CB-CG2 4.2Å; L97-I143 HydrophobicContact CD1-CD1 4.26Å; L97-V149 HydrophobicContact CD1-CG2 3.69Å
98	K	94.5	Very high	93.3	Very high	144 Å²	144	63.1 Å²	63.1	63%	0.626	29%	0.293	S	S	*	.			trans	-78.6	127.5	175.1	-169.5	-177.5	-179.3	-179.5	0	109.8	R95 R96 N145	R95-K98 WeakPolarHBondContact O-CB 3.28Å; R95-K98 PolarHBondContact O-N 3.04Å; R96-K98 VanDerWaalsContact C-N 3.31Å; K98-N145 VanDerWaalsContact CG-O 3.32Å; K98-N145 WeakPolarHBondContact CG-O 3.39Å
99	F	92.7	Very high	93	Very high	16 Å²	16	67.8 Å²	67.8	7%	0.07	32%	0.318	C	S	.	.			trans	-129.8	145.1	177	62	-84.2	0	0	0	110.7	I40 L44 I103 L106 I143 W144 N145	I40-F99 HydrophobicContact CG2-CB 3.85Å; I40-F99 HydrophobicContact CG2-CD2 3.99Å; I40-F99 HydrophobicContact CG2-CG 3.92Å; L44-F99 HydrophobicContact CD1-CB 4.18Å; L44-F99 HydrophobicContact CD1-CD1 3.98Å; L44-F99 HydrophobicContact CD1-CG 4.31Å; L44-F99 HydrophobicContact CD2-CB 4.01Å; L44-F99 HydrophobicContact CG-CB 4.37Å; F99-I103 VanDerWaalsContact CE2-O 3.29Å; F99-I103 WeakPolarHBondContact CE2-O 3.4Å; F99-L106 HydrophobicContact CD1-CD1 4.08Å; F99-L106 HydrophobicContact CE1-CD1 3.61Å; F99-L106 HydrophobicContact CE1-CG 3.99Å; F99-L106 HydrophobicContact CE2-CD1 4.08Å; F99-L106 HydrophobicContact CE2-CG 4.13Å; F99-L106 HydrophobicContact CZ-CD1 3.63Å; F99-L106 HydrophobicContact CZ-CD2 4.49Å; F99-L106 HydrophobicContact CZ-CG 3.58Å; F99-I143 HydrophobicContact CE1-CG2 4.09Å; F99-W144 WeakPolarHBondContact CE1-O 3.49Å; F99-N145 HydrophobicContact CD2-CB 4.5Å; F99-N145 HydrophobicContact CE1-CB 4.41Å; F99-N145 HydrophobicContact CE2-CB 4.03Å; F99-N145 HydrophobicContact CZ-CB 3.96Å
100	N	89.9	Confident	92.7	Very high	172 Å²	172	67.6 Å²	67.6	92%	0.92	32%	0.316	S	S	*	.			trans	-103.4	108.6	175.5	-167.8	5.5	0	0	0	109.2
101	S	86.1	Confident	92.3	Very high	33 Å²	33	73.4 Å²	73.4	23%	0.231	35%	0.347	C	S	.	.	S	Bend	trans	-154.8	167	179.6	-176.6	0	0	0	0	109.9	I40 I103	I40-S101 WeakPolarHBondContact CD1-OG 3.3Å; S101-I103 PolarHBondContact O-N 2.96Å; S101-I103 PolarHBondContact OG-N 2.97Å
102	T	87.3	Confident	92	Very high	135 Å²	135	73.7 Å²	73.7	83%	0.828	35%	0.349	S	S	*	.	S	Bend	trans	-64.6	-23.7	169.9	52	0	0	0	0	112
103	I	87.7	Confident	91.8	Very high	25 Å²	25	73.8 Å²	73.8	13%	0.128	35%	0.349	C	S	.	.			trans	-77.6	122.6	179.5	-52.3	167.2	0	0	0	109.9	V32 V37 I40 F99 S101 L106	V32-I103 HydrophobicContact CG1-CD1 3.47Å; V32-I103 VanDerWaalsContact CG1-CD1 3.47Å; V32-I103 HydrophobicContact CG1-CG1 4.01Å; V32-I103 HydrophobicContact CG2-CG1 4.46Å; V37-I103 HydrophobicContact CG2-CD1 3.59Å; I40-I103 HydrophobicContact CD1-CD1 4.48Å; F99-I103 VanDerWaalsContact CE2-O 3.29Å; F99-I103 WeakPolarHBondContact CE2-O 3.4Å; S101-I103 PolarHBondContact O-N 2.96Å; S101-I103 PolarHBondContact OG-N 2.97Å; I103-L106 HydrophobicContact CD1-CD2 4.35Å; I103-L106 HydrophobicContact CG2-CD2 3.92Å
104	K	89.1	Confident	91.5	Very high	157 Å²	157	72.2 Å²	72.2	68%	0.683	36%	0.362	S	S	*	.	S	Bend	trans	-80	-35.2	179.6	-66.2	-174.9	178.6	-179.1	0	113.8	W144 N145	K104-W144 WeakPolarHBondContact O-CA 3.43Å; K104-N145 PolarHBondContact O-N 3.34Å
105	V	93.6	Very high	91.4	Very high	38 Å²	38	77.8 Å²	77.8	23%	0.23	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	125	-173.5	-173.2	0	0	0	0	110.5	R142 I143 W144	V105-R142 HydrophobicContact CG1-CB 4.25Å; V105-I143 WeakPolarHBondContact CA-O 3.45Å; V105-W144 HydrophobicContact CG1-CD2 4.46Å; V105-W144 VanDerWaalsContact CG2-CD1 3.49Å; V105-W144 HydrophobicContact CG2-CD2 4.38Å; V105-W144 HydrophobicContact CG2-CG 4.05Å
106	L	92.1	Very high	91.5	Very high	7 Å²	7	69.9 Å²	69.9	4%	0.037	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	120.4	170.6	-61.2	174.7	0	0	0	108.9	V37 I40 L44 F99 I103 L108 R142 I143	V37-L106 HydrophobicContact CG1-CD2 4.06Å; I40-L106 HydrophobicContact CG2-CD1 4.19Å; L44-L106 HydrophobicContact CD1-CD1 4.4Å; F99-L106 HydrophobicContact CD1-CD1 4.08Å; F99-L106 HydrophobicContact CE1-CD1 3.61Å; F99-L106 HydrophobicContact CE1-CG 3.99Å; F99-L106 HydrophobicContact CE2-CD1 4.08Å; F99-L106 HydrophobicContact CE2-CG 4.13Å; F99-L106 HydrophobicContact CZ-CD1 3.63Å; F99-L106 HydrophobicContact CZ-CD2 4.49Å; F99-L106 HydrophobicContact CZ-CG 3.58Å; I103-L106 HydrophobicContact CD1-CD2 4.35Å; I103-L106 HydrophobicContact CG2-CD2 3.92Å; L106-L108 HydrophobicContact CB-CD2 4.37Å; L106-L108 HydrophobicContact CB-CG 4.32Å; L106-R142 WeakPolarHBondContact O-CA 3.37Å; L106-I143 PolarHBondContact N-O 3.08Å; L106-I143 PolarHBondContact O-N 2.97Å
107	R	93.3	Very high	91.5	Very high	185 Å²	185	66.3 Å²	66.3	70%	0.698	34%	0.343	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.9	112.7	172.9	-60.5	-178.6	-176.8	91.6	-2.7	107.4	R142	R107-R142 HydrophobicContact CG-CG 4.32Å
108	L	91.4	Very high	91.6	Very high	31 Å²	31	69.3 Å²	69.3	16%	0.162	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	150.2	-171.1	-59.7	173.6	0	0	0	110.5	L41 L106 M112 L141 I143	L41-L108 HydrophobicContact CD1-CD1 4.15Å; L41-L108 HydrophobicContact CD1-CD2 4.3Å; L106-L108 HydrophobicContact CB-CD2 4.37Å; L106-L108 HydrophobicContact CB-CG 4.32Å; L108-M112 HydrophobicContact CB-CB 4.17Å; L108-M112 HydrophobicContact CB-CG 4.39Å; L108-M112 HydrophobicContact CD1-CG 3.89Å; L108-L141 HydrophobicContact CB-CB 4.32Å; L108-L141 HydrophobicContact CB-CD2 4.22Å; L108-L141 HydrophobicContact CB-CG 4.43Å; L108-L141 HydrophobicContact CD1-CD2 4.14Å; L108-L141 PolarHBondContact N-O 2.78Å; L108-I143 HydrophobicContact CD1-CD1 3.58Å; L108-I143 HydrophobicContact CD1-CG1 4.04Å
109	N	90.9	Very high	91.7	Very high	102 Å²	102	63 Å²	63	55%	0.545	33%	0.332	S	S	.	.			trans	-74.4	161	176.5	-164.7	-6.3	0	0	0	111	N111 M112	N109-N111 PolarHBondContact O-N 3.14Å; N109-N111 VanDerWaalsContact O-N 3.14Å; N109-M112 WeakPolarHBondContact O-CB 3.47Å; N109-M112 PolarHBondContact O-N 3.08Å
110	S	90.4	Very high	91.8	Very high	10 Å²	10	64.4 Å²	64.4	7%	0.07	34%	0.34	C	S	.	.	G	3₁₀ helix	trans	-56.1	-27.9	179	60.9	0	0	0	0	113.7	M112 V113	S110-M112 PolarHBondContact O-N 3.47Å; S110-M112 VanDerWaalsContact O-N 3.17Å; S110-V113 VanDerWaalsContact O-CB 3.29Å; S110-V113 WeakPolarHBondContact O-CB 3.44Å; S110-V113 WeakPolarHBondContact O-CG2 3.44Å; S110-V113 PolarHBondContact O-N 2.87Å
111	N	88.9	Confident	92.2	Very high	126 Å²	126	57.7 Å²	57.7	67%	0.674	31%	0.306	S	S	*	.	G	3₁₀ helix	trans	-58.7	-26.6	175.1	-67.3	-19.9	0	0	0	113.7	N109 V113	N109-N111 PolarHBondContact O-N 3.14Å; N109-N111 VanDerWaalsContact O-N 3.14Å; N111-V113 VanDerWaalsContact C-N 3.34Å
112	M	91.8	Very high	92.7	Very high	14 Å²	14	59.4 Å²	59.4	7%	0.069	31%	0.309	C	S	.	.	G	3₁₀ helix	trans	-76.2	-23.6	178.5	-172.9	66.5	177.2	0	0	112.6	L41 L45 L108 N109 S110 G114 K115 I116 L141	L41-M112 HydrophobicContact CD1-CE 3.39Å; L41-M112 HydrophobicContact CD1-SD 4.06Å; L41-M112 HydrophobicContact CD2-SD 4.29Å; L41-M112 HydrophobicContact CG-CE 4.11Å; L41-M112 HydrophobicContact CG-SD 4.44Å; L45-M112 HydrophobicContact CD1-CE 3.74Å; L45-M112 HydrophobicContact CD1-SD 4.07Å; L45-M112 HydrophobicContact CD2-CE 3.52Å; L45-M112 HydrophobicContact CG-CE 3.74Å; L108-M112 HydrophobicContact CB-CB 4.17Å; L108-M112 HydrophobicContact CB-CG 4.39Å; L108-M112 HydrophobicContact CD1-CG 3.89Å; N109-M112 WeakPolarHBondContact O-CB 3.47Å; N109-M112 PolarHBondContact O-N 3.08Å; S110-M112 PolarHBondContact O-N 3.47Å; S110-M112 VanDerWaalsContact O-N 3.17Å; M112-G114 PolarHBondContact O-N 2.69Å; M112-K115 PolarHBondContact O-N 2.86Å; M112-K115 HydrophobicContact SD-CB 4.29Å; M112-K115 HydrophobicContact SD-CD 4.09Å; M112-I116 HydrophobicContact CE-CG2 4.14Å; M112-L141 HydrophobicContact CB-CD2 4Å; M112-L141 HydrophobicContact CG-CD2 3.77Å
113	V	91.9	Very high	93.2	Very high	2 Å²	2	54 Å²	54	1%	0.012	27%	0.274	C	S	.	.	G	3₁₀ helix	trans	-59.3	-34.5	-175.1	178.3	0	0	0	0	111.5	S110 N111 K115 I118 R139 L141 Y151	S110-V113 VanDerWaalsContact O-CB 3.29Å; S110-V113 WeakPolarHBondContact O-CB 3.44Å; S110-V113 WeakPolarHBondContact O-CG2 3.44Å; S110-V113 PolarHBondContact O-N 2.87Å; N111-V113 VanDerWaalsContact C-N 3.34Å; V113-K115 PolarHBondContact O-N 3.05Å; V113-I118 HydrophobicContact CG1-CD1 4.41Å; V113-I118 HydrophobicContact CG1-CG2 4.03Å; V113-R139 HydrophobicContact CG2-CB 4.5Å; V113-L141 HydrophobicContact CG2-CB 4.17Å; V113-L141 HydrophobicContact CG2-CD2 4.44Å; V113-Y151 HydrophobicContact CG1-CD2 4.28Å; V113-Y151 HydrophobicContact CG1-CE2 3.63Å; V113-Y151 HydrophobicContact CG2-CD2 4.35Å; V113-Y151 HydrophobicContact CG2-CE2 4.03Å
114	G	90.6	Very high	93.6	Very high	62 Å²	62	56.7 Å²	56.7	64%	0.639	28%	0.283	S	S	*	.	G	3₁₀ helix	trans	-72.6	-10.8	178.3	0	0	0	0	0	115.3	N50 M112	N50-G114 PolarHBondContact ND2-O 2.92Å; M112-G114 PolarHBondContact O-N 2.69Å
115	K	93.6	Very high	93.9	Very high	119 Å²	119	50.1 Å²	50.1	52%	0.517	26%	0.255	S	S	.	.	G	3₁₀ helix	trans	-96.7	-17	-178.3	-62.3	-169.5	178.6	-174.5	0	113.6	L45 M112 V113	L45-K115 HydrophobicContact CD1-CD 3.79Å; L45-K115 HydrophobicContact CD2-CB 4.03Å; M112-K115 PolarHBondContact O-N 2.86Å; M112-K115 HydrophobicContact SD-CB 4.29Å; M112-K115 HydrophobicContact SD-CD 4.09Å; V113-K115 PolarHBondContact O-N 3.05Å
116	I	95.5	Very high	94	Very high	6 Å²	6	50 Å²	50	3%	0.031	26%	0.255	C	S	.	.	S	Bend	trans	-107.7	160.9	180	61.9	162.6	0	0	0	110.6	Y48 L97 M112 I118 L141 V149	Y48-I116 HydrophobicContact CE1-CB 4.27Å; Y48-I116 HydrophobicContact CE1-CG2 4.48Å; L97-I116 HydrophobicContact CD1-CG2 4.21Å; L97-I116 HydrophobicContact CD2-CG2 4.29Å; M112-I116 HydrophobicContact CE-CG2 4.14Å; I116-I118 HydrophobicContact CG1-CG2 4.41Å; I116-L141 HydrophobicContact CD1-CD1 3.57Å; I116-L141 HydrophobicContact CD1-CD2 3.66Å; I116-L141 HydrophobicContact CD1-CG 4.26Å; I116-L141 HydrophobicContact CG1-CD2 4.38Å; I116-V149 HydrophobicContact CD1-CG1 4.3Å
117	W	96.4	Very high	94.1	Very high	8 Å²	8	54.3 Å²	54.3	3%	0.03	27%	0.274	C	S	.	.			trans	-68.4	136.9	169.7	177.8	86.5	0	0	0	110.1	Y48 R53 P54 W92 P119 Y184 I189	Y48-W117 PolarHBondContact OH-N 3.37Å; Y48-W117 VanDerWaalsContact OH-N 3.08Å; R53-W117 HydrophobicContact CB-CD2 4.21Å; R53-W117 HydrophobicContact CB-CH2 4.41Å; R53-W117 HydrophobicContact CB-CZ2 3.68Å; P54-W117 HydrophobicContact CG-CE3 4.14Å; P54-W117 HydrophobicContact CG-CZ3 4.1Å; W92-W117 HydrophobicContact CD2-CZ3 4.39Å; W92-W117 HydrophobicContact CG-CZ3 4.39Å; W92-W117 HydrophobicContact CZ2-CE3 4.48Å; W92-W117 WeakPolarHBondContact CZ2-O 3.38Å; W92-W117 AromaticContact NE1-CE3 3.88Å; W92-W117 AromaticContact NE1-CZ3 3.87Å; W117-P119 HydrophobicContact CH2-CB 3.95Å; W117-P119 HydrophobicContact CZ2-CB 4.43Å; W117-P119 HydrophobicContact CZ3-CB 4.47Å; W117-Y184 HydrophobicContact CZ2-CE2 4.18Å; W117-Y184 PolarHBondContact NE1-OH 2.94Å; W117-I189 HydrophobicContact CH2-CD1 3.88Å; W117-I189 HydrophobicContact CZ2-CD1 3.76Å
118	I	96.1	Very high	94.2	Very high	64 Å²	64	50.8 Å²	50.8	33%	0.328	26%	0.264	S	S	.	.			trans	-128.6	145	173.9	57	173.7	0	0	0	109.2	W92 V113 I116	W92-I118 HydrophobicContact CH2-CG2 4.43Å; V113-I118 HydrophobicContact CG1-CD1 4.41Å; V113-I118 HydrophobicContact CG1-CG2 4.03Å; I116-I118 HydrophobicContact CG1-CG2 4.41Å
119	P	96.6	Very high	94.4	Very high	10 Å²	10	51.7 Å²	51.7	7%	0.065	28%	0.276	C	S	.	.			trans	-67.8	147.3	176.6	29.8	-35.9	0	0	0	111.7	I63 W92 W117 T121	I63-P119 HydrophobicContact CD1-CB 3.47Å; I63-P119 VanDerWaalsContact CD1-CB 3.47Å; I63-P119 HydrophobicContact CD1-CG 4.02Å; W92-P119 HydrophobicContact CE3-CG 4.44Å; W92-P119 HydrophobicContact CZ3-CG 4.14Å; W117-P119 HydrophobicContact CH2-CB 3.95Å; W117-P119 HydrophobicContact CZ2-CB 4.43Å; W117-P119 HydrophobicContact CZ3-CB 4.47Å; P119-T121 VanDerWaalsContact C-N 3.25Å; P119-T121 PolarHBondContact O-N 2.98Å; P119-T121 VanDerWaalsContact O-N 3.16Å
120	D	95.6	Very high	94.7	Very high	47 Å²	47	50 Å²	50	25%	0.251	27%	0.267	S	S	.	.			trans	-89.6	47	-175.9	67.4	-17.5	0	0	0	112.4	F122 S181 Y182 G183 Y184	D120-F122 PolarHBondContact O-N 3.32Å; D120-S181 WeakPolarHBondContact OD1-CB 3.45Å; D120-S181 PolarHBondContact OD1-OG 3.39Å; D120-S181 PolarHBondContact OD2-OG 3.22Å; D120-Y182 PolarHBondContact O-N 2.75Å; D120-Y182 PolarHBondContact OD2-N 2.86Å; D120-G183 WeakPolarHBondContact OD2-CA 3.48Å; D120-G183 PolarHBondContact OD2-N 2.87Å; D120-Y184 HydrophobicContact CB-CE2 4.43Å; D120-Y184 VanDerWaalsContact OD1-CD2 3.3Å; D120-Y184 WeakPolarHBondContact OD1-CD2 3.29Å; D120-Y184 WeakPolarHBondContact OD2-CD2 3.47Å
121	T	97	Very high	94.9	Very high	31 Å²	31	51.1 Å²	51.1	19%	0.19	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	127.3	-176.8	-48.9	0	0	0	0	111.1	F88 Q90 P119 F179 S180 Y191	F88-T121 HydrophobicContact CE1-CG2 3.9Å; F88-T121 HydrophobicContact CZ-CG2 3.88Å; Q90-T121 PolarHBondContact NE2-OG1 2.9Å; P119-T121 VanDerWaalsContact C-N 3.25Å; P119-T121 PolarHBondContact O-N 2.98Å; P119-T121 VanDerWaalsContact O-N 3.16Å; T121-F179 HydrophobicContact CG2-CB 4.05Å; T121-F179 HydrophobicContact CG2-CD2 3.72Å; T121-F179 HydrophobicContact CG2-CG 4.26Å; T121-S180 WeakPolarHBondContact CA-O 3.46Å; T121-Y191 HydrophobicContact CG2-CE1 4.39Å; T121-Y191 PolarHBondContact OG1-OH 3.18Å
122	F	96.9	Very high	95.1	Very high	68 Å²	68	48 Å²	48	30%	0.298	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	155.9	175	82.6	-73.7	0	0	0	110.8	D120 R124 F179 S180 S181 Y182	D120-F122 PolarHBondContact O-N 3.32Å; F122-R124 HydrophobicContact CE1-CG 4.48Å; F122-R124 HydrophobicContact CE2-CB 4.43Å; F122-R124 HydrophobicContact CE2-CG 3.8Å; F122-R124 HydrophobicContact CZ-CG 3.72Å; F122-F179 VanDerWaalsContact O-CA 3.23Å; F122-F179 WeakPolarHBondContact O-CA 3.3Å; F122-F179 WeakPolarHBondContact O-CB 3.36Å; F122-S180 WeakPolarHBondContact CD1-O 3.37Å; F122-S180 VanDerWaalsContact CE1-OG 3.28Å; F122-S180 WeakPolarHBondContact CE1-OG 3.33Å; F122-S180 PolarHBondContact N-O 2.76Å; F122-S180 PolarHBondContact O-N 2.88Å; F122-S180 VanDerWaalsContact O-N 3.07Å; F122-S181 WeakPolarHBondContact CE1-O 3.38Å; F122-Y182 AromaticContact CD1-CD2 3.89Å; F122-Y182 HydrophobicContact CD1-CD2 3.89Å; F122-Y182 HydrophobicContact CD1-CG 4.26Å; F122-Y182 HydrophobicContact CD2-CD2 4.44Å; F122-Y182 AromaticContact CE1-CD2 3.78Å; F122-Y182 HydrophobicContact CE1-CD2 3.78Å; F122-Y182 HydrophobicContact CE1-CG 4.32Å; F122-Y182 HydrophobicContact CE2-CD2 4.33Å; F122-Y182 HydrophobicContact CG-CD2 4.22Å; F122-Y182 HydrophobicContact CZ-CD2 4Å
123	F	97.8	Very high	95.1	Very high	22 Å²	22	56 Å²	56	10%	0.096	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	121.2	176.5	-65.7	-87.5	0	0	0	109.4	I86 F88 L155 I157 L177 E178 F179	I86-F123 HydrophobicContact CD1-CE1 4.28Å; I86-F123 HydrophobicContact CD1-CZ 3.96Å; F88-F123 HydrophobicContact CD2-CZ 4.28Å; F88-F123 HydrophobicContact CE2-CZ 4.4Å; F88-F123 HydrophobicContact CG-CZ 4.5Å; F123-L155 HydrophobicContact CE2-CD1 3.6Å; F123-L155 HydrophobicContact CZ-CD1 4.13Å; F123-I157 HydrophobicContact CD1-CD1 3.85Å; F123-I157 HydrophobicContact CD2-CD1 3.64Å; F123-I157 HydrophobicContact CD2-CG1 4.43Å; F123-I157 HydrophobicContact CE1-CD1 3.65Å; F123-I157 HydrophobicContact CE2-CD1 3.47Å; F123-I157 VanDerWaalsContact CE2-CD1 3.47Å; F123-I157 HydrophobicContact CE2-CG1 4.5Å; F123-I157 HydrophobicContact CG-CD1 3.84Å; F123-I157 HydrophobicContact CZ-CD1 3.46Å; F123-I157 VanDerWaalsContact CZ-CD1 3.46Å; F123-L177 HydrophobicContact CD1-CD1 3.64Å; F123-L177 HydrophobicContact CD1-CD2 4.47Å; F123-L177 HydrophobicContact CD1-CG 3.96Å; F123-L177 HydrophobicContact CE1-CD1 4.1Å; F123-L177 HydrophobicContact CE1-CD2 4.1Å; F123-L177 HydrophobicContact CE1-CG 4.05Å; F123-E178 CarbonylContact C-O 3.11Å; F123-E178 VanDerWaalsContact CA-O 3.25Å; F123-E178 WeakPolarHBondContact CA-O 3.46Å; F123-F179 HydrophobicContact CD1-CB 3.8Å; F123-F179 HydrophobicContact CE1-CB 3.92Å; F123-F179 HydrophobicContact CE1-CD1 4.06Å; F123-F179 HydrophobicContact CE1-CG 4.29Å; F123-F179 HydrophobicContact CG-CB 4.38Å
124	R	95.6	Very high	95.1	Very high	82 Å²	82	62.3 Å²	62.3	31%	0.309	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-42.2	-172.8	-74	179.5	150.3	-125.1	-5.5	112.6	F122 S126 E178 S180	F122-R124 HydrophobicContact CE1-CG 4.48Å; F122-R124 HydrophobicContact CE2-CB 4.43Å; F122-R124 HydrophobicContact CE2-CG 3.8Å; F122-R124 HydrophobicContact CZ-CG 3.72Å; R124-S126 VanDerWaalsContact C-N 3.31Å; R124-E178 HydrophobicContact CB-CB 4.27Å; R124-E178 PolarHBondContact N-O 2.87Å; R124-S180 PolarHBondContact NE-OG 3.02Å
125	N	96.2	Very high	95.1	Very high	19 Å²	19	66 Å²	66	10%	0.102	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.7	18.9	-179.1	71.3	-43.1	0	0	0	112.9	A159 E160 P176 E178	N125-A159 CarbonylContact O-C 3.59Å; N125-A159 VanDerWaalsContact O-CA 3.3Å; N125-A159 WeakPolarHBondContact O-CA 3.39Å; N125-E160 PolarHBondContact ND2-O 3.19Å; N125-E160 PolarHBondContact O-N 3.39Å; N125-P176 PolarHBondContact ND2-O 2.8Å; N125-E178 PolarHBondContact OD1-N 2.91Å
126	S	96.3	Very high	95	Very high	34 Å²	34	64 Å²	64	24%	0.238	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	122.9	176.5	165.2	0	0	0	0	110.5	R124 K128	R124-S126 VanDerWaalsContact C-N 3.31Å; S126-K128 PolarHBondContact OG-N 3.17Å; S126-K128 PolarHBondContact OG-O 3.04Å
127	K	94.5	Very high	94.9	Very high	99 Å²	99	66.5 Å²	66.5	43%	0.43	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	-39.1	166.4	-73.8	177.5	173.9	175.1	0	111.5	N79 E81 D158 E160	N79-K127 PolarHBondContact O-NZ 3.3Å; E81-K127 WeakPolarHBondContact OE2-CD 3.49Å; E81-K127 IonicContact OE2-NZ 2.87Å; E81-K127 PolarHBondContact OE2-NZ 2.76Å; K127-D158 PolarHBondContact N-O 3.03Å; K127-E160 HydrophobicContact CD-CG 4Å; K127-E160 WeakPolarHBondContact CE-OE1 3.15Å; K127-E160 HydrophobicContact CG-CG 3.67Å; K127-E160 WeakPolarHBondContact CG-OE1 3.45Å
128	K	95.1	Very high	94.7	Very high	110 Å²	110	68.7 Å²	68.7	48%	0.478	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	134.8	-179.6	-167.1	-173.5	-174.1	-132.2	0	109.3	S126 D130 D158	S126-K128 PolarHBondContact OG-N 3.17Å; S126-K128 PolarHBondContact OG-O 3.04Å; K128-D130 VanDerWaalsContact CE-OD2 3.25Å; K128-D130 WeakPolarHBondContact CE-OD2 3.44Å; K128-D130 IonicContact NZ-OD2 2.83Å; K128-D130 PolarHBondContact NZ-OD2 3.14Å; K128-D158 HydrophobicContact CB-CB 4.18Å; K128-D158 PolarHBondContact N-O 2.93Å; K128-D158 PolarHBondContact O-N 3.36Å
129	A	95.9	Very high	94.6	Very high	50 Å²	50	70.9 Å²	70.9	41%	0.413	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	124.2	174.7	0	0	0	0	0	109.6	T156 I157	A129-T156 WeakPolarHBondContact CA-O 3.34Å; A129-I157 HydrophobicContact CB-CG1 4.18Å; A129-I157 HydrophobicContact CB-CG2 4.49Å
130	D	95.3	Very high	94.5	Very high	67 Å²	67	73.6 Å²	73.6	36%	0.358	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	129.2	-179	-67.8	-46	0	0	0	109.9	K128 T156	K128-D130 VanDerWaalsContact CE-OD2 3.25Å; K128-D130 WeakPolarHBondContact CE-OD2 3.44Å; K128-D130 IonicContact NZ-OD2 2.83Å; K128-D130 PolarHBondContact NZ-OD2 3.14Å; D130-T156 PolarHBondContact N-O 3.22Å; D130-T156 PolarHBondContact O-N 3.36Å
131	A	94.8	Very high	94.5	Very high	34 Å²	34	71.4 Å²	71.4	28%	0.281	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	137.7	171.5	0	0	0	0	0	110.3	L155	A131-L155 HydrophobicContact CB-CD2 3.84Å
132	H	94	Very high	94.4	Very high	61 Å²	61	73.9 Å²	73.9	28%	0.282	37%	0.368	S	S	.	.			trans	-79.9	137.2	-177.6	-67.5	-95.2	0	0	0	112.3	D85 N138 R154 T156	D85-H132 IonicContact OD1-NE2 2.87Å; H132-N138 HydrophobicContact CB-CB 4.16Å; H132-N138 VanDerWaalsContact CB-ND2 3.27Å; H132-N138 WeakPolarHBondContact CB-ND2 3.33Å; H132-N138 WeakPolarHBondContact O-CB 3.23Å; H132-N138 PolarHBondContact O-N 2.85Å; H132-R154 PolarHBondContact N-O 2.8Å; H132-T156 PolarHBondContact CE1-OG1 2.84Å; H132-T156 PolarHBondContact NE2-OG1 2.71Å
133	W	91.9	Very high	94.4	Very high	181 Å²	181	70.7 Å²	70.7	69%	0.686	35%	0.354	S	S	*	.			trans	-129.1	6.2	-175.7	57	59.9	0	0	0	116.2	T135 T136	W133-T135 CarbonylContact O-C 3.54Å; W133-T136 CarbonylContact C-O 3.57Å; W133-T136 WeakPolarHBondContact CA-O 3.47Å; W133-T136 CarbonylContact O-C 3.45Å; W133-T136 WeakPolarHBondContact O-CA 3.4Å; W133-T136 PolarHBondContact O-N 3.29Å; W133-T136 VanDerWaalsContact O-O 3.07Å
134	I	91.5	Very high	94.3	Very high	135 Å²	135	72.6 Å²	72.6	69%	0.692	36%	0.36	S	S	*	.	S	Bend	trans	-99.9	129.9	-178.9	-58	177.3	0	0	0	109.2
135	T	90.9	Very high	94.2	Very high	138 Å²	138	71.6 Å²	71.6	85%	0.847	36%	0.361	S	S	*	.	S	Bend	cis	-81.5	-16.5	-6	51.6	0	0	0	0	113.7	W133	W133-T135 CarbonylContact O-C 3.54Å
136	T	91.6	Very high	94.1	Very high	78 Å²	78	73.6 Å²	73.6	48%	0.479	37%	0.372	S	S	.	.	S	Bend	trans	-133.2	167.3	170.5	59	0	0	0	0	108.8	W133 N138	W133-T136 CarbonylContact C-O 3.57Å; W133-T136 WeakPolarHBondContact CA-O 3.47Å; W133-T136 CarbonylContact O-C 3.45Å; W133-T136 WeakPolarHBondContact O-CA 3.4Å; W133-T136 PolarHBondContact O-N 3.29Å; W133-T136 VanDerWaalsContact O-O 3.07Å; T136-N138 PolarHBondContact O-N 3.05Å; T136-N138 VanDerWaalsContact O-N 3.09Å; T136-N138 PolarHBondContact O-OD1 2.9Å
137	P	92.7	Very high	94	Very high	58 Å²	58	72 Å²	72	38%	0.377	36%	0.361	S	S	.	.			trans	-51.7	119	175.6	-28.3	36.7	0	0	0	111.7	R139	P137-R139 PolarHBondContact O-N 2.89Å
138	N	93	Very high	94.1	Very high	55 Å²	55	71.6 Å²	71.6	29%	0.294	36%	0.357	S	S	.	.			trans	-76.2	68.1	-177.8	-71.7	-22.7	0	0	0	110.5	H132 T136 L153 R154	H132-N138 HydrophobicContact CB-CB 4.16Å; H132-N138 VanDerWaalsContact CB-ND2 3.27Å; H132-N138 WeakPolarHBondContact CB-ND2 3.33Å; H132-N138 WeakPolarHBondContact O-CB 3.23Å; H132-N138 PolarHBondContact O-N 2.85Å; T136-N138 PolarHBondContact O-N 3.05Å; T136-N138 VanDerWaalsContact O-N 3.09Å; T136-N138 PolarHBondContact O-OD1 2.9Å; N138-L153 WeakPolarHBondContact O-CA 3.41Å; N138-R154 HydrophobicContact CB-CB 4.17Å; N138-R154 PolarHBondContact O-N 3.43Å
139	R	93.9	Very high	94.2	Very high	109 Å²	109	66.4 Å²	66.4	41%	0.411	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	140.1	179.5	-62.5	178.5	-175	171.1	-0.2	108.2	V113 P137 Y151 T152 L153	V113-R139 HydrophobicContact CG2-CB 4.5Å; P137-R139 PolarHBondContact O-N 2.89Å; R139-Y151 HydrophobicContact CB-CE2 4.2Å; R139-Y151 HydrophobicContact CG-CE2 4.41Å; R139-T152 CarbonylContact C-O 3.56Å; R139-T152 WeakPolarHBondContact CA-O 3.32Å; R139-L153 HydrophobicContact CG-CB 4.18Å
140	M	93.4	Very high	94.2	Very high	68 Å²	68	65.4 Å²	65.4	34%	0.335	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	134	-177.9	161.8	-174.9	175.6	0	0	109.7	R142 Y151 T152	M140-R142 HydrophobicContact CE-CG 3.95Å; M140-Y151 WeakPolarHBondContact O-CA 3.44Å; M140-T152 HydrophobicContact CB-CG2 3.57Å; M140-T152 HydrophobicContact CG-CG2 3.84Å; M140-T152 PolarHBondContact N-O 2.87Å; M140-T152 PolarHBondContact O-N 3.21Å; M140-T152 HydrophobicContact SD-CG2 3.79Å
141	L	95.6	Very high	94.3	Very high	1 Å²	1	62.8 Å²	62.8	1%	0.005	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	127.4	-177.6	-176.9	65.1	0	0	0	109.7	L108 M112 V113 I116 I143 V149 L150	L108-L141 HydrophobicContact CB-CB 4.32Å; L108-L141 HydrophobicContact CB-CD2 4.22Å; L108-L141 HydrophobicContact CB-CG 4.43Å; L108-L141 HydrophobicContact CD1-CD2 4.14Å; L108-L141 PolarHBondContact N-O 2.78Å; M112-L141 HydrophobicContact CB-CD2 4Å; M112-L141 HydrophobicContact CG-CD2 3.77Å; V113-L141 HydrophobicContact CG2-CB 4.17Å; V113-L141 HydrophobicContact CG2-CD2 4.44Å; I116-L141 HydrophobicContact CD1-CD1 3.57Å; I116-L141 HydrophobicContact CD1-CD2 3.66Å; I116-L141 HydrophobicContact CD1-CG 4.26Å; I116-L141 HydrophobicContact CG1-CD2 4.38Å; L141-I143 HydrophobicContact CG-CG1 4.4Å; L141-V149 HydrophobicContact CD1-CG1 3.51Å; L141-L150 WeakPolarHBondContact CA-O 3.3Å
142	R	95.9	Very high	94.4	Very high	82 Å²	82	62.2 Å²	62.2	31%	0.309	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	131.6	170.4	-65.8	-174.6	173.1	162.6	6.6	109.9	V105 L106 R107 M140 W144 V149 L150	V105-R142 HydrophobicContact CG1-CB 4.25Å; L106-R142 WeakPolarHBondContact O-CA 3.37Å; R107-R142 HydrophobicContact CG-CG 4.32Å; M140-R142 HydrophobicContact CE-CG 3.95Å; R142-W144 HydrophobicContact CB-CE3 4.45Å; R142-W144 HydrophobicContact CB-CH2 4.08Å; R142-W144 HydrophobicContact CB-CZ3 3.82Å; R142-V149 CarbonylContact O-C 3.42Å; R142-V149 WeakPolarHBondContact O-CA 3.39Å; R142-L150 HydrophobicContact CB-CB 4.3Å; R142-L150 PolarHBondContact N-O 3.12Å; R142-L150 PolarHBondContact O-N 3.48Å
143	I	96.2	Very high	94.5	Very high	1 Å²	1	60.3 Å²	60.3	1%	0.005	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	125.4	176.3	-52.5	-179.3	0	0	0	107.8	L97 F99 V105 L106 L108 L141 R148 V149	L97-I143 HydrophobicContact CB-CG2 4.2Å; L97-I143 HydrophobicContact CD1-CD1 4.26Å; F99-I143 HydrophobicContact CE1-CG2 4.09Å; V105-I143 WeakPolarHBondContact CA-O 3.45Å; L106-I143 PolarHBondContact N-O 3.08Å; L106-I143 PolarHBondContact O-N 2.97Å; L108-I143 HydrophobicContact CD1-CD1 3.58Å; L108-I143 HydrophobicContact CD1-CG1 4.04Å; L141-I143 HydrophobicContact CG-CG1 4.4Å; I143-R148 WeakPolarHBondContact CA-O 3.42Å; I143-V149 HydrophobicContact CG1-CG2 4.49Å
144	W	96.4	Very high	94.7	Very high	62 Å²	62	55 Å²	55	24%	0.235	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	157.4	172.3	-75.6	-107.4	0	0	0	110.3	F99 K104 V105 R142 D146 G147 R148 L150	F99-W144 WeakPolarHBondContact CE1-O 3.49Å; K104-W144 WeakPolarHBondContact O-CA 3.43Å; V105-W144 HydrophobicContact CG1-CD2 4.46Å; V105-W144 VanDerWaalsContact CG2-CD1 3.49Å; V105-W144 HydrophobicContact CG2-CD2 4.38Å; V105-W144 HydrophobicContact CG2-CG 4.05Å; R142-W144 HydrophobicContact CB-CE3 4.45Å; R142-W144 HydrophobicContact CB-CH2 4.08Å; R142-W144 HydrophobicContact CB-CZ3 3.82Å; W144-D146 WeakPolarHBondContact CB-OD1 3.29Å; W144-D146 PolarHBondContact O-N 2.88Å; W144-D146 VanDerWaalsContact O-N 3.14Å; W144-G147 PolarHBondContact O-N 3.16Å; W144-R148 HydrophobicContact CB-CB 4.13Å; W144-R148 HydrophobicContact CD2-CB 4.49Å; W144-R148 HydrophobicContact CE3-CB 4.2Å; W144-R148 HydrophobicContact CE3-CG 4.1Å; W144-R148 HydrophobicContact CG-CB 4.5Å; W144-R148 PolarHBondContact N-O 2.86Å; W144-L150 HydrophobicContact CH2-CB 3.67Å; W144-L150 HydrophobicContact CH2-CD2 3.94Å; W144-L150 HydrophobicContact CH2-CG 4.46Å; W144-L150 HydrophobicContact CZ3-CB 3.38Å
145	N	93.9	Very high	94.9	Very high	62 Å²	62	49.4 Å²	49.4	33%	0.332	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-21.3	178.6	68.4	-20.4	0	0	0	114.4	K98 F99 K104 G147	K98-N145 VanDerWaalsContact CG-O 3.32Å; K98-N145 WeakPolarHBondContact CG-O 3.39Å; F99-N145 HydrophobicContact CD2-CB 4.5Å; F99-N145 HydrophobicContact CE1-CB 4.41Å; F99-N145 HydrophobicContact CE2-CB 4.03Å; F99-N145 HydrophobicContact CZ-CB 3.96Å; K104-N145 PolarHBondContact O-N 3.34Å; N145-G147 VanDerWaalsContact C-N 3.28Å; N145-G147 PolarHBondContact O-N 2.88Å
146	D	94.6	Very high	95.2	Very high	61 Å²	61	44.4 Å²	44.4	33%	0.326	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-2.6	176.6	69.4	-18.2	0	0	0	113.8	Y93 W144 R148	Y93-D146 VanDerWaalsContact CE1-OD2 3.27Å; Y93-D146 WeakPolarHBondContact CE1-OD2 3.35Å; Y93-D146 PolarHBondContact OH-OD2 2.74Å; W144-D146 WeakPolarHBondContact CB-OD1 3.29Å; W144-D146 PolarHBondContact O-N 2.88Å; W144-D146 VanDerWaalsContact O-N 3.14Å; D146-R148 WeakPolarHBondContact OD1-CB 3.16Å; D146-R148 PolarHBondContact OD1-N 2.91Å; D146-R148 IonicContact OD2-NE 3.53Å
147	G	93.9	Very high	95.4	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	19%	0.189	C	C	.	.	S	Bend	trans	87.3	6.6	-175.7	0	0	0	0	0	113.7	D94 W144 N145	D94-G147 PolarHBondContact N-O 3.03Å; D94-G147 WeakPolarHBondContact O-CA 3.47Å; W144-G147 PolarHBondContact O-N 3.16Å; N145-G147 VanDerWaalsContact C-N 3.28Å; N145-G147 PolarHBondContact O-N 2.88Å
148	R	96.4	Very high	95.6	Very high	91 Å²	91	39.8 Å²	39.8	34%	0.343	18%	0.181	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	134.1	169.5	-175	-170.2	-64.7	-172.8	-1.4	109.5	T91 W92 Y93 I143 W144 D146	T91-R148 HydrophobicContact CG2-CG 3.53Å; W92-R148 CarbonylContact O-C 3.59Å; W92-R148 WeakPolarHBondContact O-CA 3.34Å; Y93-R148 HydrophobicContact CD1-CB 4.16Å; Y93-R148 HydrophobicContact CE1-CB 3.75Å; Y93-R148 HydrophobicContact CE2-CG 4.41Å; Y93-R148 VanDerWaalsContact OH-CZ 3.31Å; Y93-R148 PolarHBondContact OH-NE 3.1Å; Y93-R148 PolarHBondContact OH-NH2 3.48Å; I143-R148 WeakPolarHBondContact CA-O 3.42Å; W144-R148 HydrophobicContact CB-CB 4.13Å; W144-R148 HydrophobicContact CD2-CB 4.49Å; W144-R148 HydrophobicContact CE3-CB 4.2Å; W144-R148 HydrophobicContact CE3-CG 4.1Å; W144-R148 HydrophobicContact CG-CB 4.5Å; W144-R148 PolarHBondContact N-O 2.86Å; D146-R148 WeakPolarHBondContact OD1-CB 3.16Å; D146-R148 PolarHBondContact OD1-N 2.91Å; D146-R148 IonicContact OD2-NE 3.53Å
149	V	96.9	Very high	95.8	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	130.4	175.8	-176.3	0	0	0	0	108.8	T91 W92 D94 L97 I116 L141 R142 I143	T91-V149 WeakPolarHBondContact CA-O 3.48Å; T91-V149 WeakPolarHBondContact CG2-O 3.13Å; W92-V149 HydrophobicContact CD2-CB 4.22Å; W92-V149 HydrophobicContact CH2-CG1 3.89Å; W92-V149 HydrophobicContact CZ2-CB 3.97Å; W92-V149 HydrophobicContact CZ2-CG1 3.59Å; W92-V149 PolarHBondContact N-O 3.42Å; W92-V149 VanDerWaalsContact N-O 3.08Å; W92-V149 PolarHBondContact O-N 3.02Å; D94-V149 HydrophobicContact CB-CG2 4.46Å; L97-V149 HydrophobicContact CD1-CG2 3.69Å; I116-V149 HydrophobicContact CD1-CG1 4.3Å; L141-V149 HydrophobicContact CD1-CG1 3.51Å; R142-V149 CarbonylContact O-C 3.42Å; R142-V149 WeakPolarHBondContact O-CA 3.39Å; I143-V149 HydrophobicContact CG1-CG2 4.49Å
150	L	96.6	Very high	95.9	Very high	29 Å²	29	36.8 Å²	36.8	15%	0.152	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	121.6	166.6	172.2	70.1	0	0	0	107.9	A89 Q90 T91 L141 R142 W144	A89-L150 HydrophobicContact CB-CD1 4.31Å; Q90-L150 WeakPolarHBondContact O-CA 3.38Å; T91-L150 WeakPolarHBondContact OG1-CD1 3.48Å; L141-L150 WeakPolarHBondContact CA-O 3.3Å; R142-L150 HydrophobicContact CB-CB 4.3Å; R142-L150 PolarHBondContact N-O 3.12Å; R142-L150 PolarHBondContact O-N 3.48Å; W144-L150 HydrophobicContact CH2-CB 3.67Å; W144-L150 HydrophobicContact CH2-CD2 3.94Å; W144-L150 HydrophobicContact CH2-CG 4.46Å; W144-L150 HydrophobicContact CZ3-CB 3.38Å
151	Y	96.7	Very high	96	Very high	12 Å²	12	33.6 Å²	33.6	5%	0.047	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	131	170.9	175.7	-122.3	0	0	0	108.7	A89 Q90 W92 V113 R139 M140 L153	A89-Y151 WeakPolarHBondContact CA-O 3.3Å; Q90-Y151 PolarHBondContact N-O 2.79Å; Q90-Y151 PolarHBondContact O-N 2.81Å; W92-Y151 HydrophobicContact CH2-CG 4.36Å; V113-Y151 HydrophobicContact CG1-CD2 4.28Å; V113-Y151 HydrophobicContact CG1-CE2 3.63Å; V113-Y151 HydrophobicContact CG2-CD2 4.35Å; V113-Y151 HydrophobicContact CG2-CE2 4.03Å; R139-Y151 HydrophobicContact CB-CE2 4.2Å; R139-Y151 HydrophobicContact CG-CE2 4.41Å; M140-Y151 WeakPolarHBondContact O-CA 3.44Å; Y151-L153 HydrophobicContact CD1-CD2 4.21Å; Y151-L153 HydrophobicContact CE1-CD1 4.46Å; Y151-L153 HydrophobicContact CE1-CD2 3.67Å
152	T	96	Very high	95.8	Very high	22 Å²	22	40 Å²	40	14%	0.135	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	147.4	173.6	-176.4	0	0	0	0	111	F88 R139 M140	F88-T152 CarbonylContact O-C 3.55Å; F88-T152 WeakPolarHBondContact O-CA 3.36Å; F88-T152 WeakPolarHBondContact O-CB 3.34Å; F88-T152 PolarHBondContact O-OG1 2.84Å; R139-T152 CarbonylContact C-O 3.56Å; R139-T152 WeakPolarHBondContact CA-O 3.32Å; M140-T152 HydrophobicContact CB-CG2 3.57Å; M140-T152 HydrophobicContact CG-CG2 3.84Å; M140-T152 PolarHBondContact N-O 2.87Å; M140-T152 PolarHBondContact O-N 3.21Å; M140-T152 HydrophobicContact SD-CG2 3.79Å
153	L	95.8	Very high	95.6	Very high	22 Å²	22	36.2 Å²	36.2	12%	0.115	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	149.6	178.4	66	168.1	0	0	0	110.8	F88 N138 R139 Y151 L155	F88-L153 HydrophobicContact CB-CD2 4.1Å; F88-L153 HydrophobicContact CD1-CD2 3.99Å; F88-L153 PolarHBondContact N-O 3.19Å; F88-L153 PolarHBondContact O-N 2.89Å; N138-L153 WeakPolarHBondContact O-CA 3.41Å; R139-L153 HydrophobicContact CG-CB 4.18Å; Y151-L153 HydrophobicContact CD1-CD2 4.21Å; Y151-L153 HydrophobicContact CE1-CD1 4.46Å; Y151-L153 HydrophobicContact CE1-CD2 3.67Å; L153-L155 HydrophobicContact CD1-CD1 4.09Å; L153-L155 HydrophobicContact CD1-CD2 3.75Å; L153-L155 HydrophobicContact CD1-CG 4Å; L153-L155 HydrophobicContact CG-CD1 4.19Å; L153-L155 HydrophobicContact CG-CD2 4.28Å; L153-L155 HydrophobicContact CG-CG 4.03Å
154	R	96.1	Very high	95.4	Very high	69 Å²	69	43.2 Å²	43.2	26%	0.26	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	129.3	172.6	-170.7	-176.4	175.8	-179.1	-2	110.4	D85 I86 F87 H132 N138	D85-R154 IonicContact OD1-CZ 2.91Å; D85-R154 IonicContact OD1-NE 3.83Å; D85-R154 PolarHBondContact OD1-NE 2.88Å; D85-R154 IonicContact OD1-NH2 3.38Å; D85-R154 IonicContact OD2-CZ 3.07Å; D85-R154 IonicContact OD2-NE 3.72Å; D85-R154 PolarHBondContact OD2-NE 2.89Å; D85-R154 IonicContact OD2-NH2 3.47Å; D85-R154 PolarHBondContact OD2-NH2 2.88Å; I86-R154 WeakPolarHBondContact O-CA 3.3Å; F87-R154 HydrophobicContact CD1-CB 3.93Å; F87-R154 HydrophobicContact CD1-CG 4.2Å; F87-R154 HydrophobicContact CE1-CB 3.84Å; F87-R154 HydrophobicContact CE1-CG 3.94Å; F87-R154 HydrophobicContact CE2-CG 4.48Å; F87-R154 HydrophobicContact CZ-CB 4.5Å; F87-R154 HydrophobicContact CZ-CG 4.1Å; H132-R154 PolarHBondContact N-O 2.8Å; N138-R154 HydrophobicContact CB-CB 4.17Å; N138-R154 PolarHBondContact O-N 3.43Å
155	L	96.4	Very high	95.1	Very high	17 Å²	17	40.4 Å²	40.4	9%	0.089	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	139.9	-176.7	-64.7	174.5	0	0	0	110.6	D85 I86 F88 F123 A131 L153 I157	D85-L155 WeakPolarHBondContact CA-O 3.21Å; I86-L155 HydrophobicContact CG1-CB 4.16Å; I86-L155 PolarHBondContact N-O 2.79Å; I86-L155 PolarHBondContact O-N 2.91Å; F88-L155 HydrophobicContact CB-CD1 4.24Å; F123-L155 HydrophobicContact CE2-CD1 3.6Å; F123-L155 HydrophobicContact CZ-CD1 4.13Å; A131-L155 HydrophobicContact CB-CD2 3.84Å; L153-L155 HydrophobicContact CD1-CD1 4.09Å; L153-L155 HydrophobicContact CD1-CD2 3.75Å; L153-L155 HydrophobicContact CD1-CG 4Å; L153-L155 HydrophobicContact CG-CD1 4.19Å; L153-L155 HydrophobicContact CG-CD2 4.28Å; L153-L155 HydrophobicContact CG-CG 4.03Å; L155-I157 HydrophobicContact CB-CD1 4.27Å; L155-I157 HydrophobicContact CB-CG1 4.15Å; L155-I157 HydrophobicContact CD1-CD1 4.5Å
156	T	96.7	Very high	95	Very high	33 Å²	33	42.6 Å²	42.6	20%	0.202	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	125.8	161.3	-66.7	0	0	0	0	108.9	T83 I84 A129 D130 H132	T83-T156 HydrophobicContact CG2-CG2 3.65Å; I84-T156 CarbonylContact O-C 3.54Å; I84-T156 VanDerWaalsContact O-CA 3.29Å; I84-T156 WeakPolarHBondContact O-CA 3.43Å; A129-T156 WeakPolarHBondContact CA-O 3.34Å; D130-T156 PolarHBondContact N-O 3.22Å; D130-T156 PolarHBondContact O-N 3.36Å; H132-T156 PolarHBondContact CE1-OG1 2.84Å; H132-T156 PolarHBondContact NE2-OG1 2.71Å
157	I	97.2	Very high	94.9	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	127.3	-172.1	-54.6	165.7	0	0	0	108.4	T83 I84 I86 F123 A129 L155 A159 L177	T83-I157 CarbonylContact C-O 3.38Å; T83-I157 WeakPolarHBondContact CA-O 3.27Å; I84-I157 HydrophobicContact CG2-CB 3.96Å; I84-I157 PolarHBondContact N-O 2.87Å; I84-I157 PolarHBondContact O-N 3.16Å; I86-I157 HydrophobicContact CD1-CD1 3.72Å; I86-I157 HydrophobicContact CG1-CD1 4.25Å; F123-I157 HydrophobicContact CD1-CD1 3.85Å; F123-I157 HydrophobicContact CD2-CD1 3.64Å; F123-I157 HydrophobicContact CD2-CG1 4.43Å; F123-I157 HydrophobicContact CE1-CD1 3.65Å; F123-I157 HydrophobicContact CE2-CD1 3.47Å; F123-I157 VanDerWaalsContact CE2-CD1 3.47Å; F123-I157 HydrophobicContact CE2-CG1 4.5Å; F123-I157 HydrophobicContact CG-CD1 3.84Å; F123-I157 HydrophobicContact CZ-CD1 3.46Å; F123-I157 VanDerWaalsContact CZ-CD1 3.46Å; A129-I157 HydrophobicContact CB-CG1 4.18Å; A129-I157 HydrophobicContact CB-CG2 4.49Å; L155-I157 HydrophobicContact CB-CD1 4.27Å; L155-I157 HydrophobicContact CB-CG1 4.15Å; L155-I157 HydrophobicContact CD1-CD1 4.5Å; I157-A159 HydrophobicContact CG2-CB 4.28Å; I157-L177 HydrophobicContact CD1-CD1 4.35Å; I157-L177 HydrophobicContact CG2-CD1 4.29Å
158	D	96.7	Very high	94.7	Very high	39 Å²	39	43.2 Å²	43.2	21%	0.209	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	105.7	165.7	-64.6	-33.4	0	0	0	107.6	Y82 T83 K127 K128	Y82-D158 WeakPolarHBondContact O-CA 3.46Å; T83-D158 VanDerWaalsContact CB-OD1 3.29Å; T83-D158 WeakPolarHBondContact CB-OD1 3.35Å; T83-D158 VanDerWaalsContact CG2-OD1 3.26Å; T83-D158 WeakPolarHBondContact CG2-OD1 3.49Å; T83-D158 PolarHBondContact OG1-OD1 3.09Å; K127-D158 PolarHBondContact N-O 3.03Å; K128-D158 HydrophobicContact CB-CB 4.18Å; K128-D158 PolarHBondContact N-O 2.93Å; K128-D158 PolarHBondContact O-N 3.36Å
159	A	96.8	Very high	94.5	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	146.9	-174.9	0	0	0	0	0	111.4	E81 Y82 N125 I157 L177	E81-A159 VanDerWaalsContact CA-O 3.29Å; E81-A159 WeakPolarHBondContact CA-O 3.42Å; Y82-A159 HydrophobicContact CD1-CB 4.22Å; Y82-A159 VanDerWaalsContact CD1-O 3.32Å; Y82-A159 WeakPolarHBondContact CD1-O 3.42Å; Y82-A159 HydrophobicContact CE1-CB 3.57Å; Y82-A159 PolarHBondContact N-O 3.11Å; Y82-A159 PolarHBondContact O-N 3.26Å; N125-A159 CarbonylContact O-C 3.59Å; N125-A159 VanDerWaalsContact O-CA 3.3Å; N125-A159 WeakPolarHBondContact O-CA 3.39Å; I157-A159 HydrophobicContact CG2-CB 4.28Å; A159-L177 HydrophobicContact CB-CD1 4.22Å
160	E	95.8	Very high	94.3	Very high	102 Å²	102	40.3 Å²	40.3	48%	0.477	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	134.4	174.8	-53	-159.6	151.3	0	0	110.3	N125 K127	N125-E160 PolarHBondContact ND2-O 3.19Å; N125-E160 PolarHBondContact O-N 3.39Å; K127-E160 HydrophobicContact CD-CG 4Å; K127-E160 WeakPolarHBondContact CE-OE1 3.15Å; K127-E160 HydrophobicContact CG-CG 3.67Å; K127-E160 WeakPolarHBondContact CG-OE1 3.45Å
161	C	95.1	Very high	94.1	Very high	1 Å²	1	39.1 Å²	39.1	1%	0.007	19%	0.188	C	C	.	.			trans	-134.3	110.4	172.6	179	0	0	0	0	109.4	M80 Y82 L163 C175	M80-C161 CarbonylContact C-O 3.59Å; M80-C161 PolarHBondContact O-N 2.9Å; Y82-C161 HydrophobicContact CD1-CB 3.54Å; Y82-C161 HydrophobicContact CE1-CB 3.89Å; C161-L163 HydrophobicContact CB-CD2 4.41Å; C161-L163 PolarHBondContact O-N 2.8Å; C161-L163 VanDerWaalsContact SG-CD2 3.57Å; C161-C175 HydrophobicContact CB-CB 3.72Å; C161-C175 WeakPolarHBondContact CB-SG 3.33Å; C161-C175 WeakPolarHBondContact SG-CA 3.37Å; C161-C175 WeakPolarHBondContact SG-CB 3.29Å; C161-C175 CovalentContact SG-SG 2.04Å; C161-C175 PolarHBondContact SG-SG 2.81Å
162	Q	92	Very high	93.9	Very high	136 Å²	136	45.5 Å²	45.5	64%	0.636	22%	0.219	S	C	*	.			trans	-72.5	100.9	178.3	-175.2	59.3	58.9	0	0	109.9	M80	M80-Q162 PolarHBondContact SD-NE2 2.88Å; M80-Q162 VanDerWaalsContact SD-NE2 3.37Å
163	L	91.7	Very high	93.9	Very high	2 Å²	2	44.9 Å²	44.9	1%	0.01	21%	0.214	C	C	.	.			trans	-79.9	135.4	178.4	-50.9	-179.2	0	0	0	110.6	V75 A77 C161 L165 H173	V75-L163 HydrophobicContact CG1-CD1 4.48Å; V75-L163 HydrophobicContact CG1-CD2 4.49Å; A77-L163 HydrophobicContact CB-CD1 3.92Å; C161-L163 HydrophobicContact CB-CD2 4.41Å; C161-L163 PolarHBondContact O-N 2.8Å; C161-L163 VanDerWaalsContact SG-CD2 3.57Å; L163-L165 HydrophobicContact CB-CD2 4.1Å; L163-L165 HydrophobicContact CB-CG 4.41Å; L163-H173 HydrophobicContact CD2-CB 4.2Å
164	Q	91.3	Very high	93.8	Very high	148 Å²	148	46.7 Å²	46.7	69%	0.692	23%	0.229	S	C	*	.			trans	-105	107.4	172.9	-64.6	-176.9	-0.8	0	0	109	H173	Q164-H173 PolarHBondContact O-CE1 3.33Å; Q164-H173 VanDerWaalsContact O-CE1 3.24Å
165	L	90.9	Very high	93.8	Very high	2 Å²	2	43.4 Å²	43.4	1%	0.01	22%	0.216	C	C	.	.			trans	-99.4	15.6	-168.6	-57.9	176.3	0	0	0	113.5	L163 N167 F168 D171 P298 V300 Y302 T304	L163-L165 HydrophobicContact CB-CD2 4.1Å; L163-L165 HydrophobicContact CB-CG 4.41Å; L165-N167 VanDerWaalsContact C-N 3.3Å; L165-N167 PolarHBondContact O-N 2.84Å; L165-F168 HydrophobicContact CB-CB 4.06Å; L165-F168 HydrophobicContact CD2-CD2 4.18Å; L165-F168 WeakPolarHBondContact O-CB 3.49Å; L165-F168 PolarHBondContact O-N 2.93Å; L165-D171 WeakPolarHBondContact CD2-OD2 3.47Å; L165-P298 HydrophobicContact CD1-CG 3.36Å; L165-V300 HydrophobicContact CD1-CG1 4.14Å; L165-Y302 HydrophobicContact CB-CE2 3.99Å; L165-Y302 WeakPolarHBondContact CB-OH 3.42Å; L165-Y302 PolarHBondContact N-OH 2.87Å; L165-T304 HydrophobicContact CB-CG2 4.43Å; L165-T304 WeakPolarHBondContact O-CG2 3.47Å
166	H	91.1	Very high	93.9	Very high	108 Å²	108	43.8 Å²	43.8	50%	0.5	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-45.4	-176.6	-160.3	68.9	0	0	0	111.4	F168 V303 T304 A305	H166-F168 VanDerWaalsContact C-N 3.28Å; H166-F168 PolarHBondContact O-N 2.92Å; H166-V303 PolarHBondContact ND1-O 2.97Å; H166-T304 CarbonylContact O-C 3.56Å; H166-A305 PolarHBondContact O-N 2.94Å
167	N	92.1	Very high	93.9	Very high	74 Å²	74	42.2 Å²	42.2	40%	0.396	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.8	11.6	178.4	-66.1	-9.9	0	0	0	113.2	L165 M170	L165-N167 VanDerWaalsContact C-N 3.3Å; L165-N167 PolarHBondContact O-N 2.84Å; N167-M170 CarbonylContact O-C 3.58Å; N167-M170 WeakPolarHBondContact O-CA 3.22Å; N167-M170 PolarHBondContact O-N 2.95Å
168	F	91.5	Very high	93.9	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.3	128.5	-178.2	176	-87.5	0	0	0	111.3	L165 H166 F246 L297 T304 A305 M306	L165-F168 HydrophobicContact CB-CB 4.06Å; L165-F168 HydrophobicContact CD2-CD2 4.18Å; L165-F168 WeakPolarHBondContact O-CB 3.49Å; L165-F168 PolarHBondContact O-N 2.93Å; H166-F168 VanDerWaalsContact C-N 3.28Å; H166-F168 PolarHBondContact O-N 2.92Å; F168-F246 HydrophobicContact CE1-CD1 4.29Å; F168-F246 HydrophobicContact CE1-CE1 4.25Å; F168-F246 HydrophobicContact CE2-CE1 4.35Å; F168-F246 HydrophobicContact CE2-CE2 4.26Å; F168-F246 AromaticContact CE2-CZ 3.98Å; F168-F246 HydrophobicContact CE2-CZ 3.98Å; F168-F246 AromaticContact CZ-CD1 3.86Å; F168-F246 HydrophobicContact CZ-CD1 3.86Å; F168-F246 HydrophobicContact CZ-CD2 4.38Å; F168-F246 AromaticContact CZ-CE1 3.45Å; F168-F246 HydrophobicContact CZ-CE1 3.45Å; F168-F246 VanDerWaalsContact CZ-CE1 3.45Å; F168-F246 HydrophobicContact CZ-CE2 4.02Å; F168-F246 HydrophobicContact CZ-CG 4.32Å; F168-F246 AromaticContact CZ-CZ 3.53Å; F168-F246 HydrophobicContact CZ-CZ 3.53Å; F168-L297 HydrophobicContact CD1-CD1 3.87Å; F168-L297 HydrophobicContact CD1-CD2 4.19Å; F168-L297 HydrophobicContact CD2-CD2 3.94Å; F168-L297 HydrophobicContact CE1-CD1 3.48Å; F168-L297 VanDerWaalsContact CE1-CD1 3.48Å; F168-L297 HydrophobicContact CE1-CD2 3.74Å; F168-L297 HydrophobicContact CE1-CG 4.16Å; F168-L297 HydrophobicContact CE2-CD2 3.43Å; F168-L297 VanDerWaalsContact CE2-CD2 3.43Å; F168-L297 HydrophobicContact CG-CD2 4.29Å; F168-L297 HydrophobicContact CZ-CD1 3.94Å; F168-L297 HydrophobicContact CZ-CD2 3.32Å; F168-L297 HydrophobicContact CZ-CG 4.11Å; F168-T304 HydrophobicContact CB-CG2 4.39Å; F168-A305 WeakPolarHBondContact O-CB 3.38Å; F168-M306 HydrophobicContact CD1-CB 4.04Å; F168-M306 HydrophobicContact CD1-SD 4.41Å; F168-M306 HydrophobicContact CE1-CB 4.31Å; F168-M306 HydrophobicContact CE1-CE 4.08Å; F168-M306 HydrophobicContact CE1-SD 3.77Å; F168-M306 PolarHBondContact O-N 3.03Å
169	P	92.3	Very high	93.9	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	cis	-99	9.2	11.7	23.3	-7.2	0	0	0	115.8	D171 R241 M243 F246 Y251	P169-D171 PolarHBondContact O-N 3.07Å; P169-R241 WeakPolarHBondContact O-CB 3.23Å; P169-R241 WeakPolarHBondContact O-CD 3.21Å; P169-M243 HydrophobicContact CB-CE 4.4Å; P169-M243 HydrophobicContact CB-SD 3.51Å; P169-M243 VanDerWaalsContact CB-SD 3.51Å; P169-M243 HydrophobicContact CG-CE 3.75Å; P169-M243 HydrophobicContact CG-SD 3.54Å; P169-M243 VanDerWaalsContact CG-SD 3.54Å; P169-F246 HydrophobicContact CB-CB 4.18Å; P169-F246 HydrophobicContact CB-CD2 3.57Å; P169-F246 HydrophobicContact CB-CE2 4.18Å; P169-F246 HydrophobicContact CB-CG 3.88Å; P169-F246 HydrophobicContact CG-CB 3.77Å; P169-F246 HydrophobicContact CG-CD2 4.15Å; P169-F246 HydrophobicContact CG-CG 3.98Å; P169-Y251 WeakPolarHBondContact CD-OH 3.44Å; P169-Y251 HydrophobicContact CG-CE2 3.96Å
170	M	91.9	Very high	93.9	Very high	30 Å²	30	42.8 Å²	42.8	15%	0.148	21%	0.212	C	C	.	.	S	Bend	trans	-89.6	38.9	178.2	-56.7	178.7	-145.2	0	0	111	N167 M243 Y439 W440 Y443 L444	N167-M170 CarbonylContact O-C 3.58Å; N167-M170 WeakPolarHBondContact O-CA 3.22Å; N167-M170 PolarHBondContact O-N 2.95Å; M170-M243 HydrophobicContact CB-SD 4.22Å; M170-M243 HydrophobicContact CE-CE 3.42Å; M170-M243 VanDerWaalsContact CE-CE 3.42Å; M170-M243 HydrophobicContact CG-CE 3.18Å; M170-M243 HydrophobicContact CG-CG 4.11Å; M170-M243 HydrophobicContact CG-SD 3.39Å; M170-M243 WeakPolarHBondContact CG-SD 3.36Å; M170-M243 PolarHBondContact N-SD 3.39Å; M170-M243 HydrophobicContact SD-CE 3.95Å; M170-Y439 HydrophobicContact CE-CE1 4.07Å; M170-W440 HydrophobicContact CE-CE3 3.6Å; M170-W440 HydrophobicContact CE-CH2 4.11Å; M170-W440 HydrophobicContact CE-CZ3 3.28Å; M170-W440 HydrophobicContact SD-CZ3 4.5Å; M170-Y443 WeakPolarHBondContact SD-CB 3.39Å; M170-Y443 VanDerWaalsContact SD-O 3.39Å; M170-L444 HydrophobicContact SD-CD2 4.26Å; M170-L444 HydrophobicContact SD-CG 3.97Å
171	D	92.3	Very high	94	Very high	4 Å²	4	38.1 Å²	38.1	2%	0.021	19%	0.19	C	C	.	.			trans	-95.4	141.3	-171.6	50.9	-25	0	0	0	112.3	L165 P169 H173 R241	L165-D171 WeakPolarHBondContact CD2-OD2 3.47Å; P169-D171 PolarHBondContact O-N 3.07Å; D171-H173 IonicContact OD2-CE1 3.36Å; D171-H173 PolarHBondContact OD2-CE1 3.33Å; D171-H173 IonicContact OD2-NE2 3.4Å; D171-H173 PolarHBondContact OD2-NE2 2.58Å; D171-R241 VanDerWaalsContact CG-NE 3.35Å; D171-R241 PolarHBondContact O-N 2.73Å; D171-R241 VanDerWaalsContact O-N 3.15Å; D171-R241 VanDerWaalsContact OD1-CB 3.26Å; D171-R241 WeakPolarHBondContact OD1-CB 3.42Å; D171-R241 VanDerWaalsContact OD1-CD 3.23Å; D171-R241 WeakPolarHBondContact OD1-CD 3.29Å; D171-R241 IonicContact OD1-CZ 3.81Å; D171-R241 IonicContact OD1-NE 2.89Å; D171-R241 PolarHBondContact OD1-NE 2.97Å; D171-R241 IonicContact OD1-NH2 3.93Å; D171-R241 IonicContact OD2-CZ 3.87Å; D171-R241 IonicContact OD2-NE 3.39Å; D171-R241 PolarHBondContact OD2-NE 2.85Å; D171-R241 VanDerWaalsContact OD2-NE 3.17Å; D171-R241 IonicContact OD2-NH2 3.03Å; D171-R241 PolarHBondContact OD2-NH2 3.41Å
172	E	93	Very high	94	Very high	146 Å²	146	46.3 Å²	46.3	68%	0.682	22%	0.222	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-111.9	141.9	168.2	-62	-169.6	164.6	0	0	109.2	L239	E172-L239 WeakPolarHBondContact CA-O 3.39Å
173	H	94.3	Very high	94.2	Very high	10 Å²	10	41.9 Å²	41.9	5%	0.046	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	141.2	-175.8	-56.3	-40.1	0	0	0	110.7	L163 Q164 D171 F211 D238 L239 R241	L163-H173 HydrophobicContact CD2-CB 4.2Å; Q164-H173 PolarHBondContact O-CE1 3.33Å; Q164-H173 VanDerWaalsContact O-CE1 3.24Å; D171-H173 IonicContact OD2-CE1 3.36Å; D171-H173 PolarHBondContact OD2-CE1 3.33Å; D171-H173 IonicContact OD2-NE2 3.4Å; D171-H173 PolarHBondContact OD2-NE2 2.58Å; H173-F211 AromaticContact CD2-CE1 3.59Å; H173-D238 CarbonylContact O-C 3.47Å; H173-D238 WeakPolarHBondContact O-CA 3.37Å; H173-L239 PolarHBondContact N-O 3.43Å; H173-L239 PolarHBondContact O-N 3.27Å; H173-R241 PolarHBondContact NE2-NH2 2.86Å
174	S	95.4	Very high	94.4	Very high	60 Å²	60	44.1 Å²	44.1	42%	0.42	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	104.8	171.4	-58.3	0	0	0	0	108.7	P176 F237 D238	S174-P176 WeakPolarHBondContact O-CD 3.42Å; S174-F237 WeakPolarHBondContact CA-O 3.43Å; S174-D238 WeakPolarHBondContact CB-OD1 3.33Å; S174-D238 PolarHBondContact OG-OD1 3.05Å
175	C	96.1	Very high	94.6	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	118.1	178.9	-68.4	0	0	0	0	110.6	Y82 C161 F237	Y82-C175 HydrophobicContact CD1-CB 4Å; Y82-C175 HydrophobicContact CE1-CB 3.67Å; C161-C175 HydrophobicContact CB-CB 3.72Å; C161-C175 WeakPolarHBondContact CB-SG 3.33Å; C161-C175 WeakPolarHBondContact SG-CA 3.37Å; C161-C175 WeakPolarHBondContact SG-CB 3.29Å; C161-C175 CovalentContact SG-SG 2.04Å; C161-C175 PolarHBondContact SG-SG 2.81Å; C175-F237 PolarHBondContact N-O 3.32Å; C175-F237 PolarHBondContact O-N 2.87Å
176	P	96.8	Very high	94.9	Very high	24 Å²	24	42.7 Å²	42.7	16%	0.156	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	151.6	179.4	31.8	-33.7	0	0	0	111.7	Y82 N125 S174 E178 V235 Y236	Y82-P176 PolarHBondContact OH-O 3.22Å; N125-P176 PolarHBondContact ND2-O 2.8Å; S174-P176 WeakPolarHBondContact O-CD 3.42Å; P176-E178 HydrophobicContact CB-CG 4.13Å; P176-V235 CarbonylContact C-O 3.56Å; P176-V235 WeakPolarHBondContact CA-O 3.3Å; P176-Y236 HydrophobicContact CB-CD1 3.89Å; P176-Y236 HydrophobicContact CB-CE1 3.73Å
177	L	97.2	Very high	95.1	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	112	161.3	-176.9	65.9	0	0	0	107.4	M67 I84 I86 F123 I157 A159 V235 F237	M67-L177 HydrophobicContact SD-CD2 3.92Å; I84-L177 HydrophobicContact CD1-CD2 4.49Å; I84-L177 HydrophobicContact CG2-CD2 4.47Å; I86-L177 HydrophobicContact CD1-CD2 4.23Å; F123-L177 HydrophobicContact CD1-CD1 3.64Å; F123-L177 HydrophobicContact CD1-CD2 4.47Å; F123-L177 HydrophobicContact CD1-CG 3.96Å; F123-L177 HydrophobicContact CE1-CD1 4.1Å; F123-L177 HydrophobicContact CE1-CD2 4.1Å; F123-L177 HydrophobicContact CE1-CG 4.05Å; I157-L177 HydrophobicContact CD1-CD1 4.35Å; I157-L177 HydrophobicContact CG2-CD1 4.29Å; A159-L177 HydrophobicContact CB-CD1 4.22Å; L177-V235 PolarHBondContact N-O 3.46Å; L177-V235 PolarHBondContact O-N 3.41Å; L177-F237 HydrophobicContact CB-CE2 3.9Å; L177-F237 HydrophobicContact CD2-CE2 4.34Å
178	E	96.9	Very high	95.2	Very high	52 Å²	52	41.8 Å²	41.8	24%	0.243	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	130.2	-170.8	-52.6	-174.8	165.8	0	0	110.1	F123 R124 N125 P176 V232 M233	F123-E178 CarbonylContact C-O 3.11Å; F123-E178 VanDerWaalsContact CA-O 3.25Å; F123-E178 WeakPolarHBondContact CA-O 3.46Å; R124-E178 HydrophobicContact CB-CB 4.27Å; R124-E178 PolarHBondContact N-O 2.87Å; N125-E178 PolarHBondContact OD1-N 2.91Å; P176-E178 HydrophobicContact CB-CG 4.13Å; E178-V232 HydrophobicContact CB-CG1 4.29Å; E178-M233 WeakPolarHBondContact CA-O 3.48Å
179	F	97.4	Very high	95.5	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	147.5	175.1	62.3	-88.9	0	0	0	112	T65 F88 T121 F122 F123 W193 M233	T65-F179 HydrophobicContact CG2-CE2 3.76Å; T65-F179 HydrophobicContact CG2-CZ 3.61Å; F88-F179 HydrophobicContact CE2-CD1 4.28Å; F88-F179 HydrophobicContact CE2-CD2 4.24Å; F88-F179 HydrophobicContact CE2-CE1 4.05Å; F88-F179 HydrophobicContact CE2-CE2 4.01Å; F88-F179 HydrophobicContact CE2-CG 4.37Å; F88-F179 AromaticContact CE2-CZ 3.92Å; F88-F179 HydrophobicContact CE2-CZ 3.92Å; F88-F179 AromaticContact CZ-CD2 3.87Å; F88-F179 HydrophobicContact CZ-CD2 3.87Å; F88-F179 AromaticContact CZ-CE2 3.82Å; F88-F179 HydrophobicContact CZ-CE2 3.82Å; F88-F179 HydrophobicContact CZ-CG 4.29Å; F88-F179 HydrophobicContact CZ-CZ 4.21Å; T121-F179 HydrophobicContact CG2-CB 4.05Å; T121-F179 HydrophobicContact CG2-CD2 3.72Å; T121-F179 HydrophobicContact CG2-CG 4.26Å; F122-F179 VanDerWaalsContact O-CA 3.23Å; F122-F179 WeakPolarHBondContact O-CA 3.3Å; F122-F179 WeakPolarHBondContact O-CB 3.36Å; F123-F179 HydrophobicContact CD1-CB 3.8Å; F123-F179 HydrophobicContact CE1-CB 3.92Å; F123-F179 HydrophobicContact CE1-CD1 4.06Å; F123-F179 HydrophobicContact CE1-CG 4.29Å; F123-F179 HydrophobicContact CG-CB 4.38Å; F179-W193 AromaticContact CE1-CH2 3.67Å; F179-W193 HydrophobicContact CE1-CH2 3.67Å; F179-W193 HydrophobicContact CE1-CZ2 4.28Å; F179-W193 HydrophobicContact CE1-CZ3 4.39Å; F179-W193 AromaticContact CZ-CH2 3.68Å; F179-W193 HydrophobicContact CZ-CH2 3.68Å; F179-W193 HydrophobicContact CZ-CZ2 4.23Å; F179-W193 HydrophobicContact CZ-CZ3 4.08Å; F179-M233 HydrophobicContact CD1-CB 4.19Å; F179-M233 HydrophobicContact CD2-CB 3.92Å; F179-M233 HydrophobicContact CD2-CG 4.22Å; F179-M233 HydrophobicContact CE1-CB 3.73Å; F179-M233 HydrophobicContact CE2-CB 3.42Å; F179-M233 VanDerWaalsContact CE2-CB 3.42Å; F179-M233 HydrophobicContact CE2-CG 3.58Å; F179-M233 HydrophobicContact CG-CB 4.28Å; F179-M233 HydrophobicContact CZ-CB 3.31Å; F179-M233 HydrophobicContact CZ-CG 3.87Å; F179-M233 PolarHBondContact N-O 2.04Å; F179-M233 PolarHBondContact O-N 3.05Å
180	S	97.5	Very high	95.7	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	174.1	177.7	70	0	0	0	0	110.8	T121 F122 R124 V231	T121-S180 WeakPolarHBondContact CA-O 3.46Å; F122-S180 WeakPolarHBondContact CD1-O 3.37Å; F122-S180 VanDerWaalsContact CE1-OG 3.28Å; F122-S180 WeakPolarHBondContact CE1-OG 3.33Å; F122-S180 PolarHBondContact N-O 2.76Å; F122-S180 PolarHBondContact O-N 2.88Å; F122-S180 VanDerWaalsContact O-N 3.07Å; R124-S180 PolarHBondContact NE-OG 3.02Å; S180-V231 VanDerWaalsContact CB-O 3.29Å; S180-V231 WeakPolarHBondContact CB-O 3.48Å
181	S	97.3	Very high	95.9	Very high	4 Å²	4	42.9 Å²	42.9	3%	0.028	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	146.4	164.4	175.5	0	0	0	0	109	D120 F122 Y184 Y191 Y230	D120-S181 WeakPolarHBondContact OD1-CB 3.45Å; D120-S181 PolarHBondContact OD1-OG 3.39Å; D120-S181 PolarHBondContact OD2-OG 3.22Å; F122-S181 WeakPolarHBondContact CE1-O 3.38Å; S181-Y184 WeakPolarHBondContact CB-O 3.44Å; S181-Y184 WeakPolarHBondContact OG-CB 3.23Å; S181-Y184 PolarHBondContact OG-N 2.91Å; S181-Y184 PolarHBondContact OG-O 2.85Å; S181-Y191 VanDerWaalsContact N-CE2 3.33Å; S181-Y230 WeakPolarHBondContact O-CD1 3.48Å
182	Y	95.6	Very high	96.1	Very high	173 Å²	173	47.1 Å²	47.1	68%	0.678	23%	0.233	S	C	*	.	S	Bend	trans	-85.8	-52.1	178.2	-173.2	-97.6	0	0	0	112	D120 F122	D120-Y182 PolarHBondContact O-N 2.75Å; D120-Y182 PolarHBondContact OD2-N 2.86Å; F122-Y182 AromaticContact CD1-CD2 3.89Å; F122-Y182 HydrophobicContact CD1-CD2 3.89Å; F122-Y182 HydrophobicContact CD1-CG 4.26Å; F122-Y182 HydrophobicContact CD2-CD2 4.44Å; F122-Y182 AromaticContact CE1-CD2 3.78Å; F122-Y182 HydrophobicContact CE1-CD2 3.78Å; F122-Y182 HydrophobicContact CE1-CG 4.32Å; F122-Y182 HydrophobicContact CE2-CD2 4.33Å; F122-Y182 HydrophobicContact CG-CD2 4.22Å; F122-Y182 HydrophobicContact CZ-CD2 4Å
183	G	94.9	Very high	96.2	Very high	42 Å²	42	41.8 Å²	41.8	43%	0.433	21%	0.207	S	C	.	.	S	Bend	trans	-102.5	-23.7	-173.3	0	0	0	0	0	114.5	D120	D120-G183 WeakPolarHBondContact OD2-CA 3.48Å; D120-G183 PolarHBondContact OD2-N 2.87Å
184	Y	96.2	Very high	96.1	Very high	49 Å²	49	44.8 Å²	44.8	19%	0.192	22%	0.22	C	C	.	.			trans	-96.7	118.2	-174.9	-58.5	-78.1	0	0	0	112	R53 W117 D120 S181 E188 I189 Y230	R53-Y184 HydrophobicContact CB-CE1 4.43Å; R53-Y184 HydrophobicContact CG-CE1 4.44Å; W117-Y184 HydrophobicContact CZ2-CE2 4.18Å; W117-Y184 PolarHBondContact NE1-OH 2.94Å; D120-Y184 HydrophobicContact CB-CE2 4.43Å; D120-Y184 VanDerWaalsContact OD1-CD2 3.3Å; D120-Y184 WeakPolarHBondContact OD1-CD2 3.29Å; D120-Y184 WeakPolarHBondContact OD2-CD2 3.47Å; S181-Y184 WeakPolarHBondContact CB-O 3.44Å; S181-Y184 WeakPolarHBondContact OG-CB 3.23Å; S181-Y184 PolarHBondContact OG-N 2.91Å; S181-Y184 PolarHBondContact OG-O 2.85Å; Y184-E188 HydrophobicContact CD1-CB 4.15Å; Y184-E188 WeakPolarHBondContact CD1-OE2 3.39Å; Y184-I189 HydrophobicContact CD1-CD1 4.22Å; Y184-I189 HydrophobicContact CD1-CG1 4.48Å; Y184-I189 HydrophobicContact CD2-CD1 3.27Å; Y184-I189 HydrophobicContact CD2-CG1 4.24Å; Y184-I189 HydrophobicContact CE2-CD1 3.91Å; Y184-I189 HydrophobicContact CG-CD1 3.43Å; Y184-I189 VanDerWaalsContact CG-CD1 3.43Å; Y184-I189 HydrophobicContact CG-CG1 3.89Å; Y184-Y230 VanDerWaalsContact C-CE1 3.48Å; Y184-Y230 WeakPolarHBondContact O-CD1 3.28Å; Y184-Y230 WeakPolarHBondContact O-CE1 3.44Å
185	P	96.4	Very high	95.5	Very high	25 Å²	25	54.6 Å²	54.6	16%	0.162	25%	0.248	C	C	.	.			trans	-71	172.2	174.3	33.3	-36.6	0	0	0	110.8	E187 E188 I189 D229	P185-E187 PolarHBondContact O-N 2.92Å; P185-E187 VanDerWaalsContact O-N 3.11Å; P185-E188 HydrophobicContact CG-CG 4.25Å; P185-E188 PolarHBondContact O-N 2.85Å; P185-I189 PolarHBondContact O-N 2.86Å; P185-D229 CarbonylContact C-O 3.43Å; P185-D229 WeakPolarHBondContact CA-O 3.29Å
186	R	96.2	Very high	94.8	Very high	95 Å²	95	58 Å²	58	36%	0.358	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-31.4	-178.2	-179.9	-173.8	64.6	-167.1	-13.6	112.9	E188 V190 D229 V231	R186-E188 PolarHBondContact O-N 2.77Å; R186-V190 HydrophobicContact CG-CG2 4.32Å; R186-V190 WeakPolarHBondContact O-CG2 3.5Å; R186-D229 WeakPolarHBondContact CB-O 3.5Å; R186-D229 PolarHBondContact N-O 3.02Å; R186-D229 IonicContact NH2-OD2 3.88Å; R186-D229 PolarHBondContact NH2-OD2 3.44Å; R186-V231 HydrophobicContact CB-CG2 4.06Å; R186-V231 HydrophobicContact CG-CG2 3.71Å
187	E	94.9	Very high	94	Very high	103 Å²	103	57.1 Å²	57.1	48%	0.481	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-16.1	179	-63.7	67.2	-140.2	0	0	112.6	P60 P185	P60-E187 WeakPolarHBondContact CB-O 3.19Å; P185-E187 PolarHBondContact O-N 2.92Å; P185-E187 VanDerWaalsContact O-N 3.11Å
188	E	95.4	Very high	93.5	Very high	60 Å²	60	58.5 Å²	58.5	28%	0.28	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.3	-39.5	-179.5	-68.5	-157	-143	0	0	114.1	R53 P60 T61 Y184 P185 R186	R53-E188 IonicContact CZ-OE2 3.84Å; R53-E188 IonicContact NE-OE2 3.55Å; R53-E188 PolarHBondContact NE-OE2 2.96Å; R53-E188 IonicContact NH2-OE2 3.04Å; P60-E188 CarbonylContact C-O 3.56Å; P60-E188 WeakPolarHBondContact CA-O 3.37Å; T61-E188 PolarHBondContact N-O 3.25Å; Y184-E188 HydrophobicContact CD1-CB 4.15Å; Y184-E188 WeakPolarHBondContact CD1-OE2 3.39Å; P185-E188 HydrophobicContact CG-CG 4.25Å; P185-E188 PolarHBondContact O-N 2.85Å; R186-E188 PolarHBondContact O-N 2.77Å
189	I	96.3	Very high	93.1	Very high	3 Å²	3	60.7 Å²	60.7	2%	0.015	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	135.7	179.5	-66.7	-174.2	0	0	0	110.4	I63 W117 Y184 P185 Y191	I63-I189 HydrophobicContact CD1-CD1 4.32Å; I63-I189 HydrophobicContact CD1-CG2 3.44Å; I63-I189 VanDerWaalsContact CD1-CG2 3.44Å; I63-I189 HydrophobicContact CG1-CG2 4.08Å; W117-I189 HydrophobicContact CH2-CD1 3.88Å; W117-I189 HydrophobicContact CZ2-CD1 3.76Å; Y184-I189 HydrophobicContact CD1-CD1 4.22Å; Y184-I189 HydrophobicContact CD1-CG1 4.48Å; Y184-I189 HydrophobicContact CD2-CD1 3.27Å; Y184-I189 HydrophobicContact CD2-CG1 4.24Å; Y184-I189 HydrophobicContact CE2-CD1 3.91Å; Y184-I189 HydrophobicContact CG-CD1 3.43Å; Y184-I189 VanDerWaalsContact CG-CD1 3.43Å; Y184-I189 HydrophobicContact CG-CG1 3.89Å; P185-I189 PolarHBondContact O-N 2.86Å; I189-Y191 HydrophobicContact CG2-CE2 4.12Å
190	V	97	Very high	92.6	Very high	41 Å²	41	63.5 Å²	63.5	25%	0.248	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	127.6	174.7	179.6	0	0	0	0	109.4	P60 T61 L62 I63 R186 V231	P60-V190 HydrophobicContact CB-CG2 4.15Å; P60-V190 HydrophobicContact CG-CG2 4.39Å; T61-V190 PolarHBondContact O-N 3.27Å; T61-V190 VanDerWaalsContact O-N 3.09Å; L62-V190 HydrophobicContact CD1-CB 4.22Å; L62-V190 HydrophobicContact CD1-CG1 4.11Å; I63-V190 PolarHBondContact N-O 3.44Å; R186-V190 HydrophobicContact CG-CG2 4.32Å; R186-V190 WeakPolarHBondContact O-CG2 3.5Å; V190-V231 HydrophobicContact CG1-CG2 4.46Å
191	Y	97.1	Very high	91.8	Very high	9 Å²	9	63.9 Å²	63.9	4%	0.035	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	145.1	172.1	-65.7	-78.7	0	0	0	111.2	I63 T121 S181 I189 M233	I63-Y191 HydrophobicContact CB-CD1 3.86Å; I63-Y191 HydrophobicContact CB-CE1 4.09Å; I63-Y191 HydrophobicContact CD1-CD1 4.4Å; I63-Y191 HydrophobicContact CD1-CE1 3.82Å; I63-Y191 HydrophobicContact CG2-CD1 3.93Å; I63-Y191 HydrophobicContact CG2-CE1 3.97Å; I63-Y191 CarbonylContact O-C 3.49Å; I63-Y191 WeakPolarHBondContact O-CA 3.43Å; T121-Y191 HydrophobicContact CG2-CE1 4.39Å; T121-Y191 PolarHBondContact OG1-OH 3.18Å; S181-Y191 VanDerWaalsContact N-CE2 3.33Å; I189-Y191 HydrophobicContact CG2-CE2 4.12Å; Y191-M233 VanDerWaalsContact CB-CG 3.47Å; Y191-M233 VanDerWaalsContact CB-SD 3.59Å; Y191-M233 HydrophobicContact CD2-CG 4.49Å; Y191-M233 HydrophobicContact CG-CG 4.08Å
192	Q	95.9	Very high	91.2	Very high	94 Å²	94	68.3 Å²	68.3	44%	0.439	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	135.5	175.3	-168.9	178.7	22.5	0	0	111	L62 I63 H64 T65	L62-Q192 HydrophobicContact CD1-CB 3.99Å; I63-Q192 PolarHBondContact O-N 2.61Å; H64-Q192 CarbonylContact C-O 3.6Å; H64-Q192 VanDerWaalsContact CA-O 3.28Å; H64-Q192 WeakPolarHBondContact CA-O 3.48Å; H64-Q192 PolarHBondContact CE1-OE1 3.34Å; H64-Q192 VanDerWaalsContact CE1-OE1 3.26Å; T65-Q192 PolarHBondContact N-O 2.97Å
193	W	94.8	Very high	90.5	Very high	34 Å²	34	63.5 Å²	63.5	13%	0.129	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	141.3	172.7	-66.5	117.6	0	0	0	111.5	F179 V198 N218 T219 M233 V235	F179-W193 AromaticContact CE1-CH2 3.67Å; F179-W193 HydrophobicContact CE1-CH2 3.67Å; F179-W193 HydrophobicContact CE1-CZ2 4.28Å; F179-W193 HydrophobicContact CE1-CZ3 4.39Å; F179-W193 AromaticContact CZ-CH2 3.68Å; F179-W193 HydrophobicContact CZ-CH2 3.68Å; F179-W193 HydrophobicContact CZ-CZ2 4.23Å; F179-W193 HydrophobicContact CZ-CZ3 4.08Å; W193-V198 HydrophobicContact CE3-CG2 4.49Å; W193-V198 HydrophobicContact CH2-CG2 4.25Å; W193-V198 HydrophobicContact CZ3-CG2 3.94Å; W193-N218 HydrophobicContact CZ2-CB 4.13Å; W193-T219 PolarHBondContact NE1-O 3.01Å; W193-M233 HydrophobicContact CB-CE 4.41Å; W193-M233 HydrophobicContact CD2-CE 3.45Å; W193-M233 VanDerWaalsContact CD2-CE 3.45Å; W193-M233 HydrophobicContact CE3-CE 4.17Å; W193-M233 HydrophobicContact CG-CE 3.51Å; W193-M233 HydrophobicContact CZ2-CB 4.06Å; W193-M233 HydrophobicContact CZ2-CE 4.01Å; W193-M233 VanDerWaalsContact NE1-CE 3.26Å; W193-V235 HydrophobicContact CH2-CG2 3.24Å; W193-V235 HydrophobicContact CZ2-CG2 3.52Å; W193-V235 HydrophobicContact CZ3-CG2 4.31Å
194	K	92.3	Very high	89.7	Confident	73 Å²	73	72.4 Å²	72.4	32%	0.317	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	169.7	161	-72.9	-171	-178.8	164.9	0	111.2	H64 T65 D66 T91 S197	H64-K194 HydrophobicContact CB-CG 4.06Å; T65-K194 PolarHBondContact O-N 3.36Å; D66-K194 HydrophobicContact CB-CD 4.28Å; T91-K194 PolarHBondContact OG1-NZ 2.72Å; K194-S197 VanDerWaalsContact O-CB 3.3Å; K194-S197 WeakPolarHBondContact O-CB 3.41Å
195	R	83.3	Confident	88.9	Confident	265 Å²	265	73.6 Å²	73.6	100%	1	35%	0.354	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.4	-43	-178.8	-70.6	-175.4	178.1	-176.6	-1.2	113.4
196	S	80.4	Confident	88.4	Confident	73 Å²	73	73.3 Å²	73.3	51%	0.51	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	88.1	166.8	-175.2	0	0	0	0	105.6	E199	S196-E199 PolarHBondContact OG-OE1 2.85Å
197	S	80.9	Confident	87.6	Confident	5 Å²	5	76.6 Å²	76.6	4%	0.035	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	-9.5	-169.5	64.6	0	0	0	0	114.7	D66 M67 K194	D66-S197 CarbonylContact C-O 3.56Å; D66-S197 WeakPolarHBondContact CA-O 3.43Å; D66-S197 VanDerWaalsContact OD1-C 3.23Å; D66-S197 WeakPolarHBondContact OD1-CA 3.28Å; M67-S197 PolarHBondContact N-O 3.15Å; K194-S197 VanDerWaalsContact O-CB 3.3Å; K194-S197 WeakPolarHBondContact O-CB 3.41Å
198	V	86.1	Confident	87	Confident	28 Å²	28	72.5 Å²	72.5	17%	0.17	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	107.6	175.8	-171.2	0	0	0	0	107.9	M67 V69 W193 L216 V235	M67-V198 HydrophobicContact CE-CG1 3.66Å; M67-V198 HydrophobicContact CE-CG2 4.13Å; M67-V198 VanDerWaalsContact O-CA 3.3Å; M67-V198 WeakPolarHBondContact O-CA 3.46Å; V69-V198 HydrophobicContact CG2-CG1 4.42Å; W193-V198 HydrophobicContact CE3-CG2 4.49Å; W193-V198 HydrophobicContact CH2-CG2 4.25Å; W193-V198 HydrophobicContact CZ3-CG2 3.94Å; V198-L216 HydrophobicContact CB-CD2 3.96Å; V198-L216 HydrophobicContact CG1-CD1 3.61Å; V198-L216 HydrophobicContact CG1-CD2 3.9Å; V198-L216 HydrophobicContact CG1-CG 4.44Å; V198-L216 HydrophobicContact CG2-CD2 4.33Å; V198-V235 HydrophobicContact CG2-CG2 4.19Å
199	E	88.6	Confident	86.3	Confident	98 Å²	98	77.8 Å²	77.8	46%	0.458	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	141.7	174.7	-69.4	-177.8	-176.8	0	0	109.2	M67 Y68 V69 S196	M67-E199 PolarHBondContact O-N 2.76Å; Y68-E199 CarbonylContact C-O 3.57Å; Y68-E199 WeakPolarHBondContact CA-O 3.27Å; Y68-E199 HydrophobicContact CD2-CB 3.84Å; Y68-E199 HydrophobicContact CE2-CB 4.48Å; V69-E199 PolarHBondContact N-O 2.67Å; S196-E199 PolarHBondContact OG-OE1 2.85Å
200	V	87.8	Confident	85.8	Confident	59 Å²	59	82.4 Å²	82.4	36%	0.358	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	133.5	178.1	-66.3	0	0	0	0	108.9	V69 W206 F213	V69-V200 HydrophobicContact CB-CG1 4.27Å; V69-V200 HydrophobicContact CG2-CG1 4.49Å; V200-W206 HydrophobicContact CB-CH2 3.98Å; V200-W206 HydrophobicContact CB-CZ2 3.92Å; V200-W206 HydrophobicContact CG1-CH2 3.98Å; V200-W206 HydrophobicContact CG1-CZ2 4.3Å; V200-F213 HydrophobicContact CG1-CZ 4.44Å
201	G	81.3	Confident	85.5	Confident	9 Å²	9	80.7 Å²	80.7	9%	0.093	37%	0.372	C	S	.	.			trans	-68.6	-172.4	171.7	0	0	0	0	0	112.7	Y68 V69 T203	Y68-G201 VanDerWaalsContact OH-CA 3.23Å; Y68-G201 WeakPolarHBondContact OH-CA 3.49Å; V69-G201 PolarHBondContact O-N 3.29Å; G201-T203 PolarHBondContact O-N 2.91Å
202	D	82.9	Confident	85.2	Confident	97 Å²	97	82.2 Å²	82.2	52%	0.519	38%	0.384	S	S	.	.			trans	-60.7	108.1	-179.8	-176.6	5.6	0	0	0	111.6	R204 S205 W206	D202-R204 PolarHBondContact O-N 2.84Å; D202-R204 VanDerWaalsContact O-N 3.14Å; D202-R204 WeakPolarHBondContact OD1-CB 3.46Å; D202-R204 WeakPolarHBondContact OD1-CG 3.06Å; D202-R204 PolarHBondContact OD1-N 3.4Å; D202-S205 PolarHBondContact O-N 3Å; D202-S205 VanDerWaalsContact O-N 3.08Å; D202-S205 PolarHBondContact O-OG 3.49Å; D202-W206 PolarHBondContact O-NE1 2.75Å
203	T	80.9	Confident	85.1	Confident	72 Å²	72	80.3 Å²	80.3	44%	0.442	38%	0.375	S	S	.	.	G	3₁₀ helix	trans	-62.5	-20.4	-178.4	58.1	0	0	0	0	112.9	G201 S205 W206 F213	G201-T203 PolarHBondContact O-N 2.91Å; T203-S205 VanDerWaalsContact C-N 3.29Å; T203-S205 PolarHBondContact O-N 3.47Å; T203-W206 HydrophobicContact CG2-CH2 4.21Å; T203-W206 HydrophobicContact CG2-CZ2 4.29Å; T203-W206 HydrophobicContact CG2-CZ3 4.32Å; T203-W206 PolarHBondContact O-N 3.37Å; T203-F213 HydrophobicContact CG2-CD1 4.24Å
204	R	79.1	Confident	84.9	Confident	228 Å²	228	82.9 Å²	82.9	86%	0.86	39%	0.394	S	S	*	.	G	3₁₀ helix	trans	-71.2	-26.3	177	-62.3	178.8	177.4	-177	0.5	112.8	D202 W206	D202-R204 PolarHBondContact O-N 2.84Å; D202-R204 VanDerWaalsContact O-N 3.14Å; D202-R204 WeakPolarHBondContact OD1-CB 3.46Å; D202-R204 WeakPolarHBondContact OD1-CG 3.06Å; D202-R204 PolarHBondContact OD1-N 3.4Å; R204-W206 VanDerWaalsContact C-N 3.29Å
205	S	78.8	Confident	84.9	Confident	74 Å²	74	80.3 Å²	80.3	52%	0.517	39%	0.388	S	S	.	.	G	3₁₀ helix	trans	-81.4	-11.7	179.9	71.6	0	0	0	0	113	D202 T203	D202-S205 PolarHBondContact O-N 3Å; D202-S205 VanDerWaalsContact O-N 3.08Å; D202-S205 PolarHBondContact O-OG 3.49Å; T203-S205 VanDerWaalsContact C-N 3.29Å; T203-S205 PolarHBondContact O-N 3.47Å
206	W	85.8	Confident	85.4	Confident	19 Å²	19	70.2 Å²	70.2	7%	0.072	35%	0.354	C	S	.	.			trans	-71.8	136.6	-176.2	-64	2.9	0	0	0	111	V69 N70 I72 V200 D202 T203 R204 L208 F213	V69-W206 HydrophobicContact CG1-CH2 4.29Å; V69-W206 HydrophobicContact CG1-CZ2 3.98Å; N70-W206 PolarHBondContact O-NE1 2.85Å; N70-W206 VanDerWaalsContact O-NE1 3.12Å; I72-W206 HydrophobicContact CB-CE3 4.26Å; I72-W206 HydrophobicContact CD1-CE3 3.98Å; I72-W206 HydrophobicContact CD1-CH2 3.96Å; I72-W206 HydrophobicContact CD1-CZ3 3.48Å; I72-W206 VanDerWaalsContact CD1-CZ3 3.48Å; I72-W206 HydrophobicContact CG1-CD2 4.38Å; I72-W206 HydrophobicContact CG1-CE3 3.97Å; I72-W206 HydrophobicContact CG1-CH2 4.17Å; I72-W206 HydrophobicContact CG1-CZ3 3.86Å; V200-W206 HydrophobicContact CB-CH2 3.98Å; V200-W206 HydrophobicContact CB-CZ2 3.92Å; V200-W206 HydrophobicContact CG1-CH2 3.98Å; V200-W206 HydrophobicContact CG1-CZ2 4.3Å; D202-W206 PolarHBondContact O-NE1 2.75Å; T203-W206 HydrophobicContact CG2-CH2 4.21Å; T203-W206 HydrophobicContact CG2-CZ2 4.29Å; T203-W206 HydrophobicContact CG2-CZ3 4.32Å; T203-W206 PolarHBondContact O-N 3.37Å; R204-W206 VanDerWaalsContact C-N 3.29Å; W206-L208 HydrophobicContact CB-CD1 4.35Å; W206-L208 HydrophobicContact CB-CG 4.36Å; W206-L208 HydrophobicContact CE3-CD1 3.79Å; W206-L208 PolarHBondContact O-N 2.62Å; W206-F213 HydrophobicContact CE3-CB 4.17Å; W206-F213 HydrophobicContact CE3-CG 4.41Å; W206-F213 HydrophobicContact CH2-CD1 4.45Å; W206-F213 HydrophobicContact CH2-CD2 4.36Å; W206-F213 HydrophobicContact CH2-CE2 4.49Å; W206-F213 HydrophobicContact CH2-CG 4.33Å; W206-F213 HydrophobicContact CZ3-CB 3.79Å; W206-F213 HydrophobicContact CZ3-CD1 4.04Å; W206-F213 AromaticContact CZ3-CD2 3.72Å; W206-F213 HydrophobicContact CZ3-CD2 3.72Å; W206-F213 HydrophobicContact CZ3-CE2 4.27Å; W206-F213 AromaticContact CZ3-CG 3.57Å; W206-F213 HydrophobicContact CZ3-CG 3.57Å
207	R	79.6	Confident	86	Confident	164 Å²	164	73.4 Å²	73.4	62%	0.619	36%	0.355	S	S	*	.			trans	-87.4	40.6	-175.5	-60	-176.5	72.4	-177.1	1.7	112	Y209	R207-Y209 HydrophobicContact CB-CE2 4.11Å; R207-Y209 WeakPolarHBondContact O-CD2 3.25Å; R207-Y209 PolarHBondContact O-N 2.79Å
208	L	82.2	Confident	86.6	Confident	17 Å²	17	76.7 Å²	76.7	9%	0.089	37%	0.372	C	S	.	.			trans	-86.3	81.5	175.9	-65.1	171.3	0	0	0	109.1	I72 G73 V75 W206 F211 F213 L239	I72-L208 HydrophobicContact CB-CD1 4.24Å; I72-L208 HydrophobicContact CB-CD2 4.25Å; I72-L208 HydrophobicContact CB-CG 4.39Å; I72-L208 HydrophobicContact CG2-CD2 3.89Å; G73-L208 VanDerWaalsContact O-CD2 3.28Å; G73-L208 WeakPolarHBondContact O-CD2 3.33Å; V75-L208 HydrophobicContact CG2-CD2 4.22Å; W206-L208 HydrophobicContact CB-CD1 4.35Å; W206-L208 HydrophobicContact CB-CG 4.36Å; W206-L208 HydrophobicContact CE3-CD1 3.79Å; W206-L208 PolarHBondContact O-N 2.62Å; L208-F211 WeakPolarHBondContact CB-O 3.26Å; L208-F213 HydrophobicContact CD1-CB 4.42Å; L208-L239 HydrophobicContact CD1-CD2 4.23Å
209	Y	80.6	Confident	87	Confident	171 Å²	171	77.6 Å²	77.6	67%	0.671	38%	0.378	S	S	*	.	S	Bend	trans	-74.2	-38.8	-179	-62.3	-73.4	0	0	0	112.8	R207	R207-Y209 HydrophobicContact CB-CE2 4.11Å; R207-Y209 WeakPolarHBondContact O-CD2 3.25Å; R207-Y209 PolarHBondContact O-N 2.79Å
210	Q	86.4	Confident	87.3	Confident	101 Å²	101	76.9 Å²	76.9	47%	0.472	38%	0.38	S	S	.	.	S	Bend	trans	-90.5	-19.1	-177.4	-63.4	-174.8	17.1	0	0	113.3	R242	Q210-R242 PolarHBondContact O-N 3.41Å
211	F	91.2	Very high	87.7	Confident	4 Å²	4	78.9 Å²	78.9	2%	0.018	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	158.1	-174.3	-67	-85.1	0	0	0	111.1	V75 H173 L208 L239 S240 R241	V75-F211 HydrophobicContact CB-CD2 3.83Å; V75-F211 HydrophobicContact CB-CE2 3.59Å; V75-F211 HydrophobicContact CB-CZ 4.43Å; V75-F211 HydrophobicContact CG1-CD2 4.43Å; V75-F211 HydrophobicContact CG1-CE2 3.8Å; V75-F211 HydrophobicContact CG1-CZ 4.17Å; V75-F211 HydrophobicContact CG2-CD2 4Å; V75-F211 HydrophobicContact CG2-CE2 4.21Å; H173-F211 AromaticContact CD2-CE1 3.59Å; L208-F211 WeakPolarHBondContact CB-O 3.26Å; F211-L239 HydrophobicContact CB-CB 4.4Å; F211-L239 HydrophobicContact CD1-CB 4.16Å; F211-S240 CarbonylContact C-O 3.12Å; F211-S240 VanDerWaalsContact CA-O 3.27Å; F211-S240 WeakPolarHBondContact CA-O 3.42Å; F211-R241 HydrophobicContact CD1-CB 4.08Å; F211-R241 HydrophobicContact CE1-CB 3.96Å; F211-R241 HydrophobicContact CE1-CG 4.31Å; F211-R241 VanDerWaalsContact CZ-NH2 3.31Å
212	S	91.2	Very high	88.5	Confident	41 Å²	41	82.2 Å²	82.2	29%	0.287	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	136.1	166.5	46.9	0	0	0	0	108.9	L239 S240	S212-L239 WeakPolarHBondContact O-CA 3.46Å; S212-S240 PolarHBondContact N-O 2.94Å; S212-S240 PolarHBondContact O-N 2.86Å; S212-S240 PolarHBondContact OG-O 3.22Å
213	F	92.4	Very high	89.1	Confident	54 Å²	54	79.8 Å²	79.8	24%	0.237	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	127.3	171.6	176.9	-105.8	0	0	0	109.8	I72 V200 T203 W206 L208 G215 L216 F237 L239	I72-F213 HydrophobicContact CD1-CD2 4.47Å; V200-F213 HydrophobicContact CG1-CZ 4.44Å; T203-F213 HydrophobicContact CG2-CD1 4.24Å; W206-F213 HydrophobicContact CE3-CB 4.17Å; W206-F213 HydrophobicContact CE3-CG 4.41Å; W206-F213 HydrophobicContact CH2-CD1 4.45Å; W206-F213 HydrophobicContact CH2-CD2 4.36Å; W206-F213 HydrophobicContact CH2-CE2 4.49Å; W206-F213 HydrophobicContact CH2-CG 4.33Å; W206-F213 HydrophobicContact CZ3-CB 3.79Å; W206-F213 HydrophobicContact CZ3-CD1 4.04Å; W206-F213 AromaticContact CZ3-CD2 3.72Å; W206-F213 HydrophobicContact CZ3-CD2 3.72Å; W206-F213 HydrophobicContact CZ3-CE2 4.27Å; W206-F213 AromaticContact CZ3-CG 3.57Å; W206-F213 HydrophobicContact CZ3-CG 3.57Å; L208-F213 HydrophobicContact CD1-CB 4.42Å; F213-G215 WeakPolarHBondContact CE2-O 3.27Å; F213-G215 WeakPolarHBondContact CZ-O 3.08Å; F213-L216 HydrophobicContact CE2-CB 4.5Å; F213-L216 HydrophobicContact CZ-CB 4.11Å; F213-F237 HydrophobicContact CE2-CD1 4.22Å; F213-L239 HydrophobicContact CB-CD2 4.45Å; F213-L239 HydrophobicContact CD2-CD2 4.25Å
214	V	91.9	Very high	89.8	Confident	88 Å²	88	84.4 Å²	84.4	53%	0.533	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	-48	-178.7	-178.9	0	0	0	0	110.5	D238 S240	V214-D238 HydrophobicContact CB-CB 4.26Å; V214-D238 PolarHBondContact N-O 3.17Å; V214-S240 VanDerWaalsContact CG2-CB 3.5Å
215	G	91.8	Very high	90.5	Very high	19 Å²	19	75.8 Å²	75.8	20%	0.196	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-172.9	178.8	-172.9	0	0	0	0	0	113.8	F213 D238	F213-G215 WeakPolarHBondContact CE2-O 3.27Å; F213-G215 WeakPolarHBondContact CZ-O 3.08Å; G215-D238 PolarHBondContact O-N 2.7Å
216	L	92.7	Very high	91.2	Very high	54 Å²	54	79.6 Å²	79.6	28%	0.283	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	142.5	-178.4	-176	139.4	0	0	0	110.5	V198 F213 V235 Y236 F237	V198-L216 HydrophobicContact CB-CD2 3.96Å; V198-L216 HydrophobicContact CG1-CD1 3.61Å; V198-L216 HydrophobicContact CG1-CD2 3.9Å; V198-L216 HydrophobicContact CG1-CG 4.44Å; V198-L216 HydrophobicContact CG2-CD2 4.33Å; F213-L216 HydrophobicContact CE2-CB 4.5Å; F213-L216 HydrophobicContact CZ-CB 4.11Å; L216-V235 HydrophobicContact CD1-CG1 3.6Å; L216-V235 HydrophobicContact CD2-CG1 3.9Å; L216-V235 HydrophobicContact CG-CG1 3.71Å; L216-Y236 VanDerWaalsContact CA-O 3.3Å; L216-Y236 WeakPolarHBondContact CA-O 3.32Å; L216-F237 HydrophobicContact CD1-CD1 3.57Å; L216-F237 HydrophobicContact CD1-CE1 3.24Å; L216-F237 HydrophobicContact CD1-CZ 4.06Å; L216-F237 HydrophobicContact CG-CE1 4.47Å
217	R	93.4	Very high	91.6	Very high	139 Å²	139	83.6 Å²	83.6	53%	0.525	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	144.4	173.2	-52.2	-173.2	-157.2	89.6	3.1	109.9	V235 Y236 D238	R217-V235 CarbonylContact O-C 3.57Å; R217-V235 WeakPolarHBondContact O-CA 3.3Å; R217-Y236 PolarHBondContact N-O 3.32Å; R217-Y236 PolarHBondContact O-N 3.31Å; R217-D238 IonicContact CZ-OD1 2.89Å; R217-D238 IonicContact CZ-OD2 3.84Å; R217-D238 IonicContact NE-OD2 2.89Å; R217-D238 VanDerWaalsContact NH1-CG 3.29Å; R217-D238 IonicContact NH1-OD1 2.71Å; R217-D238 PolarHBondContact NH1-OD1 3.44Å; R217-D238 IonicContact NH1-OD2 2.71Å; R217-D238 PolarHBondContact NH1-OD2 2.71Å; R217-D238 IonicContact NH2-OD1 3.45Å; R217-D238 IonicContact NH2-OD2 3.17Å; R217-D238 PolarHBondContact NH2-OD2 2.89Å
218	N	93.9	Very high	92.3	Very high	75 Å²	75	76.8 Å²	76.8	40%	0.401	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	141	174.1	60.3	-12.3	0	0	0	110.7	W193 S234	W193-N218 HydrophobicContact CZ2-CB 4.13Å; N218-S234 WeakPolarHBondContact CA-O 3.26Å
219	T	94.4	Very high	93	Very high	46 Å²	46	77.7 Å²	77.7	28%	0.282	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	164.3	175.5	66.2	0	0	0	0	110.3	W193 S234 Y236	W193-T219 PolarHBondContact NE1-O 3.01Å; T219-S234 PolarHBondContact N-O 3.44Å; T219-S234 PolarHBondContact O-N 3.28Å; T219-S234 VanDerWaalsContact O-N 3.08Å; T219-Y236 HydrophobicContact CG2-CD2 4.43Å; T219-Y236 HydrophobicContact CG2-CE2 4Å; T219-Y236 WeakPolarHBondContact OG1-CE2 3.29Å
220	T	95.9	Very high	93.8	Very high	83 Å²	83	70.5 Å²	70.5	51%	0.509	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	124.8	176.5	58.9	0	0	0	0	108.2	M233	T220-M233 HydrophobicContact CG2-CE 3.74Å; T220-M233 HydrophobicContact CG2-SD 3.5Å; T220-M233 VanDerWaalsContact CG2-SD 3.5Å
221	E	96.3	Very high	94.3	Very high	102 Å²	102	66.4 Å²	66.4	48%	0.477	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	158.4	-174.9	-65	-178	-170.5	0	0	110.6	V232	E221-V232 PolarHBondContact N-O 3.07Å; E221-V232 PolarHBondContact O-N 3.41Å
222	V	96.6	Very high	94.6	Very high	79 Å²	79	66.4 Å²	66.4	48%	0.479	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	117.1	173.4	-179.6	0	0	0	0	107.9	D229 Y230	V222-D229 HydrophobicContact CG1-CB 4.05Å; V222-Y230 WeakPolarHBondContact CA-O 3.38Å
223	V	95.7	Very high	94.9	Very high	46 Å²	46	64.5 Å²	64.5	28%	0.279	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	123.8	-178.5	179.2	0	0	0	0	109.2	T225 Y230 V232	V223-T225 HydrophobicContact CG1-CG2 4.43Å; V223-Y230 PolarHBondContact N-O 3.24Å; V223-Y230 PolarHBondContact O-N 3.16Å; V223-V232 HydrophobicContact CB-CG2 3.88Å; V223-V232 HydrophobicContact CG2-CB 4.2Å; V223-V232 HydrophobicContact CG2-CG2 3.56Å
224	K	96.2	Very high	95.1	Very high	169 Å²	169	62 Å²	62	74%	0.735	35%	0.346	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82	127.7	174.1	-175.1	158.2	-171.2	154.1	0	110.2	D229	K224-D229 WeakPolarHBondContact CB-OD1 3.43Å; K224-D229 WeakPolarHBondContact CD-OD1 3.4Å; K224-D229 VanDerWaalsContact CG-OD1 3.29Å; K224-D229 WeakPolarHBondContact CG-OD1 3.48Å
225	T	94.1	Very high	95.2	Very high	47 Å²	47	57.8 Å²	57.8	29%	0.288	32%	0.32	S	S	.	.			trans	-122.4	175.7	175.3	69	0	0	0	0	109.9	V223 S227 G228 Y230	V223-T225 HydrophobicContact CG1-CG2 4.43Å; T225-S227 PolarHBondContact O-N 3.11Å; T225-S227 PolarHBondContact OG1-N 3.03Å; T225-G228 PolarHBondContact N-O 3.27Å; T225-G228 PolarHBondContact O-N 3.45Å; T225-G228 PolarHBondContact OG1-N 2.91Å; T225-G228 PolarHBondContact OG1-O 2.75Å; T225-Y230 HydrophobicContact CG2-CD2 4.06Å; T225-Y230 WeakPolarHBondContact OG1-CD2 3.25Å; T225-Y230 WeakPolarHBondContact OG1-CE2 3.28Å
226	T	94	Very high	95.4	Very high	154 Å²	154	59.6 Å²	59.6	95%	0.945	32%	0.322	S	S	*	.	S	Bend	trans	-59	-34.5	175.7	-43.3	0	0	0	0	112.5
227	S	92.6	Very high	95.5	Very high	102 Å²	102	57.1 Å²	57.1	71%	0.713	31%	0.309	S	S	*	.	S	Bend	trans	-82.9	-21	-177.2	-52.8	0	0	0	0	113.6	T225	T225-S227 PolarHBondContact O-N 3.11Å; T225-S227 PolarHBondContact OG1-N 3.03Å
228	G	94.8	Very high	95.6	Very high	21 Å²	21	51.3 Å²	51.3	22%	0.216	29%	0.288	C	S	.	.			trans	152.7	-173.4	-175.5	0	0	0	0	0	113.3	T225 Y230	T225-G228 PolarHBondContact N-O 3.27Å; T225-G228 PolarHBondContact O-N 3.45Å; T225-G228 PolarHBondContact OG1-N 2.91Å; T225-G228 PolarHBondContact OG1-O 2.75Å; G228-Y230 WeakPolarHBondContact O-CD2 3.14Å
229	D	97.1	Very high	95.6	Very high	37 Å²	37	47.9 Å²	47.9	20%	0.198	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	126.6	177.1	-66.3	-15.4	0	0	0	109.6	P185 R186 V222 K224	P185-D229 CarbonylContact C-O 3.43Å; P185-D229 WeakPolarHBondContact CA-O 3.29Å; R186-D229 WeakPolarHBondContact CB-O 3.5Å; R186-D229 PolarHBondContact N-O 3.02Å; R186-D229 IonicContact NH2-OD2 3.88Å; R186-D229 PolarHBondContact NH2-OD2 3.44Å; V222-D229 HydrophobicContact CG1-CB 4.05Å; K224-D229 WeakPolarHBondContact CB-OD1 3.43Å; K224-D229 WeakPolarHBondContact CD-OD1 3.4Å; K224-D229 VanDerWaalsContact CG-OD1 3.29Å; K224-D229 WeakPolarHBondContact CG-OD1 3.48Å
230	Y	97.1	Very high	95.5	Very high	20 Å²	20	47 Å²	47	8%	0.078	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	140.1	-179.3	-68.6	-94.5	0	0	0	111.1	S181 Y184 V222 V223 T225 G228	S181-Y230 WeakPolarHBondContact O-CD1 3.48Å; Y184-Y230 VanDerWaalsContact C-CE1 3.48Å; Y184-Y230 WeakPolarHBondContact O-CD1 3.28Å; Y184-Y230 WeakPolarHBondContact O-CE1 3.44Å; V222-Y230 WeakPolarHBondContact CA-O 3.38Å; V223-Y230 PolarHBondContact N-O 3.24Å; V223-Y230 PolarHBondContact O-N 3.16Å; T225-Y230 HydrophobicContact CG2-CD2 4.06Å; T225-Y230 WeakPolarHBondContact OG1-CD2 3.25Å; T225-Y230 WeakPolarHBondContact OG1-CE2 3.28Å; G228-Y230 WeakPolarHBondContact O-CD2 3.14Å
231	V	96.9	Very high	95.4	Very high	15 Å²	15	43.5 Å²	43.5	9%	0.091	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	122.5	171.2	-177	0	0	0	0	108.8	S180 R186 V190 M233	S180-V231 VanDerWaalsContact CB-O 3.29Å; S180-V231 WeakPolarHBondContact CB-O 3.48Å; R186-V231 HydrophobicContact CB-CG2 4.06Å; R186-V231 HydrophobicContact CG-CG2 3.71Å; V190-V231 HydrophobicContact CG1-CG2 4.46Å; V231-M233 HydrophobicContact CG1-SD 4.28Å
232	V	97.7	Very high	95.1	Very high	4 Å²	4	45.6 Å²	45.6	2%	0.024	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	129	177.3	-176.3	0	0	0	0	108.8	E178 E221 V223	E178-V232 HydrophobicContact CB-CG1 4.29Å; E221-V232 PolarHBondContact N-O 3.07Å; E221-V232 PolarHBondContact O-N 3.41Å; V223-V232 HydrophobicContact CB-CG2 3.88Å; V223-V232 HydrophobicContact CG2-CB 4.2Å; V223-V232 HydrophobicContact CG2-CG2 3.56Å
233	M	96.9	Very high	94.8	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	128	176.3	-56.9	-66.9	-76.7	0	0	107.7	E178 F179 Y191 W193 T220 V231	E178-M233 WeakPolarHBondContact CA-O 3.48Å; F179-M233 HydrophobicContact CD1-CB 4.19Å; F179-M233 HydrophobicContact CD2-CB 3.92Å; F179-M233 HydrophobicContact CD2-CG 4.22Å; F179-M233 HydrophobicContact CE1-CB 3.73Å; F179-M233 HydrophobicContact CE2-CB 3.42Å; F179-M233 VanDerWaalsContact CE2-CB 3.42Å; F179-M233 HydrophobicContact CE2-CG 3.58Å; F179-M233 HydrophobicContact CG-CB 4.28Å; F179-M233 HydrophobicContact CZ-CB 3.31Å; F179-M233 HydrophobicContact CZ-CG 3.87Å; F179-M233 PolarHBondContact N-O 2.04Å; F179-M233 PolarHBondContact O-N 3.05Å; Y191-M233 VanDerWaalsContact CB-CG 3.47Å; Y191-M233 VanDerWaalsContact CB-SD 3.59Å; Y191-M233 HydrophobicContact CD2-CG 4.49Å; Y191-M233 HydrophobicContact CG-CG 4.08Å; W193-M233 HydrophobicContact CB-CE 4.41Å; W193-M233 HydrophobicContact CD2-CE 3.45Å; W193-M233 VanDerWaalsContact CD2-CE 3.45Å; W193-M233 HydrophobicContact CE3-CE 4.17Å; W193-M233 HydrophobicContact CG-CE 3.51Å; W193-M233 HydrophobicContact CZ2-CB 4.06Å; W193-M233 HydrophobicContact CZ2-CE 4.01Å; W193-M233 VanDerWaalsContact NE1-CE 3.26Å; T220-M233 HydrophobicContact CG2-CE 3.74Å; T220-M233 HydrophobicContact CG2-SD 3.5Å; T220-M233 VanDerWaalsContact CG2-SD 3.5Å; V231-M233 HydrophobicContact CG1-SD 4.28Å
234	S	96.3	Very high	94.6	Very high	1 Å²	1	43.6 Å²	43.6	1%	0.007	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	138.4	-176.3	-56.8	0	0	0	0	110.9	N218 T219	N218-S234 WeakPolarHBondContact CA-O 3.26Å; T219-S234 PolarHBondContact N-O 3.44Å; T219-S234 PolarHBondContact O-N 3.28Å; T219-S234 VanDerWaalsContact O-N 3.08Å
235	V	95.9	Very high	94.3	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	126.1	171.7	-177.2	0	0	0	0	108.4	M67 P176 L177 W193 V198 L216 R217 F237	M67-V235 HydrophobicContact CE-CB 4.19Å; M67-V235 HydrophobicContact CE-CG1 4.03Å; M67-V235 HydrophobicContact CE-CG2 3.87Å; P176-V235 CarbonylContact C-O 3.56Å; P176-V235 WeakPolarHBondContact CA-O 3.3Å; L177-V235 PolarHBondContact N-O 3.46Å; L177-V235 PolarHBondContact O-N 3.41Å; W193-V235 HydrophobicContact CH2-CG2 3.24Å; W193-V235 HydrophobicContact CZ2-CG2 3.52Å; W193-V235 HydrophobicContact CZ3-CG2 4.31Å; V198-V235 HydrophobicContact CG2-CG2 4.19Å; L216-V235 HydrophobicContact CD1-CG1 3.6Å; L216-V235 HydrophobicContact CD2-CG1 3.9Å; L216-V235 HydrophobicContact CG-CG1 3.71Å; R217-V235 CarbonylContact O-C 3.57Å; R217-V235 WeakPolarHBondContact O-CA 3.3Å; V235-F237 HydrophobicContact CB-CE2 4.39Å; V235-F237 HydrophobicContact CG1-CE1 4.21Å; V235-F237 HydrophobicContact CG1-CE2 3.99Å; V235-F237 HydrophobicContact CG1-CZ 3.78Å
236	Y	95.6	Very high	94.1	Very high	58 Å²	58	40 Å²	40	23%	0.227	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	124.8	177.5	-60.6	-84.4	0	0	0	109.5	P176 L216 R217 T219	P176-Y236 HydrophobicContact CB-CD1 3.89Å; P176-Y236 HydrophobicContact CB-CE1 3.73Å; L216-Y236 VanDerWaalsContact CA-O 3.3Å; L216-Y236 WeakPolarHBondContact CA-O 3.32Å; R217-Y236 PolarHBondContact N-O 3.32Å; R217-Y236 PolarHBondContact O-N 3.31Å; T219-Y236 HydrophobicContact CG2-CD2 4.43Å; T219-Y236 HydrophobicContact CG2-CE2 4Å; T219-Y236 WeakPolarHBondContact OG1-CE2 3.29Å
237	F	94.8	Very high	94	Very high	1 Å²	1	34.6 Å²	34.6	0%	0.004	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	113.9	173.5	-60.2	-82.6	0	0	0	109.2	M67 V69 I72 Y82 I84 S174 C175 L177 F213 L216 V235	M67-F237 HydrophobicContact CE-CZ 3.97Å; V69-F237 HydrophobicContact CG2-CE1 3.92Å; V69-F237 HydrophobicContact CG2-CZ 4.05Å; I72-F237 HydrophobicContact CD1-CD1 3.99Å; I72-F237 HydrophobicContact CD1-CE1 4.49Å; I72-F237 HydrophobicContact CD1-CG 4.39Å; Y82-F237 HydrophobicContact CE2-CD2 4.5Å; I84-F237 HydrophobicContact CD1-CE1 4.15Å; I84-F237 HydrophobicContact CD1-CE2 3.75Å; I84-F237 HydrophobicContact CD1-CZ 3.53Å; S174-F237 WeakPolarHBondContact CA-O 3.43Å; C175-F237 PolarHBondContact N-O 3.32Å; C175-F237 PolarHBondContact O-N 2.87Å; L177-F237 HydrophobicContact CB-CE2 3.9Å; L177-F237 HydrophobicContact CD2-CE2 4.34Å; F213-F237 HydrophobicContact CE2-CD1 4.22Å; L216-F237 HydrophobicContact CD1-CD1 3.57Å; L216-F237 HydrophobicContact CD1-CE1 3.24Å; L216-F237 HydrophobicContact CD1-CZ 4.06Å; L216-F237 HydrophobicContact CG-CE1 4.47Å; V235-F237 HydrophobicContact CB-CE2 4.39Å; V235-F237 HydrophobicContact CG1-CE1 4.21Å; V235-F237 HydrophobicContact CG1-CE2 3.99Å; V235-F237 HydrophobicContact CG1-CZ 3.78Å
238	D	94.9	Very high	94	Very high	17 Å²	17	35.4 Å²	35.4	9%	0.091	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	120.5	177.2	-60.5	-46.3	0	0	0	110.1	H173 S174 V214 G215 R217	H173-D238 CarbonylContact O-C 3.47Å; H173-D238 WeakPolarHBondContact O-CA 3.37Å; S174-D238 WeakPolarHBondContact CB-OD1 3.33Å; S174-D238 PolarHBondContact OG-OD1 3.05Å; V214-D238 HydrophobicContact CB-CB 4.26Å; V214-D238 PolarHBondContact N-O 3.17Å; G215-D238 PolarHBondContact O-N 2.7Å; R217-D238 IonicContact CZ-OD1 2.89Å; R217-D238 IonicContact CZ-OD2 3.84Å; R217-D238 IonicContact NE-OD2 2.89Å; R217-D238 VanDerWaalsContact NH1-CG 3.29Å; R217-D238 IonicContact NH1-OD1 2.71Å; R217-D238 PolarHBondContact NH1-OD1 3.44Å; R217-D238 IonicContact NH1-OD2 2.71Å; R217-D238 PolarHBondContact NH1-OD2 2.71Å; R217-D238 IonicContact NH2-OD1 3.45Å; R217-D238 IonicContact NH2-OD2 3.17Å; R217-D238 PolarHBondContact NH2-OD2 2.89Å
239	L	93.9	Very high	93.8	Very high	4 Å²	4	39 Å²	39	2%	0.021	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	131	-177.9	-58.9	178.8	0	0	0	109.3	V75 E172 H173 L208 F211 S212 F213	V75-L239 HydrophobicContact CG2-CD1 3.79Å; E172-L239 WeakPolarHBondContact CA-O 3.39Å; H173-L239 PolarHBondContact N-O 3.43Å; H173-L239 PolarHBondContact O-N 3.27Å; L208-L239 HydrophobicContact CD1-CD2 4.23Å; F211-L239 HydrophobicContact CB-CB 4.4Å; F211-L239 HydrophobicContact CD1-CB 4.16Å; S212-L239 WeakPolarHBondContact O-CA 3.46Å; F213-L239 HydrophobicContact CB-CD2 4.45Å; F213-L239 HydrophobicContact CD2-CD2 4.25Å
240	S	93.1	Very high	93.6	Very high	27 Å²	27	37.7 Å²	37.7	19%	0.189	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	138.3	174.6	176.3	0	0	0	0	110.1	F211 S212 V214	F211-S240 CarbonylContact C-O 3.12Å; F211-S240 VanDerWaalsContact CA-O 3.27Å; F211-S240 WeakPolarHBondContact CA-O 3.42Å; S212-S240 PolarHBondContact N-O 2.94Å; S212-S240 PolarHBondContact O-N 2.86Å; S212-S240 PolarHBondContact OG-O 3.22Å; V214-S240 VanDerWaalsContact CG2-CB 3.5Å
241	R	92.4	Very high	93.4	Very high	10 Å²	10	37 Å²	37	4%	0.038	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	139.9	-177.7	-170.3	-179.6	-55.6	-85.3	0.5	112.2	P169 D171 H173 F211 M243 F246	P169-R241 WeakPolarHBondContact O-CB 3.23Å; P169-R241 WeakPolarHBondContact O-CD 3.21Å; D171-R241 VanDerWaalsContact CG-NE 3.35Å; D171-R241 PolarHBondContact O-N 2.73Å; D171-R241 VanDerWaalsContact O-N 3.15Å; D171-R241 VanDerWaalsContact OD1-CB 3.26Å; D171-R241 WeakPolarHBondContact OD1-CB 3.42Å; D171-R241 VanDerWaalsContact OD1-CD 3.23Å; D171-R241 WeakPolarHBondContact OD1-CD 3.29Å; D171-R241 IonicContact OD1-CZ 3.81Å; D171-R241 IonicContact OD1-NE 2.89Å; D171-R241 PolarHBondContact OD1-NE 2.97Å; D171-R241 IonicContact OD1-NH2 3.93Å; D171-R241 IonicContact OD2-CZ 3.87Å; D171-R241 IonicContact OD2-NE 3.39Å; D171-R241 PolarHBondContact OD2-NE 2.85Å; D171-R241 VanDerWaalsContact OD2-NE 3.17Å; D171-R241 IonicContact OD2-NH2 3.03Å; D171-R241 PolarHBondContact OD2-NH2 3.41Å; H173-R241 PolarHBondContact NE2-NH2 2.86Å; F211-R241 HydrophobicContact CD1-CB 4.08Å; F211-R241 HydrophobicContact CE1-CB 3.96Å; F211-R241 HydrophobicContact CE1-CG 4.31Å; F211-R241 VanDerWaalsContact CZ-NH2 3.31Å; R241-M243 PolarHBondContact O-N 2.88Å; R241-F246 HydrophobicContact CG-CE2 4.42Å
242	R	91.3	Very high	93.3	Very high	145 Å²	145	40.2 Å²	40.2	55%	0.547	20%	0.198	S	C	.	.			trans	-81.2	117.3	172.9	-61.6	-175.9	-174.3	-140.1	2.5	111.1	Q210 G244	Q210-R242 PolarHBondContact O-N 3.41Å; R242-G244 PolarHBondContact O-N 3.45Å
243	M	90.1	Very high	93.2	Very high	40 Å²	40	41.9 Å²	41.9	20%	0.197	21%	0.209	C	C	.	.			trans	-73.1	-18.7	-175.5	-73.4	-67	-74.3	0	0	116.2	P169 M170 R241 Y245 F246 T247 Y251 W440	P169-M243 HydrophobicContact CB-CE 4.4Å; P169-M243 HydrophobicContact CB-SD 3.51Å; P169-M243 VanDerWaalsContact CB-SD 3.51Å; P169-M243 HydrophobicContact CG-CE 3.75Å; P169-M243 HydrophobicContact CG-SD 3.54Å; P169-M243 VanDerWaalsContact CG-SD 3.54Å; M170-M243 HydrophobicContact CB-SD 4.22Å; M170-M243 HydrophobicContact CE-CE 3.42Å; M170-M243 VanDerWaalsContact CE-CE 3.42Å; M170-M243 HydrophobicContact CG-CE 3.18Å; M170-M243 HydrophobicContact CG-CG 4.11Å; M170-M243 HydrophobicContact CG-SD 3.39Å; M170-M243 WeakPolarHBondContact CG-SD 3.36Å; M170-M243 PolarHBondContact N-SD 3.39Å; M170-M243 HydrophobicContact SD-CE 3.95Å; R241-M243 PolarHBondContact O-N 2.88Å; M243-Y245 PolarHBondContact O-N 2.95Å; M243-F246 PolarHBondContact O-N 3.05Å; M243-T247 PolarHBondContact O-N 3.41Å; M243-T247 PolarHBondContact O-OG1 2.66Å; M243-Y251 HydrophobicContact CE-CE2 4.4Å; M243-W440 HydrophobicContact CE-CZ3 4.38Å
244	G	90.1	Very high	93.2	Very high	43 Å²	43	41.9 Å²	41.9	44%	0.443	21%	0.209	S	C	.	.	H	α-helix	trans	-59.2	-42	-167.3	0	0	0	0	0	114.5	R242 T247 I248	R242-G244 PolarHBondContact O-N 3.45Å; G244-T247 PolarHBondContact O-N 2.84Å; G244-I248 WeakPolarHBondContact O-CG1 3.41Å; G244-I248 PolarHBondContact O-N 2.98Å; G244-I248 VanDerWaalsContact O-N 3.14Å
245	Y	90.3	Very high	93.1	Very high	127 Å²	127	43.9 Å²	43.9	50%	0.498	22%	0.221	S	C	.	.	H	α-helix	trans	-61.7	-49	-180	176.4	-92.9	0	0	0	112.3	M243 T247 I248 Q249	M243-Y245 PolarHBondContact O-N 2.95Å; Y245-T247 VanDerWaalsContact C-N 3.31Å; Y245-T247 PolarHBondContact O-N 3.14Å; Y245-I248 PolarHBondContact O-N 3.45Å; Y245-Q249 HydrophobicContact CE1-CG 4.49Å; Y245-Q249 VanDerWaalsContact CE2-CD 3.47Å; Y245-Q249 HydrophobicContact CE2-CG 4.27Å; Y245-Q249 WeakPolarHBondContact O-CB 3.4Å; Y245-Q249 PolarHBondContact O-N 3.29Å; Y245-Q249 VanDerWaalsContact OH-CD 3.25Å; Y245-Q249 PolarHBondContact OH-NE2 3.32Å; Y245-Q249 VanDerWaalsContact OH-NE2 3.13Å; Y245-Q249 PolarHBondContact OH-OE1 3.48Å
246	F	91	Very high	93.1	Very high	15 Å²	15	48.7 Å²	48.7	7%	0.066	25%	0.246	C	C	.	.	H	α-helix	trans	-69.4	-31.3	-179	-59.8	-73	0	0	0	112.1	F168 P169 R241 M243 T250 Y251	F168-F246 HydrophobicContact CE1-CD1 4.29Å; F168-F246 HydrophobicContact CE1-CE1 4.25Å; F168-F246 HydrophobicContact CE2-CE1 4.35Å; F168-F246 HydrophobicContact CE2-CE2 4.26Å; F168-F246 AromaticContact CE2-CZ 3.98Å; F168-F246 HydrophobicContact CE2-CZ 3.98Å; F168-F246 AromaticContact CZ-CD1 3.86Å; F168-F246 HydrophobicContact CZ-CD1 3.86Å; F168-F246 HydrophobicContact CZ-CD2 4.38Å; F168-F246 AromaticContact CZ-CE1 3.45Å; F168-F246 HydrophobicContact CZ-CE1 3.45Å; F168-F246 VanDerWaalsContact CZ-CE1 3.45Å; F168-F246 HydrophobicContact CZ-CE2 4.02Å; F168-F246 HydrophobicContact CZ-CG 4.32Å; F168-F246 AromaticContact CZ-CZ 3.53Å; F168-F246 HydrophobicContact CZ-CZ 3.53Å; P169-F246 HydrophobicContact CB-CB 4.18Å; P169-F246 HydrophobicContact CB-CD2 3.57Å; P169-F246 HydrophobicContact CB-CE2 4.18Å; P169-F246 HydrophobicContact CB-CG 3.88Å; P169-F246 HydrophobicContact CG-CB 3.77Å; P169-F246 HydrophobicContact CG-CD2 4.15Å; P169-F246 HydrophobicContact CG-CG 3.98Å; R241-F246 HydrophobicContact CG-CE2 4.42Å; M243-F246 PolarHBondContact O-N 3.05Å; F246-T250 WeakPolarHBondContact O-CA 3.48Å; F246-T250 WeakPolarHBondContact O-CB 3.39Å; F246-T250 PolarHBondContact O-N 2.83Å; F246-Y251 HydrophobicContact CB-CE2 4.5Å; F246-Y251 WeakPolarHBondContact O-CD2 3.2Å; F246-Y251 PolarHBondContact O-N 3.44Å
247	T	91.4	Very high	93.1	Very high	40 Å²	40	46.6 Å²	46.6	25%	0.245	24%	0.239	C	C	.	.	I	π-helix	trans	-60.8	-49.6	173.4	-55	0	0	0	0	111.1	M243 G244 Y245 Y251 I252	M243-T247 PolarHBondContact O-N 3.41Å; M243-T247 PolarHBondContact O-OG1 2.66Å; G244-T247 PolarHBondContact O-N 2.84Å; Y245-T247 VanDerWaalsContact C-N 3.31Å; Y245-T247 PolarHBondContact O-N 3.14Å; T247-Y251 PolarHBondContact O-N 3.34Å; T247-I252 HydrophobicContact CG2-CD1 4.34Å; T247-I252 HydrophobicContact CG2-CG1 4.42Å; T247-I252 WeakPolarHBondContact O-CG1 3.23Å; T247-I252 PolarHBondContact O-N 2.98Å
248	I	92.6	Very high	93.2	Very high	119 Å²	119	46.6 Å²	46.6	61%	0.61	24%	0.239	S	C	*	.	I	π-helix	trans	-72.4	-40.9	-176.9	-63.8	167.2	0	0	0	111.9	G244 Y245 P253	G244-I248 WeakPolarHBondContact O-CG1 3.41Å; G244-I248 PolarHBondContact O-N 2.98Å; G244-I248 VanDerWaalsContact O-N 3.14Å; Y245-I248 PolarHBondContact O-N 3.45Å; I248-P253 VanDerWaalsContact O-CD 3.26Å; I248-P253 WeakPolarHBondContact O-CD 3.12Å
249	Q	90.3	Very high	93.3	Very high	97 Å²	97	48.9 Å²	48.9	45%	0.453	25%	0.253	S	S	.	.	I	π-helix	trans	-86.9	-25.7	-174.7	-70.5	-157.6	0.6	0	0	115	Y245 P253	Y245-Q249 HydrophobicContact CE1-CG 4.49Å; Y245-Q249 VanDerWaalsContact CE2-CD 3.47Å; Y245-Q249 HydrophobicContact CE2-CG 4.27Å; Y245-Q249 WeakPolarHBondContact O-CB 3.4Å; Y245-Q249 PolarHBondContact O-N 3.29Å; Y245-Q249 VanDerWaalsContact OH-CD 3.25Å; Y245-Q249 PolarHBondContact OH-NE2 3.32Å; Y245-Q249 VanDerWaalsContact OH-NE2 3.13Å; Y245-Q249 PolarHBondContact OH-OE1 3.48Å; Q249-P253 WeakPolarHBondContact O-CG 3.33Å
250	T	92.1	Very high	93.3	Very high	9 Å²	9	53.1 Å²	53.1	6%	0.055	28%	0.276	C	S	.	.	I	π-helix	trans	-121.3	-59.5	-172.6	-50.3	0	0	0	0	111.8	F246 I252 P253 C254 A293 M306 V310	F246-T250 WeakPolarHBondContact O-CA 3.48Å; F246-T250 WeakPolarHBondContact O-CB 3.39Å; F246-T250 PolarHBondContact O-N 2.83Å; T250-I252 PolarHBondContact O-N 2.96Å; T250-P253 WeakPolarHBondContact O-CD 3.28Å; T250-C254 VanDerWaalsContact O-CB 3.29Å; T250-C254 WeakPolarHBondContact O-CB 3.44Å; T250-C254 PolarHBondContact O-N 3.32Å; T250-C254 PolarHBondContact O-SG 2.98Å; T250-A293 HydrophobicContact CG2-CB 4.21Å; T250-M306 HydrophobicContact CG2-CG 4.26Å; T250-M306 HydrophobicContact CG2-SD 4.06Å; T250-V310 HydrophobicContact CG2-CG2 4.09Å
251	Y	94.2	Very high	93.4	Very high	4 Å²	4	52 Å²	52	2%	0.016	27%	0.268	C	S	.	.	I	π-helix	trans	-64.8	-45.2	-173.6	-70.5	-80	0	0	0	113.4	P169 M243 F246 T247 T255 F309 Y439 W440	P169-Y251 WeakPolarHBondContact CD-OH 3.44Å; P169-Y251 HydrophobicContact CG-CE2 3.96Å; M243-Y251 HydrophobicContact CE-CE2 4.4Å; F246-Y251 HydrophobicContact CB-CE2 4.5Å; F246-Y251 WeakPolarHBondContact O-CD2 3.2Å; F246-Y251 PolarHBondContact O-N 3.44Å; T247-Y251 PolarHBondContact O-N 3.34Å; Y251-T255 WeakPolarHBondContact O-CB 3.39Å; Y251-T255 PolarHBondContact O-N 3.27Å; Y251-T255 PolarHBondContact O-OG1 2.83Å; Y251-F309 HydrophobicContact CD1-CB 4.41Å; Y251-F309 AromaticContact CD1-CD1 3.45Å; Y251-F309 HydrophobicContact CD1-CD1 3.45Å; Y251-F309 VanDerWaalsContact CD1-CD1 3.45Å; Y251-F309 AromaticContact CD1-CD2 3.96Å; Y251-F309 HydrophobicContact CD1-CD2 3.96Å; Y251-F309 AromaticContact CD1-CE1 3.55Å; Y251-F309 HydrophobicContact CD1-CE1 3.55Å; Y251-F309 HydrophobicContact CD1-CE2 4.04Å; Y251-F309 AromaticContact CD1-CG 3.67Å; Y251-F309 HydrophobicContact CD1-CG 3.67Å; Y251-F309 AromaticContact CD1-CZ 3.86Å; Y251-F309 HydrophobicContact CD1-CZ 3.86Å; Y251-F309 HydrophobicContact CE1-CB 3.75Å; Y251-F309 AromaticContact CE1-CD1 3.69Å; Y251-F309 HydrophobicContact CE1-CD1 3.69Å; Y251-F309 AromaticContact CE1-CD2 3.87Å; Y251-F309 HydrophobicContact CE1-CD2 3.87Å; Y251-F309 HydrophobicContact CE1-CE1 4.25Å; Y251-F309 HydrophobicContact CE1-CE2 4.41Å; Y251-F309 AromaticContact CE1-CG 3.48Å; Y251-F309 HydrophobicContact CE1-CG 3.48Å; Y251-F309 VanDerWaalsContact CE1-CG 3.48Å; Y251-F309 HydrophobicContact CG-CE1 4.48Å; Y251-Y439 AromaticContact CE1-CE1 3.92Å; Y251-Y439 HydrophobicContact CE1-CE1 3.92Å; Y251-Y439 PolarHBondContact OH-OH 3.14Å; Y251-W440 HydrophobicContact CD1-CH2 4.39Å; Y251-W440 HydrophobicContact CD1-CZ2 4.14Å; Y251-W440 HydrophobicContact CG-CH2 4.39Å; Y251-W440 HydrophobicContact CG-CZ2 4.38Å
252	I	95	Very high	93.4	Very high	83 Å²	83	53.2 Å²	53.2	43%	0.426	27%	0.272	S	S	.	.	H	α-helix	trans	-63.4	-52.9	179.1	-71.4	172.9	0	0	0	110.8	T247 T250 C254 T255 L256	T247-I252 HydrophobicContact CG2-CD1 4.34Å; T247-I252 HydrophobicContact CG2-CG1 4.42Å; T247-I252 WeakPolarHBondContact O-CG1 3.23Å; T247-I252 PolarHBondContact O-N 2.98Å; T250-I252 PolarHBondContact O-N 2.96Å; I252-C254 PolarHBondContact O-N 3.33Å; I252-T255 PolarHBondContact O-N 2.82Å; I252-L256 HydrophobicContact CG2-CD1 3.92Å; I252-L256 HydrophobicContact CG2-CG 4.41Å; I252-L256 WeakPolarHBondContact O-CG 3.08Å; I252-L256 PolarHBondContact O-N 3.47Å
253	P	95.6	Very high	93.5	Very high	40 Å²	40	49.6 Å²	49.6	26%	0.26	27%	0.266	S	S	.	.	H	α-helix	trans	-59.4	-42.2	176.7	-28.5	37.7	0	0	0	114	I248 Q249 T250 T255 L256 I257 L289	I248-P253 VanDerWaalsContact O-CD 3.26Å; I248-P253 WeakPolarHBondContact O-CD 3.12Å; Q249-P253 WeakPolarHBondContact O-CG 3.33Å; T250-P253 WeakPolarHBondContact O-CD 3.28Å; P253-T255 VanDerWaalsContact C-N 3.34Å; P253-T255 PolarHBondContact O-N 3.48Å; P253-L256 PolarHBondContact O-N 2.94Å; P253-I257 VanDerWaalsContact O-CG1 3.26Å; P253-I257 WeakPolarHBondContact O-CG1 3.47Å; P253-I257 PolarHBondContact O-N 3.41Å; P253-L289 HydrophobicContact CB-CD2 3.91Å
254	C	95.3	Very high	93.5	Very high	0 Å²	0	48 Å²	48	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-58.1	-46.9	175.1	-77.5	0	0	0	0	111.6	T250 I252 L256 I257 V258 M286 L289 F309	T250-C254 VanDerWaalsContact O-CB 3.29Å; T250-C254 WeakPolarHBondContact O-CB 3.44Å; T250-C254 PolarHBondContact O-N 3.32Å; T250-C254 PolarHBondContact O-SG 2.98Å; I252-C254 PolarHBondContact O-N 3.33Å; C254-L256 PolarHBondContact O-N 3.3Å; C254-I257 PolarHBondContact O-N 2.95Å; C254-V258 WeakPolarHBondContact O-CG2 3.34Å; C254-V258 PolarHBondContact O-N 3.07Å; C254-M286 HydrophobicContact CB-CE 4.5Å; C254-L289 HydrophobicContact CB-CD2 4.4Å; C254-L289 WeakPolarHBondContact SG-CD2 3.5Å; C254-F309 HydrophobicContact CB-CD1 4.46Å; C254-F309 HydrophobicContact CB-CE1 3.9Å
255	T	95.9	Very high	93.5	Very high	42 Å²	42	46 Å²	46	26%	0.258	24%	0.238	S	C	.	.	H	α-helix	trans	-62.3	-43.2	178.8	-59.6	0	0	0	0	111.3	Y251 I252 P253 I257 V258 V259 F432	Y251-T255 WeakPolarHBondContact O-CB 3.39Å; Y251-T255 PolarHBondContact O-N 3.27Å; Y251-T255 PolarHBondContact O-OG1 2.83Å; I252-T255 PolarHBondContact O-N 2.82Å; P253-T255 VanDerWaalsContact C-N 3.34Å; P253-T255 PolarHBondContact O-N 3.48Å; T255-I257 PolarHBondContact O-N 3.17Å; T255-V258 PolarHBondContact O-N 3.36Å; T255-V259 WeakPolarHBondContact O-CG2 3.33Å; T255-V259 PolarHBondContact O-N 2.87Å; T255-F432 HydrophobicContact CG2-CE1 3.91Å; T255-F432 HydrophobicContact CG2-CZ 4.21Å
256	L	95.8	Very high	93.5	Very high	101 Å²	101	48.3 Å²	48.3	53%	0.529	25%	0.246	S	C	.	.	H	α-helix	trans	-62.4	-41.2	176.8	-70	172.6	0	0	0	112.2	I252 P253 C254 V258 V259 L260	I252-L256 HydrophobicContact CG2-CD1 3.92Å; I252-L256 HydrophobicContact CG2-CG 4.41Å; I252-L256 WeakPolarHBondContact O-CG 3.08Å; I252-L256 PolarHBondContact O-N 3.47Å; P253-L256 PolarHBondContact O-N 2.94Å; C254-L256 PolarHBondContact O-N 3.3Å; L256-V258 VanDerWaalsContact C-N 3.34Å; L256-V258 PolarHBondContact O-N 2.97Å; L256-V259 PolarHBondContact O-N 2.82Å; L256-L260 WeakPolarHBondContact O-CB 3.28Å; L256-L260 VanDerWaalsContact O-CG 3.24Å; L256-L260 WeakPolarHBondContact O-CG 3.48Å; L256-L260 PolarHBondContact O-N 3.03Å
257	I	96	Very high	93.5	Very high	15 Å²	15	49.8 Å²	49.8	8%	0.077	25%	0.254	C	S	.	.	H	α-helix	trans	-63.2	-41.3	176.6	-66.4	162.4	0	0	0	111	P253 C254 T255 L260 S261 T282 T285 M286 L289 V317	P253-I257 VanDerWaalsContact O-CG1 3.26Å; P253-I257 WeakPolarHBondContact O-CG1 3.47Å; P253-I257 PolarHBondContact O-N 3.41Å; C254-I257 PolarHBondContact O-N 2.95Å; T255-I257 PolarHBondContact O-N 3.17Å; I257-L260 PolarHBondContact O-N 3.04Å; I257-S261 PolarHBondContact O-N 3Å; I257-T282 HydrophobicContact CG2-CG2 4.31Å; I257-T285 HydrophobicContact CD1-CG2 3.55Å; I257-T285 HydrophobicContact CG1-CG2 4.17Å; I257-M286 HydrophobicContact CG2-CB 4.47Å; I257-L289 HydrophobicContact CD1-CD2 3.98Å; I257-V317 HydrophobicContact CG2-CG2 4.1Å
258	V	96.5	Very high	93.2	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-61.7	-48.2	175.2	173.5	0	0	0	0	110.6	C254 T255 L256 L260 S261 W262 C313 F316 V317 F432	C254-V258 WeakPolarHBondContact O-CG2 3.34Å; C254-V258 PolarHBondContact O-N 3.07Å; T255-V258 PolarHBondContact O-N 3.36Å; L256-V258 VanDerWaalsContact C-N 3.34Å; L256-V258 PolarHBondContact O-N 2.97Å; V258-L260 VanDerWaalsContact C-N 3.32Å; V258-L260 PolarHBondContact O-N 3.37Å; V258-S261 WeakPolarHBondContact O-CB 3.21Å; V258-S261 PolarHBondContact O-N 3.28Å; V258-S261 VanDerWaalsContact O-N 3.13Å; V258-S261 PolarHBondContact O-OG 3.5Å; V258-W262 HydrophobicContact CG1-CZ2 3.6Å; V258-W262 PolarHBondContact O-NE1 2.93Å; V258-C313 HydrophobicContact CG2-CB 3.65Å; V258-F316 HydrophobicContact CG1-CB 4.21Å; V258-V317 HydrophobicContact CG2-CG2 4.02Å; V258-F432 HydrophobicContact CB-CE2 4.39Å; V258-F432 HydrophobicContact CB-CZ 4.39Å; V258-F432 HydrophobicContact CG1-CD1 4.48Å; V258-F432 HydrophobicContact CG1-CD2 3.96Å; V258-F432 HydrophobicContact CG1-CE1 4.5Å; V258-F432 HydrophobicContact CG1-CE2 3.99Å; V258-F432 HydrophobicContact CG1-CG 4.22Å; V258-F432 HydrophobicContact CG1-CZ 4.25Å; V258-F432 HydrophobicContact CG2-CE2 4.26Å
259	V	95.6	Very high	92.6	Very high	65 Å²	65	53.6 Å²	53.6	39%	0.394	27%	0.269	S	S	.	.	H	α-helix	trans	-61.9	-39.8	177.6	174.3	0	0	0	0	111.6	T255 L256 S261 W262	T255-V259 WeakPolarHBondContact O-CG2 3.33Å; T255-V259 PolarHBondContact O-N 2.87Å; L256-V259 PolarHBondContact O-N 2.82Å; V259-S261 VanDerWaalsContact C-N 3.28Å; V259-S261 PolarHBondContact O-N 2.83Å; V259-W262 HydrophobicContact CB-CE3 4.48Å; V259-W262 HydrophobicContact CG1-CE3 4.44Å; V259-W262 HydrophobicContact CG2-CE3 4.32Å; V259-W262 HydrophobicContact CG2-CH2 4.25Å; V259-W262 HydrophobicContact CG2-CZ3 3.94Å; V259-W262 WeakPolarHBondContact O-CB 2.88Å; V259-W262 PolarHBondContact O-N 2.98Å; V259-W262 VanDerWaalsContact O-N 3.15Å
260	L	94.2	Very high	92.1	Very high	94 Å²	94	54.8 Å²	54.8	49%	0.492	28%	0.278	S	S	.	.	H	α-helix	trans	-61.9	-35.2	175.7	-76.8	172.2	0	0	0	112.3	L256 I257 V258 W262 V263 T282	L256-L260 WeakPolarHBondContact O-CB 3.28Å; L256-L260 VanDerWaalsContact O-CG 3.24Å; L256-L260 WeakPolarHBondContact O-CG 3.48Å; L256-L260 PolarHBondContact O-N 3.03Å; I257-L260 PolarHBondContact O-N 3.04Å; V258-L260 VanDerWaalsContact C-N 3.32Å; V258-L260 PolarHBondContact O-N 3.37Å; L260-W262 PolarHBondContact O-N 3.19Å; L260-V263 WeakPolarHBondContact O-CB 3.36Å; L260-V263 WeakPolarHBondContact O-CG2 3.47Å; L260-V263 PolarHBondContact O-N 3.14Å; L260-T282 HydrophobicContact CB-CG2 4.49Å
261	S	94.8	Very high	91.9	Very high	2 Å²	2	56 Å²	56	1%	0.014	29%	0.289	C	S	.	.	H	α-helix	trans	-61.3	-31.5	176.6	78.6	0	0	0	0	112.6	I257 V258 V259 V263 S264	I257-S261 PolarHBondContact O-N 3Å; V258-S261 WeakPolarHBondContact O-CB 3.21Å; V258-S261 PolarHBondContact O-N 3.28Å; V258-S261 VanDerWaalsContact O-N 3.13Å; V258-S261 PolarHBondContact O-OG 3.5Å; V259-S261 VanDerWaalsContact C-N 3.28Å; V259-S261 PolarHBondContact O-N 2.83Å; S261-V263 VanDerWaalsContact C-N 3.27Å; S261-V263 PolarHBondContact O-N 2.83Å; S261-S264 WeakPolarHBondContact O-CB 3.49Å; S261-S264 PolarHBondContact O-N 2.81Å
262	W	93.2	Very high	91.6	Very high	36 Å²	36	58.3 Å²	58.3	14%	0.136	30%	0.304	C	S	.	.	H	α-helix	trans	-73.6	-18.3	-179.4	-52.2	-18.2	0	0	0	113.5	V258 V259 L260 S264 F265 F428 P429 F432	V258-W262 HydrophobicContact CG1-CZ2 3.6Å; V258-W262 PolarHBondContact O-NE1 2.93Å; V259-W262 HydrophobicContact CB-CE3 4.48Å; V259-W262 HydrophobicContact CG1-CE3 4.44Å; V259-W262 HydrophobicContact CG2-CE3 4.32Å; V259-W262 HydrophobicContact CG2-CH2 4.25Å; V259-W262 HydrophobicContact CG2-CZ3 3.94Å; V259-W262 WeakPolarHBondContact O-CB 2.88Å; V259-W262 PolarHBondContact O-N 2.98Å; V259-W262 VanDerWaalsContact O-N 3.15Å; L260-W262 PolarHBondContact O-N 3.19Å; W262-S264 PolarHBondContact O-N 3.24Å; W262-F265 HydrophobicContact CB-CD2 3.95Å; W262-F265 HydrophobicContact CB-CE2 4.03Å; W262-F265 AromaticContact CD1-CE2 3.83Å; W262-F265 HydrophobicContact CG-CE2 4.15Å; W262-F265 WeakPolarHBondContact O-CB 3.34Å; W262-F265 WeakPolarHBondContact O-CD2 3.29Å; W262-F265 PolarHBondContact O-N 3Å; W262-F428 AromaticContact NE1-CD1 3.93Å; W262-P429 HydrophobicContact CD2-CG 4.28Å; W262-P429 HydrophobicContact CE3-CB 4.37Å; W262-P429 HydrophobicContact CE3-CG 3.81Å; W262-P429 HydrophobicContact CH2-CB 4.1Å; W262-P429 HydrophobicContact CH2-CG 4.31Å; W262-P429 HydrophobicContact CZ3-CB 3.86Å; W262-P429 HydrophobicContact CZ3-CG 3.82Å; W262-F432 HydrophobicContact CH2-CB 3.93Å; W262-F432 AromaticContact CH2-CD1 3.81Å; W262-F432 HydrophobicContact CH2-CD1 3.81Å; W262-F432 HydrophobicContact CH2-CG 4.12Å; W262-F432 HydrophobicContact CZ2-CB 3.66Å; W262-F432 HydrophobicContact CZ2-CD1 4Å; W262-F432 AromaticContact CZ2-CG 3.9Å; W262-F432 HydrophobicContact CZ2-CG 3.9Å
263	V	92.8	Very high	91.4	Very high	70 Å²	70	59 Å²	59	42%	0.424	31%	0.313	S	S	.	.	G	3₁₀ helix	trans	-58.6	-28.7	173.3	-179.5	0	0	0	0	110.3	L260 S261 F265 W266 I267 L278	L260-V263 WeakPolarHBondContact O-CB 3.36Å; L260-V263 WeakPolarHBondContact O-CG2 3.47Å; L260-V263 PolarHBondContact O-N 3.14Å; S261-V263 VanDerWaalsContact C-N 3.27Å; S261-V263 PolarHBondContact O-N 2.83Å; V263-F265 PolarHBondContact O-N 3.42Å; V263-W266 PolarHBondContact O-N 3.31Å; V263-I267 PolarHBondContact O-N 2.96Å; V263-L278 HydrophobicContact CB-CD2 4.31Å
264	S	91.1	Very high	91.2	Very high	6 Å²	6	59.2 Å²	59.2	4%	0.042	32%	0.319	C	S	.	.	G	3₁₀ helix	trans	-52.7	-39.9	174.2	-163.1	0	0	0	0	113	S261 W262 W266 I267 R275	S261-S264 WeakPolarHBondContact O-CB 3.49Å; S261-S264 PolarHBondContact O-N 2.81Å; W262-S264 PolarHBondContact O-N 3.24Å; S264-W266 PolarHBondContact O-N 2.94Å; S264-I267 PolarHBondContact O-N 2.81Å; S264-R275 PolarHBondContact O-NE 3.09Å; S264-R275 VanDerWaalsContact O-NE 3.12Å
265	F	90.3	Very high	91	Very high	0 Å²	0	59.4 Å²	59.4	0%	0	32%	0.319	C	S	.	.	G	3₁₀ helix	trans	-68.8	-17.3	-177	-51.5	-42	0	0	0	113.4	W262 V263 A320 E323 A424 R425 F428	W262-F265 HydrophobicContact CB-CD2 3.95Å; W262-F265 HydrophobicContact CB-CE2 4.03Å; W262-F265 AromaticContact CD1-CE2 3.83Å; W262-F265 HydrophobicContact CG-CE2 4.15Å; W262-F265 WeakPolarHBondContact O-CB 3.34Å; W262-F265 WeakPolarHBondContact O-CD2 3.29Å; W262-F265 PolarHBondContact O-N 3Å; V263-F265 PolarHBondContact O-N 3.42Å; F265-A320 HydrophobicContact CE1-CB 4.23Å; F265-A320 HydrophobicContact CZ-CB 3.85Å; F265-E323 HydrophobicContact CE1-CB 4.48Å; F265-E323 HydrophobicContact CE1-CG 4.23Å; F265-A424 HydrophobicContact CD1-CB 4.11Å; F265-A424 HydrophobicContact CD2-CB 4.35Å; F265-A424 HydrophobicContact CE1-CB 4.1Å; F265-A424 HydrophobicContact CE2-CB 4.33Å; F265-A424 HydrophobicContact CG-CB 4.25Å; F265-A424 HydrophobicContact CZ-CB 4.22Å; F265-R425 HydrophobicContact CB-CG 3.88Å; F265-R425 PolarHBondContact O-NE 3.35Å; F265-R425 PolarHBondContact O-NH2 3.05Å; F265-F428 HydrophobicContact CE2-CB 4.02Å; F265-F428 HydrophobicContact CE2-CD1 4.11Å; F265-F428 AromaticContact CE2-CD2 3.86Å; F265-F428 HydrophobicContact CE2-CD2 3.86Å; F265-F428 HydrophobicContact CE2-CE2 4.32Å; F265-F428 AromaticContact CE2-CG 3.74Å; F265-F428 HydrophobicContact CE2-CG 3.74Å; F265-F428 HydrophobicContact CZ-CD1 4.01Å; F265-F428 AromaticContact CZ-CD2 3.8Å; F265-F428 HydrophobicContact CZ-CD2 3.8Å; F265-F428 AromaticContact CZ-CE1 3.97Å; F265-F428 HydrophobicContact CZ-CE1 3.97Å; F265-F428 AromaticContact CZ-CE2 3.77Å; F265-F428 HydrophobicContact CZ-CE2 3.77Å; F265-F428 AromaticContact CZ-CG 3.92Å; F265-F428 HydrophobicContact CZ-CG 3.92Å; F265-F428 AromaticContact CZ-CZ 3.86Å; F265-F428 HydrophobicContact CZ-CZ 3.86Å
266	W	90.2	Very high	90.8	Very high	176 Å²	176	59.6 Å²	59.6	67%	0.667	32%	0.32	S	S	*	.	G	3₁₀ helix	trans	-95.5	-22.6	179	-69.9	91.7	0	0	0	113.1	V263 S264	V263-W266 PolarHBondContact O-N 3.31Å; S264-W266 PolarHBondContact O-N 2.94Å
267	I	89.9	Confident	90.7	Very high	46 Å²	46	58 Å²	58	24%	0.236	32%	0.318	C	S	.	.	S	Bend	trans	-67.2	145.3	177.2	-65.9	172.6	0	0	0	109.1	V263 S264 K269 A271 A274 R275 L278	V263-I267 PolarHBondContact O-N 2.96Å; S264-I267 PolarHBondContact O-N 2.81Å; I267-K269 PolarHBondContact O-N 3.13Å; I267-A271 HydrophobicContact CG2-CB 3.86Å; I267-A274 HydrophobicContact CG2-CB 4.32Å; I267-R275 HydrophobicContact CB-CG 4Å; I267-R275 HydrophobicContact CG2-CG 3.83Å; I267-R275 PolarHBondContact O-NE 3.43Å; I267-R275 PolarHBondContact O-NH2 3.38Å; I267-L278 HydrophobicContact CD1-CD2 4.49Å
268	N	85.4	Confident	90.6	Very high	125 Å²	125	59.5 Å²	59.5	67%	0.668	33%	0.326	S	S	*	.			trans	-61	138.6	176.9	-69.6	-37.1	0	0	0	111.8	D270 A271	N268-D270 PolarHBondContact O-N 3Å; N268-D270 VanDerWaalsContact O-N 3.08Å; N268-A271 WeakPolarHBondContact O-CB 3.47Å; N268-A271 PolarHBondContact O-N 2.68Å
269	K	79.8	Confident	90.4	Very high	115 Å²	115	59.9 Å²	59.9	50%	0.5	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-24.1	178.5	68.5	-178.1	178.8	58.9	0	114.3	I267 A271	I267-K269 PolarHBondContact O-N 3.13Å; K269-A271 VanDerWaalsContact C-N 3.31Å
270	D	80.9	Confident	90.3	Very high	122 Å²	122	61.8 Å²	61.8	65%	0.652	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.3	-14.2	-179.1	-51.4	-45.2	0	0	0	112	N268 V272	N268-D270 PolarHBondContact O-N 3Å; N268-D270 VanDerWaalsContact O-N 3.08Å; D270-V272 PolarHBondContact O-N 3.32Å; D270-V272 VanDerWaalsContact O-N 3.08Å
271	A	88.3	Confident	90.4	Very high	34 Å²	34	60.8 Å²	60.8	28%	0.281	34%	0.335	S	S	.	.			trans	-86.7	58.2	175.5	0	0	0	0	0	111.6	I267 N268 K269 P273 A274 R275	I267-A271 HydrophobicContact CG2-CB 3.86Å; N268-A271 WeakPolarHBondContact O-CB 3.47Å; N268-A271 PolarHBondContact O-N 2.68Å; K269-A271 VanDerWaalsContact C-N 3.31Å; A271-P273 VanDerWaalsContact C-CD 3.49Å; A271-A274 HydrophobicContact CB-CB 4.29Å; A271-A274 PolarHBondContact O-N 3Å; A271-A274 VanDerWaalsContact O-N 3.15Å; A271-R275 PolarHBondContact O-N 2.89Å
272	V	86.2	Confident	90.4	Very high	53 Å²	53	61.1 Å²	61.1	32%	0.321	34%	0.337	S	S	.	.	H	α-helix	trans	-44.3	-52.9	177.7	173.6	0	0	0	0	113.3	D270 A274 R275 T276 Y324	D270-V272 PolarHBondContact O-N 3.32Å; D270-V272 VanDerWaalsContact O-N 3.08Å; V272-A274 VanDerWaalsContact C-N 3.28Å; V272-A274 PolarHBondContact O-N 3.32Å; V272-R275 PolarHBondContact O-N 2.97Å; V272-T276 PolarHBondContact O-N 3.06Å; V272-T276 VanDerWaalsContact O-N 3.12Å; V272-T276 PolarHBondContact O-OG1 3.44Å; V272-T276 VanDerWaalsContact O-OG1 3.05Å; V272-Y324 WeakPolarHBondContact CA-OH 3.48Å; V272-Y324 WeakPolarHBondContact CG1-OH 3.34Å; V272-Y324 PolarHBondContact O-OH 3.22Å
273	P	91.3	Very high	90.5	Very high	97 Å²	97	60.7 Å²	60.7	63%	0.63	34%	0.338	S	S	*	.	H	α-helix	trans	-66.7	-27.4	-175.3	25.8	-35.5	0	0	0	113.7	A271 T276 S277	A271-P273 VanDerWaalsContact C-CD 3.49Å; P273-T276 WeakPolarHBondContact CA-OG1 3.46Å; P273-T276 PolarHBondContact O-OG1 2.94Å; P273-S277 WeakPolarHBondContact O-CB 3.34Å; P273-S277 PolarHBondContact O-N 3.38Å
274	A	91.8	Very high	90.6	Very high	45 Å²	45	62.6 Å²	62.6	37%	0.372	35%	0.345	S	S	.	.	H	α-helix	trans	-73.4	-45.5	179.3	0	0	0	0	0	111.3	I267 A271 V272 L278	I267-A274 HydrophobicContact CG2-CB 4.32Å; A271-A274 HydrophobicContact CB-CB 4.29Å; A271-A274 PolarHBondContact O-N 3Å; A271-A274 VanDerWaalsContact O-N 3.15Å; V272-A274 VanDerWaalsContact C-N 3.28Å; V272-A274 PolarHBondContact O-N 3.32Å; A274-L278 WeakPolarHBondContact O-CB 3.49Å; A274-L278 PolarHBondContact O-N 3.3Å; A274-L278 VanDerWaalsContact O-N 3.09Å
275	R	90.9	Very high	90.8	Very high	4 Å²	4	65.3 Å²	65.3	2%	0.015	36%	0.361	C	S	.	.	H	α-helix	trans	-67.9	-42.5	179.7	-71.1	-174	169.3	-159.6	-2.4	112.1	S264 I267 A271 V272 G279 Y324 D421	S264-R275 PolarHBondContact O-NE 3.09Å; S264-R275 VanDerWaalsContact O-NE 3.12Å; I267-R275 HydrophobicContact CB-CG 4Å; I267-R275 HydrophobicContact CG2-CG 3.83Å; I267-R275 PolarHBondContact O-NE 3.43Å; I267-R275 PolarHBondContact O-NH2 3.38Å; A271-R275 PolarHBondContact O-N 2.89Å; V272-R275 PolarHBondContact O-N 2.97Å; R275-G279 PolarHBondContact O-N 3.18Å; R275-G279 VanDerWaalsContact O-N 3.08Å; R275-Y324 HydrophobicContact CB-CD2 3.73Å; R275-Y324 HydrophobicContact CB-CE2 3.62Å; R275-Y324 HydrophobicContact CB-CG 4.26Å; R275-Y324 HydrophobicContact CG-CD2 4.28Å; R275-Y324 HydrophobicContact CG-CE2 4.25Å; R275-D421 IonicContact CZ-OD1 2.97Å; R275-D421 IonicContact CZ-OD2 3.84Å; R275-D421 IonicContact NH1-OD1 3.92Å; R275-D421 IonicContact NH1-OD2 3.66Å; R275-D421 IonicContact NH2-OD1 3.55Å; R275-D421 PolarHBondContact NH2-OD1 2.96Å; R275-D421 IonicContact NH2-OD2 2.97Å; R275-D421 PolarHBondContact NH2-OD2 2.99Å
276	T	91.2	Very high	91	Very high	45 Å²	45	65.3 Å²	65.3	28%	0.276	36%	0.362	S	S	.	.	H	α-helix	trans	-64.6	-45.4	177	49.5	0	0	0	0	112.3	V272 P273 G279 I280 Y324	V272-T276 PolarHBondContact O-N 3.06Å; V272-T276 VanDerWaalsContact O-N 3.12Å; V272-T276 PolarHBondContact O-OG1 3.44Å; V272-T276 VanDerWaalsContact O-OG1 3.05Å; P273-T276 WeakPolarHBondContact CA-OG1 3.46Å; P273-T276 PolarHBondContact O-OG1 2.94Å; T276-G279 PolarHBondContact O-N 3.39Å; T276-I280 VanDerWaalsContact O-CG1 3.32Å; T276-I280 WeakPolarHBondContact O-CG1 3.34Å; T276-I280 PolarHBondContact O-N 3.39Å; T276-Y324 HydrophobicContact CG2-CD1 4.19Å; T276-Y324 HydrophobicContact CG2-CE1 3.28Å
277	S	94.1	Very high	91.1	Very high	68 Å²	68	60 Å²	60	48%	0.476	35%	0.348	S	S	.	.	H	α-helix	trans	-60.4	-49.5	179.3	-175	0	0	0	0	111	P273 G279 I280 T281	P273-S277 WeakPolarHBondContact O-CB 3.34Å; P273-S277 PolarHBondContact O-N 3.38Å; S277-G279 VanDerWaalsContact C-N 3.35Å; S277-G279 PolarHBondContact O-N 2.96Å; S277-I280 PolarHBondContact O-N 2.97Å; S277-T281 WeakPolarHBondContact O-CB 3.26Å; S277-T281 PolarHBondContact O-N 3.2Å; S277-T281 PolarHBondContact O-OG1 2.84Å
278	L	93.6	Very high	91.3	Very high	46 Å²	46	61.1 Å²	61.1	24%	0.241	36%	0.358	C	S	.	.	H	α-helix	trans	-57.7	-44.7	177.2	-171.8	81.4	0	0	0	112.3	V263 I267 A274 T282	V263-L278 HydrophobicContact CB-CD2 4.31Å; I267-L278 HydrophobicContact CD1-CD2 4.49Å; A274-L278 WeakPolarHBondContact O-CB 3.49Å; A274-L278 PolarHBondContact O-N 3.3Å; A274-L278 VanDerWaalsContact O-N 3.09Å; L278-T282 WeakPolarHBondContact O-CB 3.49Å; L278-T282 VanDerWaalsContact O-CG2 3.29Å; L278-T282 WeakPolarHBondContact O-CG2 3.37Å; L278-T282 PolarHBondContact O-N 3.43Å; L278-T282 PolarHBondContact O-OG1 3.1Å
279	G	92.7	Very high	91.6	Very high	9 Å²	9	56.5 Å²	56.5	9%	0.093	33%	0.333	C	S	.	.	H	α-helix	trans	-65.1	-42.7	178.8	0	0	0	0	0	113.3	R275 T276 S277 T282 V283	R275-G279 PolarHBondContact O-N 3.18Å; R275-G279 VanDerWaalsContact O-N 3.08Å; T276-G279 PolarHBondContact O-N 3.39Å; S277-G279 VanDerWaalsContact C-N 3.35Å; S277-G279 PolarHBondContact O-N 2.96Å; G279-T282 WeakPolarHBondContact CA-OG1 3.22Å; G279-T282 PolarHBondContact O-OG1 2.99Å; G279-V283 VanDerWaalsContact O-CG2 3.32Å; G279-V283 WeakPolarHBondContact O-CG2 3.38Å; G279-V283 PolarHBondContact O-N 3.28Å; G279-V283 VanDerWaalsContact O-N 3.16Å
280	I	94	Very high	92.1	Very high	104 Å²	104	52 Å²	52	53%	0.533	32%	0.316	S	S	.	.	H	α-helix	trans	-66.7	-46.4	176.9	-67.2	166.5	0	0	0	110.6	T276 S277 T282 V283 L284	T276-I280 VanDerWaalsContact O-CG1 3.32Å; T276-I280 WeakPolarHBondContact O-CG1 3.34Å; T276-I280 PolarHBondContact O-N 3.39Å; S277-I280 PolarHBondContact O-N 2.97Å; I280-T282 PolarHBondContact O-N 2.69Å; I280-V283 PolarHBondContact O-N 2.98Å; I280-L284 WeakPolarHBondContact O-CB 3.16Å; I280-L284 PolarHBondContact O-N 3.49Å
281	T	95.6	Very high	92.5	Very high	74 Å²	74	49.1 Å²	49.1	45%	0.454	30%	0.303	S	S	.	.	H	α-helix	trans	-60.5	-46.1	179.6	-59.2	0	0	0	0	111	S277 V283 L284 T285	S277-T281 WeakPolarHBondContact O-CB 3.26Å; S277-T281 PolarHBondContact O-N 3.2Å; S277-T281 PolarHBondContact O-OG1 2.84Å; T281-V283 PolarHBondContact O-N 3.32Å; T281-L284 PolarHBondContact O-N 3.06Å; T281-T285 WeakPolarHBondContact O-CB 3.46Å; T281-T285 PolarHBondContact O-N 3.48Å; T281-T285 PolarHBondContact O-OG1 2.67Å
282	T	95.4	Very high	92.5	Very high	9 Å²	9	52.3 Å²	52.3	6%	0.055	31%	0.314	C	S	.	.	H	α-helix	trans	-63.5	-42.1	179.6	49	0	0	0	0	112.7	I257 L260 L278 G279 I280 M286 V317	I257-T282 HydrophobicContact CG2-CG2 4.31Å; L260-T282 HydrophobicContact CB-CG2 4.49Å; L278-T282 WeakPolarHBondContact O-CB 3.49Å; L278-T282 VanDerWaalsContact O-CG2 3.29Å; L278-T282 WeakPolarHBondContact O-CG2 3.37Å; L278-T282 PolarHBondContact O-N 3.43Å; L278-T282 PolarHBondContact O-OG1 3.1Å; G279-T282 WeakPolarHBondContact CA-OG1 3.22Å; G279-T282 PolarHBondContact O-OG1 2.99Å; I280-T282 PolarHBondContact O-N 2.69Å; T282-M286 VanDerWaalsContact O-CB 3.29Å; T282-M286 WeakPolarHBondContact O-CB 3.37Å; T282-M286 PolarHBondContact O-N 3.23Å; T282-V317 WeakPolarHBondContact OG1-CG1 3.48Å
283	V	95.4	Very high	92.5	Very high	27 Å²	27	50.1 Å²	50.1	16%	0.164	30%	0.302	C	S	.	.	H	α-helix	trans	-63.5	-44.5	174.8	172.5	0	0	0	0	111.4	G279 I280 T281 M286 T287 F314 V317 L321	G279-V283 VanDerWaalsContact O-CG2 3.32Å; G279-V283 WeakPolarHBondContact O-CG2 3.38Å; G279-V283 PolarHBondContact O-N 3.28Å; G279-V283 VanDerWaalsContact O-N 3.16Å; I280-V283 PolarHBondContact O-N 2.98Å; T281-V283 PolarHBondContact O-N 3.32Å; V283-M286 PolarHBondContact O-N 3.3Å; V283-T287 PolarHBondContact O-N 3.28Å; V283-T287 PolarHBondContact O-OG1 3.1Å; V283-F314 HydrophobicContact CG1-CE2 4.05Å; V283-F314 HydrophobicContact CG1-CZ 4.46Å; V283-V317 HydrophobicContact CG2-CG1 3.77Å; V283-L321 HydrophobicContact CG2-CD2 4.19Å
284	L	95.2	Very high	92.2	Very high	110 Å²	110	51.7 Å²	51.7	58%	0.576	30%	0.295	S	S	*	.	H	α-helix	trans	-62.3	-52	178.4	-179.9	61.1	0	0	0	110.5	I280 T281 M286 T287 T288	I280-L284 WeakPolarHBondContact O-CB 3.16Å; I280-L284 PolarHBondContact O-N 3.49Å; T281-L284 PolarHBondContact O-N 3.06Å; L284-M286 VanDerWaalsContact C-N 3.26Å; L284-M286 PolarHBondContact O-N 3.48Å; L284-T287 WeakPolarHBondContact O-CB 3.26Å; L284-T287 PolarHBondContact O-N 3.48Å; L284-T288 PolarHBondContact O-N 3.49Å; L284-T288 PolarHBondContact O-OG1 3.26Å
285	T	95.4	Very high	91.9	Very high	62 Å²	62	57.3 Å²	57.3	38%	0.38	31%	0.311	S	S	.	.	H	α-helix	trans	-56.6	-41.2	178.5	-55.1	0	0	0	0	111.5	I257 T281 T288 L289	I257-T285 HydrophobicContact CD1-CG2 3.55Å; I257-T285 HydrophobicContact CG1-CG2 4.17Å; T281-T285 WeakPolarHBondContact O-CB 3.46Å; T281-T285 PolarHBondContact O-N 3.48Å; T281-T285 PolarHBondContact O-OG1 2.67Å; T285-T288 PolarHBondContact O-N 3.45Å; T285-L289 WeakPolarHBondContact O-CB 3.31Å; T285-L289 PolarHBondContact O-N 3.36Å
286	M	93.9	Very high	91.3	Very high	1 Å²	1	60.1 Å²	60.1	1%	0.005	33%	0.332	C	S	.	.	H	α-helix	trans	-64.3	-41.1	177.1	-168.7	61.1	-169.8	0	0	112.4	C254 I257 T282 V283 L284 L289 S290 V310 C313 F314	C254-M286 HydrophobicContact CB-CE 4.5Å; I257-M286 HydrophobicContact CG2-CB 4.47Å; T282-M286 VanDerWaalsContact O-CB 3.29Å; T282-M286 WeakPolarHBondContact O-CB 3.37Å; T282-M286 PolarHBondContact O-N 3.23Å; V283-M286 PolarHBondContact O-N 3.3Å; L284-M286 VanDerWaalsContact C-N 3.26Å; L284-M286 PolarHBondContact O-N 3.48Å; M286-L289 PolarHBondContact O-N 3.49Å; M286-S290 WeakPolarHBondContact O-CB 3.49Å; M286-S290 PolarHBondContact O-N 3.38Å; M286-V310 HydrophobicContact CE-CB 4.19Å; M286-V310 HydrophobicContact CE-CG1 3.61Å; M286-V310 WeakPolarHBondContact CE-O 3.38Å; M286-C313 HydrophobicContact CE-CB 3.3Å; M286-C313 HydrophobicContact SD-CB 4.24Å; M286-F314 HydrophobicContact CB-CD2 4.33Å; M286-F314 HydrophobicContact CE-CB 4.37Å; M286-F314 HydrophobicContact CG-CB 4.06Å; M286-F314 HydrophobicContact CG-CD2 3.95Å
287	T	93.3	Very high	90.9	Very high	63 Å²	63	59 Å²	59	39%	0.387	32%	0.323	S	S	.	.	H	α-helix	trans	-63.3	-42.7	175.7	-54.2	0	0	0	0	111.3	V283 L284 T291	V283-T287 PolarHBondContact O-N 3.28Å; V283-T287 PolarHBondContact O-OG1 3.1Å; L284-T287 WeakPolarHBondContact O-CB 3.26Å; L284-T287 PolarHBondContact O-N 3.48Å; T287-T291 PolarHBondContact O-N 2.85Å; T287-T291 VanDerWaalsContact O-N 3.12Å; T287-T291 PolarHBondContact O-OG1 3.3Å
288	T	93.5	Very high	90.4	Very high	71 Å²	71	56.4 Å²	56.4	44%	0.436	31%	0.305	S	S	.	.	H	α-helix	trans	-63.9	-46.3	177.2	-33.2	0	0	0	0	111	L284 T285 T291 I292	L284-T288 PolarHBondContact O-N 3.49Å; L284-T288 PolarHBondContact O-OG1 3.26Å; T285-T288 PolarHBondContact O-N 3.45Å; T288-T291 PolarHBondContact O-N 3.35Å; T288-I292 HydrophobicContact CG2-CD1 4.22Å; T288-I292 WeakPolarHBondContact O-CG1 3.36Å; T288-I292 PolarHBondContact O-N 2.93Å
289	L	91.9	Very high	90	Very high	27 Å²	27	64.6 Å²	64.6	14%	0.141	34%	0.339	C	S	.	.	H	α-helix	trans	-63.5	-43.9	-179.9	-175.6	60.3	0	0	0	112.1	P253 C254 I257 T285 M286 T291 I292 A293	P253-L289 HydrophobicContact CB-CD2 3.91Å; C254-L289 HydrophobicContact CB-CD2 4.4Å; C254-L289 WeakPolarHBondContact SG-CD2 3.5Å; I257-L289 HydrophobicContact CD1-CD2 3.98Å; T285-L289 WeakPolarHBondContact O-CB 3.31Å; T285-L289 PolarHBondContact O-N 3.36Å; M286-L289 PolarHBondContact O-N 3.49Å; L289-T291 VanDerWaalsContact C-N 3.28Å; L289-T291 PolarHBondContact O-N 2.96Å; L289-I292 PolarHBondContact O-N 3.44Å; L289-A293 WeakPolarHBondContact O-CB 3.48Å; L289-A293 PolarHBondContact O-N 2.87Å
290	S	89.8	Confident	89.7	Confident	20 Å²	20	66.1 Å²	66.1	14%	0.14	35%	0.347	C	S	.	.	H	α-helix	trans	-58.2	-39.9	174.2	177.4	0	0	0	0	112.2	M286 R294	M286-S290 WeakPolarHBondContact O-CB 3.49Å; M286-S290 PolarHBondContact O-N 3.38Å; S290-R294 PolarHBondContact O-N 3.48Å; S290-R294 PolarHBondContact O-NE 3.37Å; S290-R294 PolarHBondContact OG-NH2 3.04Å
291	T	89.4	Confident	89.4	Confident	62 Å²	62	67.4 Å²	67.4	38%	0.38	36%	0.364	S	S	.	.	H	α-helix	trans	-69.9	-39.7	178.5	-55.2	0	0	0	0	111.9	T287 T288 L289 K295	T287-T291 PolarHBondContact O-N 2.85Å; T287-T291 VanDerWaalsContact O-N 3.12Å; T287-T291 PolarHBondContact O-OG1 3.3Å; T288-T291 PolarHBondContact O-N 3.35Å; L289-T291 VanDerWaalsContact C-N 3.28Å; L289-T291 PolarHBondContact O-N 2.96Å; T291-K295 PolarHBondContact O-N 3.06Å
292	I	89	Confident	89.1	Confident	101 Å²	101	67.7 Å²	67.7	52%	0.518	36%	0.358	S	S	.	.	H	α-helix	trans	-65.7	-44.8	177.4	-67.8	164.9	0	0	0	110.6	T288 L289 R294 K295	T288-I292 HydrophobicContact CG2-CD1 4.22Å; T288-I292 WeakPolarHBondContact O-CG1 3.36Å; T288-I292 PolarHBondContact O-N 2.93Å; L289-I292 PolarHBondContact O-N 3.44Å; I292-R294 VanDerWaalsContact C-N 3.25Å; I292-R294 PolarHBondContact O-N 3.18Å; I292-K295 PolarHBondContact O-N 3.39Å; I292-K295 VanDerWaalsContact O-N 3.1Å
293	A	85.8	Confident	88.8	Confident	8 Å²	8	71.5 Å²	71.5	7%	0.066	38%	0.381	C	S	.	.	H	α-helix	trans	-60.4	-32.8	-179.2	0	0	0	0	0	113.1	T250 L289 S296 M306	T250-A293 HydrophobicContact CG2-CB 4.21Å; L289-A293 WeakPolarHBondContact O-CB 3.48Å; L289-A293 PolarHBondContact O-N 2.87Å; A293-S296 PolarHBondContact O-OG 3.06Å; A293-S296 VanDerWaalsContact O-OG 3.14Å; A293-M306 HydrophobicContact CB-CE 3.89Å; A293-M306 HydrophobicContact CB-SD 4.29Å
294	R	84.1	Confident	88.7	Confident	130 Å²	130	70.5 Å²	70.5	49%	0.491	38%	0.375	S	S	.	.	H	α-helix	trans	-80.5	-14.9	177.9	-71.2	-176	-66.8	-142.3	-1.2	114.5	S290 I292 S296 L297	S290-R294 PolarHBondContact O-N 3.48Å; S290-R294 PolarHBondContact O-NE 3.37Å; S290-R294 PolarHBondContact OG-NH2 3.04Å; I292-R294 VanDerWaalsContact C-N 3.25Å; I292-R294 PolarHBondContact O-N 3.18Å; R294-S296 VanDerWaalsContact C-N 3.31Å; R294-S296 PolarHBondContact O-N 3.18Å; R294-L297 PolarHBondContact O-N 3.47Å
295	K	85.8	Confident	88.6	Confident	162 Å²	162	65.2 Å²	65.2	70%	0.704	35%	0.347	S	S	*	.	H	α-helix	trans	-71.9	-26.4	179.4	-77.2	-179.3	178.8	-176.1	0	113	T291 I292 L297	T291-K295 PolarHBondContact O-N 3.06Å; I292-K295 PolarHBondContact O-N 3.39Å; I292-K295 VanDerWaalsContact O-N 3.1Å; K295-L297 VanDerWaalsContact C-N 3.32Å
296	S	78.5	Confident	88.4	Confident	64 Å²	64	62.4 Å²	62.4	45%	0.448	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.1	-1.4	-179.8	48.2	0	0	0	0	113.8	A293 R294	A293-S296 PolarHBondContact O-OG 3.06Å; A293-S296 VanDerWaalsContact O-OG 3.14Å; R294-S296 VanDerWaalsContact C-N 3.31Å; R294-S296 PolarHBondContact O-N 3.18Å
297	L	81.8	Confident	88.3	Confident	20 Å²	20	63.6 Å²	63.6	11%	0.105	34%	0.336	C	S	.	.	S	Bend	trans	-116.7	149.5	-176.4	-67	165	0	0	0	111.3	F168 R294 K295 M306	F168-L297 HydrophobicContact CD1-CD1 3.87Å; F168-L297 HydrophobicContact CD1-CD2 4.19Å; F168-L297 HydrophobicContact CD2-CD2 3.94Å; F168-L297 HydrophobicContact CE1-CD1 3.48Å; F168-L297 VanDerWaalsContact CE1-CD1 3.48Å; F168-L297 HydrophobicContact CE1-CD2 3.74Å; F168-L297 HydrophobicContact CE1-CG 4.16Å; F168-L297 HydrophobicContact CE2-CD2 3.43Å; F168-L297 VanDerWaalsContact CE2-CD2 3.43Å; F168-L297 HydrophobicContact CG-CD2 4.29Å; F168-L297 HydrophobicContact CZ-CD1 3.94Å; F168-L297 HydrophobicContact CZ-CD2 3.32Å; F168-L297 HydrophobicContact CZ-CG 4.11Å; R294-L297 PolarHBondContact O-N 3.47Å; K295-L297 VanDerWaalsContact C-N 3.32Å; L297-M306 HydrophobicContact CD1-CE 3.51Å
298	P	85.3	Confident	88.3	Confident	15 Å²	15	63.7 Å²	63.7	10%	0.097	33%	0.334	C	S	.	.			trans	-58.9	147.5	168.1	28.1	-35.9	0	0	0	110	A77 M80 L165 V300	A77-P298 WeakPolarHBondContact O-CD 3.35Å; A77-P298 WeakPolarHBondContact O-CG 3.21Å; M80-P298 HydrophobicContact CE-CB 4.46Å; L165-P298 HydrophobicContact CD1-CG 3.36Å; P298-V300 HydrophobicContact CG-CG1 4.33Å; P298-V300 PolarHBondContact O-N 3.36Å
299	K	83.9	Confident	88.4	Confident	217 Å²	217	60.4 Å²	60.4	94%	0.943	31%	0.314	S	S	*	.			trans	-73.7	95.8	175.1	-64.2	179.3	-177	176	0	109
300	V	86.8	Confident	88.5	Confident	42 Å²	42	59.3 Å²	59.3	26%	0.255	31%	0.308	S	S	.	.			trans	-96.2	150.9	173.2	-66.2	0	0	0	0	110.5	L165 P298 Y302 T304	L165-V300 HydrophobicContact CD1-CG1 4.14Å; P298-V300 HydrophobicContact CG-CG1 4.33Å; P298-V300 PolarHBondContact O-N 3.36Å; V300-Y302 HydrophobicContact CB-CD1 4.21Å; V300-Y302 HydrophobicContact CB-CD2 4.43Å; V300-Y302 HydrophobicContact CB-CE1 3.87Å; V300-Y302 HydrophobicContact CB-CE2 4.1Å; V300-Y302 HydrophobicContact CB-CG 4.49Å; V300-Y302 HydrophobicContact CG1-CE1 4.09Å; V300-Y302 HydrophobicContact CG1-CE2 4.43Å; V300-Y302 HydrophobicContact CG2-CD2 4.16Å; V300-Y302 HydrophobicContact CG2-CE2 3.9Å; V300-T304 HydrophobicContact CG2-CG2 4.24Å
301	S	87.3	Confident	88.6	Confident	130 Å²	130	61.3 Å²	61.3	91%	0.909	32%	0.322	S	S	*	.	S	Bend	trans	-82.9	-17.4	-179.6	53.9	0	0	0	0	113.7
302	Y	89.6	Confident	88.9	Confident	80 Å²	80	59.9 Å²	59.9	31%	0.314	31%	0.313	S	S	.	.	S	Bend	trans	-95.7	158.3	179.8	54	-99.6	0	0	0	111.9	L165 V300	L165-Y302 HydrophobicContact CB-CE2 3.99Å; L165-Y302 WeakPolarHBondContact CB-OH 3.42Å; L165-Y302 PolarHBondContact N-OH 2.87Å; V300-Y302 HydrophobicContact CB-CD1 4.21Å; V300-Y302 HydrophobicContact CB-CD2 4.43Å; V300-Y302 HydrophobicContact CB-CE1 3.87Å; V300-Y302 HydrophobicContact CB-CE2 4.1Å; V300-Y302 HydrophobicContact CB-CG 4.49Å; V300-Y302 HydrophobicContact CG1-CE1 4.09Å; V300-Y302 HydrophobicContact CG1-CE2 4.43Å; V300-Y302 HydrophobicContact CG2-CD2 4.16Å; V300-Y302 HydrophobicContact CG2-CE2 3.9Å
303	V	89.8	Confident	89.3	Confident	90 Å²	90	55.1 Å²	55.1	55%	0.545	29%	0.289	S	S	.	.	P	Polyproline II helix	trans	-78.3	133.1	177.7	-178.6	0	0	0	0	109.7	H166 D307 L308	H166-V303 PolarHBondContact ND1-O 2.97Å; V303-D307 HydrophobicContact CG1-CB 4.03Å; V303-L308 HydrophobicContact CG1-CB 4.43Å
304	T	92.7	Very high	89.7	Confident	5 Å²	5	58.4 Å²	58.4	3%	0.031	30%	0.302	C	S	.	.	P	Polyproline II helix	trans	-91.9	158.6	173.3	68.4	0	0	0	0	111.6	L165 H166 F168 V300 M306 D307 L308	L165-T304 HydrophobicContact CB-CG2 4.43Å; L165-T304 WeakPolarHBondContact O-CG2 3.47Å; H166-T304 CarbonylContact O-C 3.56Å; F168-T304 HydrophobicContact CB-CG2 4.39Å; V300-T304 HydrophobicContact CG2-CG2 4.24Å; T304-M306 PolarHBondContact O-N 3.32Å; T304-D307 PolarHBondContact N-OD2 2.97Å; T304-D307 WeakPolarHBondContact O-CB 3.48Å; T304-D307 PolarHBondContact O-N 3.23Å; T304-D307 WeakPolarHBondContact OG1-CB 3.35Å; T304-D307 PolarHBondContact OG1-N 3.07Å; T304-D307 VanDerWaalsContact OG1-N 3.1Å; T304-D307 PolarHBondContact OG1-OD2 3.29Å; T304-L308 PolarHBondContact O-N 3.15Å
305	A	92.6	Very high	90.3	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-57.6	-36.8	175	0	0	0	0	0	112.5	H166 F168 L308 F309 Y439 Y443	H166-A305 PolarHBondContact O-N 2.94Å; F168-A305 WeakPolarHBondContact O-CB 3.38Å; A305-L308 PolarHBondContact O-N 3.44Å; A305-F309 PolarHBondContact O-N 3.14Å; A305-Y439 VanDerWaalsContact C-OH 3.3Å; A305-Y439 WeakPolarHBondContact O-CE2 3.47Å; A305-Y439 PolarHBondContact O-OH 2.97Å; A305-Y443 HydrophobicContact CB-CD1 3.84Å; A305-Y443 HydrophobicContact CB-CD2 4.36Å; A305-Y443 HydrophobicContact CB-CE1 3.4Å; A305-Y443 VanDerWaalsContact CB-CE1 3.4Å; A305-Y443 HydrophobicContact CB-CE2 3.99Å; A305-Y443 HydrophobicContact CB-CG 4.31Å; A305-Y443 VanDerWaalsContact CB-CZ 3.48Å
306	M	92.1	Very high	90.8	Very high	2 Å²	2	51 Å²	51	1%	0.01	28%	0.277	C	S	.	.	H	α-helix	trans	-63.3	-45.8	172.3	-173.5	-171.2	70.1	0	0	112	F168 T250 A293 L297 T304 L308 F309 V310	F168-M306 HydrophobicContact CD1-CB 4.04Å; F168-M306 HydrophobicContact CD1-SD 4.41Å; F168-M306 HydrophobicContact CE1-CB 4.31Å; F168-M306 HydrophobicContact CE1-CE 4.08Å; F168-M306 HydrophobicContact CE1-SD 3.77Å; F168-M306 PolarHBondContact O-N 3.03Å; T250-M306 HydrophobicContact CG2-CG 4.26Å; T250-M306 HydrophobicContact CG2-SD 4.06Å; A293-M306 HydrophobicContact CB-CE 3.89Å; A293-M306 HydrophobicContact CB-SD 4.29Å; L297-M306 HydrophobicContact CD1-CE 3.51Å; T304-M306 PolarHBondContact O-N 3.32Å; M306-L308 VanDerWaalsContact C-N 3.27Å; M306-L308 PolarHBondContact O-N 3.25Å; M306-F309 PolarHBondContact O-N 3.13Å; M306-V310 HydrophobicContact CG-CG2 4.41Å; M306-V310 WeakPolarHBondContact O-CG2 3.42Å; M306-V310 PolarHBondContact O-N 3.24Å
307	D	91.8	Very high	91.6	Very high	26 Å²	26	48 Å²	48	14%	0.139	26%	0.256	C	S	.	.	H	α-helix	trans	-61.5	-37.4	178.6	-71	-46.4	0	0	0	111.7	V303 T304 S311	V303-D307 HydrophobicContact CG1-CB 4.03Å; T304-D307 PolarHBondContact N-OD2 2.97Å; T304-D307 WeakPolarHBondContact O-CB 3.48Å; T304-D307 PolarHBondContact O-N 3.23Å; T304-D307 WeakPolarHBondContact OG1-CB 3.35Å; T304-D307 PolarHBondContact OG1-N 3.07Å; T304-D307 VanDerWaalsContact OG1-N 3.1Å; T304-D307 PolarHBondContact OG1-OD2 3.29Å; D307-S311 WeakPolarHBondContact O-CB 3.44Å; D307-S311 PolarHBondContact O-N 3.18Å; D307-S311 PolarHBondContact O-OG 3.35Å
308	L	93.3	Very high	92.2	Very high	66 Å²	66	51.9 Å²	51.9	35%	0.346	27%	0.272	S	S	.	.	H	α-helix	trans	-61.9	-46.8	175	-176.5	139.7	0	0	0	111.2	V303 T304 A305 M306 S311 V312 F435 Y439	V303-L308 HydrophobicContact CG1-CB 4.43Å; T304-L308 PolarHBondContact O-N 3.15Å; A305-L308 PolarHBondContact O-N 3.44Å; M306-L308 VanDerWaalsContact C-N 3.27Å; M306-L308 PolarHBondContact O-N 3.25Å; L308-S311 PolarHBondContact O-N 3.37Å; L308-V312 WeakPolarHBondContact O-CG2 3.24Å; L308-V312 PolarHBondContact O-N 2.61Å; L308-F435 HydrophobicContact CD2-CE2 4.2Å; L308-F435 HydrophobicContact CD2-CZ 4.34Å; L308-Y439 HydrophobicContact CD2-CD2 3.9Å; L308-Y439 HydrophobicContact CD2-CE2 3.93Å
309	F	94.9	Very high	92.7	Very high	1 Å²	1	53 Å²	53	0%	0.004	28%	0.281	C	S	.	.	H	α-helix	trans	-60.7	-49.6	177	-173.9	-89.2	0	0	0	112.1	Y251 C254 A305 M306 S311 V312 C313 F435 Y439	Y251-F309 HydrophobicContact CD1-CB 4.41Å; Y251-F309 AromaticContact CD1-CD1 3.45Å; Y251-F309 HydrophobicContact CD1-CD1 3.45Å; Y251-F309 VanDerWaalsContact CD1-CD1 3.45Å; Y251-F309 AromaticContact CD1-CD2 3.96Å; Y251-F309 HydrophobicContact CD1-CD2 3.96Å; Y251-F309 AromaticContact CD1-CE1 3.55Å; Y251-F309 HydrophobicContact CD1-CE1 3.55Å; Y251-F309 HydrophobicContact CD1-CE2 4.04Å; Y251-F309 AromaticContact CD1-CG 3.67Å; Y251-F309 HydrophobicContact CD1-CG 3.67Å; Y251-F309 AromaticContact CD1-CZ 3.86Å; Y251-F309 HydrophobicContact CD1-CZ 3.86Å; Y251-F309 HydrophobicContact CE1-CB 3.75Å; Y251-F309 AromaticContact CE1-CD1 3.69Å; Y251-F309 HydrophobicContact CE1-CD1 3.69Å; Y251-F309 AromaticContact CE1-CD2 3.87Å; Y251-F309 HydrophobicContact CE1-CD2 3.87Å; Y251-F309 HydrophobicContact CE1-CE1 4.25Å; Y251-F309 HydrophobicContact CE1-CE2 4.41Å; Y251-F309 AromaticContact CE1-CG 3.48Å; Y251-F309 HydrophobicContact CE1-CG 3.48Å; Y251-F309 VanDerWaalsContact CE1-CG 3.48Å; Y251-F309 HydrophobicContact CG-CE1 4.48Å; C254-F309 HydrophobicContact CB-CD1 4.46Å; C254-F309 HydrophobicContact CB-CE1 3.9Å; A305-F309 PolarHBondContact O-N 3.14Å; M306-F309 PolarHBondContact O-N 3.13Å; F309-S311 VanDerWaalsContact C-N 3.3Å; F309-S311 PolarHBondContact O-N 3.4Å; F309-V312 PolarHBondContact O-N 2.97Å; F309-C313 WeakPolarHBondContact CE1-SG 3.26Å; F309-C313 PolarHBondContact O-N 3.41Å; F309-C313 PolarHBondContact O-SG 3.22Å; F309-C313 VanDerWaalsContact O-SG 3.39Å; F309-F435 AromaticContact CD2-CE1 3.64Å; F309-F435 HydrophobicContact CD2-CE1 3.64Å; F309-F435 AromaticContact CD2-CZ 3.99Å; F309-F435 HydrophobicContact CD2-CZ 3.99Å; F309-F435 AromaticContact CE2-CE1 3.83Å; F309-F435 HydrophobicContact CE2-CE1 3.83Å; F309-F435 HydrophobicContact CG-CE1 4.49Å; F309-Y439 HydrophobicContact CB-CE1 4.5Å; F309-Y439 HydrophobicContact CB-CE2 3.89Å; F309-Y439 AromaticContact CD2-CD1 3.98Å; F309-Y439 HydrophobicContact CD2-CD1 3.98Å; F309-Y439 HydrophobicContact CD2-CD2 4.33Å; F309-Y439 AromaticContact CD2-CE1 3.91Å; F309-Y439 HydrophobicContact CD2-CE1 3.91Å; F309-Y439 HydrophobicContact CD2-CE2 4.26Å; F309-Y439 HydrophobicContact CD2-CG 4.2Å
310	V	93.8	Very high	93	Very high	4 Å²	4	42.9 Å²	42.9	2%	0.024	24%	0.238	C	C	.	.	H	α-helix	trans	-61	-40.1	178.1	173	0	0	0	0	110.8	T250 M286 M306 C313 F314	T250-V310 HydrophobicContact CG2-CG2 4.09Å; M286-V310 HydrophobicContact CE-CB 4.19Å; M286-V310 HydrophobicContact CE-CG1 3.61Å; M286-V310 WeakPolarHBondContact CE-O 3.38Å; M306-V310 HydrophobicContact CG-CG2 4.41Å; M306-V310 WeakPolarHBondContact O-CG2 3.42Å; M306-V310 PolarHBondContact O-N 3.24Å; V310-C313 PolarHBondContact O-N 3.36Å; V310-F314 WeakPolarHBondContact O-CB 3.36Å; V310-F314 PolarHBondContact O-N 3.4Å
311	S	93.4	Very high	93.3	Very high	63 Å²	63	43.1 Å²	43.1	44%	0.441	24%	0.237	S	C	.	.	H	α-helix	trans	-65.9	-41.8	178.3	-60.5	0	0	0	0	112	D307 L308 F309 F314 I315	D307-S311 WeakPolarHBondContact O-CB 3.44Å; D307-S311 PolarHBondContact O-N 3.18Å; D307-S311 PolarHBondContact O-OG 3.35Å; L308-S311 PolarHBondContact O-N 3.37Å; F309-S311 VanDerWaalsContact C-N 3.3Å; F309-S311 PolarHBondContact O-N 3.4Å; S311-F314 WeakPolarHBondContact O-CB 3.44Å; S311-F314 PolarHBondContact O-N 3.07Å; S311-I315 WeakPolarHBondContact O-CG1 3.29Å; S311-I315 PolarHBondContact O-N 3.43Å
312	V	95.6	Very high	93.5	Very high	32 Å²	32	40.2 Å²	40.2	19%	0.194	21%	0.214	C	C	.	.	H	α-helix	trans	-65.3	-44.6	176.2	171.4	0	0	0	0	111	L308 F309 F314 I315 F316 F435	L308-V312 WeakPolarHBondContact O-CG2 3.24Å; L308-V312 PolarHBondContact O-N 2.61Å; F309-V312 PolarHBondContact O-N 2.97Å; V312-F314 VanDerWaalsContact C-N 3.26Å; V312-F314 PolarHBondContact O-N 3.2Å; V312-I315 PolarHBondContact O-N 3.12Å; V312-I315 VanDerWaalsContact O-N 3.14Å; V312-F316 HydrophobicContact CG1-CD2 3.69Å; V312-F316 HydrophobicContact CG1-CE2 3.53Å; V312-F316 VanDerWaalsContact O-CD2 3.29Å; V312-F316 WeakPolarHBondContact O-CD2 3.42Å; V312-F316 PolarHBondContact O-N 2.97Å; V312-F435 HydrophobicContact CB-CE1 4.05Å; V312-F435 HydrophobicContact CB-CE2 3.95Å; V312-F435 HydrophobicContact CB-CZ 3.68Å; V312-F435 HydrophobicContact CG1-CD1 3.82Å; V312-F435 HydrophobicContact CG1-CD2 3.86Å; V312-F435 HydrophobicContact CG1-CE1 3.71Å; V312-F435 HydrophobicContact CG1-CE2 3.76Å; V312-F435 HydrophobicContact CG1-CG 3.89Å; V312-F435 HydrophobicContact CG1-CZ 3.69Å; V312-F435 HydrophobicContact CG2-CD2 4.41Å; V312-F435 HydrophobicContact CG2-CE2 3.72Å; V312-F435 HydrophobicContact CG2-CZ 3.88Å
313	C	96	Very high	93.6	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-56.6	-40.5	172.9	-72.8	0	0	0	0	112	V258 M286 F309 V310 F316 V317	V258-C313 HydrophobicContact CG2-CB 3.65Å; M286-C313 HydrophobicContact CE-CB 3.3Å; M286-C313 HydrophobicContact SD-CB 4.24Å; F309-C313 WeakPolarHBondContact CE1-SG 3.26Å; F309-C313 PolarHBondContact O-N 3.41Å; F309-C313 PolarHBondContact O-SG 3.22Å; F309-C313 VanDerWaalsContact O-SG 3.39Å; V310-C313 PolarHBondContact O-N 3.36Å; C313-F316 PolarHBondContact O-N 3.28Å; C313-V317 WeakPolarHBondContact O-CG2 3.26Å; C313-V317 PolarHBondContact O-N 3.24Å
314	F	95.3	Very high	93.6	Very high	77 Å²	77	33.8 Å²	33.8	34%	0.338	18%	0.18	S	C	.	.	H	α-helix	trans	-63.6	-43.3	176	-179	-93.8	0	0	0	112	V283 M286 V310 S311 V312 F316 V317 F318	V283-F314 HydrophobicContact CG1-CE2 4.05Å; V283-F314 HydrophobicContact CG1-CZ 4.46Å; M286-F314 HydrophobicContact CB-CD2 4.33Å; M286-F314 HydrophobicContact CE-CB 4.37Å; M286-F314 HydrophobicContact CG-CB 4.06Å; M286-F314 HydrophobicContact CG-CD2 3.95Å; V310-F314 WeakPolarHBondContact O-CB 3.36Å; V310-F314 PolarHBondContact O-N 3.4Å; S311-F314 WeakPolarHBondContact O-CB 3.44Å; S311-F314 PolarHBondContact O-N 3.07Å; V312-F314 VanDerWaalsContact C-N 3.26Å; V312-F314 PolarHBondContact O-N 3.2Å; F314-F316 PolarHBondContact O-N 2.93Å; F314-V317 PolarHBondContact O-N 2.98Å; F314-F318 VanDerWaalsContact O-CB 3.26Å; F314-F318 WeakPolarHBondContact O-CB 3.34Å; F314-F318 PolarHBondContact O-N 3.02Å
315	I	95.8	Very high	93.4	Very high	108 Å²	108	35.3 Å²	35.3	55%	0.554	20%	0.197	S	C	*	.	H	α-helix	trans	-60.6	-44.1	175.8	-67.7	164.9	0	0	0	110.9	S311 V312 F318 S319	S311-I315 WeakPolarHBondContact O-CG1 3.29Å; S311-I315 PolarHBondContact O-N 3.43Å; V312-I315 PolarHBondContact O-N 3.12Å; V312-I315 VanDerWaalsContact O-N 3.14Å; I315-F318 PolarHBondContact O-N 3.4Å; I315-S319 VanDerWaalsContact O-CB 3.24Å; I315-S319 WeakPolarHBondContact O-CB 3.38Å; I315-S319 PolarHBondContact O-N 3.17Å; I315-S319 PolarHBondContact O-OG 2.86Å; I315-S319 VanDerWaalsContact O-OG 3.14Å
316	F	95.9	Very high	93.1	Very high	28 Å²	28	37.8 Å²	37.8	12%	0.123	21%	0.212	C	C	.	.	H	α-helix	trans	-60.8	-49.2	177.2	-86.1	-73.2	0	0	0	112.2	V258 V312 C313 F314 F318 S319 A320 F428 A431 F432	V258-F316 HydrophobicContact CG1-CB 4.21Å; V312-F316 HydrophobicContact CG1-CD2 3.69Å; V312-F316 HydrophobicContact CG1-CE2 3.53Å; V312-F316 VanDerWaalsContact O-CD2 3.29Å; V312-F316 WeakPolarHBondContact O-CD2 3.42Å; V312-F316 PolarHBondContact O-N 2.97Å; C313-F316 PolarHBondContact O-N 3.28Å; F314-F316 PolarHBondContact O-N 2.93Å; F316-F318 PolarHBondContact O-N 3.34Å; F316-S319 WeakPolarHBondContact CA-OG 3.46Å; F316-S319 PolarHBondContact O-N 3.14Å; F316-S319 PolarHBondContact O-OG 3.33Å; F316-A320 PolarHBondContact O-N 3.04Å; F316-F428 AromaticContact CD1-CD1 4Å; F316-F428 HydrophobicContact CD1-CD1 4Å; F316-F428 HydrophobicContact CD1-CE1 4.4Å; F316-A431 HydrophobicContact CE1-CB 3.99Å; F316-A431 HydrophobicContact CZ-CB 4.03Å; F316-F432 AromaticContact CD2-CD2 3.93Å; F316-F432 HydrophobicContact CD2-CD2 3.93Å; F316-F432 HydrophobicContact CE1-CB 4.45Å; F316-F432 AromaticContact CE2-CD2 3.93Å; F316-F432 HydrophobicContact CE2-CD2 3.93Å; F316-F432 HydrophobicContact CG-CD2 4.47Å; F316-F432 HydrophobicContact CZ-CB 4.29Å; F316-F432 HydrophobicContact CZ-CD2 4.46Å
317	V	95.8	Very high	92.8	Very high	1 Å²	1	38.2 Å²	38.2	1%	0.006	21%	0.214	C	C	.	.	H	α-helix	trans	-63	-43.8	179.2	174.8	0	0	0	0	111.2	I257 V258 T282 V283 C313 F314 S319 A320 L321	I257-V317 HydrophobicContact CG2-CG2 4.1Å; V258-V317 HydrophobicContact CG2-CG2 4.02Å; T282-V317 WeakPolarHBondContact OG1-CG1 3.48Å; V283-V317 HydrophobicContact CG2-CG1 3.77Å; C313-V317 WeakPolarHBondContact O-CG2 3.26Å; C313-V317 PolarHBondContact O-N 3.24Å; F314-V317 PolarHBondContact O-N 2.98Å; V317-S319 PolarHBondContact O-N 3.27Å; V317-A320 PolarHBondContact O-N 3.41Å; V317-L321 PolarHBondContact O-N 3.14Å
318	F	95.3	Very high	92.6	Very high	102 Å²	102	41.2 Å²	41.2	45%	0.447	23%	0.227	S	C	.	.	H	α-helix	trans	-64.4	-40.8	177.2	-174.2	-102.6	0	0	0	111.9	F314 I315 F316 A320 L321 V322	F314-F318 VanDerWaalsContact O-CB 3.26Å; F314-F318 WeakPolarHBondContact O-CB 3.34Å; F314-F318 PolarHBondContact O-N 3.02Å; I315-F318 PolarHBondContact O-N 3.4Å; F316-F318 PolarHBondContact O-N 3.34Å; F318-A320 VanDerWaalsContact C-N 3.31Å; F318-A320 PolarHBondContact O-N 3.31Å; F318-L321 WeakPolarHBondContact O-CB 2.92Å; F318-L321 PolarHBondContact O-N 2.95Å; F318-L321 VanDerWaalsContact O-N 3.13Å; F318-V322 HydrophobicContact CD1-CG2 3.99Å; F318-V322 HydrophobicContact CE1-CG2 3.63Å; F318-V322 HydrophobicContact CZ-CG2 4.02Å; F318-V322 WeakPolarHBondContact O-CG2 3.21Å; F318-V322 PolarHBondContact O-N 2.81Å
319	S	94.1	Very high	92.2	Very high	39 Å²	39	44.5 Å²	44.5	27%	0.273	24%	0.236	S	C	.	.	H	α-helix	trans	-64.9	-32.9	177.1	69.8	0	0	0	0	112.8	I315 F316 V317 L321 V322 E323 F428	I315-S319 VanDerWaalsContact O-CB 3.24Å; I315-S319 WeakPolarHBondContact O-CB 3.38Å; I315-S319 PolarHBondContact O-N 3.17Å; I315-S319 PolarHBondContact O-OG 2.86Å; I315-S319 VanDerWaalsContact O-OG 3.14Å; F316-S319 WeakPolarHBondContact CA-OG 3.46Å; F316-S319 PolarHBondContact O-N 3.14Å; F316-S319 PolarHBondContact O-OG 3.33Å; V317-S319 PolarHBondContact O-N 3.27Å; S319-L321 VanDerWaalsContact C-N 3.35Å; S319-V322 PolarHBondContact O-N 3.47Å; S319-E323 WeakPolarHBondContact O-CB 3.45Å; S319-E323 PolarHBondContact O-N 2.93Å; S319-F428 WeakPolarHBondContact OG-CE1 3.36Å
320	A	92.2	Very high	91.7	Very high	5 Å²	5	49.2 Å²	49.2	4%	0.041	26%	0.257	C	S	.	.	H	α-helix	trans	-65.4	-37	172.3	0	0	0	0	0	112.1	F265 F316 V317 F318 Y324 F428	F265-A320 HydrophobicContact CE1-CB 4.23Å; F265-A320 HydrophobicContact CZ-CB 3.85Å; F316-A320 PolarHBondContact O-N 3.04Å; V317-A320 PolarHBondContact O-N 3.41Å; F318-A320 VanDerWaalsContact C-N 3.31Å; F318-A320 PolarHBondContact O-N 3.31Å; A320-Y324 PolarHBondContact O-N 2.74Å; A320-F428 HydrophobicContact CB-CE1 4.15Å
321	L	92.1	Very high	91	Very high	46 Å²	46	52 Å²	52	24%	0.241	27%	0.274	C	S	.	.	H	α-helix	trans	-67.4	-41.4	173.3	179.3	65.6	0	0	0	111.8	V283 V317 F318 S319 Y324 G325	V283-L321 HydrophobicContact CG2-CD2 4.19Å; V317-L321 PolarHBondContact O-N 3.14Å; F318-L321 WeakPolarHBondContact O-CB 2.92Å; F318-L321 PolarHBondContact O-N 2.95Å; F318-L321 VanDerWaalsContact O-N 3.13Å; S319-L321 VanDerWaalsContact C-N 3.35Å; L321-Y324 PolarHBondContact O-N 2.63Å; L321-G325 PolarHBondContact O-N 3.29Å
322	V	92.3	Very high	90.2	Very high	69 Å²	69	53 Å²	53	42%	0.418	28%	0.28	S	S	.	.	H	α-helix	trans	-65.9	-39	177.2	172.2	0	0	0	0	111.5	F318 S319 Y324 G325 T326	F318-V322 HydrophobicContact CD1-CG2 3.99Å; F318-V322 HydrophobicContact CE1-CG2 3.63Å; F318-V322 HydrophobicContact CZ-CG2 4.02Å; F318-V322 WeakPolarHBondContact O-CG2 3.21Å; F318-V322 PolarHBondContact O-N 2.81Å; S319-V322 PolarHBondContact O-N 3.47Å; V322-Y324 VanDerWaalsContact C-N 3.34Å; V322-Y324 PolarHBondContact O-N 3.5Å; V322-G325 PolarHBondContact O-N 3.48Å; V322-T326 WeakPolarHBondContact O-CB 3.46Å; V322-T326 PolarHBondContact O-N 3.44Å; V322-T326 PolarHBondContact O-OG1 2.88Å
323	E	91.3	Very high	89	Confident	21 Å²	21	56.3 Å²	56.3	10%	0.098	30%	0.297	C	S	.	.	H	α-helix	trans	-56.5	-48.8	174.4	-173.3	-77.6	154.8	0	0	110.6	F265 S319 G325 T326 L327 A424	F265-E323 HydrophobicContact CE1-CB 4.48Å; F265-E323 HydrophobicContact CE1-CG 4.23Å; S319-E323 WeakPolarHBondContact O-CB 3.45Å; S319-E323 PolarHBondContact O-N 2.93Å; E323-G325 PolarHBondContact O-N 2.85Å; E323-T326 WeakPolarHBondContact O-CB 3.41Å; E323-T326 PolarHBondContact O-N 3.4Å; E323-L327 PolarHBondContact O-N 2.97Å; E323-L327 WeakPolarHBondContact OE1-CD1 3.41Å; E323-L327 WeakPolarHBondContact OE1-CG 3.29Å; E323-A424 HydrophobicContact CG-CB 4.47Å
324	Y	89	Confident	87.6	Confident	15 Å²	15	64.1 Å²	64.1	6%	0.059	33%	0.327	C	S	.	.	H	α-helix	trans	-61.4	-45.3	175.5	169.4	-100.7	0	0	0	112.6	V272 R275 T276 A320 L321 V322 T326 L327 H328	V272-Y324 WeakPolarHBondContact CA-OH 3.48Å; V272-Y324 WeakPolarHBondContact CG1-OH 3.34Å; V272-Y324 PolarHBondContact O-OH 3.22Å; R275-Y324 HydrophobicContact CB-CD2 3.73Å; R275-Y324 HydrophobicContact CB-CE2 3.62Å; R275-Y324 HydrophobicContact CB-CG 4.26Å; R275-Y324 HydrophobicContact CG-CD2 4.28Å; R275-Y324 HydrophobicContact CG-CE2 4.25Å; T276-Y324 HydrophobicContact CG2-CD1 4.19Å; T276-Y324 HydrophobicContact CG2-CE1 3.28Å; A320-Y324 PolarHBondContact O-N 2.74Å; L321-Y324 PolarHBondContact O-N 2.63Å; V322-Y324 VanDerWaalsContact C-N 3.34Å; V322-Y324 PolarHBondContact O-N 3.5Å; Y324-T326 PolarHBondContact O-N 3.24Å; Y324-L327 WeakPolarHBondContact O-CB 3.29Å; Y324-L327 PolarHBondContact O-N 3.05Å; Y324-H328 WeakPolarHBondContact O-CB 3.4Å; Y324-H328 PolarHBondContact O-N 3.21Å
325	G	89	Confident	85.4	Confident	37 Å²	37	69.3 Å²	69.3	38%	0.381	35%	0.349	S	S	.	.	H	α-helix	trans	-58.7	-39.6	176.8	0	0	0	0	0	112.1	L321 V322 E323 H328 Y329	L321-G325 PolarHBondContact O-N 3.29Å; V322-G325 PolarHBondContact O-N 3.48Å; E323-G325 PolarHBondContact O-N 2.85Å; G325-H328 PolarHBondContact O-N 3.12Å; G325-Y329 WeakPolarHBondContact O-CB 3.4Å; G325-Y329 PolarHBondContact O-N 3.01Å
326	T	87.1	Confident	83.2	Confident	51 Å²	51	69.7 Å²	69.7	31%	0.313	36%	0.358	S	S	.	.	H	α-helix	trans	-68	-45.1	177.2	-55.4	0	0	0	0	111.2	V322 E323 Y324 H328 Y329 F330 M420	V322-T326 WeakPolarHBondContact O-CB 3.46Å; V322-T326 PolarHBondContact O-N 3.44Å; V322-T326 PolarHBondContact O-OG1 2.88Å; E323-T326 WeakPolarHBondContact O-CB 3.41Å; E323-T326 PolarHBondContact O-N 3.4Å; Y324-T326 PolarHBondContact O-N 3.24Å; T326-H328 PolarHBondContact O-N 3.25Å; T326-Y329 PolarHBondContact O-N 2.81Å; T326-F330 HydrophobicContact CG2-CD2 3.63Å; T326-F330 HydrophobicContact CG2-CE2 3.37Å; T326-F330 WeakPolarHBondContact O-CD2 3.05Å; T326-F330 PolarHBondContact O-N 3.48Å; T326-M420 HydrophobicContact CG2-CE 4Å
327	L	85.6	Confident	80.6	Confident	11 Å²	11	72.7 Å²	72.7	6%	0.058	38%	0.383	C	S	.	.	H	α-helix	trans	-55	-51.8	172.1	-82.5	175	0	0	0	111.3	E323 Y324 Y329 F330 V331 I417 M420 D421	E323-L327 PolarHBondContact O-N 2.97Å; E323-L327 WeakPolarHBondContact OE1-CD1 3.41Å; E323-L327 WeakPolarHBondContact OE1-CG 3.29Å; Y324-L327 WeakPolarHBondContact O-CB 3.29Å; Y324-L327 PolarHBondContact O-N 3.05Å; L327-Y329 PolarHBondContact O-N 2.81Å; L327-F330 PolarHBondContact O-N 3.35Å; L327-V331 WeakPolarHBondContact O-CB 3.36Å; L327-V331 VanDerWaalsContact O-CG2 3.25Å; L327-V331 WeakPolarHBondContact O-CG2 3.33Å; L327-V331 PolarHBondContact O-N 3.26Å; L327-I417 HydrophobicContact CD2-CG2 4Å; L327-M420 HydrophobicContact CB-CE 4.19Å; L327-M420 HydrophobicContact CD2-CB 3.99Å; L327-M420 HydrophobicContact CD2-CE 3.49Å; L327-M420 VanDerWaalsContact CD2-CE 3.49Å; L327-M420 HydrophobicContact CD2-CG 4.31Å; L327-M420 HydrophobicContact CG-CE 3.42Å; L327-M420 VanDerWaalsContact CG-CE 3.42Å; L327-D421 WeakPolarHBondContact CD1-OD1 3.24Å
328	H	86.1	Confident	78.1	Confident	89 Å²	89	81.7 Å²	81.7	41%	0.412	42%	0.422	S	S	.	.	H	α-helix	trans	-63.3	-41.9	-176.7	-175.9	-92.8	0	0	0	111.8	Y324 G325 T326 V331 S332	Y324-H328 WeakPolarHBondContact O-CB 3.4Å; Y324-H328 PolarHBondContact O-N 3.21Å; G325-H328 PolarHBondContact O-N 3.12Å; T326-H328 PolarHBondContact O-N 3.25Å; H328-V331 PolarHBondContact O-N 3.36Å; H328-S332 VanDerWaalsContact O-CB 3.29Å; H328-S332 WeakPolarHBondContact O-CB 3.17Å; H328-S332 PolarHBondContact O-N 3.08Å
329	Y	86.3	Confident	75.7	Confident	136 Å²	136	82 Å²	82	53%	0.533	43%	0.428	S	S	.	.	H	α-helix	trans	-60.7	-48.7	176.2	-179.7	-101.2	0	0	0	112.2	G325 T326 L327 S332 N333	G325-Y329 WeakPolarHBondContact O-CB 3.4Å; G325-Y329 PolarHBondContact O-N 3.01Å; T326-Y329 PolarHBondContact O-N 2.81Å; L327-Y329 PolarHBondContact O-N 2.81Å; Y329-S332 PolarHBondContact O-N 2.89Å; Y329-N333 WeakPolarHBondContact CE1-ND2 3.4Å; Y329-N333 WeakPolarHBondContact O-CB 3.32Å; Y329-N333 PolarHBondContact O-N 3.16Å; Y329-N333 PolarHBondContact OH-ND2 2.84Å; Y329-N333 VanDerWaalsContact OH-ND2 3.14Å
330	F	83.4	Confident	73.2	Confident	100 Å²	100	89.6 Å²	89.6	44%	0.439	46%	0.456	S	S	.	.	H	α-helix	trans	-70.1	-31.8	-179.6	-75.3	-59.4	0	0	0	113.6	T326 L327 R334 I417	T326-F330 HydrophobicContact CG2-CD2 3.63Å; T326-F330 HydrophobicContact CG2-CE2 3.37Å; T326-F330 WeakPolarHBondContact O-CD2 3.05Å; T326-F330 PolarHBondContact O-N 3.48Å; L327-F330 PolarHBondContact O-N 3.35Å; F330-R334 PolarHBondContact O-N 3.3Å; F330-I417 HydrophobicContact CB-CD1 3.76Å; F330-I417 HydrophobicContact CB-CG1 4.21Å
331	V	80.2	Confident	70.8	Confident	62 Å²	62	95.7 Å²	95.7	38%	0.376	49%	0.488	S	S	.	.	H	α-helix	trans	-68.5	-44	173	171.4	0	0	0	0	110.7	L327 H328 R334 I417	L327-V331 WeakPolarHBondContact O-CB 3.36Å; L327-V331 VanDerWaalsContact O-CG2 3.25Å; L327-V331 WeakPolarHBondContact O-CG2 3.33Å; L327-V331 PolarHBondContact O-N 3.26Å; H328-V331 PolarHBondContact O-N 3.36Å; V331-R334 PolarHBondContact O-N 2.93Å; V331-I417 HydrophobicContact CG2-CG2 3.88Å
332	S	76.2	Confident	68.4	Low	83 Å²	83	101.3 Å²	101.3	58%	0.58	51%	0.511	S	S	*	.	H	α-helix	trans	-67.2	-39.8	179.5	-172.9	0	0	0	0	112.8	H328 Y329 R334	H328-S332 VanDerWaalsContact O-CB 3.29Å; H328-S332 WeakPolarHBondContact O-CB 3.17Å; H328-S332 PolarHBondContact O-N 3.08Å; Y329-S332 PolarHBondContact O-N 2.89Å; S332-R334 PolarHBondContact O-N 2.98Å
333	N	70.3	Confident	65.9	Low	102 Å²	102	107.8 Å²	107.8	55%	0.545	53%	0.533	S	S	.	.	H	α-helix	trans	-69.4	-17	177.4	-93.6	1.4	0	0	0	114	Y329 K335	Y329-N333 WeakPolarHBondContact CE1-ND2 3.4Å; Y329-N333 WeakPolarHBondContact O-CB 3.32Å; Y329-N333 PolarHBondContact O-N 3.16Å; Y329-N333 PolarHBondContact OH-ND2 2.84Å; Y329-N333 VanDerWaalsContact OH-ND2 3.14Å; N333-K335 VanDerWaalsContact C-N 3.32Å; N333-K335 PolarHBondContact O-N 2.97Å
334	R	66	Low	63.5	Low	165 Å²	165	115.8 Å²	115.8	62%	0.623	57%	0.568	S	S	*	*	S	Bend	trans	-77.4	87.2	167.1	-76.4	-173.1	176.5	-171.7	0.8	108.7	F330 V331 S332	F330-R334 PolarHBondContact O-N 3.3Å; V331-R334 PolarHBondContact O-N 2.93Å; S332-R334 PolarHBondContact O-N 2.98Å
335	K	49.9	Very low	61.3	Low	186 Å²	186	123.4 Å²	123.4	81%	0.809	60%	0.601	S	S	*	*	P	Polyproline II helix	trans	-46.4	131.4	166.2	-72.8	179.3	178.8	174.5	0	108.6	N333 S337	N333-K335 VanDerWaalsContact C-N 3.32Å; N333-K335 PolarHBondContact O-N 2.97Å; K335-S337 PolarHBondContact O-N 3.4Å
336	P	48.8	Very low	58.8	Low	116 Å²	116	129.2 Å²	129.2	75%	0.753	62%	0.623	S	S	*	*	P	Polyproline II helix	trans	-57.2	119.1	167.8	23.9	-30.5	0	0	0	106.6	K338	P336-K338 PolarHBondContact O-N 3.49Å
337	S	41.9	Very low	56.8	Low	91 Å²	91	132.6 Å²	132.6	64%	0.636	65%	0.646	S	S	*	*	P	Polyproline II helix	trans	-52.5	118.5	173.2	-177.2	0	0	0	0	107.3	K335 D339	K335-S337 PolarHBondContact O-N 3.4Å; S337-D339 PolarHBondContact O-N 3.47Å
338	K	42.4	Very low	54.9	Low	190 Å²	190	139.8 Å²	139.8	83%	0.826	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.5	42.1	175.8	-72.6	-174.8	171.8	-177	0	111.4	P336	P336-K338 PolarHBondContact O-N 3.49Å
339	D	46	Very low	52.6	Low	108 Å²	108	143.9 Å²	143.9	58%	0.578	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.9	-7.4	179.8	-109.4	-14.5	0	0	0	113.8	S337 D341	S337-D339 PolarHBondContact O-N 3.47Å; D339-D341 VanDerWaalsContact C-N 3.35Å
340	K	41.9	Very low	50.2	Low	198 Å²	198	149.3 Å²	149.3	86%	0.861	73%	0.727	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.9	-15.6	171.1	-75.9	-169.7	174.4	-177.9	0	114.1
341	D	41.8	Very low	47.9	Very low	133 Å²	133	152.2 Å²	152.2	71%	0.711	74%	0.744	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.3	-13.1	177.9	-79.7	-33.3	0	0	0	114.7	D339	D339-D341 VanDerWaalsContact C-N 3.35Å
342	K	40.9	Very low	45.6	Very low	164 Å²	164	159 Å²	159	71%	0.713	77%	0.769	S	S	*	*	G	3₁₀ helix	trans	-82.8	-19.1	177.7	-81.9	-175.2	175.7	179.8	0	114.4	K344	K342-K344 VanDerWaalsContact C-N 3.25Å; K342-K344 PolarHBondContact O-N 2.88Å
343	K	39.3	Very low	43.3	Very low	205 Å²	205	160.6 Å²	160.6	89%	0.891	78%	0.78	S	S	*	*	G	3₁₀ helix	trans	-75.1	-6	174.6	-97.4	-176.9	177.6	178.2	0	114.7
344	K	42.4	Very low	41.4	Very low	190 Å²	190	165.6 Å²	165.6	83%	0.826	80%	0.797	S	S	*	*	G	3₁₀ helix	trans	-98.8	3.2	178.8	-103.3	-177.9	178.5	179	0	115.3	K342	K342-K344 VanDerWaalsContact C-N 3.25Å; K342-K344 PolarHBondContact O-N 2.88Å
345	K	42.4	Very low	39.5	Very low	175 Å²	175	167.4 Å²	167.4	76%	0.761	81%	0.81	S	S	*	*			trans	-133.1	69.9	-179.8	-73.8	-175	176.8	-178.8	0	112.5
346	N	35.4	Very low	38.4	Very low	158 Å²	158	162.8 Å²	162.8	85%	0.845	81%	0.807	S	S	*	*			trans	-127	99	153	-88.2	-5.5	0	0	0	108.4	L348	N346-L348 VanDerWaalsContact C-N 3.34Å; N346-L348 PolarHBondContact O-N 2.81Å
347	P	46.3	Very low	37.7	Very low	122 Å²	122	162.8 Å²	162.8	79%	0.792	81%	0.806	S	S	*	*			trans	-90	63	-180	35.9	-31.7	0	0	0	110.6
348	L	45.3	Very low	37	Very low	163 Å²	163	165.5 Å²	165.5	85%	0.853	82%	0.82	S	S	*	*			trans	-146	37.4	-177.1	-115	164.4	0	0	0	114.6	N346	N346-L348 VanDerWaalsContact C-N 3.34Å; N346-L348 PolarHBondContact O-N 2.81Å
349	L	38.3	Very low	36.3	Very low	174 Å²	174	163.9 Å²	163.9	91%	0.911	82%	0.818	S	S	*	*	S	Bend	trans	-148.2	42.7	166.5	-122.5	135.1	0	0	0	111.1
350	R	35.8	Very low	35.2	Very low	251 Å²	251	165.6 Å²	165.6	95%	0.947	83%	0.827	S	S	*	*			trans	-113.4	22.8	-179.5	-135	-174.1	-169.4	-160.8	2.3	113.8
351	M	34.6	Very low	34.4	Very low	160 Å²	160	163.7 Å²	163.7	79%	0.788	83%	0.825	S	S	*	*	S	Bend	trans	-133	128.5	176.3	-155.7	159.3	-115.4	0	0	107.3
352	F	32.8	Very low	33.6	Very low	204 Å²	204	168.4 Å²	168.4	90%	0.895	83%	0.833	S	S	*	*	S	Bend	trans	83.1	78.1	-169.8	-55	-77.1	0	0	0	116.3
353	S	27	Very low	33.7	Very low	117 Å²	117	165.7 Å²	165.7	82%	0.818	83%	0.832	S	S	*	*				-172.6	106.3	111.6	-159	0	0	0	0	109.5
354	F	29.3	Very low	33	Very low	207 Å²	207	167.5 Å²	167.5	91%	0.908	83%	0.833	S	S	*	*			trans	-60.2	133.1	161.1	-104.8	-101.4	0	0	0	108.8
355	K	26.9	Very low	32.3	Very low	203 Å²	203	164 Å²	164	88%	0.883	83%	0.833	S	S	*	*			trans	-160	121.6	140.3	-108.7	166.6	-171.4	-173.2	0	111.1
356	A	27.5	Very low	31.5	Very low	90 Å²	90	160.1 Å²	160.1	74%	0.744	83%	0.833	S	S	*	*			trans	-71.4	165.6	166.8	0	0	0	0	0	110.5
357	P	33.7	Very low	31.2	Very low	115 Å²	115	159.3 Å²	159.3	75%	0.747	83%	0.834	S	S	*	*			trans	-95.4	160.5	-152.2	37.3	-33.4	0	0	0	113.3
358	T	27.7	Very low	30.3	Very low	149 Å²	149	160.5 Å²	160.5	91%	0.914	83%	0.832	S	S	*	*			trans	-172.5	138.5	142.4	19.4	0	0	0	0	111.3
359	I	26.1	Very low	29.4	Very low	156 Å²	156	162 Å²	162	80%	0.8	84%	0.835	S	S	*	*			trans	-90.7	138.5	170.8	-73.4	162.1	0	0	0	107.2
360	D	24.5	Very low	28.7	Very low	143 Å²	143	160.9 Å²	160.9	77%	0.765	83%	0.827	S	S	*	*				149	156.3	116.4	-137.7	-16.3	0	0	0	114.8
361	I	25.3	Very low	28.4	Very low	159 Å²	159	155 Å²	155	82%	0.815	81%	0.814	S	S	*	*			trans	102.8	107.7	161.1	-52.7	155.5	0	0	0	117.9
362	R	25.1	Very low	28	Very low	231 Å²	231	154.9 Å²	154.9	87%	0.872	82%	0.817	S	S	*	*			trans	-79.5	-177	162.6	-123.2	-168.2	-175.3	178.9	2.6	110.6
363	P	41.4	Very low	27.9	Very low	107 Å²	107	149.8 Å²	149.8	70%	0.695	81%	0.812	S	S	*	*				-128.1	174.6	-54	29.8	-9.5	0	0	0	113.1
364	R	25.9	Very low	27.9	Very low	243 Å²	243	150.7 Å²	150.7	92%	0.917	81%	0.813	S	S	*	*			trans	173.7	114.9	148.1	-102.6	169.2	174.1	179.5	-1.3	109.1
365	S	26.4	Very low	27.7	Very low	117 Å²	117	148.7 Å²	148.7	82%	0.818	81%	0.806	S	S	*	*				92.7	133.2	71.2	-67.8	0	0	0	0	114
366	A	26.5	Very low	27.8	Very low	93 Å²	93	146.5 Å²	146.5	77%	0.769	80%	0.803	S	S	*	*			trans	101.7	128.4	174.2	0	0	0	0	0	114.1
367	T	28	Very low	27.7	Very low	141 Å²	141	150 Å²	150	87%	0.865	80%	0.804	S	S	*	*			cis	-163.8	163.3	3.7	13.6	0	0	0	0	108.5
368	I	27.3	Very low	27.4	Very low	147 Å²	147	153.3 Å²	153.3	75%	0.754	81%	0.81	S	S	*	*			trans	-66.7	144	-171.3	-64	156	0	0	0	114
369	Q	26.4	Very low	27.2	Very low	196 Å²	196	157.2 Å²	157.2	92%	0.916	81%	0.808	S	S	*	*			trans	-140.6	134.1	134.7	-80.6	-135.8	-8.8	0	0	111.2
370	M	25.5	Very low	27.2	Very low	150 Å²	150	157.1 Å²	157.1	74%	0.739	81%	0.809	S	S	*	*			trans	-97.2	157.2	-177.7	-107.1	175.6	76.8	0	0	110.9
371	N	28.6	Very low	27.5	Very low	126 Å²	126	158 Å²	158	67%	0.674	81%	0.808	S	S	*	*			trans	90.1	105.7	158.3	-57.6	-13	0	0	0	117.9
372	N	26.8	Very low	27.5	Very low	158 Å²	158	159.5 Å²	159.5	85%	0.845	81%	0.812	S	S	*	*				-171.5	128.2	89.1	-103.2	-10.9	0	0	0	110.8
373	A	30.8	Very low	27.8	Very low	97 Å²	97	157.5 Å²	157.5	80%	0.802	81%	0.806	S	S	*	*			trans	-83.1	122.4	167.4	0	0	0	0	0	108.9
374	T	26.4	Very low	27.2	Very low	136 Å²	136	155.5 Å²	155.5	83%	0.834	81%	0.805	S	S	*	*			trans	-161.3	130.3	152	43.4	0	0	0	0	111.4
375	H	24.6	Very low	27.6	Very low	166 Å²	166	154.1 Å²	154.1	77%	0.769	80%	0.801	S	S	*	*			trans	91.5	106.3	143.5	-137	-95.6	0	0	0	119.9
376	L	29.5	Very low	27.8	Very low	156 Å²	156	157.7 Å²	157.7	82%	0.817	81%	0.805	S	S	*	*			trans	-43.1	131.2	150.7	-81.4	124.3	0	0	0	111.6
377	Q	25.3	Very low	28	Very low	164 Å²	164	159.5 Å²	159.5	77%	0.766	81%	0.81	S	S	*	*			trans	-156.4	102.9	136.1	-149.7	144.2	-7.5	0	0	110.1	R379	Q377-R379 PolarHBondContact O-N 2.93Å; Q377-R379 VanDerWaalsContact O-N 3.11Å
378	E	26.9	Very low	28.3	Very low	184 Å²	184	161.2 Å²	161.2	86%	0.86	81%	0.813	S	S	*	*			trans	-54.2	111.3	154.1	-71.9	179.4	145.4	0	0	106.9
379	R	24.9	Very low	28.6	Very low	231 Å²	231	162 Å²	162	87%	0.872	82%	0.82	S	S	*	*			trans	-89.6	108.8	176.1	-160.4	-179	-164.7	-169.5	4.1	107.4	Q377 E381	Q377-R379 PolarHBondContact O-N 2.93Å; Q377-R379 VanDerWaalsContact O-N 3.11Å; R379-E381 PolarHBondContact O-N 3.06Å
380	D	26.1	Very low	29.2	Very low	155 Å²	155	155.7 Å²	155.7	83%	0.829	81%	0.806	S	S	*	*			trans	-47.4	119.7	168.1	-79	-52.9	0	0	0	110.6	E382	D380-E382 PolarHBondContact O-N 2.88Å; D380-E382 VanDerWaalsContact O-N 3.12Å
381	E	29.3	Very low	29.5	Very low	161 Å²	161	158 Å²	158	75%	0.752	81%	0.812	S	S	*	*			trans	-75.8	95	170	-75.3	-172.5	163.4	0	0	109.6	R379 Y383	R379-E381 PolarHBondContact O-N 3.06Å; E381-Y383 PolarHBondContact O-N 3Å
382	E	26.7	Very low	29.7	Very low	191 Å²	191	159.2 Å²	159.2	89%	0.893	82%	0.819	S	S	*	*			trans	-73	100.8	167.5	-172.6	171.2	-166.2	0	0	109.8	D380 G384	D380-E382 PolarHBondContact O-N 2.88Å; D380-E382 VanDerWaalsContact O-N 3.12Å; E382-G384 PolarHBondContact O-N 3.09Å; E382-G384 VanDerWaalsContact O-N 3.09Å
383	Y	31.1	Very low	30	Very low	188 Å²	188	157.1 Å²	157.1	74%	0.737	82%	0.815	S	S	*	*			trans	-75.8	91.6	170.8	-86.4	-85.9	0	0	0	110.2	E381	E381-Y383 PolarHBondContact O-N 3Å
384	G	28.4	Very low	30.2	Very low	66 Å²	66	157.4 Å²	157.4	68%	0.68	82%	0.818	S	S	*	*			trans	-79.4	127.2	161.7	0	0	0	0	0	110.5	E382	E382-G384 PolarHBondContact O-N 3.09Å; E382-G384 VanDerWaalsContact O-N 3.09Å
385	Y	34.1	Very low	30.7	Very low	214 Å²	214	154.9 Å²	154.9	84%	0.839	81%	0.806	S	S	*	*			trans	-88.7	108.7	168.4	-69.3	-87.2	0	0	0	108.1
386	E	30.1	Very low	31.1	Very low	191 Å²	191	157 Å²	157	89%	0.893	81%	0.813	S	S	*	*			trans	-72.9	125	164.4	-78.4	179.7	151.7	0	0	109.1	L388	E386-L388 PolarHBondContact O-N 2.95Å
387	C	31	Very low	31.3	Very low	131 Å²	131	158.5 Å²	158.5	89%	0.885	81%	0.813	S	S	*	*			trans	-74.9	115.8	169.4	-74.5	0	0	0	0	108.9
388	L	35.8	Very low	31.7	Very low	177 Å²	177	155 Å²	155	93%	0.927	81%	0.806	S	S	*	*			trans	-71	139.1	172	-81	159.9	0	0	0	111	E386	E386-L388 PolarHBondContact O-N 2.95Å
389	D	32.6	Very low	32.1	Very low	165 Å²	165	152.2 Å²	152.2	88%	0.882	81%	0.805	S	S	*	*			trans	-71.8	137.3	-174.4	-151.6	0.7	0	0	0	112.4
390	G	39.3	Very low	32.7	Very low	62 Å²	62	148.9 Å²	148.9	64%	0.639	80%	0.797	S	S	*	*			trans	60.2	90	159.5	0	0	0	0	0	120
391	K	32	Very low	33.3	Very low	198 Å²	198	149.9 Å²	149.9	86%	0.861	80%	0.797	S	S	*	*	S	Bend		172.7	131.8	118	-100.9	172.5	174.9	169.7	0	112.6
392	D	31.9	Very low	33.7	Very low	153 Å²	153	146.7 Å²	146.7	82%	0.818	79%	0.785	S	S	*	*			trans	66.1	85.6	163.1	-54.1	-22.2	0	0	0	118.5	A394	D392-A394 PolarHBondContact O-N 3.12Å
393	C	33	Very low	34.4	Very low	114 Å²	114	142.8 Å²	142.8	77%	0.77	78%	0.778	S	S	*	*			trans	-70.6	101.6	166.1	-76.3	0	0	0	0	111.5
394	A	36.1	Very low	34.8	Very low	103 Å²	103	144.8 Å²	144.8	85%	0.851	78%	0.784	S	S	*	*			trans	-112.2	58.4	164.9	0	0	0	0	0	110.9	D392	D392-A394 PolarHBondContact O-N 3.12Å
395	S	35.8	Very low	35.4	Very low	83 Å²	83	146.7 Å²	146.7	58%	0.58	78%	0.783	S	S	*	*	S	Bend	trans	-160	136.5	160	67.7	0	0	0	0	110.8	F397	S395-F397 PolarHBondContact O-N 3.27Å
396	F	34.6	Very low	35.9	Very low	210 Å²	210	138.3 Å²	138.3	92%	0.921	76%	0.761	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.1	6.2	-164.9	-147.2	-98.8	0	0	0	115.7
397	F	33.1	Very low	36.4	Very low	188 Å²	188	132.1 Å²	132.1	83%	0.825	74%	0.742	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.7	7.8	-169.4	-100.9	-82.5	0	0	0	115.5	S395	S395-F397 PolarHBondContact O-N 3.27Å
398	C	34	Very low	36.9	Very low	91 Å²	91	136 Å²	136	62%	0.615	74%	0.739	S	S	*	*			trans	-94.2	10.6	-179.8	-79.4	0	0	0	0	115.5
399	C	34.7	Very low	37.3	Very low	124 Å²	124	136.8 Å²	136.8	84%	0.838	73%	0.729	S	S	*	*			trans	-107.8	29.5	-179.4	-70.1	0	0	0	0	114.4
400	F	36.4	Very low	37.5	Very low	161 Å²	161	137.5 Å²	137.5	71%	0.706	73%	0.727	S	S	*	*			trans	-121.2	121.6	169.3	-96.2	-87.9	0	0	0	110.5	D402 C403	F400-D402 PolarHBondContact O-N 2.78Å; F400-C403 PolarHBondContact O-N 3.07Å; F400-C403 VanDerWaalsContact O-N 3.16Å
401	E	39.6	Very low	37.6	Very low	177 Å²	177	138.1 Å²	138.1	83%	0.827	73%	0.734	S	S	*	*	G	3₁₀ helix	trans	-54.8	-21.8	177.6	-114.3	-178.5	150	0	0	113.3	C403 R404	E401-C403 PolarHBondContact O-N 3.11Å; E401-C403 VanDerWaalsContact O-N 3.15Å; E401-R404 PolarHBondContact O-N 3.23Å
402	D	37	Very low	38	Very low	93 Å²	93	138 Å²	138	50%	0.497	73%	0.728	S	S	.	*	G	3₁₀ helix	trans	-68.8	-5.9	177.5	-70.3	-33.6	0	0	0	115	F400 R404	F400-D402 PolarHBondContact O-N 2.78Å; D402-R404 VanDerWaalsContact C-N 3.34Å
403	C	42	Very low	38.4	Very low	109 Å²	109	138 Å²	138	74%	0.736	73%	0.726	S	S	*	*	G	3₁₀ helix	trans	-78.8	-19.7	173.6	-137.3	0	0	0	0	112.3	F400 E401	F400-C403 PolarHBondContact O-N 3.07Å; F400-C403 VanDerWaalsContact O-N 3.16Å; E401-C403 PolarHBondContact O-N 3.11Å; E401-C403 VanDerWaalsContact O-N 3.15Å
404	R	39.2	Very low	38.8	Very low	231 Å²	231	140.1 Å²	140.1	87%	0.872	72%	0.724	S	S	*	*	S	Bend	trans	-79.2	-21.3	-176.2	-163.2	173.8	176.5	170.5	-0.3	113.6	E401 D402	E401-R404 PolarHBondContact O-N 3.23Å; D402-R404 VanDerWaalsContact C-N 3.34Å
405	T	41	Very low	39.6	Very low	106 Å²	106	140.1 Å²	140.1	65%	0.65	71%	0.709	S	S	*	*	S	Bend	trans	-105	1.8	-174.2	52.2	0	0	0	0	114.3	A407	T405-A407 PolarHBondContact O-N 3.48Å
406	G	45.1	Very low	40.7	Very low	38 Å²	38	144.2 Å²	144.2	39%	0.392	71%	0.712	S	S	.	*			trans	62.1	14.3	173.9	0	0	0	0	0	114.9	W408 R409	G406-W408 PolarHBondContact O-N 3.13Å; G406-R409 PolarHBondContact O-N 3.21Å
407	A	39.6	Very low	41.9	Very low	60 Å²	60	135.3 Å²	135.3	50%	0.496	67%	0.674	S	S	.	*	G	3₁₀ helix	trans	-65.5	-25.7	-175.9	0	0	0	0	0	113	T405 R409 H410	T405-A407 PolarHBondContact O-N 3.48Å; A407-R409 PolarHBondContact O-N 2.85Å; A407-R409 VanDerWaalsContact O-N 3.12Å; A407-H410 PolarHBondContact O-N 2.74Å
408	W	41.3	Very low	43.4	Very low	214 Å²	214	130.7 Å²	130.7	81%	0.811	67%	0.67	S	S	*	*	G	3₁₀ helix	trans	-68.7	-4	175.3	-88.5	84.3	0	0	0	115.2	G406	G406-W408 PolarHBondContact O-N 3.13Å
409	R	44.5	Very low	45.3	Very low	192 Å²	192	131 Å²	131	73%	0.725	66%	0.661	S	S	*	*	G	3₁₀ helix	trans	-95.6	-12.4	177	-66.5	-173.8	-179.2	-175.6	2.3	114.2	G406 A407 G411	G406-R409 PolarHBondContact O-N 3.21Å; A407-R409 PolarHBondContact O-N 2.85Å; A407-R409 VanDerWaalsContact O-N 3.12Å; R409-G411 PolarHBondContact O-N 2.87Å
410	H	36.6	Very low	47.5	Very low	180 Å²	180	126.7 Å²	126.7	83%	0.833	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.3	91.6	178.1	-84	72.9	0	0	0	110.3	A407	A407-H410 PolarHBondContact O-N 2.74Å
411	G	41.2	Very low	49.8	Very low	76 Å²	76	120 Å²	120	78%	0.784	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	145.5	-7.3	171.4	0	0	0	0	0	116.4	R409	R409-G411 PolarHBondContact O-N 2.87Å
412	R	41.3	Very low	52	Low	196 Å²	196	114.6 Å²	114.6	74%	0.74	58%	0.582	S	S	*	*			trans	-91.1	117.9	171.6	-69.5	-168.1	-168.3	-176.7	5.1	110.3	H414	R412-H414 PolarHBondContact O-N 3.25Å
413	I	40.1	Very low	54.4	Low	151 Å²	151	117.6 Å²	117.6	77%	0.774	59%	0.588	S	S	*	*			trans	-56.8	103.4	168.1	-61.4	169	0	0	0	107.7	I415	I413-I415 VanDerWaalsContact C-N 3.29Å; I413-I415 HydrophobicContact CG2-CD1 4.41Å; I413-I415 HydrophobicContact CG2-CG1 3.65Å; I413-I415 PolarHBondContact O-N 3.48Å
414	H	42.1	Very low	56.7	Low	159 Å²	159	112.8 Å²	112.8	74%	0.736	56%	0.556	S	S	*	*			trans	-74.3	83.5	172.8	-85.3	-61.5	0	0	0	109.3	R412 R416	R412-H414 PolarHBondContact O-N 3.25Å; H414-R416 PolarHBondContact O-N 2.96Å
415	I	53	Low	59.2	Low	103 Å²	103	105.9 Å²	105.9	53%	0.528	53%	0.53	S	S	.	.			trans	-67.8	99.6	172.3	-55.1	177.5	0	0	0	107.9	I413 I417 M420	I413-I415 VanDerWaalsContact C-N 3.29Å; I413-I415 HydrophobicContact CG2-CD1 4.41Å; I413-I415 HydrophobicContact CG2-CG1 3.65Å; I413-I415 PolarHBondContact O-N 3.48Å; I415-I417 PolarHBondContact O-N 3.13Å; I415-I417 VanDerWaalsContact O-N 3.12Å; I415-M420 HydrophobicContact CG2-SD 4.18Å
416	R	58.3	Low	61.7	Low	169 Å²	169	106.1 Å²	106.1	64%	0.638	53%	0.526	S	S	*	.			trans	-70.5	106.5	171.5	-164	179.7	-84.8	-168.9	-2.6	106.8	H414 A418 K419	H414-R416 PolarHBondContact O-N 2.96Å; R416-A418 PolarHBondContact O-N 3.39Å; R416-A418 VanDerWaalsContact O-N 3.07Å; R416-K419 HydrophobicContact CB-CD 4.34Å; R416-K419 HydrophobicContact CB-CG 4.25Å; R416-K419 WeakPolarHBondContact O-CA 3.44Å; R416-K419 WeakPolarHBondContact O-CB 3.5Å; R416-K419 PolarHBondContact O-N 3.01Å
417	I	60.7	Low	64	Low	24 Å²	24	110.7 Å²	110.7	12%	0.123	54%	0.535	C	S	.	.	H	α-helix	trans	-49.5	-37	-175.3	-59	166	0	0	0	112.6	L327 F330 V331 I415 K419 M420	L327-I417 HydrophobicContact CD2-CG2 4Å; F330-I417 HydrophobicContact CB-CD1 3.76Å; F330-I417 HydrophobicContact CB-CG1 4.21Å; V331-I417 HydrophobicContact CG2-CG2 3.88Å; I415-I417 PolarHBondContact O-N 3.13Å; I415-I417 VanDerWaalsContact O-N 3.12Å; I417-K419 PolarHBondContact O-N 3.08Å; I417-M420 WeakPolarHBondContact O-CB 3.21Å; I417-M420 PolarHBondContact O-N 2.99Å; I417-M420 VanDerWaalsContact O-N 3.13Å
418	A	63.1	Low	66.6	Low	90 Å²	90	108.7 Å²	108.7	74%	0.744	52%	0.515	S	S	*	.	H	α-helix	trans	-65.2	-19.3	176.5	0	0	0	0	0	114.4	R416	R416-A418 PolarHBondContact O-N 3.39Å; R416-A418 VanDerWaalsContact O-N 3.07Å
419	K	75.5	Confident	69.2	Low	98 Å²	98	100.4 Å²	100.4	43%	0.426	49%	0.489	S	S	.	.	H	α-helix	trans	-93.5	-9.8	176.1	-64.3	-171.3	173.8	-174.3	0	112.7	R416 I417 S422 Y423	R416-K419 HydrophobicContact CB-CD 4.34Å; R416-K419 HydrophobicContact CB-CG 4.25Å; R416-K419 WeakPolarHBondContact O-CA 3.44Å; R416-K419 WeakPolarHBondContact O-CB 3.5Å; R416-K419 PolarHBondContact O-N 3.01Å; I417-K419 PolarHBondContact O-N 3.08Å; K419-S422 WeakPolarHBondContact O-CB 3.26Å; K419-S422 PolarHBondContact O-N 3.29Å; K419-S422 VanDerWaalsContact O-N 3.14Å; K419-Y423 HydrophobicContact CB-CD2 4.14Å; K419-Y423 HydrophobicContact CB-CE2 3.75Å; K419-Y423 WeakPolarHBondContact O-CD2 3.34Å; K419-Y423 PolarHBondContact O-N 3.15Å
420	M	80.1	Confident	71.6	Confident	33 Å²	33	95 Å²	95	16%	0.163	48%	0.477	C	S	.	.	H	α-helix	trans	-67.7	-46.2	-175.2	-168.3	155	98.5	0	0	112	T326 L327 I415 I417 S422 Y423 A424	T326-M420 HydrophobicContact CG2-CE 4Å; L327-M420 HydrophobicContact CB-CE 4.19Å; L327-M420 HydrophobicContact CD2-CB 3.99Å; L327-M420 HydrophobicContact CD2-CE 3.49Å; L327-M420 VanDerWaalsContact CD2-CE 3.49Å; L327-M420 HydrophobicContact CD2-CG 4.31Å; L327-M420 HydrophobicContact CG-CE 3.42Å; L327-M420 VanDerWaalsContact CG-CE 3.42Å; I415-M420 HydrophobicContact CG2-SD 4.18Å; I417-M420 WeakPolarHBondContact O-CB 3.21Å; I417-M420 PolarHBondContact O-N 2.99Å; I417-M420 VanDerWaalsContact O-N 3.13Å; M420-S422 PolarHBondContact O-N 3.33Å; M420-Y423 PolarHBondContact O-N 3.4Å; M420-Y423 VanDerWaalsContact O-N 3.17Å; M420-A424 WeakPolarHBondContact O-CB 3.4Å; M420-A424 PolarHBondContact O-N 3.29Å
421	D	83.9	Confident	74.4	Confident	21 Å²	21	87.5 Å²	87.5	11%	0.112	45%	0.447	C	S	.	.	H	α-helix	trans	-56.4	-37.8	169.7	-84.3	-35.5	0	0	0	111.2	R275 L327 A424 R425	R275-D421 IonicContact CZ-OD1 2.97Å; R275-D421 IonicContact CZ-OD2 3.84Å; R275-D421 IonicContact NH1-OD1 3.92Å; R275-D421 IonicContact NH1-OD2 3.66Å; R275-D421 IonicContact NH2-OD1 3.55Å; R275-D421 PolarHBondContact NH2-OD1 2.96Å; R275-D421 IonicContact NH2-OD2 2.97Å; R275-D421 PolarHBondContact NH2-OD2 2.99Å; L327-D421 WeakPolarHBondContact CD1-OD1 3.24Å; D421-A424 PolarHBondContact O-N 3.12Å; D421-R425 WeakPolarHBondContact O-CG 3.35Å; D421-R425 PolarHBondContact O-N 3.19Å
422	S	86.1	Confident	77	Confident	63 Å²	63	84.3 Å²	84.3	44%	0.441	41%	0.411	S	S	.	.	H	α-helix	trans	-67.8	-38.3	179.1	-169.7	0	0	0	0	112.9	K419 M420	K419-S422 WeakPolarHBondContact O-CB 3.26Å; K419-S422 PolarHBondContact O-N 3.29Å; K419-S422 VanDerWaalsContact O-N 3.14Å; M420-S422 PolarHBondContact O-N 3.33Å
423	Y	88.3	Confident	79.6	Confident	157 Å²	157	78.9 Å²	78.9	62%	0.616	40%	0.402	S	S	*	.	H	α-helix	trans	-71.1	-42.9	174.8	-69.8	-60.6	0	0	0	111.1	K419 M420 R425 I426 F427	K419-Y423 HydrophobicContact CB-CD2 4.14Å; K419-Y423 HydrophobicContact CB-CE2 3.75Å; K419-Y423 WeakPolarHBondContact O-CD2 3.34Å; K419-Y423 PolarHBondContact O-N 3.15Å; M420-Y423 PolarHBondContact O-N 3.4Å; M420-Y423 VanDerWaalsContact O-N 3.17Å; Y423-R425 VanDerWaalsContact C-N 3.31Å; Y423-R425 PolarHBondContact O-N 3.05Å; Y423-I426 PolarHBondContact O-N 2.92Å; Y423-F427 VanDerWaalsContact O-CB 3.26Å; Y423-F427 WeakPolarHBondContact O-CB 3.49Å; Y423-F427 PolarHBondContact O-N 3.12Å
424	A	90.4	Very high	82.3	Confident	8 Å²	8	77.1 Å²	77.1	7%	0.066	39%	0.394	C	S	.	.	H	α-helix	trans	-59.5	-41	178.9	0	0	0	0	0	112.1	F265 E323 M420 D421 I426 F427 F428	F265-A424 HydrophobicContact CD1-CB 4.11Å; F265-A424 HydrophobicContact CD2-CB 4.35Å; F265-A424 HydrophobicContact CE1-CB 4.1Å; F265-A424 HydrophobicContact CE2-CB 4.33Å; F265-A424 HydrophobicContact CG-CB 4.25Å; F265-A424 HydrophobicContact CZ-CB 4.22Å; E323-A424 HydrophobicContact CG-CB 4.47Å; M420-A424 WeakPolarHBondContact O-CB 3.4Å; M420-A424 PolarHBondContact O-N 3.29Å; D421-A424 PolarHBondContact O-N 3.12Å; A424-I426 PolarHBondContact O-N 2.94Å; A424-F427 PolarHBondContact O-N 3.26Å; A424-F428 HydrophobicContact CB-CD2 4.01Å; A424-F428 HydrophobicContact CB-CE2 4.07Å; A424-F428 WeakPolarHBondContact O-CB 3.32Å; A424-F428 WeakPolarHBondContact O-CD2 3.38Å; A424-F428 PolarHBondContact O-N 3.24Å
425	R	92.3	Very high	84.9	Confident	86 Å²	86	71.2 Å²	71.2	33%	0.325	37%	0.366	S	S	.	.	H	α-helix	trans	-57.7	-29.7	177.2	-75.6	169.7	-162.3	177.6	3.9	114.5	F265 D421 Y423 P429	F265-R425 HydrophobicContact CB-CG 3.88Å; F265-R425 PolarHBondContact O-NE 3.35Å; F265-R425 PolarHBondContact O-NH2 3.05Å; D421-R425 WeakPolarHBondContact O-CG 3.35Å; D421-R425 PolarHBondContact O-N 3.19Å; Y423-R425 VanDerWaalsContact C-N 3.31Å; Y423-R425 PolarHBondContact O-N 3.05Å; R425-P429 VanDerWaalsContact O-CD 3.26Å; R425-P429 WeakPolarHBondContact O-CD 3.42Å; R425-P429 VanDerWaalsContact O-CG 3.31Å; R425-P429 WeakPolarHBondContact O-CG 3.39Å
426	I	92.4	Very high	86.9	Confident	111 Å²	111	67.7 Å²	67.7	57%	0.569	35%	0.348	S	S	*	.	H	α-helix	trans	-96.9	-44.2	-179.9	-60.2	170	0	0	0	110	Y423 A424 T430	Y423-I426 PolarHBondContact O-N 2.92Å; A424-I426 PolarHBondContact O-N 2.94Å; I426-T430 HydrophobicContact CG2-CG2 4.24Å; I426-T430 WeakPolarHBondContact O-CB 3.44Å; I426-T430 VanDerWaalsContact O-CG2 3.22Å; I426-T430 WeakPolarHBondContact O-CG2 3.07Å; I426-T430 PolarHBondContact O-N 3.3Å; I426-T430 PolarHBondContact O-OG1 3.48Å
427	F	93.5	Very high	88.6	Confident	133 Å²	133	65 Å²	65	58%	0.583	35%	0.346	S	S	*	.	H	α-helix	trans	-66.1	-43.9	-174.1	-177.5	-99.8	0	0	0	112.9	Y423 A424 T430 A431	Y423-F427 VanDerWaalsContact O-CB 3.26Å; Y423-F427 WeakPolarHBondContact O-CB 3.49Å; Y423-F427 PolarHBondContact O-N 3.12Å; A424-F427 PolarHBondContact O-N 3.26Å; F427-T430 WeakPolarHBondContact CA-OG1 3.36Å; F427-T430 PolarHBondContact O-N 3.06Å; F427-T430 PolarHBondContact O-OG1 3.34Å; F427-A431 HydrophobicContact CE1-CB 4.42Å; F427-A431 HydrophobicContact CZ-CB 4.46Å; F427-A431 WeakPolarHBondContact O-CB 3.43Å; F427-A431 PolarHBondContact O-N 3.46Å
428	F	94.3	Very high	90.3	Very high	19 Å²	19	67.6 Å²	67.6	8%	0.083	36%	0.363	C	S	.	.	H	α-helix	trans	-64.5	-50.3	-177.2	-84.6	-106.1	0	0	0	112.8	W262 F265 F316 S319 A320 A424 F432	W262-F428 AromaticContact NE1-CD1 3.93Å; F265-F428 HydrophobicContact CE2-CB 4.02Å; F265-F428 HydrophobicContact CE2-CD1 4.11Å; F265-F428 AromaticContact CE2-CD2 3.86Å; F265-F428 HydrophobicContact CE2-CD2 3.86Å; F265-F428 HydrophobicContact CE2-CE2 4.32Å; F265-F428 AromaticContact CE2-CG 3.74Å; F265-F428 HydrophobicContact CE2-CG 3.74Å; F265-F428 HydrophobicContact CZ-CD1 4.01Å; F265-F428 AromaticContact CZ-CD2 3.8Å; F265-F428 HydrophobicContact CZ-CD2 3.8Å; F265-F428 AromaticContact CZ-CE1 3.97Å; F265-F428 HydrophobicContact CZ-CE1 3.97Å; F265-F428 AromaticContact CZ-CE2 3.77Å; F265-F428 HydrophobicContact CZ-CE2 3.77Å; F265-F428 AromaticContact CZ-CG 3.92Å; F265-F428 HydrophobicContact CZ-CG 3.92Å; F265-F428 AromaticContact CZ-CZ 3.86Å; F265-F428 HydrophobicContact CZ-CZ 3.86Å; F316-F428 AromaticContact CD1-CD1 4Å; F316-F428 HydrophobicContact CD1-CD1 4Å; F316-F428 HydrophobicContact CD1-CE1 4.4Å; S319-F428 WeakPolarHBondContact OG-CE1 3.36Å; A320-F428 HydrophobicContact CB-CE1 4.15Å; A424-F428 HydrophobicContact CB-CD2 4.01Å; A424-F428 HydrophobicContact CB-CE2 4.07Å; A424-F428 WeakPolarHBondContact O-CB 3.32Å; A424-F428 WeakPolarHBondContact O-CD2 3.38Å; A424-F428 PolarHBondContact O-N 3.24Å; F428-F432 WeakPolarHBondContact O-CB 3.43Å; F428-F432 PolarHBondContact O-N 2.97Å
429	P	95.1	Very high	91.8	Very high	39 Å²	39	63.6 Å²	63.6	25%	0.253	33%	0.328	S	S	.	.	H	α-helix	trans	-61.5	-44.2	175.1	-25.7	35.3	0	0	0	113.3	W262 R425 F432 C433	W262-P429 HydrophobicContact CD2-CG 4.28Å; W262-P429 HydrophobicContact CE3-CB 4.37Å; W262-P429 HydrophobicContact CE3-CG 3.81Å; W262-P429 HydrophobicContact CH2-CB 4.1Å; W262-P429 HydrophobicContact CH2-CG 4.31Å; W262-P429 HydrophobicContact CZ3-CB 3.86Å; W262-P429 HydrophobicContact CZ3-CG 3.82Å; R425-P429 VanDerWaalsContact O-CD 3.26Å; R425-P429 WeakPolarHBondContact O-CD 3.42Å; R425-P429 VanDerWaalsContact O-CG 3.31Å; R425-P429 WeakPolarHBondContact O-CG 3.39Å; P429-F432 PolarHBondContact O-N 3.47Å; P429-C433 WeakPolarHBondContact O-CB 3.34Å; P429-C433 PolarHBondContact O-N 2.9Å; P429-C433 PolarHBondContact O-SG 2.94Å
430	T	95.1	Very high	92.7	Very high	79 Å²	79	62.2 Å²	62.2	49%	0.485	32%	0.321	S	S	.	.	H	α-helix	trans	-64.1	-44.2	-179.1	50.3	0	0	0	0	111.9	I426 F427 C433 L434	I426-T430 HydrophobicContact CG2-CG2 4.24Å; I426-T430 WeakPolarHBondContact O-CB 3.44Å; I426-T430 VanDerWaalsContact O-CG2 3.22Å; I426-T430 WeakPolarHBondContact O-CG2 3.07Å; I426-T430 PolarHBondContact O-N 3.3Å; I426-T430 PolarHBondContact O-OG1 3.48Å; F427-T430 WeakPolarHBondContact CA-OG1 3.36Å; F427-T430 PolarHBondContact O-N 3.06Å; F427-T430 PolarHBondContact O-OG1 3.34Å; T430-C433 PolarHBondContact O-N 3.43Å; T430-L434 WeakPolarHBondContact O-CB 3.42Å; T430-L434 PolarHBondContact O-N 3.45Å
431	A	96	Very high	93.3	Very high	23 Å²	23	63.8 Å²	63.8	19%	0.19	33%	0.332	C	S	.	.	H	α-helix	trans	-63.4	-41.2	175.8	0	0	0	0	0	112.1	F316 F427 L434 F435	F316-A431 HydrophobicContact CE1-CB 3.99Å; F316-A431 HydrophobicContact CZ-CB 4.03Å; F427-A431 HydrophobicContact CE1-CB 4.42Å; F427-A431 HydrophobicContact CZ-CB 4.46Å; F427-A431 WeakPolarHBondContact O-CB 3.43Å; F427-A431 PolarHBondContact O-N 3.46Å; A431-L434 PolarHBondContact O-N 3.08Å; A431-F435 WeakPolarHBondContact O-CB 3.43Å; A431-F435 PolarHBondContact O-N 3Å
432	F	96.4	Very high	93.7	Very high	8 Å²	8	65 Å²	65	4%	0.035	34%	0.342	C	S	.	.	H	α-helix	trans	-70.1	-38.2	178.4	-172.2	-106.7	0	0	0	112.5	T255 V258 W262 F316 F428 P429 F435 N436	T255-F432 HydrophobicContact CG2-CE1 3.91Å; T255-F432 HydrophobicContact CG2-CZ 4.21Å; V258-F432 HydrophobicContact CB-CE2 4.39Å; V258-F432 HydrophobicContact CB-CZ 4.39Å; V258-F432 HydrophobicContact CG1-CD1 4.48Å; V258-F432 HydrophobicContact CG1-CD2 3.96Å; V258-F432 HydrophobicContact CG1-CE1 4.5Å; V258-F432 HydrophobicContact CG1-CE2 3.99Å; V258-F432 HydrophobicContact CG1-CG 4.22Å; V258-F432 HydrophobicContact CG1-CZ 4.25Å; V258-F432 HydrophobicContact CG2-CE2 4.26Å; W262-F432 HydrophobicContact CH2-CB 3.93Å; W262-F432 AromaticContact CH2-CD1 3.81Å; W262-F432 HydrophobicContact CH2-CD1 3.81Å; W262-F432 HydrophobicContact CH2-CG 4.12Å; W262-F432 HydrophobicContact CZ2-CB 3.66Å; W262-F432 HydrophobicContact CZ2-CD1 4Å; W262-F432 AromaticContact CZ2-CG 3.9Å; W262-F432 HydrophobicContact CZ2-CG 3.9Å; F316-F432 AromaticContact CD2-CD2 3.93Å; F316-F432 HydrophobicContact CD2-CD2 3.93Å; F316-F432 HydrophobicContact CE1-CB 4.45Å; F316-F432 AromaticContact CE2-CD2 3.93Å; F316-F432 HydrophobicContact CE2-CD2 3.93Å; F316-F432 HydrophobicContact CG-CD2 4.47Å; F316-F432 HydrophobicContact CZ-CB 4.29Å; F316-F432 HydrophobicContact CZ-CD2 4.46Å; F428-F432 WeakPolarHBondContact O-CB 3.43Å; F428-F432 PolarHBondContact O-N 2.97Å; P429-F432 PolarHBondContact O-N 3.47Å; F432-F435 HydrophobicContact CD2-CD1 4.36Å; F432-F435 HydrophobicContact CE2-CD1 4.28Å; F432-F435 PolarHBondContact O-N 3.18Å; F432-N436 VanDerWaalsContact CD1-ND2 3.34Å; F432-N436 WeakPolarHBondContact CD1-ND2 3.46Å; F432-N436 WeakPolarHBondContact CE1-ND2 3.32Å; F432-N436 VanDerWaalsContact CZ-ND2 3.28Å; F432-N436 WeakPolarHBondContact CZ-ND2 3.13Å; F432-N436 PolarHBondContact O-N 3.12Å; F432-N436 PolarHBondContact O-ND2 3.35Å
433	C	95.6	Very high	93.8	Very high	83 Å²	83	64.5 Å²	64.5	56%	0.561	33%	0.331	S	S	*	.	H	α-helix	trans	-63	-43.7	173	-73.6	0	0	0	0	111.7	P429 T430 F435 N436 L437	P429-C433 WeakPolarHBondContact O-CB 3.34Å; P429-C433 PolarHBondContact O-N 2.9Å; P429-C433 PolarHBondContact O-SG 2.94Å; T430-C433 PolarHBondContact O-N 3.43Å; C433-F435 VanDerWaalsContact C-N 3.35Å; C433-N436 PolarHBondContact O-N 3.09Å; C433-L437 PolarHBondContact O-N 3.36Å
434	L	96.1	Very high	93.6	Very high	114 Å²	114	61.9 Å²	61.9	60%	0.597	33%	0.327	S	S	*	.	H	α-helix	trans	-60.8	-45.1	175.3	-179	65.8	0	0	0	111.2	T430 A431 N436 L437 V438	T430-L434 WeakPolarHBondContact O-CB 3.42Å; T430-L434 PolarHBondContact O-N 3.45Å; A431-L434 PolarHBondContact O-N 3.08Å; L434-N436 PolarHBondContact O-N 3.44Å; L434-L437 PolarHBondContact O-N 2.96Å; L434-V438 HydrophobicContact CD1-CG2 4.48Å; L434-V438 WeakPolarHBondContact O-CG2 3.25Å; L434-V438 PolarHBondContact O-N 2.94Å
435	F	96.2	Very high	93	Very high	35 Å²	35	70.6 Å²	70.6	15%	0.154	36%	0.36	C	S	.	.	H	α-helix	trans	-57.5	-47.6	175.1	168.4	-105.9	0	0	0	111.9	L308 F309 V312 A431 F432 C433 L437 V438 Y439	L308-F435 HydrophobicContact CD2-CE2 4.2Å; L308-F435 HydrophobicContact CD2-CZ 4.34Å; F309-F435 AromaticContact CD2-CE1 3.64Å; F309-F435 HydrophobicContact CD2-CE1 3.64Å; F309-F435 AromaticContact CD2-CZ 3.99Å; F309-F435 HydrophobicContact CD2-CZ 3.99Å; F309-F435 AromaticContact CE2-CE1 3.83Å; F309-F435 HydrophobicContact CE2-CE1 3.83Å; F309-F435 HydrophobicContact CG-CE1 4.49Å; V312-F435 HydrophobicContact CB-CE1 4.05Å; V312-F435 HydrophobicContact CB-CE2 3.95Å; V312-F435 HydrophobicContact CB-CZ 3.68Å; V312-F435 HydrophobicContact CG1-CD1 3.82Å; V312-F435 HydrophobicContact CG1-CD2 3.86Å; V312-F435 HydrophobicContact CG1-CE1 3.71Å; V312-F435 HydrophobicContact CG1-CE2 3.76Å; V312-F435 HydrophobicContact CG1-CG 3.89Å; V312-F435 HydrophobicContact CG1-CZ 3.69Å; V312-F435 HydrophobicContact CG2-CD2 4.41Å; V312-F435 HydrophobicContact CG2-CE2 3.72Å; V312-F435 HydrophobicContact CG2-CZ 3.88Å; A431-F435 WeakPolarHBondContact O-CB 3.43Å; A431-F435 PolarHBondContact O-N 3Å; F432-F435 HydrophobicContact CD2-CD1 4.36Å; F432-F435 HydrophobicContact CE2-CD1 4.28Å; F432-F435 PolarHBondContact O-N 3.18Å; C433-F435 VanDerWaalsContact C-N 3.35Å; F435-L437 VanDerWaalsContact C-N 3.33Å; F435-L437 PolarHBondContact O-N 3.38Å; F435-V438 PolarHBondContact O-N 3.16Å; F435-Y439 HydrophobicContact CE2-CD2 4.35Å; F435-Y439 AromaticContact CZ-CD2 3.99Å; F435-Y439 HydrophobicContact CZ-CD2 3.99Å; F435-Y439 HydrophobicContact CZ-CG 4.29Å; F435-Y439 WeakPolarHBondContact O-CB 3.43Å; F435-Y439 PolarHBondContact O-N 3.27Å
436	N	95.6	Very high	91.6	Very high	29 Å²	29	75 Å²	75	16%	0.155	39%	0.388	C	S	.	.	H	α-helix	trans	-60.8	-43.5	177.7	-83.3	-85.3	0	0	0	111.7	F432 C433 L434 V438 Y439 W440	F432-N436 VanDerWaalsContact CD1-ND2 3.34Å; F432-N436 WeakPolarHBondContact CD1-ND2 3.46Å; F432-N436 WeakPolarHBondContact CE1-ND2 3.32Å; F432-N436 VanDerWaalsContact CZ-ND2 3.28Å; F432-N436 WeakPolarHBondContact CZ-ND2 3.13Å; F432-N436 PolarHBondContact O-N 3.12Å; F432-N436 PolarHBondContact O-ND2 3.35Å; C433-N436 PolarHBondContact O-N 3.09Å; L434-N436 PolarHBondContact O-N 3.44Å; N436-V438 PolarHBondContact O-N 3.03Å; N436-Y439 PolarHBondContact O-N 3.29Å; N436-W440 WeakPolarHBondContact O-CB 3.22Å; N436-W440 PolarHBondContact O-N 2.78Å; N436-W440 PolarHBondContact OD1-NE1 3Å
437	L	94.8	Very high	91.6	Very high	113 Å²	113	73.2 Å²	73.2	59%	0.592	38%	0.379	S	S	*	.	H	α-helix	trans	-59.6	-48.2	177.8	-175.8	138	0	0	0	111.3	C433 L434 F435 V441	C433-L437 PolarHBondContact O-N 3.36Å; L434-L437 PolarHBondContact O-N 2.96Å; F435-L437 VanDerWaalsContact C-N 3.33Å; F435-L437 PolarHBondContact O-N 3.38Å; L437-V441 VanDerWaalsContact O-CB 3.28Å; L437-V441 WeakPolarHBondContact O-CB 3.4Å; L437-V441 WeakPolarHBondContact O-CG2 3.47Å; L437-V441 PolarHBondContact O-N 3.47Å; L437-V441 VanDerWaalsContact O-N 3.11Å
438	V	95.7	Very high	91.5	Very high	77 Å²	77	70.1 Å²	70.1	47%	0.467	37%	0.369	S	S	.	.	H	α-helix	trans	-63.8	-43.8	177.7	174.6	0	0	0	0	111.2	L434 F435 N436 S442	L434-V438 HydrophobicContact CD1-CG2 4.48Å; L434-V438 WeakPolarHBondContact O-CG2 3.25Å; L434-V438 PolarHBondContact O-N 2.94Å; F435-V438 PolarHBondContact O-N 3.16Å; N436-V438 PolarHBondContact O-N 3.03Å; V438-S442 VanDerWaalsContact O-CB 3.28Å; V438-S442 WeakPolarHBondContact O-CB 3.15Å; V438-S442 PolarHBondContact O-N 3.15Å; V438-S442 PolarHBondContact O-OG 3.33Å
439	Y	94.8	Very high	91.3	Very high	6 Å²	6	72.9 Å²	72.9	2%	0.024	39%	0.385	C	S	.	.	H	α-helix	trans	-62.5	-55.6	-177.7	-178.9	-93.4	0	0	0	111.6	M170 Y251 A305 L308 F309 F435 N436 V441 S442 Y443	M170-Y439 HydrophobicContact CE-CE1 4.07Å; Y251-Y439 AromaticContact CE1-CE1 3.92Å; Y251-Y439 HydrophobicContact CE1-CE1 3.92Å; Y251-Y439 PolarHBondContact OH-OH 3.14Å; A305-Y439 VanDerWaalsContact C-OH 3.3Å; A305-Y439 WeakPolarHBondContact O-CE2 3.47Å; A305-Y439 PolarHBondContact O-OH 2.97Å; L308-Y439 HydrophobicContact CD2-CD2 3.9Å; L308-Y439 HydrophobicContact CD2-CE2 3.93Å; F309-Y439 HydrophobicContact CB-CE1 4.5Å; F309-Y439 HydrophobicContact CB-CE2 3.89Å; F309-Y439 AromaticContact CD2-CD1 3.98Å; F309-Y439 HydrophobicContact CD2-CD1 3.98Å; F309-Y439 HydrophobicContact CD2-CD2 4.33Å; F309-Y439 AromaticContact CD2-CE1 3.91Å; F309-Y439 HydrophobicContact CD2-CE1 3.91Å; F309-Y439 HydrophobicContact CD2-CE2 4.26Å; F309-Y439 HydrophobicContact CD2-CG 4.2Å; F435-Y439 HydrophobicContact CE2-CD2 4.35Å; F435-Y439 AromaticContact CZ-CD2 3.99Å; F435-Y439 HydrophobicContact CZ-CD2 3.99Å; F435-Y439 HydrophobicContact CZ-CG 4.29Å; F435-Y439 WeakPolarHBondContact O-CB 3.43Å; F435-Y439 PolarHBondContact O-N 3.27Å; N436-Y439 PolarHBondContact O-N 3.29Å; Y439-V441 PolarHBondContact O-N 3.07Å; Y439-S442 PolarHBondContact O-N 3.39Å; Y439-Y443 HydrophobicContact CD1-CD2 4.47Å; Y439-Y443 AromaticContact CD2-CD2 3.8Å; Y439-Y443 HydrophobicContact CD2-CD2 3.8Å; Y439-Y443 AromaticContact CD2-CE2 3.69Å; Y439-Y443 HydrophobicContact CD2-CE2 3.69Å; Y439-Y443 HydrophobicContact CE1-CD2 4.32Å; Y439-Y443 AromaticContact CE2-CD2 3.63Å; Y439-Y443 HydrophobicContact CE2-CD2 3.63Å; Y439-Y443 AromaticContact CE2-CE2 3.44Å; Y439-Y443 HydrophobicContact CE2-CE2 3.44Å; Y439-Y443 VanDerWaalsContact CE2-CE2 3.44Å; Y439-Y443 HydrophobicContact CG-CD2 4.21Å; Y439-Y443 AromaticContact CZ-CD2 3.89Å; Y439-Y443 VanDerWaalsContact O-CD2 3.3Å; Y439-Y443 WeakPolarHBondContact O-CD2 3.44Å; Y439-Y443 PolarHBondContact O-N 2.93Å; Y439-Y443 VanDerWaalsContact O-N 3.16Å
440	W	93.6	Very high	91.1	Very high	70 Å²	70	74.9 Å²	74.9	27%	0.265	39%	0.392	S	S	.	.	H	α-helix	trans	-68.9	-34.9	-176.3	-69.2	110.6	0	0	0	112.2	M170 M243 Y251 N436 L444	M170-W440 HydrophobicContact CE-CE3 3.6Å; M170-W440 HydrophobicContact CE-CH2 4.11Å; M170-W440 HydrophobicContact CE-CZ3 3.28Å; M170-W440 HydrophobicContact SD-CZ3 4.5Å; M243-W440 HydrophobicContact CE-CZ3 4.38Å; Y251-W440 HydrophobicContact CD1-CH2 4.39Å; Y251-W440 HydrophobicContact CD1-CZ2 4.14Å; Y251-W440 HydrophobicContact CG-CH2 4.39Å; Y251-W440 HydrophobicContact CG-CZ2 4.38Å; N436-W440 WeakPolarHBondContact O-CB 3.22Å; N436-W440 PolarHBondContact O-N 2.78Å; N436-W440 PolarHBondContact OD1-NE1 3Å; W440-L444 HydrophobicContact CB-CD1 4.33Å; W440-L444 HydrophobicContact CD2-CD1 4.44Å; W440-L444 HydrophobicContact CE3-CD1 3.56Å; W440-L444 HydrophobicContact CE3-CG 4.28Å; W440-L444 HydrophobicContact CZ3-CD1 4.26Å; W440-L444 VanDerWaalsContact O-CB 3.27Å; W440-L444 WeakPolarHBondContact O-CB 3.44Å; W440-L444 PolarHBondContact O-N 3.02Å
441	V	93.8	Very high	90.9	Very high	66 Å²	66	74.6 Å²	74.6	40%	0.4	39%	0.387	S	S	.	.	H	α-helix	trans	-64.4	-44	174.1	172.1	0	0	0	0	111.1	L437 Y439 Y443 Y445 L446	L437-V441 VanDerWaalsContact O-CB 3.28Å; L437-V441 WeakPolarHBondContact O-CB 3.4Å; L437-V441 WeakPolarHBondContact O-CG2 3.47Å; L437-V441 PolarHBondContact O-N 3.47Å; L437-V441 VanDerWaalsContact O-N 3.11Å; Y439-V441 PolarHBondContact O-N 3.07Å; V441-Y443 VanDerWaalsContact C-N 3.34Å; V441-Y443 PolarHBondContact O-N 3.21Å; V441-Y445 WeakPolarHBondContact O-CB 3.37Å; V441-Y445 PolarHBondContact O-N 3.23Å; V441-L446 PolarHBondContact O-N 3.24Å
442	S	91.5	Very high	90.5	Very high	47 Å²	47	78.1 Å²	78.1	33%	0.329	40%	0.4	S	S	.	.	H	α-helix	trans	-68	-29.5	-177.1	-56.2	0	0	0	0	114.3	V438 Y439 L446	V438-S442 VanDerWaalsContact O-CB 3.28Å; V438-S442 WeakPolarHBondContact O-CB 3.15Å; V438-S442 PolarHBondContact O-N 3.15Å; V438-S442 PolarHBondContact O-OG 3.33Å; Y439-S442 PolarHBondContact O-N 3.39Å; S442-L446 WeakPolarHBondContact O-CB 3.29Å; S442-L446 VanDerWaalsContact O-OXT 3.13Å
443	Y	87.8	Confident	90.1	Very high	52 Å²	52	83.1 Å²	83.1	20%	0.204	43%	0.426	C	S	.	.	H	α-helix	trans	-106.3	-16.6	-175.2	-71.2	-72.4	0	0	0	114.7	M170 A305 Y439 V441	M170-Y443 WeakPolarHBondContact SD-CB 3.39Å; M170-Y443 VanDerWaalsContact SD-O 3.39Å; A305-Y443 HydrophobicContact CB-CD1 3.84Å; A305-Y443 HydrophobicContact CB-CD2 4.36Å; A305-Y443 HydrophobicContact CB-CE1 3.4Å; A305-Y443 VanDerWaalsContact CB-CE1 3.4Å; A305-Y443 HydrophobicContact CB-CE2 3.99Å; A305-Y443 HydrophobicContact CB-CG 4.31Å; A305-Y443 VanDerWaalsContact CB-CZ 3.48Å; Y439-Y443 HydrophobicContact CD1-CD2 4.47Å; Y439-Y443 AromaticContact CD2-CD2 3.8Å; Y439-Y443 HydrophobicContact CD2-CD2 3.8Å; Y439-Y443 AromaticContact CD2-CE2 3.69Å; Y439-Y443 HydrophobicContact CD2-CE2 3.69Å; Y439-Y443 HydrophobicContact CE1-CD2 4.32Å; Y439-Y443 AromaticContact CE2-CD2 3.63Å; Y439-Y443 HydrophobicContact CE2-CD2 3.63Å; Y439-Y443 AromaticContact CE2-CE2 3.44Å; Y439-Y443 HydrophobicContact CE2-CE2 3.44Å; Y439-Y443 VanDerWaalsContact CE2-CE2 3.44Å; Y439-Y443 HydrophobicContact CG-CD2 4.21Å; Y439-Y443 AromaticContact CZ-CD2 3.89Å; Y439-Y443 VanDerWaalsContact O-CD2 3.3Å; Y439-Y443 WeakPolarHBondContact O-CD2 3.44Å; Y439-Y443 PolarHBondContact O-N 2.93Å; Y439-Y443 VanDerWaalsContact O-N 3.16Å; V441-Y443 VanDerWaalsContact C-N 3.34Å; V441-Y443 PolarHBondContact O-N 3.21Å
444	L	84.1	Confident	89.7	Confident	101 Å²	101	83.1 Å²	83.1	53%	0.529	42%	0.415	S	S	.	.	H	α-helix	trans	-99.5	-28	174.7	-77.5	160.4	0	0	0	113.8	M170 W440	M170-L444 HydrophobicContact SD-CD2 4.26Å; M170-L444 HydrophobicContact SD-CG 3.97Å; W440-L444 HydrophobicContact CB-CD1 4.33Å; W440-L444 HydrophobicContact CD2-CD1 4.44Å; W440-L444 HydrophobicContact CE3-CD1 3.56Å; W440-L444 HydrophobicContact CE3-CG 4.28Å; W440-L444 HydrophobicContact CZ3-CD1 4.26Å; W440-L444 VanDerWaalsContact O-CB 3.27Å; W440-L444 WeakPolarHBondContact O-CB 3.44Å; W440-L444 PolarHBondContact O-N 3.02Å
445	Y	79.1	Confident	89.1	Confident	192 Å²	192	80.5 Å²	80.5	75%	0.753	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.3	-20.5	-170	-66.8	-84.3	0	0	0	114.7	V441	V441-Y445 WeakPolarHBondContact O-CB 3.37Å; V441-Y445 PolarHBondContact O-N 3.23Å
446	L	62.9	Low	88.5	Confident	178 Å²	178	84.6 Å²	84.6	93%	0.932	42%	0.423	S	S	*	.			trans	-106.3	0	173.4	-82.8	155.4	0	0	0	108.7	V441 S442	V441-L446 PolarHBondContact O-N 3.24Å; S442-L446 WeakPolarHBondContact O-CB 3.29Å; S442-L446 VanDerWaalsContact O-OXT 3.13Å

Retrieved 446 of 446 residues in 2586.4 ms (Link to these results)

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