A0A077Z633_TRITR Loading...

Protein SET

AlphaFold DB , UniProt , Accession A0A077Z633, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 272 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	38.8	Very low	45	Very low	209 Å²	209	127.5 Å²	127.5	100%	1.03	78%	0.776	S	S	*	*				0	108	0	-52.6	-168.3	-170.1	0	0	105.7
2	S	42.4	Very low	45	Very low	86 Å²	86	133.2 Å²	133.2	60%	0.601	78%	0.782	S	S	*	*			cis	-144.1	128	2.5	-65.8	0	0	0	0	106
3	T	50.3	Low	44.7	Very low	76 Å²	76	137.9 Å²	137.9	47%	0.466	79%	0.792	S	S	.	*			trans	-79.4	121.9	160.4	30.2	0	0	0	0	106.4	G5 K122	T3-G5 PolarHBondContact O-N 3.47Å; T3-K122 HydrophobicContact CG2-CD 4.11Å
4	E	44.7	Very low	44.7	Very low	173 Å²	173	143.9 Å²	143.9	81%	0.808	80%	0.795	S	S	*	*			trans	-56.3	89.2	162.3	-77	173.6	120.1	0	0	108.5
5	G	44.4	Very low	44.2	Very low	65 Å²	65	148.6 Å²	148.6	67%	0.67	80%	0.804	S	S	*	*			trans	-69.1	128.3	152.9	0	0	0	0	0	107.2	T3 A7	T3-G5 PolarHBondContact O-N 3.47Å; G5-A7 PolarHBondContact O-N 2.68Å
6	A	49.8	Very low	44.3	Very low	102 Å²	102	147.3 Å²	147.3	84%	0.843	80%	0.802	S	S	*	*			trans	-19.4	118.3	174.2	0	0	0	0	0	113.8	A8	A6-A8 PolarHBondContact O-N 3.42Å
7	A	39.5	Very low	44.1	Very low	102 Å²	102	147.5 Å²	147.5	84%	0.843	80%	0.802	S	S	*	*			trans	-46.6	108.4	178.9	0	0	0	0	0	111.7	G5	G5-A7 PolarHBondContact O-N 2.68Å
8	A	49.4	Very low	43.7	Very low	83 Å²	83	150.4 Å²	150.4	69%	0.686	81%	0.81	S	S	*	*			trans	-61.4	137.7	163.2	0	0	0	0	0	108.5	A6 T10	A6-A8 PolarHBondContact O-N 3.42Å; A8-T10 PolarHBondContact O-N 3.48Å
9	P	45.1	Very low	43.2	Very low	127 Å²	127	145.7 Å²	145.7	83%	0.825	80%	0.8	S	S	*	*			trans	-64.8	112.6	-174	25.2	-32.4	0	0	0	110.5	R11	P9-R11 PolarHBondContact O-N 2.96Å
10	T	39.2	Very low	42.8	Very low	139 Å²	139	146.5 Å²	146.5	85%	0.853	80%	0.803	S	S	*	*			trans	-57.4	109.2	169.5	39.6	0	0	0	0	110.1	A8 K12	A8-T10 PolarHBondContact O-N 3.48Å; T10-K12 PolarHBondContact O-N 3.15Å; T10-K12 VanDerWaalsContact O-N 3.07Å
11	R	51.6	Low	42.6	Very low	241 Å²	241	144.9 Å²	144.9	91%	0.909	80%	0.798	S	S	*	*			trans	-71.6	101.7	176.3	-167.1	175.1	-176.7	-171.8	0.7	109.6	P9 Q13	P9-R11 PolarHBondContact O-N 2.96Å; R11-Q13 PolarHBondContact O-N 3.35Å; R11-Q13 VanDerWaalsContact O-N 3.14Å
12	K	44.9	Very low	42.8	Very low	195 Å²	195	142 Å²	142	85%	0.848	79%	0.787	S	S	*	*			trans	-51	116.5	164.4	-80.3	175.9	176.4	169	0	109.5	T10 R14	T10-K12 PolarHBondContact O-N 3.15Å; T10-K12 VanDerWaalsContact O-N 3.07Å; K12-R14 PolarHBondContact O-N 3.11Å
13	Q	40.7	Very low	43	Very low	195 Å²	195	143.1 Å²	143.1	91%	0.911	79%	0.786	S	S	*	*			trans	-60.5	100.1	166.4	-79	-175.6	-23.5	0	0	109	R11 K15	R11-Q13 PolarHBondContact O-N 3.35Å; R11-Q13 VanDerWaalsContact O-N 3.14Å; Q13-K15 PolarHBondContact O-N 2.6Å
14	R	45.6	Very low	42.9	Very low	222 Å²	222	143.2 Å²	143.2	84%	0.838	79%	0.79	S	S	*	*			trans	-71.6	113.2	157.3	-80.6	174.1	87.2	166.5	2.7	106.3	K12 V16	K12-R14 PolarHBondContact O-N 3.11Å; R14-V16 HydrophobicContact CB-CG2 4.32Å; R14-V16 PolarHBondContact O-N 3.17Å
15	K	37	Very low	43.6	Very low	214 Å²	214	141.8 Å²	141.8	93%	0.93	78%	0.781	S	S	*	*			trans	-53.1	108.7	156.3	-96.7	-179.3	169	-179.4	0	107	Q13	Q13-K15 PolarHBondContact O-N 2.6Å
16	V	44.7	Very low	44.9	Very low	127 Å²	127	145.3 Å²	145.3	77%	0.77	78%	0.784	S	S	*	*			trans	-104.3	127.5	168	-179.7	0	0	0	0	106.7	R14	R14-V16 HydrophobicContact CB-CG2 4.32Å; R14-V16 PolarHBondContact O-N 3.17Å
17	D	41.5	Very low	46.3	Very low	151 Å²	151	146 Å²	146	81%	0.807	77%	0.766	S	S	*	*			trans	-46.9	148.6	178.9	-113.8	-30.2	0	0	0	113.2	G19	D17-G19 PolarHBondContact O-N 2.98Å; D17-G19 VanDerWaalsContact O-N 3.12Å
18	E	37.6	Very low	48.7	Very low	200 Å²	200	145.8 Å²	145.8	94%	0.935	75%	0.751	S	S	*	*	S	Bend	trans	-57.6	107.8	172.4	-67.6	174.2	145.8	0	0	110.3
19	G	34.3	Very low	50.7	Low	61 Å²	61	148.7 Å²	148.7	63%	0.629	75%	0.754	S	S	*	*			trans	-179.2	92	177.3	0	0	0	0	0	111.9	D17	D17-G19 PolarHBondContact O-N 2.98Å; D17-G19 VanDerWaalsContact O-N 3.12Å
20	D	33.9	Very low	52.9	Low	161 Å²	161	150.2 Å²	150.2	86%	0.861	75%	0.75	S	S	*	*			trans	57.4	87	142.5	-145	21.1	0	0	0	116.2
21	T	40.1	Very low	55.6	Low	114 Å²	114	146.1 Å²	146.1	70%	0.699	73%	0.725	S	S	*	*			trans	-176.3	96.2	145.7	18	0	0	0	0	109.5	D23	T21-D23 PolarHBondContact O-N 3.13Å
22	D	42.2	Very low	57.5	Low	147 Å²	147	138.2 Å²	138.2	79%	0.786	70%	0.698	S	S	*	*			trans	-63.7	75.3	149.7	179.4	19.5	0	0	0	107.5	S24	D22-S24 PolarHBondContact OD1-OG 3.47Å
23	D	46.6	Very low	59.9	Low	110 Å²	110	134.7 Å²	134.7	59%	0.588	68%	0.683	S	S	*	*			trans	-96.8	57.4	168.9	-110.1	-13	0	0	0	107	T21 K25	T21-D23 PolarHBondContact O-N 3.13Å; D23-K25 PolarHBondContact O-N 2.78Å
24	S	48.1	Very low	62.5	Low	79 Å²	79	127.4 Å²	127.4	55%	0.552	66%	0.656	S	S	*	*			trans	-62.6	87.3	147.4	52.5	0	0	0	0	105.6	D22 D26	D22-S24 PolarHBondContact OD1-OG 3.47Å; S24-D26 PolarHBondContact O-N 2.95Å
25	K	59.8	Low	64.9	Low	142 Å²	142	120.6 Å²	120.6	62%	0.617	64%	0.636	S	S	*	*			trans	-65.7	84.3	163.8	-73.8	-175.8	-178.6	176.9	0	105.6	D23 Y27	D23-K25 PolarHBondContact O-N 2.78Å; K25-Y27 WeakPolarHBondContact O-CD2 3.41Å; K25-Y27 PolarHBondContact O-N 3.05Å
26	D	71.8	Confident	67.7	Low	139 Å²	139	117 Å²	117	74%	0.743	62%	0.622	S	S	*	*			trans	-58.1	88.2	155.3	-93.9	-18.9	0	0	0	105	S24 D28	S24-D26 PolarHBondContact O-N 2.95Å; D26-D28 PolarHBondContact O-N 2.8Å
27	Y	79.5	Confident	70.2	Confident	118 Å²	118	116 Å²	116	46%	0.463	61%	0.61	S	S	.	*			trans	-48.1	138.5	165.2	-71.8	-67.5	0	0	0	107.2	K25 T31 Q32 L35	K25-Y27 WeakPolarHBondContact O-CD2 3.41Å; K25-Y27 PolarHBondContact O-N 3.05Å; Y27-T31 HydrophobicContact CD1-CG2 3.34Å; Y27-T31 HydrophobicContact CE1-CG2 4.03Å; Y27-T31 HydrophobicContact CG-CG2 3.86Å; Y27-Q32 PolarHBondContact O-NE2 2.91Å; Y27-L35 HydrophobicContact CD1-CD1 4.48Å; Y27-L35 HydrophobicContact CD2-CD1 3.72Å; Y27-L35 HydrophobicContact CE1-CD1 4.47Å; Y27-L35 HydrophobicContact CE2-CD1 3.74Å; Y27-L35 HydrophobicContact CG-CD1 4.11Å
28	D	89.8	Confident	72.9	Confident	96 Å²	96	113.9 Å²	113.9	51%	0.513	60%	0.597	S	S	.	*			trans	-57.5	159.3	170.5	57.1	44.2	0	0	0	110	D26 E30 T31 Q32	D26-D28 PolarHBondContact O-N 2.8Å; D28-E30 PolarHBondContact O-N 2.96Å; D28-E30 VanDerWaalsContact O-N 3.08Å; D28-E30 PolarHBondContact OD1-N 3.21Å; D28-T31 PolarHBondContact O-N 3.4Å; D28-T31 VanDerWaalsContact OD1-CB 3.23Å; D28-T31 WeakPolarHBondContact OD1-CB 3.22Å; D28-T31 PolarHBondContact OD1-N 3.19Å; D28-T31 PolarHBondContact OD1-OG1 3.25Å; D28-Q32 PolarHBondContact O-N 3.23Å
29	L	89.8	Confident	75.8	Confident	144 Å²	144	109.1 Å²	109.1	75%	0.754	58%	0.578	S	S	*	*	H	α-helix	trans	-55.8	-31.7	-175.1	-175.5	66	0	0	0	112.4	K33	L29-K33 WeakPolarHBondContact O-CB 3.25Å; L29-K33 PolarHBondContact O-N 2.92Å; L29-K33 VanDerWaalsContact O-N 3.08Å
30	E	92.6	Very high	78.7	Confident	160 Å²	160	109.3 Å²	109.3	75%	0.748	57%	0.569	S	S	*	*	H	α-helix	trans	-69.3	-44.1	177.9	-174.5	170.1	-166.7	0	0	111.4	D28 K33 A34	D28-E30 PolarHBondContact O-N 2.96Å; D28-E30 VanDerWaalsContact O-N 3.08Å; D28-E30 PolarHBondContact OD1-N 3.21Å; E30-K33 PolarHBondContact O-N 3.35Å; E30-A34 WeakPolarHBondContact O-CB 3.29Å; E30-A34 PolarHBondContact O-N 3.1Å
31	T	94.5	Very high	81.8	Confident	52 Å²	52	104.7 Å²	104.7	32%	0.319	55%	0.549	S	S	.	.	H	α-helix	trans	-69	-39.3	177	-54.9	0	0	0	0	111.6	Y27 D28 K33 A34 L35	Y27-T31 HydrophobicContact CD1-CG2 3.34Å; Y27-T31 HydrophobicContact CE1-CG2 4.03Å; Y27-T31 HydrophobicContact CG-CG2 3.86Å; D28-T31 PolarHBondContact O-N 3.4Å; D28-T31 VanDerWaalsContact OD1-CB 3.23Å; D28-T31 WeakPolarHBondContact OD1-CB 3.22Å; D28-T31 PolarHBondContact OD1-N 3.19Å; D28-T31 PolarHBondContact OD1-OG1 3.25Å; T31-K33 VanDerWaalsContact C-N 3.34Å; T31-K33 PolarHBondContact O-N 2.83Å; T31-A34 PolarHBondContact O-N 3.1Å; T31-L35 HydrophobicContact CG2-CD1 4.4Å; T31-L35 VanDerWaalsContact O-CG 3.32Å; T31-L35 WeakPolarHBondContact O-CG 3.45Å; T31-L35 PolarHBondContact O-N 3.32Å
32	Q	92.8	Very high	84.5	Confident	76 Å²	76	103.5 Å²	103.5	36%	0.355	54%	0.536	S	S	.	.	H	α-helix	trans	-59.7	-46.2	173.6	-68	-176.1	11.8	0	0	111.2	Y27 D28 A34 L35 E36	Y27-Q32 PolarHBondContact O-NE2 2.91Å; D28-Q32 PolarHBondContact O-N 3.23Å; Q32-A34 VanDerWaalsContact C-N 3.35Å; Q32-A34 PolarHBondContact O-N 3.17Å; Q32-L35 PolarHBondContact O-N 3.44Å; Q32-E36 PolarHBondContact O-N 3.33Å
33	K	94.8	Very high	87.2	Confident	120 Å²	120	100.3 Å²	100.3	52%	0.522	52%	0.519	S	S	.	.	H	α-helix	trans	-61.7	-41.9	176.3	-170.7	176.7	-177.4	-86.7	0	112.2	L29 E30 T31 L35 E36 E37	L29-K33 WeakPolarHBondContact O-CB 3.25Å; L29-K33 PolarHBondContact O-N 2.92Å; L29-K33 VanDerWaalsContact O-N 3.08Å; E30-K33 PolarHBondContact O-N 3.35Å; T31-K33 VanDerWaalsContact C-N 3.34Å; T31-K33 PolarHBondContact O-N 2.83Å; K33-L35 VanDerWaalsContact C-N 3.34Å; K33-L35 PolarHBondContact O-N 2.85Å; K33-E36 PolarHBondContact O-N 3.08Å; K33-E37 IonicContact NZ-OE1 3.62Å; K33-E37 PolarHBondContact NZ-OE1 2.91Å; K33-E37 WeakPolarHBondContact O-CG 3.49Å; K33-E37 PolarHBondContact O-N 3.34Å
34	A	96.3	Very high	89.6	Confident	42 Å²	42	101 Å²	101	35%	0.347	52%	0.518	S	S	.	.	H	α-helix	trans	-63.4	-38.9	176.4	0	0	0	0	0	112.2	E30 T31 Q32 E37 I38	E30-A34 WeakPolarHBondContact O-CB 3.29Å; E30-A34 PolarHBondContact O-N 3.1Å; T31-A34 PolarHBondContact O-N 3.1Å; Q32-A34 VanDerWaalsContact C-N 3.35Å; Q32-A34 PolarHBondContact O-N 3.17Å; A34-E37 PolarHBondContact O-N 3.2Å; A34-I38 WeakPolarHBondContact O-CB 3.41Å; A34-I38 WeakPolarHBondContact O-CD1 3.37Å; A34-I38 WeakPolarHBondContact O-CG1 2.88Å; A34-I38 PolarHBondContact O-N 2.95Å
35	L	96.2	Very high	92	Very high	79 Å²	79	100.7 Å²	100.7	41%	0.414	51%	0.51	S	S	.	.	H	α-helix	trans	-64.6	-41	175.4	-70.8	170.3	0	0	0	112.1	Y27 T31 Q32 K33 I38 D39	Y27-L35 HydrophobicContact CD1-CD1 4.48Å; Y27-L35 HydrophobicContact CD2-CD1 3.72Å; Y27-L35 HydrophobicContact CE1-CD1 4.47Å; Y27-L35 HydrophobicContact CE2-CD1 3.74Å; Y27-L35 HydrophobicContact CG-CD1 4.11Å; T31-L35 HydrophobicContact CG2-CD1 4.4Å; T31-L35 VanDerWaalsContact O-CG 3.32Å; T31-L35 WeakPolarHBondContact O-CG 3.45Å; T31-L35 PolarHBondContact O-N 3.32Å; Q32-L35 PolarHBondContact O-N 3.44Å; K33-L35 VanDerWaalsContact C-N 3.34Å; K33-L35 PolarHBondContact O-N 2.85Å; L35-I38 PolarHBondContact O-N 2.87Å; L35-D39 PolarHBondContact O-N 2.94Å
36	E	95.4	Very high	93.8	Very high	138 Å²	138	97.7 Å²	97.7	65%	0.645	50%	0.5	S	S	*	.	H	α-helix	trans	-63.8	-41.1	173.9	-69.7	176	177.3	0	0	112.1	Q32 K33 D39 S40	Q32-E36 PolarHBondContact O-N 3.33Å; K33-E36 PolarHBondContact O-N 3.08Å; E36-D39 PolarHBondContact O-N 2.85Å; E36-S40 PolarHBondContact O-N 3.41Å
37	E	97.2	Very high	95.1	Very high	108 Å²	108	95 Å²	95	51%	0.505	49%	0.486	S	S	.	.	H	α-helix	trans	-65.1	-38.9	175.4	-73.1	176.4	-167.8	0	0	111.8	K33 A34 S40 C41	K33-E37 IonicContact NZ-OE1 3.62Å; K33-E37 PolarHBondContact NZ-OE1 2.91Å; K33-E37 WeakPolarHBondContact O-CG 3.49Å; K33-E37 PolarHBondContact O-N 3.34Å; A34-E37 PolarHBondContact O-N 3.2Å; E37-S40 PolarHBondContact O-N 3.07Å; E37-C41 WeakPolarHBondContact O-CB 3.47Å; E37-C41 PolarHBondContact O-N 3.14Å
38	I	98	Very high	95.9	Very high	105 Å²	105	95.7 Å²	95.7	54%	0.538	49%	0.494	S	S	.	.	H	α-helix	trans	-64	-44.6	173.8	-71.4	164.3	0	0	0	110.8	A34 L35 S40 C41 Q42	A34-I38 WeakPolarHBondContact O-CB 3.41Å; A34-I38 WeakPolarHBondContact O-CD1 3.37Å; A34-I38 WeakPolarHBondContact O-CG1 2.88Å; A34-I38 PolarHBondContact O-N 2.95Å; L35-I38 PolarHBondContact O-N 2.87Å; I38-S40 PolarHBondContact O-N 3.43Å; I38-C41 WeakPolarHBondContact O-CB 3.39Å; I38-C41 PolarHBondContact O-N 3.31Å; I38-Q42 WeakPolarHBondContact O-CB 3.46Å; I38-Q42 PolarHBondContact O-N 3.36Å
39	D	97.1	Very high	96.2	Very high	100 Å²	100	95.4 Å²	95.4	54%	0.535	49%	0.493	S	S	.	.	H	α-helix	trans	-61.4	-44.1	177.8	-172.8	80.7	0	0	0	111.4	L35 E36 C41 Q42 N43	L35-D39 PolarHBondContact O-N 2.94Å; E36-D39 PolarHBondContact O-N 2.85Å; D39-C41 PolarHBondContact O-N 2.86Å; D39-Q42 PolarHBondContact O-N 3.07Å; D39-N43 PolarHBondContact O-N 3.12Å; D39-N43 PolarHBondContact O-ND2 2.67Å; D39-N43 PolarHBondContact OD2-ND2 2.93Å
40	S	97.1	Very high	96.5	Very high	65 Å²	65	94.4 Å²	94.4	46%	0.455	48%	0.484	S	S	.	.	H	α-helix	trans	-59.4	-45.1	174	-170	0	0	0	0	112.1	E36 E37 I38 N43 E44	E36-S40 PolarHBondContact O-N 3.41Å; E37-S40 PolarHBondContact O-N 3.07Å; I38-S40 PolarHBondContact O-N 3.43Å; S40-N43 PolarHBondContact O-N 3.32Å; S40-E44 PolarHBondContact O-N 3.37Å
41	C	97.8	Very high	96.8	Very high	65 Å²	65	94.4 Å²	94.4	44%	0.439	48%	0.478	S	S	.	.	H	α-helix	trans	-63.2	-41.5	177	-174.9	0	0	0	0	111.7	E37 I38 D39 N43 E44 I45	E37-C41 WeakPolarHBondContact O-CB 3.47Å; E37-C41 PolarHBondContact O-N 3.14Å; I38-C41 WeakPolarHBondContact O-CB 3.39Å; I38-C41 PolarHBondContact O-N 3.31Å; D39-C41 PolarHBondContact O-N 2.86Å; C41-N43 VanDerWaalsContact C-N 3.35Å; C41-N43 PolarHBondContact O-N 3.33Å; C41-E44 WeakPolarHBondContact O-CB 3.43Å; C41-E44 PolarHBondContact O-N 2.6Å; C41-I45 WeakPolarHBondContact O-CG1 3.43Å; C41-I45 PolarHBondContact O-N 3.36Å
42	Q	98.1	Very high	96.9	Very high	88 Å²	88	94.1 Å²	94.1	41%	0.411	48%	0.48	S	S	.	.	H	α-helix	trans	-63	-41.6	177.8	-171.3	60.5	55.8	0	0	111.5	I38 D39 E44 I45 D46	I38-Q42 WeakPolarHBondContact O-CB 3.46Å; I38-Q42 PolarHBondContact O-N 3.36Å; D39-Q42 PolarHBondContact O-N 3.07Å; Q42-E44 VanDerWaalsContact C-N 3.3Å; Q42-E44 PolarHBondContact O-N 3.15Å; Q42-I45 PolarHBondContact O-N 2.91Å; Q42-D46 PolarHBondContact NE2-OD1 2.81Å; Q42-D46 VanDerWaalsContact O-CG 3.23Å; Q42-D46 PolarHBondContact O-N 2.66Å
43	N	97.8	Very high	97	Very high	80 Å²	80	92.4 Å²	92.4	43%	0.428	48%	0.477	S	S	.	.	H	α-helix	trans	-60.1	-38.9	174.6	-70.8	-50	0	0	0	112.1	D39 S40 C41 D46 I47	D39-N43 PolarHBondContact O-N 3.12Å; D39-N43 PolarHBondContact O-ND2 2.67Å; D39-N43 PolarHBondContact OD2-ND2 2.93Å; S40-N43 PolarHBondContact O-N 3.32Å; C41-N43 VanDerWaalsContact C-N 3.35Å; C41-N43 PolarHBondContact O-N 3.33Å; N43-D46 PolarHBondContact O-N 2.94Å; N43-I47 WeakPolarHBondContact O-CD1 3.44Å; N43-I47 VanDerWaalsContact O-CG1 3.29Å; N43-I47 WeakPolarHBondContact O-CG1 3.38Å; N43-I47 PolarHBondContact O-N 3.35Å; N43-I47 VanDerWaalsContact O-N 3.13Å
44	E	98.1	Very high	97	Very high	125 Å²	125	91 Å²	91	58%	0.584	47%	0.472	S	S	*	.	H	α-helix	trans	-66.1	-41.6	175.3	-69.8	179.1	-167.9	0	0	112.2	S40 C41 Q42 I47 M48	S40-E44 PolarHBondContact O-N 3.37Å; C41-E44 WeakPolarHBondContact O-CB 3.43Å; C41-E44 PolarHBondContact O-N 2.6Å; Q42-E44 VanDerWaalsContact C-N 3.3Å; Q42-E44 PolarHBondContact O-N 3.15Å; E44-I47 PolarHBondContact O-N 2.89Å; E44-M48 WeakPolarHBondContact O-CG 3.37Å; E44-M48 PolarHBondContact O-N 3.06Å
45	I	98.3	Very high	97	Very high	73 Å²	73	95 Å²	95	37%	0.374	48%	0.484	S	S	.	.	H	α-helix	trans	-61.5	-44.8	175.1	-68.6	167.5	0	0	0	110.8	C41 Q42 I47 M48 N49	C41-I45 WeakPolarHBondContact O-CG1 3.43Å; C41-I45 PolarHBondContact O-N 3.36Å; Q42-I45 PolarHBondContact O-N 2.91Å; I45-I47 VanDerWaalsContact C-N 3.33Å; I45-I47 PolarHBondContact O-N 3.05Å; I45-M48 WeakPolarHBondContact O-CB 3.49Å; I45-M48 PolarHBondContact O-N 2.71Å; I45-M48 VanDerWaalsContact O-N 3.12Å; I45-N49 WeakPolarHBondContact CG2-ND2 3.18Å; I45-N49 PolarHBondContact O-N 2.8Å; I45-N49 PolarHBondContact O-ND2 3.08Å
46	D	97.9	Very high	97	Very high	78 Å²	78	96 Å²	96	42%	0.417	49%	0.488	S	S	.	.	H	α-helix	trans	-62.8	-40.8	-179.5	-68.1	-11.7	0	0	0	111.2	Q42 N43 M48 N49 E50	Q42-D46 PolarHBondContact NE2-OD1 2.81Å; Q42-D46 VanDerWaalsContact O-CG 3.23Å; Q42-D46 PolarHBondContact O-N 2.66Å; N43-D46 PolarHBondContact O-N 2.94Å; D46-M48 VanDerWaalsContact C-N 3.35Å; D46-M48 PolarHBondContact O-N 3.5Å; D46-N49 PolarHBondContact O-N 2.62Å; D46-E50 PolarHBondContact O-N 3.22Å
47	I	97.6	Very high	97	Very high	84 Å²	84	90.5 Å²	90.5	43%	0.431	46%	0.463	S	S	.	.	H	α-helix	trans	-62.2	-41.3	173.2	-68.3	165.2	0	0	0	111.2	N43 E44 I45 E50 R51	N43-I47 WeakPolarHBondContact O-CD1 3.44Å; N43-I47 VanDerWaalsContact O-CG1 3.29Å; N43-I47 WeakPolarHBondContact O-CG1 3.38Å; N43-I47 PolarHBondContact O-N 3.35Å; N43-I47 VanDerWaalsContact O-N 3.13Å; E44-I47 PolarHBondContact O-N 2.89Å; I45-I47 VanDerWaalsContact C-N 3.33Å; I45-I47 PolarHBondContact O-N 3.05Å; I47-E50 PolarHBondContact O-N 3.06Å; I47-R51 WeakPolarHBondContact O-CG 3.33Å; I47-R51 PolarHBondContact O-N 3.37Å; I47-R51 VanDerWaalsContact O-N 3.13Å
48	M	97.1	Very high	96.9	Very high	131 Å²	131	91.3 Å²	91.3	65%	0.645	47%	0.465	S	S	*	.	H	α-helix	trans	-64.5	-43.1	176.6	-73.7	-165.8	70.6	0	0	111.9	E44 I45 D46 E50 R51 A52	E44-M48 WeakPolarHBondContact O-CG 3.37Å; E44-M48 PolarHBondContact O-N 3.06Å; I45-M48 WeakPolarHBondContact O-CB 3.49Å; I45-M48 PolarHBondContact O-N 2.71Å; I45-M48 VanDerWaalsContact O-N 3.12Å; D46-M48 VanDerWaalsContact C-N 3.35Å; D46-M48 PolarHBondContact O-N 3.5Å; M48-E50 PolarHBondContact O-N 2.81Å; M48-R51 PolarHBondContact O-N 3.16Å; M48-A52 PolarHBondContact O-N 3.16Å
49	N	96.7	Very high	96.8	Very high	90 Å²	90	90.1 Å²	90.1	48%	0.481	46%	0.462	S	S	.	.	H	α-helix	trans	-63.7	-39.5	177.7	-72.4	-28.5	0	0	0	112.3	I45 D46 A52 S53	I45-N49 WeakPolarHBondContact CG2-ND2 3.18Å; I45-N49 PolarHBondContact O-N 2.8Å; I45-N49 PolarHBondContact O-ND2 3.08Å; D46-N49 PolarHBondContact O-N 2.62Å; N49-A52 PolarHBondContact O-N 3.01Å; N49-S53 WeakPolarHBondContact O-CB 3.47Å; N49-S53 PolarHBondContact O-N 3.21Å; N49-S53 PolarHBondContact O-OG 2.96Å
50	E	96.2	Very high	96.7	Very high	124 Å²	124	89.4 Å²	89.4	58%	0.579	46%	0.456	S	S	*	.	H	α-helix	trans	-61.9	-47.1	175.1	-174.6	171	-154.2	0	0	110.9	D46 I47 M48 A52 S53 E54	D46-E50 PolarHBondContact O-N 3.22Å; I47-E50 PolarHBondContact O-N 3.06Å; M48-E50 PolarHBondContact O-N 2.81Å; E50-A52 PolarHBondContact O-N 2.81Å; E50-S53 PolarHBondContact O-N 2.86Å; E50-E54 WeakPolarHBondContact O-CG 3.26Å; E50-E54 PolarHBondContact O-N 3.34Å
51	R	96.9	Very high	96.7	Very high	160 Å²	160	88.7 Å²	88.7	60%	0.604	45%	0.445	S	S	*	.	H	α-helix	trans	-60.4	-46	176.6	-70.9	177.3	-174.6	174.8	4.7	112.4	I47 M48 S53 E54 E55	I47-R51 WeakPolarHBondContact O-CG 3.33Å; I47-R51 PolarHBondContact O-N 3.37Å; I47-R51 VanDerWaalsContact O-N 3.13Å; M48-R51 PolarHBondContact O-N 3.16Å; R51-S53 VanDerWaalsContact C-N 3.32Å; R51-S53 PolarHBondContact O-N 3.13Å; R51-E54 PolarHBondContact O-N 3.15Å; R51-E55 WeakPolarHBondContact O-CG 3.45Å; R51-E55 PolarHBondContact O-N 2.99Å
52	A	97.3	Very high	96.6	Very high	46 Å²	46	91.6 Å²	91.6	38%	0.38	45%	0.451	S	S	.	.	H	α-helix	trans	-59.5	-44.2	176.6	0	0	0	0	0	111.4	M48 N49 E50 E54 E55 I56	M48-A52 PolarHBondContact O-N 3.16Å; N49-A52 PolarHBondContact O-N 3.01Å; E50-A52 PolarHBondContact O-N 2.81Å; A52-E54 VanDerWaalsContact C-N 3.33Å; A52-E54 PolarHBondContact O-N 3.5Å; A52-E55 PolarHBondContact O-N 2.84Å; A52-I56 WeakPolarHBondContact O-CG1 3.32Å; A52-I56 PolarHBondContact O-N 2.85Å
53	S	95.2	Very high	96.5	Very high	40 Å²	40	93.1 Å²	93.1	28%	0.28	45%	0.453	S	S	.	.	H	α-helix	trans	-63.9	-36.1	177.8	-59.1	0	0	0	0	112.6	N49 E50 R51 L57	N49-S53 WeakPolarHBondContact O-CB 3.47Å; N49-S53 PolarHBondContact O-N 3.21Å; N49-S53 PolarHBondContact O-OG 2.96Å; E50-S53 PolarHBondContact O-N 2.86Å; R51-S53 VanDerWaalsContact C-N 3.32Å; R51-S53 PolarHBondContact O-N 3.13Å; S53-L57 WeakPolarHBondContact O-CB 3.45Å; S53-L57 PolarHBondContact O-N 3.31Å; S53-L57 VanDerWaalsContact O-N 3.12Å
54	E	94.7	Very high	96.3	Very high	89 Å²	89	90.7 Å²	90.7	42%	0.416	44%	0.44	S	S	.	.	H	α-helix	trans	-69.3	-39.3	174.4	-73.5	-173.8	170.9	0	0	113	E50 R51 A52 L57 K58	E50-E54 WeakPolarHBondContact O-CG 3.26Å; E50-E54 PolarHBondContact O-N 3.34Å; R51-E54 PolarHBondContact O-N 3.15Å; A52-E54 VanDerWaalsContact C-N 3.33Å; A52-E54 PolarHBondContact O-N 3.5Å; E54-L57 PolarHBondContact O-N 2.55Å; E54-K58 WeakPolarHBondContact O-CG 3.47Å; E54-K58 PolarHBondContact O-N 2.75Å; E54-K58 VanDerWaalsContact O-N 3.09Å
55	E	96.9	Very high	96.2	Very high	127 Å²	127	91 Å²	91	59%	0.593	44%	0.44	S	S	*	.	H	α-helix	trans	-67.6	-45.9	177.5	-73.7	-177.3	-160.6	0	0	111.8	R51 A52 L57 K58 V59	R51-E55 WeakPolarHBondContact O-CG 3.45Å; R51-E55 PolarHBondContact O-N 2.99Å; A52-E55 PolarHBondContact O-N 2.84Å; E55-L57 VanDerWaalsContact C-N 3.29Å; E55-L57 PolarHBondContact O-N 3.48Å; E55-K58 PolarHBondContact O-N 3.27Å; E55-V59 WeakPolarHBondContact O-CG2 3.44Å; E55-V59 PolarHBondContact O-N 2.65Å
56	I	96.2	Very high	96.1	Very high	99 Å²	99	91.9 Å²	91.9	51%	0.508	45%	0.445	S	S	.	.	H	α-helix	trans	-56.1	-47	173.7	-69.3	167.5	0	0	0	110.1	A52 K58 V59 E60	A52-I56 WeakPolarHBondContact O-CG1 3.32Å; A52-I56 PolarHBondContact O-N 2.85Å; I56-K58 VanDerWaalsContact C-N 3.33Å; I56-K58 PolarHBondContact O-N 2.93Å; I56-V59 WeakPolarHBondContact O-CA 3.41Å; I56-V59 WeakPolarHBondContact O-CB 3.44Å; I56-V59 PolarHBondContact O-N 2.88Å; I56-E60 HydrophobicContact CG2-CG 4.34Å; I56-E60 WeakPolarHBondContact O-CG 3.27Å; I56-E60 PolarHBondContact O-N 2.67Å
57	L	94.2	Very high	96.1	Very high	24 Å²	24	93 Å²	93	13%	0.126	44%	0.443	C	S	.	.	H	α-helix	trans	-58.3	-43.9	178.5	-175.8	70.3	0	0	0	112.4	S53 E54 E55 V59 E60 Q61 D120 I121 K122	S53-L57 WeakPolarHBondContact O-CB 3.45Å; S53-L57 PolarHBondContact O-N 3.31Å; S53-L57 VanDerWaalsContact O-N 3.12Å; E54-L57 PolarHBondContact O-N 2.55Å; E55-L57 VanDerWaalsContact C-N 3.29Å; E55-L57 PolarHBondContact O-N 3.48Å; L57-V59 VanDerWaalsContact C-N 3.27Å; L57-V59 PolarHBondContact O-N 2.9Å; L57-E60 PolarHBondContact O-N 3.13Å; L57-Q61 HydrophobicContact CG-CG 4.4Å; L57-Q61 WeakPolarHBondContact O-CB 3.42Å; L57-Q61 VanDerWaalsContact O-CG 3.28Å; L57-Q61 WeakPolarHBondContact O-CG 2.91Å; L57-Q61 PolarHBondContact O-N 2.87Å; L57-D120 WeakPolarHBondContact CD1-O 3.26Å; L57-I121 HydrophobicContact CD1-CB 4.01Å; L57-I121 HydrophobicContact CD1-CG2 4.37Å; L57-K122 HydrophobicContact CD1-CD 4.2Å; L57-K122 HydrophobicContact CD1-CG 3.67Å; L57-K122 HydrophobicContact CD2-CD 3.85Å; L57-K122 HydrophobicContact CD2-CG 4.16Å
58	K	95.8	Very high	96	Very high	125 Å²	125	94.1 Å²	94.1	54%	0.543	45%	0.445	S	S	.	.	H	α-helix	trans	-62.1	-38	177.7	-72.6	166.9	-172.7	162.1	0	111.3	E54 E55 I56 K62	E54-K58 WeakPolarHBondContact O-CG 3.47Å; E54-K58 PolarHBondContact O-N 2.75Å; E54-K58 VanDerWaalsContact O-N 3.09Å; E55-K58 PolarHBondContact O-N 3.27Å; I56-K58 VanDerWaalsContact C-N 3.33Å; I56-K58 PolarHBondContact O-N 2.93Å; K58-K62 WeakPolarHBondContact O-CB 3.39Å; K58-K62 PolarHBondContact O-N 2.72Å
59	V	96.7	Very high	96	Very high	79 Å²	79	91.4 Å²	91.4	48%	0.479	44%	0.437	S	S	.	.	H	α-helix	trans	-64.3	-48.6	174.9	173.2	0	0	0	0	110.4	E55 I56 L57 Q61 K62 Y63	E55-V59 WeakPolarHBondContact O-CG2 3.44Å; E55-V59 PolarHBondContact O-N 2.65Å; I56-V59 WeakPolarHBondContact O-CA 3.41Å; I56-V59 WeakPolarHBondContact O-CB 3.44Å; I56-V59 PolarHBondContact O-N 2.88Å; L57-V59 VanDerWaalsContact C-N 3.27Å; L57-V59 PolarHBondContact O-N 2.9Å; V59-Q61 PolarHBondContact O-N 3.42Å; V59-K62 WeakPolarHBondContact O-CB 3.41Å; V59-K62 PolarHBondContact O-N 3.27Å; V59-Y63 HydrophobicContact CG1-CD2 3.7Å; V59-Y63 HydrophobicContact CG1-CE2 3.86Å; V59-Y63 WeakPolarHBondContact O-CD2 3.44Å; V59-Y63 PolarHBondContact O-N 3.44Å
60	E	95	Very high	96	Very high	86 Å²	86	95.2 Å²	95.2	40%	0.402	45%	0.446	S	S	.	.	H	α-helix	trans	-58.9	-46.5	177.4	-68.6	179.6	156.1	0	0	111.6	I56 L57 K62 Y63 N64 I121	I56-E60 HydrophobicContact CG2-CG 4.34Å; I56-E60 WeakPolarHBondContact O-CG 3.27Å; I56-E60 PolarHBondContact O-N 2.67Å; L57-E60 PolarHBondContact O-N 3.13Å; E60-K62 VanDerWaalsContact C-N 3.33Å; E60-K62 PolarHBondContact O-N 2.73Å; E60-Y63 PolarHBondContact O-N 2.98Å; E60-N64 VanDerWaalsContact O-CB 3.31Å; E60-N64 WeakPolarHBondContact O-CB 3.18Å; E60-N64 PolarHBondContact O-N 3.19Å; E60-I121 HydrophobicContact CB-CD1 3.47Å; E60-I121 VanDerWaalsContact CB-CD1 3.47Å
61	Q	95.6	Very high	96.1	Very high	50 Å²	50	91.2 Å²	91.2	23%	0.234	43%	0.426	C	S	.	.	H	α-helix	trans	-59.8	-42.1	177.3	-73.5	174.4	-4.2	0	0	112	L57 V59 K65 D120 I121	L57-Q61 HydrophobicContact CG-CG 4.4Å; L57-Q61 WeakPolarHBondContact O-CB 3.42Å; L57-Q61 VanDerWaalsContact O-CG 3.28Å; L57-Q61 WeakPolarHBondContact O-CG 2.91Å; L57-Q61 PolarHBondContact O-N 2.87Å; V59-Q61 PolarHBondContact O-N 3.42Å; Q61-K65 WeakPolarHBondContact O-CG 3.43Å; Q61-K65 PolarHBondContact O-N 3.25Å; Q61-D120 PolarHBondContact NE2-O 3.27Å; Q61-D120 VanDerWaalsContact NE2-O 3.13Å; Q61-I121 HydrophobicContact CB-CD1 4.32Å; Q61-I121 HydrophobicContact CG-CD1 3.84Å; Q61-I121 HydrophobicContact CG-CG1 4.02Å; Q61-I121 VanDerWaalsContact N-CD1 3.29Å
62	K	96.4	Very high	96.1	Very high	126 Å²	126	88.3 Å²	88.3	55%	0.548	42%	0.42	S	S	.	.	H	α-helix	trans	-60.7	-51	175	176.5	-176.5	175.6	-177.2	0	110.7	K58 V59 E60 K65 L66	K58-K62 WeakPolarHBondContact O-CB 3.39Å; K58-K62 PolarHBondContact O-N 2.72Å; V59-K62 WeakPolarHBondContact O-CB 3.41Å; V59-K62 PolarHBondContact O-N 3.27Å; E60-K62 VanDerWaalsContact C-N 3.33Å; E60-K62 PolarHBondContact O-N 2.73Å; K62-K65 PolarHBondContact O-N 3.08Å; K62-L66 HydrophobicContact CG-CD1 4.07Å; K62-L66 WeakPolarHBondContact O-CG 3.29Å; K62-L66 PolarHBondContact O-N 3.42Å; K62-L66 VanDerWaalsContact O-N 3.09Å
63	Y	96.1	Very high	96.1	Very high	120 Å²	120	92.7 Å²	92.7	47%	0.471	43%	0.43	S	S	.	.	H	α-helix	trans	-74.2	-29.9	-175.8	-80.5	-75.3	0	0	0	113.3	V59 E60 K65 L66 R67	V59-Y63 HydrophobicContact CG1-CD2 3.7Å; V59-Y63 HydrophobicContact CG1-CE2 3.86Å; V59-Y63 WeakPolarHBondContact O-CD2 3.44Å; V59-Y63 PolarHBondContact O-N 3.44Å; E60-Y63 PolarHBondContact O-N 2.98Å; Y63-K65 VanDerWaalsContact C-N 3.35Å; Y63-K65 PolarHBondContact O-N 3.34Å; Y63-L66 HydrophobicContact CD1-CD1 4.15Å; Y63-L66 HydrophobicContact CE1-CD1 4.29Å; Y63-L66 PolarHBondContact O-N 2.88Å; Y63-R67 WeakPolarHBondContact O-CB 3.29Å; Y63-R67 VanDerWaalsContact O-CG 3.25Å; Y63-R67 WeakPolarHBondContact O-CG 3.35Å; Y63-R67 PolarHBondContact O-N 3.4Å
64	N	93.8	Very high	96.3	Very high	28 Å²	28	93 Å²	93	15%	0.15	43%	0.425	C	S	.	.	H	α-helix	trans	-58.5	-47.9	171.2	-179.8	-79.4	0	0	0	110.7	E60 L66 R67 K68 E117 I121	E60-N64 VanDerWaalsContact O-CB 3.31Å; E60-N64 WeakPolarHBondContact O-CB 3.18Å; E60-N64 PolarHBondContact O-N 3.19Å; N64-L66 PolarHBondContact O-N 2.97Å; N64-R67 PolarHBondContact O-N 3.09Å; N64-K68 PolarHBondContact O-N 3.17Å; N64-K68 VanDerWaalsContact O-N 3.15Å; N64-E117 VanDerWaalsContact ND2-CD 3.32Å; N64-E117 PolarHBondContact ND2-OE1 3.36Å; N64-I121 HydrophobicContact CB-CD1 4.17Å
65	K	94.9	Very high	96.4	Very high	133 Å²	133	89 Å²	89	58%	0.578	41%	0.407	S	S	*	.	H	α-helix	trans	-61.1	-42	174.7	-69.8	174.6	-177.1	174.1	0	112.7	Q61 K62 Y63 P69	Q61-K65 WeakPolarHBondContact O-CG 3.43Å; Q61-K65 PolarHBondContact O-N 3.25Å; K62-K65 PolarHBondContact O-N 3.08Å; Y63-K65 VanDerWaalsContact C-N 3.35Å; Y63-K65 PolarHBondContact O-N 3.34Å; K65-P69 WeakPolarHBondContact O-CD 3.33Å
66	L	97	Very high	96.4	Very high	90 Å²	90	87.9 Å²	87.9	47%	0.471	40%	0.401	S	S	.	.	H	α-helix	trans	-69.4	-31.2	178	-68.7	174.3	0	0	0	113	K62 Y63 N64 P69 Y70	K62-L66 HydrophobicContact CG-CD1 4.07Å; K62-L66 WeakPolarHBondContact O-CG 3.29Å; K62-L66 PolarHBondContact O-N 3.42Å; K62-L66 VanDerWaalsContact O-N 3.09Å; Y63-L66 HydrophobicContact CD1-CD1 4.15Å; Y63-L66 HydrophobicContact CE1-CD1 4.29Å; Y63-L66 PolarHBondContact O-N 2.88Å; N64-L66 PolarHBondContact O-N 2.97Å; L66-P69 WeakPolarHBondContact O-CD 3.17Å; L66-Y70 VanDerWaalsContact O-CD2 3.28Å; L66-Y70 WeakPolarHBondContact O-CD2 3.33Å
67	R	97	Very high	96.5	Very high	103 Å²	103	87.5 Å²	87.5	39%	0.389	40%	0.4	S	S	.	.	H	α-helix	trans	-73.9	-31.8	177.6	-76.6	-173.7	-64	-126.7	8.6	112.7	Y63 N64 Y70 F71 E117	Y63-R67 WeakPolarHBondContact O-CB 3.29Å; Y63-R67 VanDerWaalsContact O-CG 3.25Å; Y63-R67 WeakPolarHBondContact O-CG 3.35Å; Y63-R67 PolarHBondContact O-N 3.4Å; N64-R67 PolarHBondContact O-N 3.09Å; R67-Y70 WeakPolarHBondContact O-CA 3.19Å; R67-Y70 WeakPolarHBondContact O-CB 3.42Å; R67-Y70 PolarHBondContact O-N 2.87Å; R67-F71 HydrophobicContact CB-CD2 4Å; R67-F71 HydrophobicContact CB-CE2 3.66Å; R67-F71 HydrophobicContact CB-CZ 4.32Å; R67-F71 HydrophobicContact CG-CE2 4.43Å; R67-F71 PolarHBondContact O-N 3.35Å; R67-E117 IonicContact NH2-OE1 3.25Å
68	K	95.4	Very high	96.7	Very high	106 Å²	106	86.9 Å²	86.9	46%	0.461	40%	0.397	S	S	.	.	H	α-helix	trans	-49.3	-49.2	-173.7	-175.8	171.9	-175	165.4	0	114.5	N64 Y70 F71 E72	N64-K68 PolarHBondContact O-N 3.17Å; N64-K68 VanDerWaalsContact O-N 3.15Å; K68-Y70 VanDerWaalsContact C-N 3.27Å; K68-Y70 PolarHBondContact O-N 2.94Å; K68-F71 PolarHBondContact O-N 2.88Å; K68-E72 WeakPolarHBondContact CE-OE1 3.38Å; K68-E72 WeakPolarHBondContact O-CG 3.49Å; K68-E72 PolarHBondContact O-N 2.89Å
69	P	97.5	Very high	96.7	Very high	74 Å²	74	86.4 Å²	86.4	48%	0.481	40%	0.395	S	S	.	.	H	α-helix	trans	-63.2	-30.2	177.7	-22.2	34.2	0	0	0	113.9	K65 L66 K73	K65-P69 WeakPolarHBondContact O-CD 3.33Å; L66-P69 WeakPolarHBondContact O-CD 3.17Å; P69-K73 VanDerWaalsContact O-CB 3.32Å; P69-K73 WeakPolarHBondContact O-CB 3.5Å; P69-K73 PolarHBondContact O-N 2.79Å
70	Y	97.9	Very high	96.7	Very high	170 Å²	170	90.1 Å²	90.1	67%	0.667	41%	0.405	S	S	*	.	H	α-helix	trans	-75.1	-37.4	177.1	-64.3	-87.1	0	0	0	111.6	L66 R67 K68 K73 R74	L66-Y70 VanDerWaalsContact O-CD2 3.28Å; L66-Y70 WeakPolarHBondContact O-CD2 3.33Å; R67-Y70 WeakPolarHBondContact O-CA 3.19Å; R67-Y70 WeakPolarHBondContact O-CB 3.42Å; R67-Y70 PolarHBondContact O-N 2.87Å; K68-Y70 VanDerWaalsContact C-N 3.27Å; K68-Y70 PolarHBondContact O-N 2.94Å; Y70-K73 PolarHBondContact O-N 3.21Å; Y70-R74 WeakPolarHBondContact O-CB 3.26Å; Y70-R74 PolarHBondContact O-N 3.04Å
71	F	97.6	Very high	96.7	Very high	40 Å²	40	89.3 Å²	89.3	18%	0.175	40%	0.402	C	S	.	.	H	α-helix	trans	-64.8	-42.6	171.8	-70.3	-44.6	0	0	0	112	R67 K68 R74 N75 W214	R67-F71 HydrophobicContact CB-CD2 4Å; R67-F71 HydrophobicContact CB-CE2 3.66Å; R67-F71 HydrophobicContact CB-CZ 4.32Å; R67-F71 HydrophobicContact CG-CE2 4.43Å; R67-F71 PolarHBondContact O-N 3.35Å; K68-F71 PolarHBondContact O-N 2.88Å; F71-R74 WeakPolarHBondContact O-CB 3.36Å; F71-R74 PolarHBondContact O-N 3.42Å; F71-N75 PolarHBondContact O-N 3.03Å; F71-W214 HydrophobicContact CB-CZ2 4.05Å; F71-W214 HydrophobicContact CD1-CZ2 4.04Å; F71-W214 HydrophobicContact CD2-CZ2 4.43Å; F71-W214 AromaticContact CE1-NE1 3.8Å; F71-W214 AromaticContact CE2-NE1 3.74Å; F71-W214 AromaticContact CG-CZ2 3.95Å; F71-W214 HydrophobicContact CG-CZ2 3.95Å; F71-W214 AromaticContact CZ-NE1 3.63Å
72	E	96.6	Very high	96.7	Very high	100 Å²	100	92 Å²	92	47%	0.467	42%	0.424	S	S	.	.	H	α-helix	trans	-60.7	-46.2	173.9	-71.4	172.3	-176.8	0	0	111.4	K68 R74 N75 E76	K68-E72 WeakPolarHBondContact CE-OE1 3.38Å; K68-E72 WeakPolarHBondContact O-CG 3.49Å; K68-E72 PolarHBondContact O-N 2.89Å; E72-R74 VanDerWaalsContact C-N 3.32Å; E72-R74 PolarHBondContact O-N 2.82Å; E72-N75 WeakPolarHBondContact O-CB 3.31Å; E72-N75 PolarHBondContact O-N 2.84Å; E72-E76 PolarHBondContact O-N 3.12Å; E72-E76 VanDerWaalsContact O-N 3.09Å
73	K	98.1	Very high	96.7	Very high	138 Å²	138	89.7 Å²	89.7	60%	0.6	42%	0.417	S	S	*	.	H	α-helix	trans	-59.3	-41.7	173.9	-177.1	-180	178.5	-177.2	0	112	P69 Y70 N75 E76 L77	P69-K73 VanDerWaalsContact O-CB 3.32Å; P69-K73 WeakPolarHBondContact O-CB 3.5Å; P69-K73 PolarHBondContact O-N 2.79Å; Y70-K73 PolarHBondContact O-N 3.21Å; K73-N75 VanDerWaalsContact C-N 3.35Å; K73-E76 PolarHBondContact O-N 3.44Å; K73-L77 WeakPolarHBondContact O-CG 3.33Å; K73-L77 PolarHBondContact O-N 3.31Å
74	R	98.2	Very high	96.8	Very high	45 Å²	45	84.4 Å²	84.4	17%	0.17	40%	0.397	C	S	.	.	H	α-helix	trans	-61.7	-43.2	175.9	-174.3	-177	70.5	-175.9	4.5	110.9	Y70 F71 E72 E76 L77 I78 W214 P215 P217	Y70-R74 WeakPolarHBondContact O-CB 3.26Å; Y70-R74 PolarHBondContact O-N 3.04Å; F71-R74 WeakPolarHBondContact O-CB 3.36Å; F71-R74 PolarHBondContact O-N 3.42Å; E72-R74 VanDerWaalsContact C-N 3.32Å; E72-R74 PolarHBondContact O-N 2.82Å; R74-E76 VanDerWaalsContact C-N 3.34Å; R74-E76 PolarHBondContact O-N 2.86Å; R74-L77 WeakPolarHBondContact O-CB 3.35Å; R74-L77 PolarHBondContact O-N 3.18Å; R74-L77 VanDerWaalsContact O-N 3.08Å; R74-I78 HydrophobicContact CG-CD1 3.8Å; R74-I78 HydrophobicContact CG-CG1 4.29Å; R74-I78 WeakPolarHBondContact O-CG1 3.32Å; R74-I78 PolarHBondContact O-N 2.91Å; R74-W214 PolarHBondContact NH1-O 2.94Å; R74-W214 VanDerWaalsContact NH2-CE2 3.32Å; R74-W214 VanDerWaalsContact NH2-CH2 3.29Å; R74-W214 PolarHBondContact NH2-O 3.43Å; R74-P215 PolarHBondContact NH1-O 3.46Å; R74-P215 VanDerWaalsContact NH1-O 3.13Å; R74-P217 VanDerWaalsContact NH1-CD 3.26Å
75	N	97	Very high	97	Very high	6 Å²	6	83.2 Å²	83.2	3%	0.032	39%	0.39	C	S	.	.	H	α-helix	trans	-59.2	-42.8	176.5	-74.5	-11	0	0	0	111.7	F71 E72 K73 L77 I78 K79 K112 E114	F71-N75 PolarHBondContact O-N 3.03Å; E72-N75 WeakPolarHBondContact O-CB 3.31Å; E72-N75 PolarHBondContact O-N 2.84Å; K73-N75 VanDerWaalsContact C-N 3.35Å; N75-L77 VanDerWaalsContact C-N 3.27Å; N75-L77 PolarHBondContact O-N 2.8Å; N75-I78 PolarHBondContact O-N 3.19Å; N75-K79 WeakPolarHBondContact O-CG 3.37Å; N75-K79 PolarHBondContact O-N 3.49Å; N75-K79 VanDerWaalsContact O-N 3.15Å; N75-K112 WeakPolarHBondContact ND2-CE 3.5Å; N75-E114 PolarHBondContact ND2-OE1 2.96Å
76	E	97.4	Very high	97.1	Very high	103 Å²	103	77 Å²	77	48%	0.481	36%	0.364	S	S	.	.	H	α-helix	trans	-66.5	-26	175.7	-64.1	-51.5	137.8	0	0	114	E72 K73 R74 K79	E72-E76 PolarHBondContact O-N 3.12Å; E72-E76 VanDerWaalsContact O-N 3.09Å; K73-E76 PolarHBondContact O-N 3.44Å; R74-E76 VanDerWaalsContact C-N 3.34Å; R74-E76 PolarHBondContact O-N 2.86Å; E76-K79 IonicContact OE1-NZ 2.67Å; E76-K79 PolarHBondContact OE1-NZ 3.16Å; E76-K79 IonicContact OE2-NZ 2.93Å; E76-K79 PolarHBondContact OE2-NZ 2.85Å
77	L	98.1	Very high	97.1	Very high	91 Å²	91	74.6 Å²	74.6	48%	0.476	35%	0.354	S	S	.	.	H	α-helix	trans	-77.7	-44.1	173.4	-67.4	171.9	0	0	0	111.5	K73 R74 N75 K79 K80	K73-L77 WeakPolarHBondContact O-CG 3.33Å; K73-L77 PolarHBondContact O-N 3.31Å; R74-L77 WeakPolarHBondContact O-CB 3.35Å; R74-L77 PolarHBondContact O-N 3.18Å; R74-L77 VanDerWaalsContact O-N 3.08Å; N75-L77 VanDerWaalsContact C-N 3.27Å; N75-L77 PolarHBondContact O-N 2.8Å; L77-K79 VanDerWaalsContact C-N 3.28Å; L77-K79 PolarHBondContact O-N 3.01Å; L77-K80 WeakPolarHBondContact O-CB 3.41Å; L77-K80 PolarHBondContact O-N 2.72Å; L77-K80 VanDerWaalsContact O-N 3.08Å
78	I	97.8	Very high	97.1	Very high	11 Å²	11	69.7 Å²	69.7	6%	0.056	34%	0.336	C	S	.	.	H	α-helix	trans	-59.5	-38.3	179.4	-73.1	170.8	0	0	0	111.3	R74 N75 K80 I81 F84 W85	R74-I78 HydrophobicContact CG-CD1 3.8Å; R74-I78 HydrophobicContact CG-CG1 4.29Å; R74-I78 WeakPolarHBondContact O-CG1 3.32Å; R74-I78 PolarHBondContact O-N 2.91Å; N75-I78 PolarHBondContact O-N 3.19Å; I78-K80 PolarHBondContact O-N 3.03Å; I78-I81 PolarHBondContact O-N 3.46Å; I78-F84 HydrophobicContact CB-CD1 4.37Å; I78-F84 HydrophobicContact CD1-CD1 3.95Å; I78-F84 HydrophobicContact CD1-CE1 3.54Å; I78-F84 HydrophobicContact CD1-CZ 4.02Å; I78-F84 HydrophobicContact CG1-CD1 3.98Å; I78-F84 HydrophobicContact CG1-CD2 4.49Å; I78-F84 HydrophobicContact CG1-CE1 3.86Å; I78-F84 HydrophobicContact CG1-CE2 4.37Å; I78-F84 HydrophobicContact CG1-CG 4.3Å; I78-F84 HydrophobicContact CG1-CZ 4.07Å; I78-F84 HydrophobicContact CG2-CB 3.82Å; I78-F84 HydrophobicContact CG2-CD1 3.5Å; I78-F84 HydrophobicContact CG2-CE1 4.23Å; I78-F84 HydrophobicContact CG2-CG 3.69Å; I78-W85 HydrophobicContact CD1-CH2 4.15Å; I78-W85 HydrophobicContact CD1-CZ2 3.6Å
79	K	95.9	Very high	97.2	Very high	115 Å²	115	64.7 Å²	64.7	50%	0.5	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.4	-19.4	175.1	-73.9	177.8	-167.2	169.5	0	114.8	N75 E76 L77 I81	N75-K79 WeakPolarHBondContact O-CG 3.37Å; N75-K79 PolarHBondContact O-N 3.49Å; N75-K79 VanDerWaalsContact O-N 3.15Å; E76-K79 IonicContact OE1-NZ 2.67Å; E76-K79 PolarHBondContact OE1-NZ 3.16Å; E76-K79 IonicContact OE2-NZ 2.93Å; E76-K79 PolarHBondContact OE2-NZ 2.85Å; L77-K79 VanDerWaalsContact C-N 3.28Å; L77-K79 PolarHBondContact O-N 3.01Å; K79-I81 VanDerWaalsContact C-N 3.35Å
80	K	97	Very high	97.1	Very high	158 Å²	158	62.8 Å²	62.8	69%	0.687	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.4	-7.7	178.9	-56.6	175.9	-175.4	175.3	0	113	L77 I78	L77-K80 WeakPolarHBondContact O-CB 3.41Å; L77-K80 PolarHBondContact O-N 2.72Å; L77-K80 VanDerWaalsContact O-N 3.08Å; I78-K80 PolarHBondContact O-N 3.03Å
81	I	96.5	Very high	97	Very high	69 Å²	69	55.8 Å²	55.8	35%	0.354	27%	0.273	S	S	.	.	S	Bend	trans	-114.9	106.4	-176.2	-54.5	175.9	0	0	0	107.6	I78 K79 F84 F221	I78-I81 PolarHBondContact O-N 3.46Å; K79-I81 VanDerWaalsContact C-N 3.35Å; I81-F84 HydrophobicContact CB-CB 4.27Å; I81-F84 HydrophobicContact CB-CD2 4.36Å; I81-F84 HydrophobicContact CD1-CD2 4.18Å; I81-F84 HydrophobicContact CG2-CB 4.18Å; I81-F84 HydrophobicContact CG2-CD2 4.16Å; I81-F221 HydrophobicContact CG2-CE1 4.21Å; I81-F221 HydrophobicContact CG2-CE2 4.06Å; I81-F221 HydrophobicContact CG2-CZ 3.55Å
82	P	95.3	Very high	96.9	Very high	106 Å²	106	54 Å²	54	69%	0.688	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	147.6	175.1	-22.4	33.5	0	0	0	111.4	F84	P82-F84 PolarHBondContact O-N 2.97Å
83	N	95.3	Very high	96.8	Very high	77 Å²	77	53.9 Å²	53.9	41%	0.412	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.7	16.1	175.2	-55.2	-35.7	0	0	0	115.4	W85 V86 S87 H108	N83-W85 PolarHBondContact O-N 3.24Å; N83-V86 HydrophobicContact CB-CG1 3.62Å; N83-V86 WeakPolarHBondContact O-CG1 3.42Å; N83-V86 PolarHBondContact O-N 3.16Å; N83-S87 WeakPolarHBondContact O-CB 3.41Å; N83-S87 PolarHBondContact O-N 3.42Å; N83-S87 PolarHBondContact O-OG 2.91Å; N83-H108 PolarHBondContact OD1-ND1 2.84Å
84	F	98	Very high	96.5	Very high	9 Å²	9	53.1 Å²	53.1	4%	0.039	27%	0.272	C	S	.	.	H	α-helix	trans	-54.9	-49.5	-175.1	-179.6	-87.4	0	0	0	113.1	I78 I81 P82 A88 P217 L218 F221	I78-F84 HydrophobicContact CB-CD1 4.37Å; I78-F84 HydrophobicContact CD1-CD1 3.95Å; I78-F84 HydrophobicContact CD1-CE1 3.54Å; I78-F84 HydrophobicContact CD1-CZ 4.02Å; I78-F84 HydrophobicContact CG1-CD1 3.98Å; I78-F84 HydrophobicContact CG1-CD2 4.49Å; I78-F84 HydrophobicContact CG1-CE1 3.86Å; I78-F84 HydrophobicContact CG1-CE2 4.37Å; I78-F84 HydrophobicContact CG1-CG 4.3Å; I78-F84 HydrophobicContact CG1-CZ 4.07Å; I78-F84 HydrophobicContact CG2-CB 3.82Å; I78-F84 HydrophobicContact CG2-CD1 3.5Å; I78-F84 HydrophobicContact CG2-CE1 4.23Å; I78-F84 HydrophobicContact CG2-CG 3.69Å; I81-F84 HydrophobicContact CB-CB 4.27Å; I81-F84 HydrophobicContact CB-CD2 4.36Å; I81-F84 HydrophobicContact CD1-CD2 4.18Å; I81-F84 HydrophobicContact CG2-CB 4.18Å; I81-F84 HydrophobicContact CG2-CD2 4.16Å; P82-F84 PolarHBondContact O-N 2.97Å; F84-A88 WeakPolarHBondContact O-CB 3.22Å; F84-A88 PolarHBondContact O-N 2.92Å; F84-P217 HydrophobicContact CE1-CB 3.9Å; F84-P217 HydrophobicContact CE1-CG 3.96Å; F84-P217 HydrophobicContact CZ-CB 4.13Å; F84-P217 HydrophobicContact CZ-CG 4.07Å; F84-L218 HydrophobicContact CE2-CD1 4.24Å; F84-F221 HydrophobicContact CB-CD2 4.37Å; F84-F221 HydrophobicContact CB-CE2 4.32Å; F84-F221 HydrophobicContact CD2-CB 4.18Å; F84-F221 AromaticContact CD2-CD1 3.99Å; F84-F221 HydrophobicContact CD2-CD1 3.99Å; F84-F221 AromaticContact CD2-CD2 3.51Å; F84-F221 HydrophobicContact CD2-CD2 3.51Å; F84-F221 HydrophobicContact CD2-CE1 4.28Å; F84-F221 AromaticContact CD2-CE2 3.87Å; F84-F221 HydrophobicContact CD2-CE2 3.87Å; F84-F221 AromaticContact CD2-CG 3.59Å; F84-F221 HydrophobicContact CD2-CG 3.59Å; F84-F221 HydrophobicContact CD2-CZ 4.23Å; F84-F221 HydrophobicContact CE2-CB 3.71Å; F84-F221 AromaticContact CE2-CD1 3.86Å; F84-F221 HydrophobicContact CE2-CD1 3.86Å; F84-F221 AromaticContact CE2-CD2 3.95Å; F84-F221 HydrophobicContact CE2-CD2 3.95Å; F84-F221 AromaticContact CE2-CG 3.53Å; F84-F221 HydrophobicContact CE2-CG 3.53Å; F84-F221 HydrophobicContact CG-CD2 4.05Å; F84-F221 HydrophobicContact CG-CE2 4.4Å; F84-F221 HydrophobicContact CG-CG 4.47Å; F84-F221 HydrophobicContact CZ-CB 4.08Å; F84-F221 HydrophobicContact CZ-CG 4.36Å
85	W	98.2	Very high	96.4	Very high	4 Å²	4	51 Å²	51	2%	0.015	26%	0.264	C	S	.	.	H	α-helix	trans	-72.1	-42.2	-175.6	-70.5	114	0	0	0	112.7	I78 N83 S87 A88 F89 L110 L113 W214 P217	I78-W85 HydrophobicContact CD1-CH2 4.15Å; I78-W85 HydrophobicContact CD1-CZ2 3.6Å; N83-W85 PolarHBondContact O-N 3.24Å; W85-S87 PolarHBondContact O-N 3.39Å; W85-A88 PolarHBondContact O-N 2.84Å; W85-F89 HydrophobicContact CE3-CE2 4.13Å; W85-F89 WeakPolarHBondContact O-CB 3.31Å; W85-F89 WeakPolarHBondContact O-CD2 3.48Å; W85-F89 PolarHBondContact O-N 3.05Å; W85-L110 HydrophobicContact CB-CD2 3.68Å; W85-L110 HydrophobicContact CB-CG 3.91Å; W85-L110 HydrophobicContact CG-CD2 4.38Å; W85-L110 HydrophobicContact CG-CG 4.4Å; W85-L113 HydrophobicContact CD2-CB 3.81Å; W85-L113 HydrophobicContact CE3-CB 3.97Å; W85-L113 HydrophobicContact CE3-CD2 3.98Å; W85-L113 HydrophobicContact CG-CB 4.46Å; W85-L113 HydrophobicContact CH2-CB 3.9Å; W85-L113 HydrophobicContact CH2-CD2 4.05Å; W85-L113 HydrophobicContact CH2-CG 4.43Å; W85-L113 HydrophobicContact CZ2-CB 3.74Å; W85-L113 HydrophobicContact CZ3-CB 4.01Å; W85-L113 HydrophobicContact CZ3-CD2 3.65Å; W85-L113 HydrophobicContact CZ3-CG 4.41Å; W85-W214 AromaticContact CH2-CE3 3.94Å; W85-W214 HydrophobicContact CH2-CE3 3.94Å; W85-W214 AromaticContact CH2-CZ3 3.74Å; W85-W214 HydrophobicContact CH2-CZ3 3.74Å; W85-W214 HydrophobicContact CZ2-CZ3 4.03Å; W85-P217 HydrophobicContact CE3-CB 4.5Å; W85-P217 HydrophobicContact CH2-CB 4.05Å; W85-P217 HydrophobicContact CH2-CG 3.87Å; W85-P217 HydrophobicContact CZ3-CB 3.63Å; W85-P217 HydrophobicContact CZ3-CG 4Å
86	V	97.1	Very high	96.3	Very high	2 Å²	2	52.6 Å²	52.6	1%	0.012	28%	0.276	C	S	.	.	H	α-helix	trans	-61.7	-43.7	176.7	60.9	0	0	0	0	111.4	N83 A88 F89 I90 E104 L107	N83-V86 HydrophobicContact CB-CG1 3.62Å; N83-V86 WeakPolarHBondContact O-CG1 3.42Å; N83-V86 PolarHBondContact O-N 3.16Å; V86-A88 PolarHBondContact O-N 3.2Å; V86-F89 PolarHBondContact O-N 3.24Å; V86-I90 HydrophobicContact CG2-CD1 3.65Å; V86-I90 HydrophobicContact CG2-CG1 4.22Å; V86-I90 WeakPolarHBondContact O-CD1 3.09Å; V86-I90 VanDerWaalsContact O-CG1 3.26Å; V86-I90 WeakPolarHBondContact O-CG1 3.48Å; V86-I90 PolarHBondContact O-N 3.15Å; V86-E104 HydrophobicContact CG2-CG 4.25Å; V86-L107 HydrophobicContact CB-CB 4.07Å; V86-L107 HydrophobicContact CG2-CB 3.78Å
87	S	96.5	Very high	96.1	Very high	40 Å²	40	51.4 Å²	51.4	28%	0.28	28%	0.284	S	S	.	.	H	α-helix	trans	-61.5	-42.1	174.4	-62.6	0	0	0	0	112.1	N83 W85 F89 N91	N83-S87 WeakPolarHBondContact O-CB 3.41Å; N83-S87 PolarHBondContact O-N 3.42Å; N83-S87 PolarHBondContact O-OG 2.91Å; W85-S87 PolarHBondContact O-N 3.39Å; S87-F89 VanDerWaalsContact C-N 3.34Å; S87-F89 PolarHBondContact O-N 2.9Å; S87-N91 VanDerWaalsContact O-CB 3.26Å; S87-N91 WeakPolarHBondContact O-CB 3.19Å; S87-N91 PolarHBondContact O-N 3.16Å; S87-N91 PolarHBondContact O-ND2 3.26Å
88	A	97.4	Very high	95.8	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-64.2	-37.5	175.9	0	0	0	0	0	112.7	F84 W85 V86 H92 M213 Y220	F84-A88 WeakPolarHBondContact O-CB 3.22Å; F84-A88 PolarHBondContact O-N 2.92Å; W85-A88 PolarHBondContact O-N 2.84Å; V86-A88 PolarHBondContact O-N 3.2Å; A88-H92 PolarHBondContact O-N 3.02Å; A88-M213 WeakPolarHBondContact O-CE 3.49Å; A88-Y220 WeakPolarHBondContact O-CB 3.49Å
89	F	97.2	Very high	95.6	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-69.8	-46.8	179.1	-86.2	-129.3	0	0	0	111.9	W85 V86 S87 N91 H92 I95 L99 L107 L110 L113 F129 F190 M213	W85-F89 HydrophobicContact CE3-CE2 4.13Å; W85-F89 WeakPolarHBondContact O-CB 3.31Å; W85-F89 WeakPolarHBondContact O-CD2 3.48Å; W85-F89 PolarHBondContact O-N 3.05Å; V86-F89 PolarHBondContact O-N 3.24Å; S87-F89 VanDerWaalsContact C-N 3.34Å; S87-F89 PolarHBondContact O-N 2.9Å; F89-N91 VanDerWaalsContact C-N 3.28Å; F89-N91 PolarHBondContact O-N 3.2Å; F89-H92 PolarHBondContact O-N 3.12Å; F89-I95 HydrophobicContact CB-CG2 4.08Å; F89-I95 HydrophobicContact CD1-CG2 3.55Å; F89-I95 HydrophobicContact CE1-CG2 4.23Å; F89-I95 HydrophobicContact CG-CG2 4.03Å; F89-L99 HydrophobicContact CB-CD1 4.21Å; F89-L107 HydrophobicContact CB-CD1 4.31Å; F89-L107 HydrophobicContact CD1-CD1 3.94Å; F89-L107 HydrophobicContact CG-CD1 4.45Å; F89-L110 HydrophobicContact CE2-CD2 4.37Å; F89-L110 HydrophobicContact CZ-CD2 4.28Å; F89-L113 HydrophobicContact CE2-CD2 4.07Å; F89-L113 HydrophobicContact CZ-CD2 4.16Å; F89-F129 HydrophobicContact CE1-CE1 4.18Å; F89-F129 AromaticContact CZ-CE1 3.98Å; F89-F129 HydrophobicContact CZ-CE1 3.98Å; F89-F190 HydrophobicContact CD1-CE2 4.36Å; F89-F190 AromaticContact CE1-CE2 3.76Å; F89-F190 HydrophobicContact CE1-CE2 3.76Å; F89-F190 HydrophobicContact CE1-CZ 4.11Å; F89-M213 HydrophobicContact CD2-CE 4.17Å; F89-M213 HydrophobicContact CD2-SD 3.4Å; F89-M213 WeakPolarHBondContact CD2-SD 3.11Å; F89-M213 HydrophobicContact CE2-SD 3.32Å; F89-M213 WeakPolarHBondContact CE2-SD 3.45Å; F89-M213 HydrophobicContact CG-SD 4.33Å; F89-M213 HydrophobicContact CZ-SD 4.17Å
90	I	95.9	Very high	95.4	Very high	35 Å²	35	46.1 Å²	46.1	18%	0.179	26%	0.262	C	S	.	.	H	α-helix	trans	-62.7	-38	177	-63.2	161.1	0	0	0	110.6	V86 H92 S96 L99 E104 M228	V86-I90 HydrophobicContact CG2-CD1 3.65Å; V86-I90 HydrophobicContact CG2-CG1 4.22Å; V86-I90 WeakPolarHBondContact O-CD1 3.09Å; V86-I90 VanDerWaalsContact O-CG1 3.26Å; V86-I90 WeakPolarHBondContact O-CG1 3.48Å; V86-I90 PolarHBondContact O-N 3.15Å; I90-H92 VanDerWaalsContact C-N 3.25Å; I90-H92 PolarHBondContact O-N 2.85Å; I90-S96 WeakPolarHBondContact O-CB 3.47Å; I90-L99 HydrophobicContact CG1-CD1 4.25Å; I90-E104 VanDerWaalsContact CD1-CD 3.43Å; I90-E104 HydrophobicContact CD1-CG 3.6Å; I90-E104 VanDerWaalsContact CD1-OE1 3.31Å; I90-E104 WeakPolarHBondContact CD1-OE1 3.5Å; I90-E104 HydrophobicContact CG1-CG 4.06Å; I90-M228 HydrophobicContact CG2-CE 3.67Å; I90-M228 WeakPolarHBondContact O-CE 3.45Å
91	N	95.7	Very high	95.2	Very high	22 Å²	22	47 Å²	47	12%	0.118	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-5.7	-179	-67.6	-8.4	0	0	0	114	S87 F89 Y220 V223 M228	S87-N91 VanDerWaalsContact O-CB 3.26Å; S87-N91 WeakPolarHBondContact O-CB 3.19Å; S87-N91 PolarHBondContact O-N 3.16Å; S87-N91 PolarHBondContact O-ND2 3.26Å; F89-N91 VanDerWaalsContact C-N 3.28Å; F89-N91 PolarHBondContact O-N 3.2Å; N91-Y220 WeakPolarHBondContact CB-O 3.38Å; N91-Y220 PolarHBondContact ND2-O 2.93Å; N91-V223 HydrophobicContact CB-CB 4.29Å; N91-V223 PolarHBondContact ND2-O 3.49Å; N91-M228 HydrophobicContact CB-CE 4.5Å; N91-M228 HydrophobicContact CB-SD 4.27Å; N91-M228 WeakPolarHBondContact OD1-CE 3.47Å; N91-M228 PolarHBondContact OD1-SD 2.76Å
92	H	96	Very high	95.1	Very high	4 Å²	4	49.2 Å²	49.2	2%	0.019	28%	0.277	C	S	.	.	S	Bend	trans	-91.7	118.2	178.6	-172.1	-68.6	0	0	0	111.4	A88 F89 I90 Q94 I95 S96 V208 D212 M213 Y220	A88-H92 PolarHBondContact O-N 3.02Å; F89-H92 PolarHBondContact O-N 3.12Å; I90-H92 VanDerWaalsContact C-N 3.25Å; I90-H92 PolarHBondContact O-N 2.85Å; H92-Q94 VanDerWaalsContact C-N 3.3Å; H92-Q94 PolarHBondContact ND1-N 2.92Å; H92-Q94 PolarHBondContact O-N 2.74Å; H92-Q94 VanDerWaalsContact O-N 3.07Å; H92-I95 HydrophobicContact CB-CB 4.15Å; H92-I95 HydrophobicContact CB-CD1 4.37Å; H92-I95 HydrophobicContact CB-CG1 4.31Å; H92-I95 PolarHBondContact O-N 2.79Å; H92-S96 WeakPolarHBondContact O-CB 3.36Å; H92-S96 PolarHBondContact O-N 3.13Å; H92-S96 PolarHBondContact O-OG 3.03Å; H92-S96 VanDerWaalsContact O-OG 3.12Å; H92-V208 WeakPolarHBondContact CE1-CG1 3.48Å; H92-V208 WeakPolarHBondContact NE2-CG1 3.37Å; H92-D212 IonicContact NE2-OD2 2.66Å; H92-D212 PolarHBondContact NE2-OD2 3.24Å; H92-M213 HydrophobicContact CB-CE 3.35Å; H92-Y220 HydrophobicContact CB-CD1 4.29Å; H92-Y220 HydrophobicContact CB-CG 4.44Å; H92-Y220 AromaticContact CD2-CD2 3.93Å; H92-Y220 AromaticContact CD2-CE1 3.63Å; H92-Y220 AromaticContact CD2-CE2 3.47Å; H92-Y220 VanDerWaalsContact CD2-CE2 3.47Å; H92-Y220 WeakPolarHBondContact CD2-CE2 3.22Å; H92-Y220 AromaticContact CD2-CZ 3.34Å; H92-Y220 AromaticContact NE2-CZ 3.76Å
93	P	93.3	Very high	95.1	Very high	97 Å²	97	44.2 Å²	44.2	63%	0.63	24%	0.244	S	C	*	.	H	α-helix	trans	-55	-36.5	-169.1	-28.3	34.4	0	0	0	115.9	S96	P93-S96 PolarHBondContact O-OG 3.29Å
94	Q	93.5	Very high	95.1	Very high	121 Å²	121	44 Å²	44	57%	0.565	24%	0.241	S	C	*	.	H	α-helix	trans	-85.9	-29	-179.5	-69.3	176	-25.8	0	0	113.7	H92	H92-Q94 VanDerWaalsContact C-N 3.3Å; H92-Q94 PolarHBondContact ND1-N 2.92Å; H92-Q94 PolarHBondContact O-N 2.74Å; H92-Q94 VanDerWaalsContact O-N 3.07Å
95	I	95.2	Very high	95	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-82.4	-41	-178.6	-62	-177.3	0	0	0	109.3	F89 H92 A97 L98 V208 I209 M213	F89-I95 HydrophobicContact CB-CG2 4.08Å; F89-I95 HydrophobicContact CD1-CG2 3.55Å; F89-I95 HydrophobicContact CE1-CG2 4.23Å; F89-I95 HydrophobicContact CG-CG2 4.03Å; H92-I95 HydrophobicContact CB-CB 4.15Å; H92-I95 HydrophobicContact CB-CD1 4.37Å; H92-I95 HydrophobicContact CB-CG1 4.31Å; H92-I95 PolarHBondContact O-N 2.79Å; I95-A97 PolarHBondContact O-N 2.67Å; I95-L98 WeakPolarHBondContact O-CA 3.42Å; I95-L98 VanDerWaalsContact O-CB 3.32Å; I95-L98 WeakPolarHBondContact O-CB 3.44Å; I95-L98 PolarHBondContact O-N 3.46Å; I95-V208 HydrophobicContact CD1-CG1 4.03Å; I95-V208 HydrophobicContact CG1-CG1 3.94Å; I95-I209 HydrophobicContact CD1-CD1 4.48Å; I95-I209 HydrophobicContact CD1-CG1 3.73Å; I95-M213 HydrophobicContact CD1-CE 3.57Å; I95-M213 HydrophobicContact CD1-SD 3.91Å
96	S	94.3	Very high	95	Very high	41 Å²	41	48.6 Å²	48.6	29%	0.287	26%	0.262	S	S	.	.	H	α-helix	trans	-60.8	-30.2	178.3	68.4	0	0	0	0	113.2	I90 H92 P93 L98 L99	I90-S96 WeakPolarHBondContact O-CB 3.47Å; H92-S96 WeakPolarHBondContact O-CB 3.36Å; H92-S96 PolarHBondContact O-N 3.13Å; H92-S96 PolarHBondContact O-OG 3.03Å; H92-S96 VanDerWaalsContact O-OG 3.12Å; P93-S96 PolarHBondContact O-OG 3.29Å; S96-L98 PolarHBondContact O-N 3.11Å; S96-L98 VanDerWaalsContact O-N 3.16Å; S96-L99 PolarHBondContact O-N 2.56Å
97	A	93.3	Very high	95	Very high	78 Å²	78	48.5 Å²	48.5	65%	0.645	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-16.6	172.9	0	0	0	0	0	113.9	I95	I95-A97 PolarHBondContact O-N 2.67Å
98	L	92.7	Very high	95.1	Very high	15 Å²	15	50.6 Å²	50.6	8%	0.079	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.5	-6	175.9	-56.2	172	0	0	0	112.7	I95 S96 P187 T189 F190 V205	I95-L98 WeakPolarHBondContact O-CA 3.42Å; I95-L98 VanDerWaalsContact O-CB 3.32Å; I95-L98 WeakPolarHBondContact O-CB 3.44Å; I95-L98 PolarHBondContact O-N 3.46Å; S96-L98 PolarHBondContact O-N 3.11Å; S96-L98 VanDerWaalsContact O-N 3.16Å; L98-P187 VanDerWaalsContact CD2-O 3.26Å; L98-P187 WeakPolarHBondContact CD2-O 3.28Å; L98-T189 CarbonylContact O-C 3.37Å; L98-T189 WeakPolarHBondContact O-CA 3.31Å; L98-F190 HydrophobicContact CB-CB 4.48Å; L98-F190 PolarHBondContact O-N 3.23Å; L98-V205 HydrophobicContact CD1-CB 4.27Å; L98-V205 HydrophobicContact CD1-CG1 3.73Å; L98-V205 HydrophobicContact CD1-CG2 3.49Å; L98-V205 VanDerWaalsContact CD1-CG2 3.49Å
99	L	94	Very high	95.1	Very high	29 Å²	29	54.1 Å²	54.1	15%	0.152	28%	0.281	C	S	.	.			trans	-99.3	125.6	-175.5	-59.7	177.3	0	0	0	110.3	F89 I90 S96 E103 L107 F190	F89-L99 HydrophobicContact CB-CD1 4.21Å; I90-L99 HydrophobicContact CG1-CD1 4.25Å; S96-L99 PolarHBondContact O-N 2.56Å; L99-E103 HydrophobicContact CD2-CB 4.26Å; L99-L107 HydrophobicContact CD1-CD1 3.73Å; L99-L107 HydrophobicContact CD2-CD1 3.44Å; L99-L107 VanDerWaalsContact CD2-CD1 3.44Å; L99-L107 HydrophobicContact CD2-CG 4.48Å; L99-L107 HydrophobicContact CG-CD1 4.25Å; L99-F190 HydrophobicContact CD2-CB 3.58Å; L99-F190 HydrophobicContact CD2-CG 4.08Å
100	D	91.8	Very high	95.1	Very high	62 Å²	62	54.5 Å²	54.5	33%	0.332	28%	0.283	S	S	.	.			trans	-95.9	176.7	162	68.7	34.4	0	0	0	111	E102 E103 E104	D100-E102 VanDerWaalsContact C-N 3.31Å; D100-E102 PolarHBondContact O-N 3.26Å; D100-E102 PolarHBondContact OD1-N 3.43Å; D100-E103 PolarHBondContact O-N 3.09Å; D100-E103 WeakPolarHBondContact OD1-CG 3.41Å; D100-E103 PolarHBondContact OD1-N 3.32Å; D100-E104 WeakPolarHBondContact O-CB 3.41Å; D100-E104 PolarHBondContact O-N 3.37Å
101	E	93	Very high	95.2	Very high	176 Å²	176	54.8 Å²	54.8	82%	0.822	29%	0.288	S	S	*	.	H	α-helix	trans	-61	-36.8	-175.9	-171.6	176.5	-178	0	0	112.6	E105	E101-E105 PolarHBondContact O-N 3.06Å; E101-E105 VanDerWaalsContact O-N 3.07Å
102	E	93.7	Very high	95.3	Very high	116 Å²	116	55.6 Å²	55.6	54%	0.542	29%	0.291	S	S	.	.	H	α-helix	trans	-76.4	-36.2	179.9	-62.4	-174.1	174	0	0	111.3	D100 E105 C106 L168	D100-E102 VanDerWaalsContact C-N 3.31Å; D100-E102 PolarHBondContact O-N 3.26Å; D100-E102 PolarHBondContact OD1-N 3.43Å; E102-E105 PolarHBondContact O-N 3.28Å; E102-C106 PolarHBondContact O-N 2.79Å; E102-L168 HydrophobicContact CB-CD2 3.73Å; E102-L168 WeakPolarHBondContact OE2-CD2 3.45Å
103	E	94.8	Very high	95.4	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-68.6	-38.9	173.9	-67.6	-163.6	152	0	0	112.3	L99 D100 E105 C106 L107 L168 T189 F190 F191	L99-E103 HydrophobicContact CD2-CB 4.26Å; D100-E103 PolarHBondContact O-N 3.09Å; D100-E103 WeakPolarHBondContact OD1-CG 3.41Å; D100-E103 PolarHBondContact OD1-N 3.32Å; E103-E105 VanDerWaalsContact C-N 3.35Å; E103-C106 WeakPolarHBondContact O-CB 3.5Å; E103-C106 PolarHBondContact O-N 3.22Å; E103-L107 WeakPolarHBondContact O-CG 3.32Å; E103-L107 PolarHBondContact O-N 3.47Å; E103-L168 HydrophobicContact CG-CD1 4.24Å; E103-T189 VanDerWaalsContact CD-CB 3.41Å; E103-T189 WeakPolarHBondContact OE1-CB 3.1Å; E103-T189 PolarHBondContact OE1-OG1 3.29Å; E103-T189 VanDerWaalsContact OE2-CB 3.31Å; E103-T189 WeakPolarHBondContact OE2-CB 3.35Å; E103-F190 PolarHBondContact OE1-N 3.43Å; E103-F190 VanDerWaalsContact OE2-CB 3.22Å; E103-F190 WeakPolarHBondContact OE2-CB 3.21Å; E103-F190 PolarHBondContact OE2-N 3.32Å; E103-F191 HydrophobicContact CB-CD2 4.46Å; E103-F191 HydrophobicContact CB-CE2 4.33Å; E103-F191 HydrophobicContact CG-CD2 3.72Å; E103-F191 HydrophobicContact CG-CE2 4.04Å; E103-F191 VanDerWaalsContact OE1-CD2 3.27Å; E103-F191 WeakPolarHBondContact OE1-CD2 3.44Å; E103-F191 PolarHBondContact OE1-N 3.24Å
104	E	95.6	Very high	95.6	Very high	74 Å²	74	52.5 Å²	52.5	35%	0.346	27%	0.268	S	S	.	.	H	α-helix	trans	-59.2	-46.6	171.2	-170.8	-179.2	146.7	0	0	110.9	V86 I90 D100 C106 L107 H108	V86-E104 HydrophobicContact CG2-CG 4.25Å; I90-E104 VanDerWaalsContact CD1-CD 3.43Å; I90-E104 HydrophobicContact CD1-CG 3.6Å; I90-E104 VanDerWaalsContact CD1-OE1 3.31Å; I90-E104 WeakPolarHBondContact CD1-OE1 3.5Å; I90-E104 HydrophobicContact CG1-CG 4.06Å; D100-E104 WeakPolarHBondContact O-CB 3.41Å; D100-E104 PolarHBondContact O-N 3.37Å; E104-C106 VanDerWaalsContact C-N 3.27Å; E104-C106 PolarHBondContact O-N 3.04Å; E104-L107 PolarHBondContact O-N 3.35Å; E104-L107 VanDerWaalsContact O-N 3.08Å; E104-H108 PolarHBondContact O-CD2 2.86Å; E104-H108 PolarHBondContact O-N 3.44Å
105	E	96.5	Very high	95.8	Very high	108 Å²	108	47.5 Å²	47.5	51%	0.505	25%	0.245	S	C	.	.	H	α-helix	trans	-57.8	-40.6	174.5	-168.9	-179.8	-177.2	0	0	111.6	E101 E102 E103 H108 Y109 F136	E101-E105 PolarHBondContact O-N 3.06Å; E101-E105 VanDerWaalsContact O-N 3.07Å; E102-E105 PolarHBondContact O-N 3.28Å; E103-E105 VanDerWaalsContact C-N 3.35Å; E105-H108 WeakPolarHBondContact O-CB 3.5Å; E105-H108 PolarHBondContact O-N 3.16Å; E105-Y109 WeakPolarHBondContact O-CD2 3.43Å; E105-F136 HydrophobicContact CB-CZ 4.08Å; E105-F136 HydrophobicContact CG-CE2 4.42Å; E105-F136 HydrophobicContact CG-CZ 3.95Å
106	C	97.4	Very high	95.8	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-66.3	-39.3	174.9	-172.3	0	0	0	0	112.8	E102 E103 E104 H108 Y109 F136 F137 L168 F191	E102-C106 PolarHBondContact O-N 2.79Å; E103-C106 WeakPolarHBondContact O-CB 3.5Å; E103-C106 PolarHBondContact O-N 3.22Å; E104-C106 VanDerWaalsContact C-N 3.27Å; E104-C106 PolarHBondContact O-N 3.04Å; C106-H108 PolarHBondContact O-N 3.24Å; C106-Y109 PolarHBondContact O-N 2.91Å; C106-Y109 VanDerWaalsContact O-N 3.1Å; C106-F136 HydrophobicContact CB-CD1 4.29Å; C106-F136 HydrophobicContact CB-CD2 3.68Å; C106-F136 HydrophobicContact CB-CE1 4.3Å; C106-F136 HydrophobicContact CB-CE2 3.71Å; C106-F136 HydrophobicContact CB-CG 4Å; C106-F136 HydrophobicContact CB-CZ 4.02Å; C106-F136 VanDerWaalsContact SG-CD2 3.57Å; C106-F137 VanDerWaalsContact SG-CE1 3.51Å; C106-L168 HydrophobicContact CB-CD1 3.83Å; C106-F191 HydrophobicContact CB-CE2 4.03Å; C106-F191 HydrophobicContact CB-CZ 4.23Å; C106-F191 VanDerWaalsContact SG-CZ 3.57Å
107	L	97.5	Very high	95.9	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-69.3	-18	-180	-73.2	-175.4	0	0	0	113.2	V86 F89 L99 E103 E104 Y109 L110 F131 F190	V86-L107 HydrophobicContact CB-CB 4.07Å; V86-L107 HydrophobicContact CG2-CB 3.78Å; F89-L107 HydrophobicContact CB-CD1 4.31Å; F89-L107 HydrophobicContact CD1-CD1 3.94Å; F89-L107 HydrophobicContact CG-CD1 4.45Å; L99-L107 HydrophobicContact CD1-CD1 3.73Å; L99-L107 HydrophobicContact CD2-CD1 3.44Å; L99-L107 VanDerWaalsContact CD2-CD1 3.44Å; L99-L107 HydrophobicContact CD2-CG 4.48Å; L99-L107 HydrophobicContact CG-CD1 4.25Å; E103-L107 WeakPolarHBondContact O-CG 3.32Å; E103-L107 PolarHBondContact O-N 3.47Å; E104-L107 PolarHBondContact O-N 3.35Å; E104-L107 VanDerWaalsContact O-N 3.08Å; L107-Y109 PolarHBondContact O-N 3.17Å; L107-Y109 VanDerWaalsContact O-N 3.1Å; L107-L110 HydrophobicContact CD2-CB 4.34Å; L107-L110 HydrophobicContact CD2-CD2 4.05Å; L107-L110 WeakPolarHBondContact O-CB 3.28Å; L107-L110 PolarHBondContact O-N 3.48Å; L107-F131 HydrophobicContact CD2-CE1 4.23Å; L107-F131 HydrophobicContact CD2-CZ 4.2Å; L107-F190 HydrophobicContact CD2-CD1 4.48Å; L107-F190 HydrophobicContact CD2-CE1 4.17Å
108	H	97.6	Very high	95.9	Very high	85 Å²	85	47.9 Å²	47.9	39%	0.394	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57	-23.3	167.9	-83.5	-74.4	0	0	0	113.6	N83 E104 E105 C106	N83-H108 PolarHBondContact OD1-ND1 2.84Å; E104-H108 PolarHBondContact O-CD2 2.86Å; E104-H108 PolarHBondContact O-N 3.44Å; E105-H108 WeakPolarHBondContact O-CB 3.5Å; E105-H108 PolarHBondContact O-N 3.16Å; C106-H108 PolarHBondContact O-N 3.24Å
109	Y	98	Very high	95.8	Very high	73 Å²	73	53.6 Å²	53.6	29%	0.286	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.7	-2.6	176	-59.1	-92.8	0	0	0	113.3	E105 C106 L107 S111 F131 D132 E133 N134 P135 F136	E105-Y109 WeakPolarHBondContact O-CD2 3.43Å; C106-Y109 PolarHBondContact O-N 2.91Å; C106-Y109 VanDerWaalsContact O-N 3.1Å; L107-Y109 PolarHBondContact O-N 3.17Å; L107-Y109 VanDerWaalsContact O-N 3.1Å; Y109-S111 PolarHBondContact O-N 3.07Å; Y109-F131 CarbonylContact O-C 3.54Å; Y109-F131 VanDerWaalsContact O-CA 3.26Å; Y109-F131 WeakPolarHBondContact O-CA 3.48Å; Y109-D132 PolarHBondContact O-N 3.12Å; Y109-E133 WeakPolarHBondContact CD1-O 3.46Å; Y109-N134 HydrophobicContact CD1-CB 3.44Å; Y109-N134 VanDerWaalsContact CD1-CB 3.44Å; Y109-N134 HydrophobicContact CD2-CB 3.76Å; Y109-N134 HydrophobicContact CE1-CB 3.96Å; Y109-N134 HydrophobicContact CE2-CB 4.26Å; Y109-N134 HydrophobicContact CG-CB 3.32Å; Y109-P135 HydrophobicContact CE2-CG 4.4Å; Y109-P135 VanDerWaalsContact CZ-CD 3.48Å; Y109-F136 HydrophobicContact CD2-CE2 4.2Å; Y109-F136 AromaticContact CE2-CE2 3.94Å; Y109-F136 HydrophobicContact CE2-CE2 3.94Å
110	L	98.2	Very high	95.7	Very high	8 Å²	8	55.2 Å²	55.2	4%	0.042	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	97.2	175.9	-179.9	62	0	0	0	109.9	W85 F89 L107 F129 Y130 F131	W85-L110 HydrophobicContact CB-CD2 3.68Å; W85-L110 HydrophobicContact CB-CG 3.91Å; W85-L110 HydrophobicContact CG-CD2 4.38Å; W85-L110 HydrophobicContact CG-CG 4.4Å; F89-L110 HydrophobicContact CE2-CD2 4.37Å; F89-L110 HydrophobicContact CZ-CD2 4.28Å; L107-L110 HydrophobicContact CD2-CB 4.34Å; L107-L110 HydrophobicContact CD2-CD2 4.05Å; L107-L110 WeakPolarHBondContact O-CB 3.28Å; L107-L110 PolarHBondContact O-N 3.48Å; L110-F129 HydrophobicContact CD1-CB 3.81Å; L110-F129 HydrophobicContact CD1-CD1 4.25Å; L110-F129 HydrophobicContact CD2-CD1 4.45Å; L110-Y130 WeakPolarHBondContact CD1-O 3.21Å; L110-F131 HydrophobicContact CB-CD1 4.27Å; L110-F131 HydrophobicContact CB-CE1 3.88Å; L110-F131 HydrophobicContact CB-CZ 4.37Å; L110-F131 HydrophobicContact CD1-CE1 4.29Å; L110-F131 HydrophobicContact CD1-CE2 4.13Å; L110-F131 HydrophobicContact CD1-CZ 4Å
111	S	96.4	Very high	95.5	Very high	41 Å²	41	53.4 Å²	53.4	29%	0.287	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	-24.1	-175.4	61.2	0	0	0	0	113.2	Y109 Y130 D132	Y109-S111 PolarHBondContact O-N 3.07Å; S111-Y130 PolarHBondContact N-O 3.47Å; S111-Y130 PolarHBondContact OG-O 3.38Å; S111-D132 WeakPolarHBondContact CB-OD1 3.37Å; S111-D132 PolarHBondContact OG-OD1 3.27Å
112	K	97.8	Very high	95.3	Very high	40 Å²	40	47.4 Å²	47.4	17%	0.174	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156	138.7	179.9	176.7	-170.7	-174.8	-155.9	0	111.8	N75 E114 Y130	N75-K112 WeakPolarHBondContact ND2-CE 3.5Å; K112-E114 HydrophobicContact CD-CG 4.36Å; K112-E114 WeakPolarHBondContact CE-OE1 3.4Å; K112-E114 HydrophobicContact CG-CG 4.28Å; K112-E114 IonicContact NZ-OE1 3.06Å; K112-E114 PolarHBondContact NZ-OE1 3.3Å; K112-E114 IonicContact NZ-OE2 2.6Å; K112-Y130 HydrophobicContact CB-CD2 4.02Å; K112-Y130 HydrophobicContact CB-CG 4.16Å; K112-Y130 HydrophobicContact CD-CD2 3.86Å; K112-Y130 HydrophobicContact CD-CE2 4.06Å; K112-Y130 HydrophobicContact CD-CG 4.16Å; K112-Y130 HydrophobicContact CG-CD2 3.89Å; K112-Y130 HydrophobicContact CG-CE2 4.36Å; K112-Y130 HydrophobicContact CG-CG 4.4Å; K112-Y130 PolarHBondContact N-O 2.99Å; K112-Y130 WeakPolarHBondContact O-CB 3.49Å; K112-Y130 WeakPolarHBondContact O-CD2 3.26Å; K112-Y130 PolarHBondContact O-N 3.41Å
113	L	98.4	Very high	95.3	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	141.6	165	177.5	66.2	0	0	0	108.9	W85 F89 K128 F129 I209 W214	W85-L113 HydrophobicContact CD2-CB 3.81Å; W85-L113 HydrophobicContact CE3-CB 3.97Å; W85-L113 HydrophobicContact CE3-CD2 3.98Å; W85-L113 HydrophobicContact CG-CB 4.46Å; W85-L113 HydrophobicContact CH2-CB 3.9Å; W85-L113 HydrophobicContact CH2-CD2 4.05Å; W85-L113 HydrophobicContact CH2-CG 4.43Å; W85-L113 HydrophobicContact CZ2-CB 3.74Å; W85-L113 HydrophobicContact CZ3-CB 4.01Å; W85-L113 HydrophobicContact CZ3-CD2 3.65Å; W85-L113 HydrophobicContact CZ3-CG 4.41Å; F89-L113 HydrophobicContact CE2-CD2 4.07Å; F89-L113 HydrophobicContact CZ-CD2 4.16Å; L113-K128 CarbonylContact C-O 3.56Å; L113-K128 WeakPolarHBondContact CA-O 3.32Å; L113-F129 HydrophobicContact CD1-CD1 3.61Å; L113-F129 HydrophobicContact CD1-CE1 3.51Å; L113-F129 HydrophobicContact CD1-CG 4.26Å; L113-F129 HydrophobicContact CD1-CZ 4.1Å; L113-I209 HydrophobicContact CD1-CG2 4.46Å; L113-I209 HydrophobicContact CD2-CG2 4.02Å; L113-W214 HydrophobicContact CB-CZ3 4.39Å; L113-W214 HydrophobicContact CD2-CE3 4.14Å; L113-W214 HydrophobicContact CG-CE3 4.18Å; L113-W214 HydrophobicContact CG-CZ3 4.25Å; L113-W214 WeakPolarHBondContact O-CH2 3.33Å; L113-W214 WeakPolarHBondContact O-CZ3 3.39Å
114	E	98	Very high	95.3	Very high	35 Å²	35	44 Å²	44	16%	0.164	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	131.6	165.5	-66.1	-173.9	146	0	0	110.9	N75 K112 K128 Y130	N75-E114 PolarHBondContact ND2-OE1 2.96Å; K112-E114 HydrophobicContact CD-CG 4.36Å; K112-E114 WeakPolarHBondContact CE-OE1 3.4Å; K112-E114 HydrophobicContact CG-CG 4.28Å; K112-E114 IonicContact NZ-OE1 3.06Å; K112-E114 PolarHBondContact NZ-OE1 3.3Å; K112-E114 IonicContact NZ-OE2 2.6Å; E114-K128 HydrophobicContact CB-CB 4.26Å; E114-K128 PolarHBondContact N-O 3.43Å; E114-K128 PolarHBondContact O-N 2.98Å; E114-Y130 HydrophobicContact CB-CE2 4.21Å; E114-Y130 HydrophobicContact CG-CE2 3.83Å; E114-Y130 WeakPolarHBondContact OE2-CE2 3.48Å; E114-Y130 PolarHBondContact OE2-OH 3.17Å
115	V	98	Very high	95.3	Very high	16 Å²	16	41.1 Å²	41.1	10%	0.097	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	119.8	166.5	-178.3	0	0	0	0	107.9	L127 I209 K210 W214	V115-L127 HydrophobicContact CB-CD2 4.21Å; V115-L127 HydrophobicContact CG1-CD2 3.86Å; V115-L127 HydrophobicContact CG2-CD2 3.63Å; V115-I209 HydrophobicContact CG2-CG2 4.14Å; V115-K210 HydrophobicContact CG1-CB 4.14Å; V115-K210 HydrophobicContact CG1-CG 3.95Å; V115-W214 HydrophobicContact CB-CB 4.2Å; V115-W214 HydrophobicContact CB-CD2 3.75Å; V115-W214 HydrophobicContact CB-CE3 4.47Å; V115-W214 HydrophobicContact CB-CG 3.59Å; V115-W214 HydrophobicContact CG1-CG 4.46Å; V115-W214 HydrophobicContact CG2-CB 3.64Å; V115-W214 HydrophobicContact CG2-CD2 3.63Å; V115-W214 HydrophobicContact CG2-CE3 3.99Å; V115-W214 HydrophobicContact CG2-CG 3.47Å; V115-W214 VanDerWaalsContact CG2-CG 3.47Å
116	E	95.8	Very high	95.4	Very high	65 Å²	65	39.3 Å²	39.3	30%	0.304	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	109.5	-178.8	173.5	175.9	-149.8	0	0	109.4	Y125 R126 K128	E116-Y125 CarbonylContact O-C 3.5Å; E116-Y125 VanDerWaalsContact O-CA 3.28Å; E116-Y125 WeakPolarHBondContact O-CA 3.42Å; E116-Y125 WeakPolarHBondContact O-CB 3.11Å; E116-R126 HydrophobicContact CB-CG 3.79Å; E116-R126 HydrophobicContact CG-CG 4.33Å; E116-R126 PolarHBondContact N-O 3.33Å; E116-R126 PolarHBondContact O-N 3.12Å; E116-R126 WeakPolarHBondContact OE2-CD 3.45Å; E116-R126 IonicContact OE2-NE 3.15Å; E116-K128 VanDerWaalsContact OE2-CE 3.29Å; E116-K128 WeakPolarHBondContact OE2-CE 3.28Å; E116-K128 IonicContact OE2-NZ 3.87Å; E116-K128 PolarHBondContact OE2-NZ 2.9Å
117	E	95.2	Very high	95.5	Very high	39 Å²	39	39.3 Å²	39.3	18%	0.182	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	147.9	168.8	-56.3	175.5	-103.7	0	0	109.8	N64 R67	N64-E117 VanDerWaalsContact ND2-CD 3.32Å; N64-E117 PolarHBondContact ND2-OE1 3.36Å; R67-E117 IonicContact NH2-OE1 3.25Å
118	F	94.6	Very high	95.5	Very high	24 Å²	24	41 Å²	41	11%	0.105	20%	0.201	C	C	.	.			trans	-71.3	157.5	174.3	-59	-18.9	0	0	0	111.2	D120 I121 G124 E145 F146 H147	F118-D120 PolarHBondContact O-N 3.32Å; F118-D120 VanDerWaalsContact O-N 3.12Å; F118-I121 WeakPolarHBondContact O-CA 3.48Å; F118-I121 PolarHBondContact O-N 3.43Å; F118-G124 WeakPolarHBondContact CB-O 3.45Å; F118-G124 VanDerWaalsContact CD2-C 3.49Å; F118-G124 WeakPolarHBondContact CD2-O 3.33Å; F118-G124 VanDerWaalsContact CG-O 3.32Å; F118-G124 WeakPolarHBondContact CG-O 3.18Å; F118-G124 PolarHBondContact N-O 3.22Å; F118-E145 HydrophobicContact CE1-CG 4.27Å; F118-E145 HydrophobicContact CZ-CG 3.7Å; F118-F146 WeakPolarHBondContact CE2-O 3.33Å; F118-H147 AromaticContact CE2-CD2 3.7Å; F118-H147 AromaticContact CE2-NE2 3.84Å; F118-H147 AromaticContact CZ-NE2 3.99Å
119	D	90.5	Very high	95.6	Very high	134 Å²	134	37 Å²	37	72%	0.717	18%	0.182	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-31.1	-172.5	-78.4	-27	0	0	0	113.9
120	D	90.2	Very high	95.6	Very high	64 Å²	64	36.1 Å²	36.1	34%	0.342	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.4	-6	177.6	74.1	-23.4	0	0	0	113.3	L57 Q61 F118 K122 S123	L57-D120 WeakPolarHBondContact CD1-O 3.26Å; Q61-D120 PolarHBondContact NE2-O 3.27Å; Q61-D120 VanDerWaalsContact NE2-O 3.13Å; F118-D120 PolarHBondContact O-N 3.32Å; F118-D120 VanDerWaalsContact O-N 3.12Å; D120-K122 PolarHBondContact O-N 3.42Å; D120-S123 VanDerWaalsContact CG-OG 3.26Å; D120-S123 WeakPolarHBondContact OD1-CB 3.48Å; D120-S123 PolarHBondContact OD1-N 3Å; D120-S123 VanDerWaalsContact OD1-N 3.09Å; D120-S123 PolarHBondContact OD1-OG 3.09Å; D120-S123 WeakPolarHBondContact OD2-CB 3.36Å; D120-S123 PolarHBondContact OD2-N 3.46Å; D120-S123 PolarHBondContact OD2-OG 3.27Å
121	I	88.9	Confident	95.6	Very high	24 Å²	24	36.1 Å²	36.1	12%	0.123	18%	0.178	C	C	.	.	S	Bend	trans	61.9	-44.2	-175.2	-62.3	-177.6	0	0	0	113.8	L57 E60 Q61 N64 F118 S123 G124	L57-I121 HydrophobicContact CD1-CB 4.01Å; L57-I121 HydrophobicContact CD1-CG2 4.37Å; E60-I121 HydrophobicContact CB-CD1 3.47Å; E60-I121 VanDerWaalsContact CB-CD1 3.47Å; Q61-I121 HydrophobicContact CB-CD1 4.32Å; Q61-I121 HydrophobicContact CG-CD1 3.84Å; Q61-I121 HydrophobicContact CG-CG1 4.02Å; Q61-I121 VanDerWaalsContact N-CD1 3.29Å; N64-I121 HydrophobicContact CB-CD1 4.17Å; F118-I121 WeakPolarHBondContact O-CA 3.48Å; F118-I121 PolarHBondContact O-N 3.43Å; I121-S123 VanDerWaalsContact C-N 3.29Å; I121-S123 PolarHBondContact O-N 3.2Å; I121-G124 PolarHBondContact O-N 3.15Å
122	K	89.2	Confident	95.7	Very high	49 Å²	49	38.8 Å²	38.8	21%	0.213	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-30.5	-179.1	-65	-172.7	177.2	-178.4	0	113.4	T3 L57 D120 G124 G149	T3-K122 HydrophobicContact CG2-CD 4.11Å; L57-K122 HydrophobicContact CD1-CD 4.2Å; L57-K122 HydrophobicContact CD1-CG 3.67Å; L57-K122 HydrophobicContact CD2-CD 3.85Å; L57-K122 HydrophobicContact CD2-CG 4.16Å; D120-K122 PolarHBondContact O-N 3.42Å; K122-G124 PolarHBondContact O-N 3.06Å; K122-G149 WeakPolarHBondContact O-CA 3.42Å; K122-G149 PolarHBondContact O-N 3.34Å
123	S	91.7	Very high	95.7	Very high	42 Å²	42	45.1 Å²	45.1	29%	0.294	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-20.5	-177.4	-71.4	0	0	0	0	112.5	D120 I121 H147 L148	D120-S123 VanDerWaalsContact CG-OG 3.26Å; D120-S123 WeakPolarHBondContact OD1-CB 3.48Å; D120-S123 PolarHBondContact OD1-N 3Å; D120-S123 VanDerWaalsContact OD1-N 3.09Å; D120-S123 PolarHBondContact OD1-OG 3.09Å; D120-S123 WeakPolarHBondContact OD2-CB 3.36Å; D120-S123 PolarHBondContact OD2-N 3.46Å; D120-S123 PolarHBondContact OD2-OG 3.27Å; I121-S123 VanDerWaalsContact C-N 3.29Å; I121-S123 PolarHBondContact O-N 3.2Å; S123-H147 CarbonylContact O-C 3.42Å; S123-H147 WeakPolarHBondContact O-CA 3.43Å; S123-L148 PolarHBondContact O-N 3.32Å
124	G	95	Very high	95.6	Very high	2 Å²	2	45.4 Å²	45.4	2%	0.021	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	129.5	-155.6	176.5	0	0	0	0	0	114.3	F118 I121 K122 F146	F118-G124 WeakPolarHBondContact CB-O 3.45Å; F118-G124 VanDerWaalsContact CD2-C 3.49Å; F118-G124 WeakPolarHBondContact CD2-O 3.33Å; F118-G124 VanDerWaalsContact CG-O 3.32Å; F118-G124 WeakPolarHBondContact CG-O 3.18Å; F118-G124 PolarHBondContact N-O 3.22Å; I121-G124 PolarHBondContact O-N 3.15Å; K122-G124 PolarHBondContact O-N 3.06Å; G124-F146 WeakPolarHBondContact CA-O 3.5Å
125	Y	97.2	Very high	95.6	Very high	15 Å²	15	46.3 Å²	46.3	6%	0.059	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.4	168.5	-171.7	62.7	-87.5	0	0	0	111.7	E116 L127 F146 L148 A206 K210	E116-Y125 CarbonylContact O-C 3.5Å; E116-Y125 VanDerWaalsContact O-CA 3.28Å; E116-Y125 WeakPolarHBondContact O-CA 3.42Å; E116-Y125 WeakPolarHBondContact O-CB 3.11Å; Y125-L127 HydrophobicContact CD2-CD2 3.91Å; Y125-L127 HydrophobicContact CD2-CG 4.28Å; Y125-L127 HydrophobicContact CE2-CD1 4.45Å; Y125-L127 HydrophobicContact CE2-CD2 3.87Å; Y125-L127 HydrophobicContact CE2-CG 4.07Å; Y125-F146 HydrophobicContact CD1-CB 4.34Å; Y125-F146 HydrophobicContact CD2-CD2 4.06Å; Y125-F146 HydrophobicContact CE1-CB 4.09Å; Y125-F146 HydrophobicContact CE1-CD2 4.37Å; Y125-F146 HydrophobicContact CE1-CG 4.27Å; Y125-F146 AromaticContact CE2-CD2 3.46Å; Y125-F146 HydrophobicContact CE2-CD2 3.46Å; Y125-F146 VanDerWaalsContact CE2-CD2 3.46Å; Y125-F146 AromaticContact CE2-CE2 3.89Å; Y125-F146 HydrophobicContact CE2-CE2 3.89Å; Y125-F146 HydrophobicContact CE2-CG 4.17Å; Y125-F146 AromaticContact CZ-CD2 3.64Å; Y125-F146 AromaticContact CZ-CG 3.89Å; Y125-F146 PolarHBondContact N-O 3.07Å; Y125-F146 VanDerWaalsContact N-O 3.12Å; Y125-F146 PolarHBondContact O-N 3.44Å; Y125-L148 HydrophobicContact CD1-CD1 4.42Å; Y125-L148 HydrophobicContact CE1-CD1 4.06Å; Y125-A206 HydrophobicContact CE2-CB 4.33Å; Y125-A206 WeakPolarHBondContact OH-CB 3.24Å; Y125-K210 HydrophobicContact CD1-CD 3.64Å; Y125-K210 HydrophobicContact CD2-CD 3.89Å; Y125-K210 HydrophobicContact CE1-CD 3.66Å; Y125-K210 HydrophobicContact CE2-CB 4.35Å; Y125-K210 HydrophobicContact CE2-CD 3.91Å; Y125-K210 HydrophobicContact CG-CD 3.76Å
126	R	97.7	Very high	95.6	Very high	70 Å²	70	45.9 Å²	45.9	26%	0.264	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	140	174.7	68.4	-170.1	85.7	-150.8	8.7	111.7	E116 K128 I143 K144 E145	E116-R126 HydrophobicContact CB-CG 3.79Å; E116-R126 HydrophobicContact CG-CG 4.33Å; E116-R126 PolarHBondContact N-O 3.33Å; E116-R126 PolarHBondContact O-N 3.12Å; E116-R126 WeakPolarHBondContact OE2-CD 3.45Å; E116-R126 IonicContact OE2-NE 3.15Å; R126-K128 HydrophobicContact CG-CG 4.39Å; R126-I143 HydrophobicContact CB-CG2 4.2Å; R126-K144 CarbonylContact C-O 3.59Å; R126-K144 WeakPolarHBondContact CA-O 3.2Å; R126-E145 HydrophobicContact CB-CB 4.14Å; R126-E145 HydrophobicContact CB-CG 3.99Å; R126-E145 IonicContact CZ-OE2 2.66Å; R126-E145 IonicContact NE-OE2 2.85Å; R126-E145 PolarHBondContact NE-OE2 3.42Å; R126-E145 IonicContact NH1-OE2 3.57Å; R126-E145 PolarHBondContact NH1-OE2 2.93Å; R126-E145 IonicContact NH2-OE2 3.56Å
127	L	98.5	Very high	95.7	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	121	172.3	-50.3	-179.3	0	0	0	107.7	V115 Y125 F129 I143 K144 F146 W193 A206 I209	V115-L127 HydrophobicContact CB-CD2 4.21Å; V115-L127 HydrophobicContact CG1-CD2 3.86Å; V115-L127 HydrophobicContact CG2-CD2 3.63Å; Y125-L127 HydrophobicContact CD2-CD2 3.91Å; Y125-L127 HydrophobicContact CD2-CG 4.28Å; Y125-L127 HydrophobicContact CE2-CD1 4.45Å; Y125-L127 HydrophobicContact CE2-CD2 3.87Å; Y125-L127 HydrophobicContact CE2-CG 4.07Å; L127-F129 HydrophobicContact CB-CE2 3.66Å; L127-F129 HydrophobicContact CB-CZ 3.99Å; L127-F129 HydrophobicContact CD1-CZ 4.37Å; L127-I143 VanDerWaalsContact O-CA 3.29Å; L127-I143 WeakPolarHBondContact O-CA 3.27Å; L127-K144 PolarHBondContact N-O 2.64Å; L127-K144 PolarHBondContact O-N 3.22Å; L127-F146 HydrophobicContact CD1-CE2 4.21Å; L127-F146 HydrophobicContact CG-CE2 4.48Å; L127-W193 HydrophobicContact CD1-CH2 3.8Å; L127-W193 HydrophobicContact CD1-CZ2 4.09Å; L127-A206 HydrophobicContact CD1-CB 4.04Å; L127-I209 HydrophobicContact CD1-CB 4.39Å; L127-I209 HydrophobicContact CD1-CD1 4.37Å; L127-I209 HydrophobicContact CD1-CG2 4.27Å; L127-I209 HydrophobicContact CD2-CG2 4.04Å
128	K	98.7	Very high	95.9	Very high	34 Å²	34	47.3 Å²	47.3	15%	0.148	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	118.8	178.2	-54.2	-178.9	-171	165	0	110	L113 E114 E116 R126 Y130 V141 L142 I143	L113-K128 CarbonylContact C-O 3.56Å; L113-K128 WeakPolarHBondContact CA-O 3.32Å; E114-K128 HydrophobicContact CB-CB 4.26Å; E114-K128 PolarHBondContact N-O 3.43Å; E114-K128 PolarHBondContact O-N 2.98Å; E116-K128 VanDerWaalsContact OE2-CE 3.29Å; E116-K128 WeakPolarHBondContact OE2-CE 3.28Å; E116-K128 IonicContact OE2-NZ 3.87Å; E116-K128 PolarHBondContact OE2-NZ 2.9Å; R126-K128 HydrophobicContact CG-CG 4.39Å; K128-Y130 HydrophobicContact CB-CD2 4.27Å; K128-Y130 HydrophobicContact CB-CE2 3.63Å; K128-Y130 HydrophobicContact CD-CE2 4.29Å; K128-V141 HydrophobicContact CB-CG1 4.17Å; K128-L142 WeakPolarHBondContact CA-O 3.12Å; K128-I143 HydrophobicContact CB-CG1 4.5Å; K128-I143 HydrophobicContact CG-CD1 4.34Å; K128-I143 HydrophobicContact CG-CG1 4.1Å; K128-I143 HydrophobicContact CG-CG2 4.27Å
129	F	98.7	Very high	96.1	Very high	1 Å²	1	47.1 Å²	47.1	0%	0.004	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	109.2	177.5	-54.2	-93.2	0	0	0	107.8	F89 L110 L113 L127 F131 V141 L142 F190 W193 F194 I209	F89-F129 HydrophobicContact CE1-CE1 4.18Å; F89-F129 AromaticContact CZ-CE1 3.98Å; F89-F129 HydrophobicContact CZ-CE1 3.98Å; L110-F129 HydrophobicContact CD1-CB 3.81Å; L110-F129 HydrophobicContact CD1-CD1 4.25Å; L110-F129 HydrophobicContact CD2-CD1 4.45Å; L113-F129 HydrophobicContact CD1-CD1 3.61Å; L113-F129 HydrophobicContact CD1-CE1 3.51Å; L113-F129 HydrophobicContact CD1-CG 4.26Å; L113-F129 HydrophobicContact CD1-CZ 4.1Å; L127-F129 HydrophobicContact CB-CE2 3.66Å; L127-F129 HydrophobicContact CB-CZ 3.99Å; L127-F129 HydrophobicContact CD1-CZ 4.37Å; F129-F131 HydrophobicContact CB-CD2 4.34Å; F129-F131 HydrophobicContact CB-CE2 3.56Å; F129-F131 HydrophobicContact CB-CZ 4.26Å; F129-F131 WeakPolarHBondContact O-CD2 3.32Å; F129-V141 CarbonylContact O-C 3.57Å; F129-V141 WeakPolarHBondContact O-CA 3.29Å; F129-L142 HydrophobicContact CB-CB 4.32Å; F129-L142 PolarHBondContact N-O 2.94Å; F129-L142 PolarHBondContact O-N 2.81Å; F129-F190 HydrophobicContact CD1-CZ 4.05Å; F129-F190 HydrophobicContact CE1-CE2 4.25Å; F129-F190 AromaticContact CE1-CZ 3.67Å; F129-F190 HydrophobicContact CE1-CZ 3.67Å; F129-F190 HydrophobicContact CZ-CE2 4.47Å; F129-F190 HydrophobicContact CZ-CZ 4.01Å; F129-W193 HydrophobicContact CE2-CH2 4.4Å; F129-W193 HydrophobicContact CE2-CZ3 4.42Å; F129-W193 AromaticContact CZ-CH2 3.98Å; F129-W193 HydrophobicContact CZ-CH2 3.98Å; F129-W193 AromaticContact CZ-CZ3 4Å; F129-W193 HydrophobicContact CZ-CZ3 4Å; F129-F194 HydrophobicContact CD2-CD2 4.37Å; F129-F194 HydrophobicContact CD2-CE2 4.02Å; F129-F194 HydrophobicContact CE2-CD2 4.19Å; F129-F194 HydrophobicContact CE2-CE2 4.12Å; F129-I209 HydrophobicContact CE1-CD1 4.31Å; F129-I209 HydrophobicContact CZ-CD1 4.03Å
130	Y	98.6	Very high	96.4	Very high	55 Å²	55	46.6 Å²	46.6	22%	0.216	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	127.2	179.9	-63.1	-104.1	0	0	0	109.1	L110 S111 K112 E114 K128 D140 V141	L110-Y130 WeakPolarHBondContact CD1-O 3.21Å; S111-Y130 PolarHBondContact N-O 3.47Å; S111-Y130 PolarHBondContact OG-O 3.38Å; K112-Y130 HydrophobicContact CB-CD2 4.02Å; K112-Y130 HydrophobicContact CB-CG 4.16Å; K112-Y130 HydrophobicContact CD-CD2 3.86Å; K112-Y130 HydrophobicContact CD-CE2 4.06Å; K112-Y130 HydrophobicContact CD-CG 4.16Å; K112-Y130 HydrophobicContact CG-CD2 3.89Å; K112-Y130 HydrophobicContact CG-CE2 4.36Å; K112-Y130 HydrophobicContact CG-CG 4.4Å; K112-Y130 PolarHBondContact N-O 2.99Å; K112-Y130 WeakPolarHBondContact O-CB 3.49Å; K112-Y130 WeakPolarHBondContact O-CD2 3.26Å; K112-Y130 PolarHBondContact O-N 3.41Å; E114-Y130 HydrophobicContact CB-CE2 4.21Å; E114-Y130 HydrophobicContact CG-CE2 3.83Å; E114-Y130 WeakPolarHBondContact OE2-CE2 3.48Å; E114-Y130 PolarHBondContact OE2-OH 3.17Å; K128-Y130 HydrophobicContact CB-CD2 4.27Å; K128-Y130 HydrophobicContact CB-CE2 3.63Å; K128-Y130 HydrophobicContact CD-CE2 4.29Å; Y130-D140 CarbonylContact C-O 3.59Å; Y130-D140 WeakPolarHBondContact CA-O 3.32Å; Y130-V141 HydrophobicContact CD1-CB 4.39Å; Y130-V141 HydrophobicContact CD1-CG1 4.18Å; Y130-V141 HydrophobicContact CD1-CG2 3.38Å; Y130-V141 HydrophobicContact CD2-CG1 4.47Å; Y130-V141 HydrophobicContact CE1-CG1 4.16Å; Y130-V141 HydrophobicContact CE1-CG2 3.58Å; Y130-V141 HydrophobicContact CE2-CG1 4.49Å; Y130-V141 HydrophobicContact CG-CG1 4.32Å; Y130-V141 HydrophobicContact CG-CG2 4.15Å
131	F	98.4	Very high	96.8	Very high	8 Å²	8	45.6 Å²	45.6	4%	0.035	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	140.4	-179.7	-69.1	-94.3	0	0	0	110.4	L107 Y109 L110 F129 F137 D140 L142	L107-F131 HydrophobicContact CD2-CE1 4.23Å; L107-F131 HydrophobicContact CD2-CZ 4.2Å; Y109-F131 CarbonylContact O-C 3.54Å; Y109-F131 VanDerWaalsContact O-CA 3.26Å; Y109-F131 WeakPolarHBondContact O-CA 3.48Å; L110-F131 HydrophobicContact CB-CD1 4.27Å; L110-F131 HydrophobicContact CB-CE1 3.88Å; L110-F131 HydrophobicContact CB-CZ 4.37Å; L110-F131 HydrophobicContact CD1-CE1 4.29Å; L110-F131 HydrophobicContact CD1-CE2 4.13Å; L110-F131 HydrophobicContact CD1-CZ 4Å; F129-F131 HydrophobicContact CB-CD2 4.34Å; F129-F131 HydrophobicContact CB-CE2 3.56Å; F129-F131 HydrophobicContact CB-CZ 4.26Å; F129-F131 WeakPolarHBondContact O-CD2 3.32Å; F131-F137 HydrophobicContact CB-CE2 3.93Å; F131-F137 HydrophobicContact CB-CZ 4.24Å; F131-F137 HydrophobicContact CD1-CE2 4.31Å; F131-F137 AromaticContact CD1-CZ 3.75Å; F131-F137 HydrophobicContact CD1-CZ 3.75Å; F131-F137 AromaticContact CD2-CE2 3.86Å; F131-F137 HydrophobicContact CD2-CE2 3.86Å; F131-F137 AromaticContact CD2-CZ 3.67Å; F131-F137 HydrophobicContact CD2-CZ 3.67Å; F131-F137 AromaticContact CE1-CZ 3.94Å; F131-F137 HydrophobicContact CE1-CZ 3.94Å; F131-F137 HydrophobicContact CE2-CE2 4.45Å; F131-F137 AromaticContact CE2-CZ 3.85Å; F131-F137 HydrophobicContact CE2-CZ 3.85Å; F131-F137 AromaticContact CG-CE2 3.77Å; F131-F137 HydrophobicContact CG-CE2 3.77Å; F131-F137 AromaticContact CG-CZ 3.61Å; F131-F137 HydrophobicContact CG-CZ 3.61Å; F131-F137 AromaticContact CZ-CZ 3.99Å; F131-F137 HydrophobicContact CZ-CZ 3.99Å; F131-D140 PolarHBondContact N-O 2.78Å; F131-L142 HydrophobicContact CD2-CD1 4.44Å; F131-L142 HydrophobicContact CD2-CG 4.33Å; F131-L142 HydrophobicContact CE2-CB 4.38Å; F131-L142 HydrophobicContact CE2-CD1 3.86Å; F131-L142 HydrophobicContact CE2-CG 4.1Å
132	D	97.9	Very high	97.3	Very high	97 Å²	97	44.5 Å²	44.5	52%	0.519	22%	0.221	S	C	.	.			trans	-72.3	170.5	164.2	-66	-15.7	0	0	0	109.8	Y109 S111 N134	Y109-D132 PolarHBondContact O-N 3.12Å; S111-D132 WeakPolarHBondContact CB-OD1 3.37Å; S111-D132 PolarHBondContact OG-OD1 3.27Å; D132-N134 PolarHBondContact O-N 3.09Å; D132-N134 VanDerWaalsContact O-N 3.13Å; D132-N134 PolarHBondContact O-ND2 3.23Å
133	E	98	Very high	97.8	Very high	173 Å²	173	44.4 Å²	44.4	81%	0.808	22%	0.223	S	C	*	.	S	Bend	trans	-55.4	121.5	175.3	-174.7	-179.2	178.5	0	0	110.3	Y109	Y109-E133 WeakPolarHBondContact CD1-O 3.46Å
134	N	97.6	Very high	98.1	Very high	7 Å²	7	42.4 Å²	42.4	4%	0.037	21%	0.209	C	C	.	.			trans	-137.6	161.7	-170.4	68.5	78.2	0	0	0	111.4	Y109 D132 F136 F137 K163	Y109-N134 HydrophobicContact CD1-CB 3.44Å; Y109-N134 VanDerWaalsContact CD1-CB 3.44Å; Y109-N134 HydrophobicContact CD2-CB 3.76Å; Y109-N134 HydrophobicContact CE1-CB 3.96Å; Y109-N134 HydrophobicContact CE2-CB 4.26Å; Y109-N134 HydrophobicContact CG-CB 3.32Å; D132-N134 PolarHBondContact O-N 3.09Å; D132-N134 VanDerWaalsContact O-N 3.13Å; D132-N134 PolarHBondContact O-ND2 3.23Å; N134-F136 VanDerWaalsContact C-N 3.3Å; N134-F136 HydrophobicContact CB-CD2 4.42Å; N134-F136 PolarHBondContact O-N 3.43Å; N134-F136 WeakPolarHBondContact OD1-CB 3.19Å; N134-F136 PolarHBondContact OD1-N 3.02Å; N134-F137 WeakPolarHBondContact ND2-CE2 3.43Å; N134-F137 PolarHBondContact OD1-N 3.31Å; N134-F137 PolarHBondContact OD1-O 3.49Å; N134-K163 PolarHBondContact O-NZ 3.33Å
135	P	97.6	Very high	98.2	Very high	53 Å²	53	44 Å²	44	34%	0.344	22%	0.215	S	C	.	.	S	Bend	trans	-76.5	-10.8	-178.1	29.6	-34.1	0	0	0	114.5	Y109 K163 M166	Y109-P135 HydrophobicContact CE2-CG 4.4Å; Y109-P135 VanDerWaalsContact CZ-CD 3.48Å; P135-K163 WeakPolarHBondContact O-CB 3.08Å; P135-K163 VanDerWaalsContact O-CD 3.25Å; P135-K163 WeakPolarHBondContact O-CD 3.42Å; P135-M166 WeakPolarHBondContact O-CG 3.38Å
136	F	97.8	Very high	98.2	Very high	8 Å²	8	43.2 Å²	43.2	4%	0.035	21%	0.213	C	C	.	.	S	Bend	trans	-89.1	-46	-167.9	-57.3	-85.5	0	0	0	114	E105 C106 Y109 N134 W162 K163 M166 L168	E105-F136 HydrophobicContact CB-CZ 4.08Å; E105-F136 HydrophobicContact CG-CE2 4.42Å; E105-F136 HydrophobicContact CG-CZ 3.95Å; C106-F136 HydrophobicContact CB-CD1 4.29Å; C106-F136 HydrophobicContact CB-CD2 3.68Å; C106-F136 HydrophobicContact CB-CE1 4.3Å; C106-F136 HydrophobicContact CB-CE2 3.71Å; C106-F136 HydrophobicContact CB-CG 4Å; C106-F136 HydrophobicContact CB-CZ 4.02Å; C106-F136 VanDerWaalsContact SG-CD2 3.57Å; Y109-F136 HydrophobicContact CD2-CE2 4.2Å; Y109-F136 AromaticContact CE2-CE2 3.94Å; Y109-F136 HydrophobicContact CE2-CE2 3.94Å; N134-F136 VanDerWaalsContact C-N 3.3Å; N134-F136 HydrophobicContact CB-CD2 4.42Å; N134-F136 PolarHBondContact O-N 3.43Å; N134-F136 WeakPolarHBondContact OD1-CB 3.19Å; N134-F136 PolarHBondContact OD1-N 3.02Å; F136-W162 HydrophobicContact CB-CZ3 4.39Å; F136-K163 PolarHBondContact O-N 3.38Å; F136-M166 HydrophobicContact CD1-CB 4.39Å; F136-L168 HydrophobicContact CD1-CD1 3.91Å; F136-L168 HydrophobicContact CD1-CD2 3.94Å; F136-L168 HydrophobicContact CD1-CG 4.15Å; F136-L168 HydrophobicContact CE1-CD1 4.32Å; F136-L168 HydrophobicContact CE1-CD2 4.08Å; F136-L168 HydrophobicContact CG-CD1 4.47Å
137	F	98.2	Very high	98.1	Very high	2 Å²	2	42.7 Å²	42.7	1%	0.009	21%	0.213	C	C	.	.	B	Isolated β-bridge	trans	-146.9	170.4	-178	49.7	-106.8	0	0	0	112.3	C106 F131 N134 N139 L142 I160 K161 W162 K163 F191	C106-F137 VanDerWaalsContact SG-CE1 3.51Å; F131-F137 HydrophobicContact CB-CE2 3.93Å; F131-F137 HydrophobicContact CB-CZ 4.24Å; F131-F137 HydrophobicContact CD1-CE2 4.31Å; F131-F137 AromaticContact CD1-CZ 3.75Å; F131-F137 HydrophobicContact CD1-CZ 3.75Å; F131-F137 AromaticContact CD2-CE2 3.86Å; F131-F137 HydrophobicContact CD2-CE2 3.86Å; F131-F137 AromaticContact CD2-CZ 3.67Å; F131-F137 HydrophobicContact CD2-CZ 3.67Å; F131-F137 AromaticContact CE1-CZ 3.94Å; F131-F137 HydrophobicContact CE1-CZ 3.94Å; F131-F137 HydrophobicContact CE2-CE2 4.45Å; F131-F137 AromaticContact CE2-CZ 3.85Å; F131-F137 HydrophobicContact CE2-CZ 3.85Å; F131-F137 AromaticContact CG-CE2 3.77Å; F131-F137 HydrophobicContact CG-CE2 3.77Å; F131-F137 AromaticContact CG-CZ 3.61Å; F131-F137 HydrophobicContact CG-CZ 3.61Å; F131-F137 AromaticContact CZ-CZ 3.99Å; F131-F137 HydrophobicContact CZ-CZ 3.99Å; N134-F137 WeakPolarHBondContact ND2-CE2 3.43Å; N134-F137 PolarHBondContact OD1-N 3.31Å; N134-F137 PolarHBondContact OD1-O 3.49Å; F137-N139 HydrophobicContact CD2-CB 3.86Å; F137-N139 HydrophobicContact CE2-CB 4.25Å; F137-N139 WeakPolarHBondContact CE2-O 3.4Å; F137-L142 HydrophobicContact CE1-CD1 4.12Å; F137-L142 HydrophobicContact CE2-CD1 4.32Å; F137-L142 HydrophobicContact CE2-CG 4.45Å; F137-L142 HydrophobicContact CZ-CD1 3.86Å; F137-L142 HydrophobicContact CZ-CG 4.44Å; F137-I160 HydrophobicContact CB-CG2 3.71Å; F137-I160 HydrophobicContact CD1-CG2 3.81Å; F137-I160 HydrophobicContact CG-CG2 3.88Å; F137-K161 CarbonylContact C-O 3.56Å; F137-K161 WeakPolarHBondContact CA-O 3.33Å; F137-K161 VanDerWaalsContact CB-O 3.29Å; F137-K161 WeakPolarHBondContact CB-O 3.14Å; F137-W162 HydrophobicContact CB-CE3 4.28Å; F137-W162 HydrophobicContact CD1-CE3 4.08Å; F137-W162 HydrophobicContact CD1-CH2 4.43Å; F137-W162 AromaticContact CD1-CZ3 3.77Å; F137-W162 HydrophobicContact CD1-CZ3 3.77Å; F137-W162 HydrophobicContact CE1-CZ3 4.47Å; F137-K163 WeakPolarHBondContact O-CE 3.37Å; F137-F191 AromaticContact CE1-CE1 3.99Å; F137-F191 HydrophobicContact CE1-CE1 3.99Å; F137-F191 HydrophobicContact CE1-CZ 4.02Å
138	E	98.2	Very high	97.7	Very high	132 Å²	132	45.5 Å²	45.5	62%	0.617	23%	0.228	S	C	*	.	S	Bend	trans	-95.1	-7.2	-179.8	-61	-177.2	169.5	0	0	114.1	D140 K161 K163	E138-D140 PolarHBondContact O-N 3.42Å; E138-K161 HydrophobicContact CB-CB 4.14Å; E138-K161 PolarHBondContact N-O 3.45Å; E138-K163 HydrophobicContact CG-CG 4.25Å
139	N	98.5	Very high	96.9	Very high	20 Å²	20	44.7 Å²	44.7	11%	0.107	23%	0.229	C	C	.	.			trans	-70.8	126.1	-178.4	-57.6	68.9	0	0	0	111.7	F137 V141 L142 E159 K161	F137-N139 HydrophobicContact CD2-CB 3.86Å; F137-N139 HydrophobicContact CE2-CB 4.25Å; F137-N139 WeakPolarHBondContact CE2-O 3.4Å; N139-V141 VanDerWaalsContact C-N 3.32Å; N139-L142 HydrophobicContact CB-CD2 3.54Å; N139-L142 HydrophobicContact CB-CG 4.33Å; N139-E159 PolarHBondContact ND2-O 2.99Å; N139-K161 WeakPolarHBondContact OD1-CB 3.02Å; N139-K161 PolarHBondContact OD1-N 3.47Å
140	D	98.3	Very high	95.9	Very high	122 Å²	122	50.7 Å²	50.7	65%	0.652	26%	0.257	S	S	*	.	S	Bend	trans	-73.6	-28.6	167.1	-57.8	-36.1	0	0	0	111.7	Y130 F131 E138	Y130-D140 CarbonylContact C-O 3.59Å; Y130-D140 WeakPolarHBondContact CA-O 3.32Å; F131-D140 PolarHBondContact N-O 2.78Å; E138-D140 PolarHBondContact O-N 3.42Å
141	V	98.6	Very high	95.2	Very high	43 Å²	43	52.8 Å²	52.8	26%	0.261	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	130	-178.9	-166.2	0	0	0	0	110	K128 F129 Y130 N139 I143	K128-V141 HydrophobicContact CB-CG1 4.17Å; F129-V141 CarbonylContact O-C 3.57Å; F129-V141 WeakPolarHBondContact O-CA 3.29Å; Y130-V141 HydrophobicContact CD1-CB 4.39Å; Y130-V141 HydrophobicContact CD1-CG1 4.18Å; Y130-V141 HydrophobicContact CD1-CG2 3.38Å; Y130-V141 HydrophobicContact CD2-CG1 4.47Å; Y130-V141 HydrophobicContact CE1-CG1 4.16Å; Y130-V141 HydrophobicContact CE1-CG2 3.58Å; Y130-V141 HydrophobicContact CE2-CG1 4.49Å; Y130-V141 HydrophobicContact CG-CG1 4.32Å; Y130-V141 HydrophobicContact CG-CG2 4.15Å; N139-V141 VanDerWaalsContact C-N 3.32Å; V141-I143 HydrophobicContact CG1-CD1 4.32Å; V141-I143 HydrophobicContact CG1-CG1 3.82Å
142	L	98.7	Very high	94.7	Very high	1 Å²	1	58.5 Å²	58.5	1%	0.005	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	130.2	166.1	-61.8	-175.6	0	0	0	109	K128 F129 F131 F137 N139 T158 I160 F191 F194	K128-L142 WeakPolarHBondContact CA-O 3.12Å; F129-L142 HydrophobicContact CB-CB 4.32Å; F129-L142 PolarHBondContact N-O 2.94Å; F129-L142 PolarHBondContact O-N 2.81Å; F131-L142 HydrophobicContact CD2-CD1 4.44Å; F131-L142 HydrophobicContact CD2-CG 4.33Å; F131-L142 HydrophobicContact CE2-CB 4.38Å; F131-L142 HydrophobicContact CE2-CD1 3.86Å; F131-L142 HydrophobicContact CE2-CG 4.1Å; F137-L142 HydrophobicContact CE1-CD1 4.12Å; F137-L142 HydrophobicContact CE2-CD1 4.32Å; F137-L142 HydrophobicContact CE2-CG 4.45Å; F137-L142 HydrophobicContact CZ-CD1 3.86Å; F137-L142 HydrophobicContact CZ-CG 4.44Å; N139-L142 HydrophobicContact CB-CD2 3.54Å; N139-L142 HydrophobicContact CB-CG 4.33Å; L142-T158 WeakPolarHBondContact CA-OG1 3.36Å; L142-I160 HydrophobicContact CD1-CD1 4.27Å; L142-I160 HydrophobicContact CD1-CG1 4.18Å; L142-I160 HydrophobicContact CD2-CG1 3.89Å; L142-F191 HydrophobicContact CD1-CD1 4.4Å; L142-F191 HydrophobicContact CD1-CE1 3.86Å; L142-F194 HydrophobicContact CB-CE1 4.21Å; L142-F194 HydrophobicContact CB-CE2 3.89Å; L142-F194 HydrophobicContact CB-CZ 3.59Å
143	I	98.7	Very high	94.5	Very high	47 Å²	47	55.9 Å²	55.9	24%	0.241	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	125.8	-178.5	-50.6	179.4	0	0	0	109.5	R126 L127 K128 V141 S157 T158 F194	R126-I143 HydrophobicContact CB-CG2 4.2Å; L127-I143 VanDerWaalsContact O-CA 3.29Å; L127-I143 WeakPolarHBondContact O-CA 3.27Å; K128-I143 HydrophobicContact CB-CG1 4.5Å; K128-I143 HydrophobicContact CG-CD1 4.34Å; K128-I143 HydrophobicContact CG-CG1 4.1Å; K128-I143 HydrophobicContact CG-CG2 4.27Å; V141-I143 HydrophobicContact CG1-CD1 4.32Å; V141-I143 HydrophobicContact CG1-CG1 3.82Å; I143-S157 CarbonylContact O-C 3.52Å; I143-S157 WeakPolarHBondContact O-CA 2.99Å; I143-T158 HydrophobicContact CB-CG2 3.72Å; I143-T158 HydrophobicContact CG1-CG2 4.07Å; I143-T158 PolarHBondContact N-OG1 3.25Å; I143-T158 PolarHBondContact O-N 2.87Å; I143-F194 WeakPolarHBondContact O-CZ 3.44Å
144	K	98.1	Very high	94.3	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	122.8	165.1	-163.4	175.9	-153	-75.4	0	108.1	R126 L127 F146 S156 W193 F194 D196 D203	R126-K144 CarbonylContact C-O 3.59Å; R126-K144 WeakPolarHBondContact CA-O 3.2Å; L127-K144 PolarHBondContact N-O 2.64Å; L127-K144 PolarHBondContact O-N 3.22Å; K144-F146 HydrophobicContact CB-CE2 4.41Å; K144-F146 HydrophobicContact CD-CE2 3.99Å; K144-F146 HydrophobicContact CD-CZ 3.76Å; K144-F146 HydrophobicContact CG-CE2 3.81Å; K144-F146 HydrophobicContact CG-CZ 3.97Å; K144-S156 CarbonylContact C-O 3.56Å; K144-S156 WeakPolarHBondContact CA-O 3.42Å; K144-W193 HydrophobicContact CD-CH2 3.94Å; K144-W193 HydrophobicContact CD-CZ2 3.61Å; K144-W193 WeakPolarHBondContact CE-O 3.49Å; K144-F194 HydrophobicContact CB-CD2 4.13Å; K144-F194 HydrophobicContact CB-CE2 3.81Å; K144-F194 WeakPolarHBondContact CE-O 3.39Å; K144-D196 WeakPolarHBondContact CE-O 3.47Å; K144-D196 PolarHBondContact NZ-O 3.21Å; K144-D203 IonicContact NZ-OD2 3.17Å; K144-D203 PolarHBondContact NZ-OD2 2.94Å
145	E	97.7	Very high	94.3	Very high	35 Å²	35	51.2 Å²	51.2	16%	0.164	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	132.9	-171.6	-173.6	164.9	109.7	0	0	110.3	F118 R126 H147 S155 S156	F118-E145 HydrophobicContact CE1-CG 4.27Å; F118-E145 HydrophobicContact CZ-CG 3.7Å; R126-E145 HydrophobicContact CB-CB 4.14Å; R126-E145 HydrophobicContact CB-CG 3.99Å; R126-E145 IonicContact CZ-OE2 2.66Å; R126-E145 IonicContact NE-OE2 2.85Å; R126-E145 PolarHBondContact NE-OE2 3.42Å; R126-E145 IonicContact NH1-OE2 3.57Å; R126-E145 PolarHBondContact NH1-OE2 2.93Å; R126-E145 IonicContact NH2-OE2 3.56Å; E145-H147 IonicContact OE1-CE1 3.5Å; E145-H147 PolarHBondContact OE1-CE1 2.89Å; E145-H147 IonicContact OE1-NE2 2.71Å; E145-S155 CarbonylContact O-C 3.58Å; E145-S155 VanDerWaalsContact O-CA 3.26Å; E145-S155 WeakPolarHBondContact O-CA 3.19Å; E145-S156 PolarHBondContact N-O 3.14Å; E145-S156 PolarHBondContact O-N 3.13Å
146	F	97.2	Very high	94.2	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	130.3	-177	-63.9	-96.1	0	0	0	109.5	F118 G124 Y125 L127 K144 L148 A200 D203 A206	F118-F146 WeakPolarHBondContact CE2-O 3.33Å; G124-F146 WeakPolarHBondContact CA-O 3.5Å; Y125-F146 HydrophobicContact CD1-CB 4.34Å; Y125-F146 HydrophobicContact CD2-CD2 4.06Å; Y125-F146 HydrophobicContact CE1-CB 4.09Å; Y125-F146 HydrophobicContact CE1-CD2 4.37Å; Y125-F146 HydrophobicContact CE1-CG 4.27Å; Y125-F146 AromaticContact CE2-CD2 3.46Å; Y125-F146 HydrophobicContact CE2-CD2 3.46Å; Y125-F146 VanDerWaalsContact CE2-CD2 3.46Å; Y125-F146 AromaticContact CE2-CE2 3.89Å; Y125-F146 HydrophobicContact CE2-CE2 3.89Å; Y125-F146 HydrophobicContact CE2-CG 4.17Å; Y125-F146 AromaticContact CZ-CD2 3.64Å; Y125-F146 AromaticContact CZ-CG 3.89Å; Y125-F146 PolarHBondContact N-O 3.07Å; Y125-F146 VanDerWaalsContact N-O 3.12Å; Y125-F146 PolarHBondContact O-N 3.44Å; L127-F146 HydrophobicContact CD1-CE2 4.21Å; L127-F146 HydrophobicContact CG-CE2 4.48Å; K144-F146 HydrophobicContact CB-CE2 4.41Å; K144-F146 HydrophobicContact CD-CE2 3.99Å; K144-F146 HydrophobicContact CD-CZ 3.76Å; K144-F146 HydrophobicContact CG-CE2 3.81Å; K144-F146 HydrophobicContact CG-CZ 3.97Å; F146-L148 HydrophobicContact CB-CD2 4.22Å; F146-L148 HydrophobicContact CB-CG 4.41Å; F146-A200 HydrophobicContact CD1-CB 4.26Å; F146-D203 HydrophobicContact CE1-CB 3.69Å; F146-D203 VanDerWaalsContact CE1-OD2 3.28Å; F146-D203 WeakPolarHBondContact CE1-OD2 3.5Å; F146-D203 HydrophobicContact CZ-CB 4.15Å; F146-D203 WeakPolarHBondContact CZ-OD2 3.26Å; F146-A206 HydrophobicContact CD2-CB 4.49Å; F146-A206 HydrophobicContact CE1-CB 4.04Å; F146-A206 HydrophobicContact CE2-CB 3.57Å; F146-A206 HydrophobicContact CZ-CB 3.29Å
147	H	95.1	Very high	94.2	Very high	58 Å²	58	52.5 Å²	52.5	27%	0.269	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	104.9	172.9	-66.2	82	0	0	0	109.5	F118 S123 E145 P153 V154	F118-H147 AromaticContact CE2-CD2 3.7Å; F118-H147 AromaticContact CE2-NE2 3.84Å; F118-H147 AromaticContact CZ-NE2 3.99Å; S123-H147 CarbonylContact O-C 3.42Å; S123-H147 WeakPolarHBondContact O-CA 3.43Å; E145-H147 IonicContact OE1-CE1 3.5Å; E145-H147 PolarHBondContact OE1-CE1 2.89Å; E145-H147 IonicContact OE1-NE2 2.71Å; H147-P153 WeakPolarHBondContact O-CA 3.19Å; H147-V154 HydrophobicContact CB-CG2 3.81Å; H147-V154 PolarHBondContact N-O 3.27Å; H147-V154 PolarHBondContact O-N 2.93Å
148	L	91.5	Very high	94.2	Very high	59 Å²	59	54.4 Å²	54.4	31%	0.309	31%	0.312	S	S	.	.			trans	-104.3	-17.7	-169.8	-53.9	-178.5	0	0	0	113.5	S123 Y125 F146 Q150 P153	S123-L148 PolarHBondContact O-N 3.32Å; Y125-L148 HydrophobicContact CD1-CD1 4.42Å; Y125-L148 HydrophobicContact CE1-CD1 4.06Å; F146-L148 HydrophobicContact CB-CD2 4.22Å; F146-L148 HydrophobicContact CB-CG 4.41Å; L148-Q150 PolarHBondContact O-N 3.37Å; L148-Q150 VanDerWaalsContact O-N 3.16Å; L148-P153 HydrophobicContact CD2-CB 3.94Å
149	G	81.2	Confident	94.2	Very high	17 Å²	17	55.7 Å²	55.7	18%	0.175	32%	0.318	C	S	.	.	S	Bend	trans	-75.4	0.3	-175.2	0	0	0	0	0	115.7	K122	K122-G149 WeakPolarHBondContact O-CA 3.42Å; K122-G149 PolarHBondContact O-N 3.34Å
150	Q	77.6	Confident	94.2	Very high	127 Å²	127	55.2 Å²	55.2	59%	0.593	32%	0.315	S	S	*	.	S	Bend	trans	-99.4	163.3	-179.4	-61.5	-173	-0.4	0	0	110.9	L148 D152	L148-Q150 PolarHBondContact O-N 3.37Å; L148-Q150 VanDerWaalsContact O-N 3.16Å; Q150-D152 PolarHBondContact O-N 2.78Å
151	A	83.5	Confident	94.1	Very high	99 Å²	99	55.1 Å²	55.1	82%	0.818	31%	0.309	S	S	*	.	S	Bend	trans	-59.1	-30.3	180	0	0	0	0	0	113
152	D	88.8	Confident	94.1	Very high	129 Å²	129	55.2 Å²	55.2	69%	0.69	31%	0.305	S	S	*	.	S	Bend	trans	-120.5	104.2	174.4	-59.9	-53.5	0	0	0	107.9	Q150 V154	Q150-D152 PolarHBondContact O-N 2.78Å; D152-V154 PolarHBondContact O-N 2.76Å
153	P	93	Very high	94	Very high	41 Å²	41	58.3 Å²	58.3	27%	0.266	32%	0.318	S	S	.	.			trans	-56.3	136.7	175.3	-28.2	36.8	0	0	0	111.6	H147 L148 A200	H147-P153 WeakPolarHBondContact O-CA 3.19Å; L148-P153 HydrophobicContact CD2-CB 3.94Å; P153-A200 HydrophobicContact CB-CB 4.14Å
154	V	95.2	Very high	93.8	Very high	68 Å²	68	64.1 Å²	64.1	41%	0.412	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	143.7	179.5	-63.6	0	0	0	0	111.3	H147 D152	H147-V154 HydrophobicContact CB-CG2 3.81Å; H147-V154 PolarHBondContact N-O 3.27Å; H147-V154 PolarHBondContact O-N 2.93Å; D152-V154 PolarHBondContact O-N 2.76Å
155	S	95.9	Very high	93.5	Very high	15 Å²	15	70.9 Å²	70.9	11%	0.105	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	151.9	171.4	52.6	0	0	0	0	110.3	E145 N197	E145-S155 CarbonylContact O-C 3.58Å; E145-S155 VanDerWaalsContact O-CA 3.26Å; E145-S155 WeakPolarHBondContact O-CA 3.19Å; S155-N197 WeakPolarHBondContact CB-OD1 3.41Å; S155-N197 WeakPolarHBondContact O-CB 3.37Å; S155-N197 PolarHBondContact O-OD1 3.15Å; S155-N197 VanDerWaalsContact OG-CA 3.24Å; S155-N197 WeakPolarHBondContact OG-CA 3.12Å; S155-N197 WeakPolarHBondContact OG-CB 3.39Å; S155-N197 PolarHBondContact OG-OD1 3.03Å; S155-N197 VanDerWaalsContact OG-OD1 3.13Å
156	S	97	Very high	93.3	Very high	58 Å²	58	73 Å²	73	41%	0.406	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	147.7	175.8	63.7	0	0	0	0	110.3	K144 E145 N197	K144-S156 CarbonylContact C-O 3.56Å; K144-S156 WeakPolarHBondContact CA-O 3.42Å; E145-S156 PolarHBondContact N-O 3.14Å; E145-S156 PolarHBondContact O-N 3.13Å; S156-N197 WeakPolarHBondContact CA-OD1 3.4Å; S156-N197 PolarHBondContact N-OD1 3.5Å; S156-N197 VanDerWaalsContact N-OD1 3.16Å
157	S	97.9	Very high	93.1	Very high	30 Å²	30	76.1 Å²	76.1	21%	0.21	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	144	-178.2	-45	0	0	0	0	110.3	I143 E159 F194 N197	I143-S157 CarbonylContact O-C 3.52Å; I143-S157 WeakPolarHBondContact O-CA 2.99Å; S157-E159 PolarHBondContact O-N 3.5Å; S157-F194 WeakPolarHBondContact CB-O 3.19Å; S157-F194 PolarHBondContact OG-O 3.32Å; S157-N197 PolarHBondContact OG-ND2 3.12Å; S157-N197 PolarHBondContact OG-OD1 3.4Å
158	T	98.2	Very high	93	Very high	42 Å²	42	74 Å²	74	26%	0.258	40%	0.397	S	S	.	.	P	Polyproline II helix	trans	-61	135.6	169.4	50	0	0	0	0	110.3	L142 I143 I160 F194	L142-T158 WeakPolarHBondContact CA-OG1 3.36Å; I143-T158 HydrophobicContact CB-CG2 3.72Å; I143-T158 HydrophobicContact CG1-CG2 4.07Å; I143-T158 PolarHBondContact N-OG1 3.25Å; I143-T158 PolarHBondContact O-N 2.87Å; T158-I160 PolarHBondContact O-N 2.63Å; T158-F194 WeakPolarHBondContact O-CE1 3.49Å; T158-F194 WeakPolarHBondContact OG1-CZ 3.47Å
159	E	97.4	Very high	92.8	Very high	158 Å²	158	72.2 Å²	72.2	74%	0.738	39%	0.388	S	S	*	.	P	Polyproline II helix	trans	-60.5	128.2	170.6	-174.2	-179.1	-178.4	0	0	110.4	N139 S157	N139-E159 PolarHBondContact ND2-O 2.99Å; S157-E159 PolarHBondContact O-N 3.5Å
160	I	98	Very high	92.5	Very high	10 Å²	10	78.6 Å²	78.6	5%	0.051	41%	0.411	C	S	.	.	P	Polyproline II helix	trans	-84.7	119.9	176.4	-54.2	171.6	0	0	0	108.7	F137 L142 T158 W162 F191 F194 L195	F137-I160 HydrophobicContact CB-CG2 3.71Å; F137-I160 HydrophobicContact CD1-CG2 3.81Å; F137-I160 HydrophobicContact CG-CG2 3.88Å; L142-I160 HydrophobicContact CD1-CD1 4.27Å; L142-I160 HydrophobicContact CD1-CG1 4.18Å; L142-I160 HydrophobicContact CD2-CG1 3.89Å; T158-I160 PolarHBondContact O-N 2.63Å; I160-W162 VanDerWaalsContact C-N 3.33Å; I160-W162 HydrophobicContact CB-CD2 4.29Å; I160-W162 HydrophobicContact CB-CZ2 4.04Å; I160-W162 HydrophobicContact CD1-CH2 4.11Å; I160-W162 HydrophobicContact CD1-CZ2 3.5Å; I160-W162 HydrophobicContact CG1-CZ2 4.37Å; I160-W162 HydrophobicContact CG2-CD2 3.51Å; I160-W162 HydrophobicContact CG2-CE3 3.88Å; I160-W162 HydrophobicContact CG2-CG 4.04Å; I160-W162 HydrophobicContact CG2-CH2 4.03Å; I160-W162 HydrophobicContact CG2-CZ2 3.67Å; I160-W162 HydrophobicContact CG2-CZ3 4.13Å; I160-W162 PolarHBondContact O-N 3.09Å; I160-W162 VanDerWaalsContact O-N 3.15Å; I160-F191 HydrophobicContact CD1-CD1 3.8Å; I160-F194 HydrophobicContact CD1-CD1 3.85Å; I160-F194 HydrophobicContact CD1-CE1 4.23Å; I160-F194 HydrophobicContact CG1-CD1 4.25Å; I160-F194 HydrophobicContact CG1-CE1 4.13Å; I160-L195 HydrophobicContact CD1-CD1 4.33Å; I160-L195 HydrophobicContact CD1-CD2 4.02Å; I160-L195 HydrophobicContact CD1-CG 4.13Å; I160-L195 HydrophobicContact CG1-CD2 4.13Å
161	K	97.8	Very high	91.8	Very high	120 Å²	120	74.8 Å²	74.8	52%	0.522	41%	0.406	S	S	.	.			trans	-87.6	73.8	177.7	-61.6	177.1	-176.5	174.3	0	109.6	F137 E138 N139	F137-K161 CarbonylContact C-O 3.56Å; F137-K161 WeakPolarHBondContact CA-O 3.33Å; F137-K161 VanDerWaalsContact CB-O 3.29Å; F137-K161 WeakPolarHBondContact CB-O 3.14Å; E138-K161 HydrophobicContact CB-CB 4.14Å; E138-K161 PolarHBondContact N-O 3.45Å; N139-K161 WeakPolarHBondContact OD1-CB 3.02Å; N139-K161 PolarHBondContact OD1-N 3.47Å
162	W	97.8	Very high	90.6	Very high	45 Å²	45	73 Å²	73	17%	0.17	38%	0.381	C	S	.	.	B	Isolated β-bridge	trans	-57.9	136.3	-179.9	-59.8	108.6	0	0	0	112	F136 F137 I160 M166 E167 L168 T169 F191	F136-W162 HydrophobicContact CB-CZ3 4.39Å; F137-W162 HydrophobicContact CB-CE3 4.28Å; F137-W162 HydrophobicContact CD1-CE3 4.08Å; F137-W162 HydrophobicContact CD1-CH2 4.43Å; F137-W162 AromaticContact CD1-CZ3 3.77Å; F137-W162 HydrophobicContact CD1-CZ3 3.77Å; F137-W162 HydrophobicContact CE1-CZ3 4.47Å; I160-W162 VanDerWaalsContact C-N 3.33Å; I160-W162 HydrophobicContact CB-CD2 4.29Å; I160-W162 HydrophobicContact CB-CZ2 4.04Å; I160-W162 HydrophobicContact CD1-CH2 4.11Å; I160-W162 HydrophobicContact CD1-CZ2 3.5Å; I160-W162 HydrophobicContact CG1-CZ2 4.37Å; I160-W162 HydrophobicContact CG2-CD2 3.51Å; I160-W162 HydrophobicContact CG2-CE3 3.88Å; I160-W162 HydrophobicContact CG2-CG 4.04Å; I160-W162 HydrophobicContact CG2-CH2 4.03Å; I160-W162 HydrophobicContact CG2-CZ2 3.67Å; I160-W162 HydrophobicContact CG2-CZ3 4.13Å; I160-W162 PolarHBondContact O-N 3.09Å; I160-W162 VanDerWaalsContact O-N 3.15Å; W162-M166 WeakPolarHBondContact CZ3-O 3.28Å; W162-E167 HydrophobicContact CB-CB 3.96Å; W162-E167 HydrophobicContact CD2-CB 4Å; W162-E167 HydrophobicContact CD2-CG 4.05Å; W162-E167 HydrophobicContact CG-CB 3.71Å; W162-E167 HydrophobicContact CG-CG 3.81Å; W162-L168 HydrophobicContact CH2-CB 3.81Å; W162-L168 HydrophobicContact CH2-CD1 4.2Å; W162-L168 HydrophobicContact CH2-CG 4Å; W162-L168 HydrophobicContact CZ3-CB 4.04Å; W162-L168 HydrophobicContact CZ3-CD1 3.99Å; W162-L168 HydrophobicContact CZ3-CG 3.73Å; W162-T169 HydrophobicContact CZ2-CG2 4.12Å; W162-F191 HydrophobicContact CH2-CB 4.13Å; W162-F191 HydrophobicContact CH2-CD1 4.04Å; W162-F191 HydrophobicContact CH2-CD2 4.09Å; W162-F191 AromaticContact CH2-CG 3.81Å; W162-F191 HydrophobicContact CH2-CG 3.81Å; W162-F191 HydrophobicContact CZ2-CB 4.27Å; W162-F191 HydrophobicContact CZ2-CG 4.38Å
163	K	97.3	Very high	88.8	Confident	66 Å²	66	75.3 Å²	75.3	29%	0.287	39%	0.388	S	S	.	.	P	Polyproline II helix	trans	-74.3	163.9	169.3	-72.2	175.3	174.7	177.6	0	110	N134 P135 F136 F137 E138 N165 M166	N134-K163 PolarHBondContact O-NZ 3.33Å; P135-K163 WeakPolarHBondContact O-CB 3.08Å; P135-K163 VanDerWaalsContact O-CD 3.25Å; P135-K163 WeakPolarHBondContact O-CD 3.42Å; F136-K163 PolarHBondContact O-N 3.38Å; F137-K163 WeakPolarHBondContact O-CE 3.37Å; E138-K163 HydrophobicContact CG-CG 4.25Å; K163-N165 PolarHBondContact O-N 3.17Å; K163-M166 HydrophobicContact CB-CB 4.48Å; K163-M166 HydrophobicContact CB-CG 4.48Å; K163-M166 PolarHBondContact O-N 3.49Å; K163-M166 VanDerWaalsContact O-N 3.11Å
164	E	94.1	Very high	86.4	Confident	170 Å²	170	78.7 Å²	78.7	79%	0.794	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	122.1	-174.7	-164.1	-174.2	167.3	0	0	111.7	M166	E164-M166 VanDerWaalsContact C-N 3.27Å; E164-M166 PolarHBondContact O-N 3.27Å
165	N	90.5	Very high	84.1	Confident	142 Å²	142	79 Å²	79	76%	0.759	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.1	17.4	-179.2	-50.8	-53.7	0	0	0	116.4	K163	K163-N165 PolarHBondContact O-N 3.17Å
166	M	94.1	Very high	81.6	Confident	79 Å²	79	82.4 Å²	82.4	39%	0.389	43%	0.434	S	S	.	.			trans	-115.4	21.3	-178.1	-58.8	-66.8	166.1	0	0	113.5	P135 F136 W162 K163 E164 L168	P135-M166 WeakPolarHBondContact O-CG 3.38Å; F136-M166 HydrophobicContact CD1-CB 4.39Å; W162-M166 WeakPolarHBondContact CZ3-O 3.28Å; K163-M166 HydrophobicContact CB-CB 4.48Å; K163-M166 HydrophobicContact CB-CG 4.48Å; K163-M166 PolarHBondContact O-N 3.49Å; K163-M166 VanDerWaalsContact O-N 3.11Å; E164-M166 VanDerWaalsContact C-N 3.27Å; E164-M166 PolarHBondContact O-N 3.27Å; M166-L168 PolarHBondContact O-N 2.89Å
167	E	93.6	Very high	79	Confident	65 Å²	65	89.2 Å²	89.2	30%	0.304	46%	0.456	S	S	.	.			trans	-79.9	102.4	178.7	178	171.3	-180	0	0	110.6	W162 T169 K170	W162-E167 HydrophobicContact CB-CB 3.96Å; W162-E167 HydrophobicContact CD2-CB 4Å; W162-E167 HydrophobicContact CD2-CG 4.05Å; W162-E167 HydrophobicContact CG-CB 3.71Å; W162-E167 HydrophobicContact CG-CG 3.81Å; E167-T169 WeakPolarHBondContact CG-OG1 3.25Å; E167-T169 PolarHBondContact O-N 3.4Å; E167-T169 PolarHBondContact OE1-OG1 3.06Å; E167-K170 HydrophobicContact CB-CD 3.94Å; E167-K170 HydrophobicContact CB-CG 4.1Å; E167-K170 HydrophobicContact CG-CB 4.44Å; E167-K170 HydrophobicContact CG-CD 4.11Å; E167-K170 HydrophobicContact CG-CG 3.78Å; E167-K170 WeakPolarHBondContact O-CB 3.41Å; E167-K170 PolarHBondContact O-N 3.05Å; E167-K170 WeakPolarHBondContact OE2-CE 3.35Å; E167-K170 IonicContact OE2-NZ 2.6Å; E167-K170 PolarHBondContact OE2-NZ 3.39Å
168	L	92.2	Very high	76.2	Confident	15 Å²	15	92.5 Å²	92.5	8%	0.079	49%	0.485	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-14.9	-173.6	-58.2	178.7	0	0	0	113.6	E102 E103 C106 F136 W162 M166 F191	E102-L168 HydrophobicContact CB-CD2 3.73Å; E102-L168 WeakPolarHBondContact OE2-CD2 3.45Å; E103-L168 HydrophobicContact CG-CD1 4.24Å; C106-L168 HydrophobicContact CB-CD1 3.83Å; F136-L168 HydrophobicContact CD1-CD1 3.91Å; F136-L168 HydrophobicContact CD1-CD2 3.94Å; F136-L168 HydrophobicContact CD1-CG 4.15Å; F136-L168 HydrophobicContact CE1-CD1 4.32Å; F136-L168 HydrophobicContact CE1-CD2 4.08Å; F136-L168 HydrophobicContact CG-CD1 4.47Å; W162-L168 HydrophobicContact CH2-CB 3.81Å; W162-L168 HydrophobicContact CH2-CD1 4.2Å; W162-L168 HydrophobicContact CH2-CG 4Å; W162-L168 HydrophobicContact CZ3-CB 4.04Å; W162-L168 HydrophobicContact CZ3-CD1 3.99Å; W162-L168 HydrophobicContact CZ3-CG 3.73Å; M166-L168 PolarHBondContact O-N 2.89Å; L168-F191 HydrophobicContact CB-CD2 4.14Å; L168-F191 HydrophobicContact CD1-CD2 3.67Å; L168-F191 HydrophobicContact CD1-CE2 3.5Å; L168-F191 HydrophobicContact CD1-CZ 4.47Å
169	T	88.7	Confident	73.5	Confident	21 Å²	21	93.9 Å²	93.9	13%	0.129	51%	0.508	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.1	-11.6	176.6	57	0	0	0	0	113	W162 E167 G171 F191 L195	W162-T169 HydrophobicContact CZ2-CG2 4.12Å; E167-T169 WeakPolarHBondContact CG-OG1 3.25Å; E167-T169 PolarHBondContact O-N 3.4Å; E167-T169 PolarHBondContact OE1-OG1 3.06Å; T169-G171 PolarHBondContact O-N 3.12Å; T169-F191 HydrophobicContact CG2-CB 3.81Å; T169-L195 HydrophobicContact CG2-CD1 4.02Å
170	K	73.7	Confident	71	Confident	150 Å²	150	95.3 Å²	95.3	65%	0.652	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.7	112.6	179.9	-82.9	178.8	174.8	135.9	0	111.2	E167	E167-K170 HydrophobicContact CB-CD 3.94Å; E167-K170 HydrophobicContact CB-CG 4.1Å; E167-K170 HydrophobicContact CG-CB 4.44Å; E167-K170 HydrophobicContact CG-CD 4.11Å; E167-K170 HydrophobicContact CG-CG 3.78Å; E167-K170 WeakPolarHBondContact O-CB 3.41Å; E167-K170 PolarHBondContact O-N 3.05Å; E167-K170 WeakPolarHBondContact OE2-CE 3.35Å; E167-K170 IonicContact OE2-NZ 2.6Å; E167-K170 PolarHBondContact OE2-NZ 3.39Å
171	G	63	Low	68.2	Low	48 Å²	48	105.1 Å²	105.1	50%	0.495	55%	0.554	S	S	.	*	T	Hydrogen-bonded Turn	trans	135.8	-22.9	176.7	0	0	0	0	0	113	T169 E173 T174	T169-G171 PolarHBondContact O-N 3.12Å; G171-E173 VanDerWaalsContact C-N 3.32Å; G171-E173 PolarHBondContact O-N 3.3Å; G171-T174 PolarHBondContact O-N 2.81Å; G171-T174 PolarHBondContact O-OG1 3.14Å
172	Q	59.1	Low	65.6	Low	60 Å²	60	110 Å²	110	28%	0.28	57%	0.569	S	S	.	*	G	3₁₀ helix	trans	-64	-32.8	-177.5	-64.3	-174.4	-22.6	0	0	113.3	T174 T189	Q172-T174 PolarHBondContact O-N 3.01Å; Q172-T174 VanDerWaalsContact O-N 3.12Å; Q172-T189 VanDerWaalsContact NE2-CB 3.33Å; Q172-T189 PolarHBondContact NE2-OG1 3.27Å
173	E	50.7	Low	62.8	Low	178 Å²	178	112.5 Å²	112.5	83%	0.832	60%	0.599	S	S	*	*	G	3₁₀ helix	trans	-64.7	-18	-179	-66.5	-164	152.7	0	0	114.4	G171	G171-E173 VanDerWaalsContact C-N 3.32Å; G171-E173 PolarHBondContact O-N 3.3Å
174	T	43.2	Very low	60.6	Low	113 Å²	113	115.2 Å²	115.2	69%	0.693	61%	0.613	S	S	*	*	G	3₁₀ helix	trans	-87.6	-10.7	-167.6	61.4	0	0	0	0	115.3	G171 Q172	G171-T174 PolarHBondContact O-N 2.81Å; G171-T174 PolarHBondContact O-OG1 3.14Å; Q172-T174 PolarHBondContact O-N 3.01Å; Q172-T174 VanDerWaalsContact O-N 3.12Å
175	T	45.6	Very low	58.6	Low	74 Å²	74	111.3 Å²	111.3	45%	0.454	60%	0.604	S	S	.	*	S	Bend	trans	-101	-3.3	-175.8	59.6	0	0	0	0	115	R188	T175-R188 PolarHBondContact OG1-NH1 2.96Å; T175-R188 PolarHBondContact OG1-NH2 2.98Å
176	S	44.6	Very low	57.1	Low	87 Å²	87	109.3 Å²	109.3	61%	0.608	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.3	2.8	-176	-49.8	0	0	0	0	114.7
177	K	40.8	Very low	55.6	Low	201 Å²	201	106.7 Å²	106.7	87%	0.874	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.5	3.5	-175.4	-75.4	-177.3	-179.9	166.7	0	115.7
178	A	39.7	Very low	54.9	Low	98 Å²	98	110.4 Å²	110.4	81%	0.81	59%	0.59	S	S	*	*	S	Bend	trans	-128.3	81.4	-179.5	0	0	0	0	0	113.1
179	G	42.3	Very low	55	Low	72 Å²	72	110.4 Å²	110.4	74%	0.742	59%	0.591	S	S	*	*	S	Bend	trans	118.1	112.2	152.2	0	0	0	0	0	117.1
180	K	43.5	Very low	55.3	Low	188 Å²	188	109.5 Å²	109.5	82%	0.817	59%	0.585	S	S	*	*			trans	51.8	99	150.8	-74.9	176.3	175.3	174.3	0	117.7	R182	K180-R182 PolarHBondContact O-N 3.07Å; K180-R182 VanDerWaalsContact O-N 3.16Å
181	K	40	Very low	56.4	Low	216 Å²	216	102.3 Å²	102.3	94%	0.939	55%	0.554	S	S	*	*			trans	22.1	83.3	131.8	-63.3	-174.3	177.9	-174.7	0	115.3
182	R	43.1	Very low	57.8	Low	221 Å²	221	100.5 Å²	100.5	83%	0.834	54%	0.535	S	S	*	.			trans	-141	103.6	157.9	-59.4	-172.2	-144.5	-168.2	8.8	104.9	K180	K180-R182 PolarHBondContact O-N 3.07Å; K180-R182 VanDerWaalsContact O-N 3.16Å
183	A	39.3	Very low	59.5	Low	98 Å²	98	97.9 Å²	97.9	81%	0.81	52%	0.523	S	S	*	.	S	Bend		52	101.7	103.4	0	0	0	0	0	110.1
184	H	50.2	Low	61.7	Low	124 Å²	124	89.4 Å²	89.4	57%	0.574	48%	0.483	S	S	*	.			trans	39.4	86.1	170	-109.3	74.6	0	0	0	114.4	Q186 D199	H184-Q186 VanDerWaalsContact C-N 3.29Å; H184-Q186 PolarHBondContact O-N 2.93Å; H184-D199 IonicContact CE1-OD2 3.7Å; H184-D199 PolarHBondContact CE1-OD2 3.43Å; H184-D199 WeakPolarHBondContact NE2-CB 3.41Å; H184-D199 IonicContact NE2-OD2 3.12Å; H184-D199 PolarHBondContact NE2-OD2 3.17Å
185	S	53.9	Low	64.2	Low	87 Å²	87	87.2 Å²	87.2	61%	0.608	47%	0.467	S	S	*	.			trans	-68.9	91	171.9	164.3	0	0	0	0	108
186	Q	58	Low	66.4	Low	101 Å²	101	86.2 Å²	86.2	47%	0.472	46%	0.459	S	S	.	.			trans	-43	134.5	169	-77.1	-94.7	-14.2	0	0	109.5	H184 R188 D204	H184-Q186 VanDerWaalsContact C-N 3.29Å; H184-Q186 PolarHBondContact O-N 2.93Å; Q186-R188 PolarHBondContact O-N 3.35Å; Q186-D204 PolarHBondContact NE2-OD2 2.98Å
187	P	63.5	Low	68.8	Low	23 Å²	23	84.9 Å²	84.9	15%	0.149	45%	0.445	C	S	.	.			trans	-55.9	136.8	178.6	20.9	-30.2	0	0	0	109.4	L98 W193	L98-P187 VanDerWaalsContact CD2-O 3.26Å; L98-P187 WeakPolarHBondContact CD2-O 3.28Å; P187-W193 HydrophobicContact CB-CB 3.62Å; P187-W193 VanDerWaalsContact CB-N 3.35Å; P187-W193 HydrophobicContact CG-CB 3.46Å; P187-W193 VanDerWaalsContact CG-CB 3.46Å; P187-W193 HydrophobicContact CG-CG 4.1Å
188	R	78.1	Confident	71.2	Confident	144 Å²	144	79.8 Å²	79.8	54%	0.543	43%	0.434	S	S	.	.	S	Bend	trans	-85.4	-16.8	-175.6	-67.9	-163.2	-175.5	176.1	11.6	113.7	T175 Q186	T175-R188 PolarHBondContact OG1-NH1 2.96Å; T175-R188 PolarHBondContact OG1-NH2 2.98Å; Q186-R188 PolarHBondContact O-N 3.35Å
189	T	93.4	Very high	73.4	Confident	14 Å²	14	76.9 Å²	76.9	9%	0.086	41%	0.405	C	S	.	.	S	Bend	trans	-141.5	163.6	178.8	85.2	0	0	0	0	110.6	L98 E103 Q172 G192 W193	L98-T189 CarbonylContact O-C 3.37Å; L98-T189 WeakPolarHBondContact O-CA 3.31Å; E103-T189 VanDerWaalsContact CD-CB 3.41Å; E103-T189 WeakPolarHBondContact OE1-CB 3.1Å; E103-T189 PolarHBondContact OE1-OG1 3.29Å; E103-T189 VanDerWaalsContact OE2-CB 3.31Å; E103-T189 WeakPolarHBondContact OE2-CB 3.35Å; Q172-T189 VanDerWaalsContact NE2-CB 3.33Å; Q172-T189 PolarHBondContact NE2-OG1 3.27Å; T189-G192 PolarHBondContact O-N 2.93Å; T189-G192 PolarHBondContact OG1-N 3.46Å; T189-W193 PolarHBondContact O-N 2.96Å
190	F	95.7	Very high	75.8	Confident	2 Å²	2	73.9 Å²	73.9	1%	0.009	37%	0.374	C	S	.	.	H	α-helix	trans	-62.8	-45.1	-178.7	176.8	-96	0	0	0	112.9	F89 L98 L99 E103 L107 F129 G192 W193 F194	F89-F190 HydrophobicContact CD1-CE2 4.36Å; F89-F190 AromaticContact CE1-CE2 3.76Å; F89-F190 HydrophobicContact CE1-CE2 3.76Å; F89-F190 HydrophobicContact CE1-CZ 4.11Å; L98-F190 HydrophobicContact CB-CB 4.48Å; L98-F190 PolarHBondContact O-N 3.23Å; L99-F190 HydrophobicContact CD2-CB 3.58Å; L99-F190 HydrophobicContact CD2-CG 4.08Å; E103-F190 PolarHBondContact OE1-N 3.43Å; E103-F190 VanDerWaalsContact OE2-CB 3.22Å; E103-F190 WeakPolarHBondContact OE2-CB 3.21Å; E103-F190 PolarHBondContact OE2-N 3.32Å; L107-F190 HydrophobicContact CD2-CD1 4.48Å; L107-F190 HydrophobicContact CD2-CE1 4.17Å; F129-F190 HydrophobicContact CD1-CZ 4.05Å; F129-F190 HydrophobicContact CE1-CE2 4.25Å; F129-F190 AromaticContact CE1-CZ 3.67Å; F129-F190 HydrophobicContact CE1-CZ 3.67Å; F129-F190 HydrophobicContact CZ-CE2 4.47Å; F129-F190 HydrophobicContact CZ-CZ 4.01Å; F190-G192 VanDerWaalsContact C-N 3.3Å; F190-G192 PolarHBondContact O-N 3.13Å; F190-W193 AromaticContact CD2-CE3 3.88Å; F190-W193 HydrophobicContact CD2-CE3 3.88Å; F190-W193 HydrophobicContact CD2-CZ3 4.09Å; F190-W193 AromaticContact CE2-CE3 3.75Å; F190-W193 HydrophobicContact CE2-CE3 3.75Å; F190-W193 AromaticContact CE2-CZ3 3.47Å; F190-W193 HydrophobicContact CE2-CZ3 3.47Å; F190-W193 VanDerWaalsContact CE2-CZ3 3.47Å; F190-W193 HydrophobicContact CZ-CE3 4.31Å; F190-W193 AromaticContact CZ-CZ3 3.85Å; F190-W193 HydrophobicContact CZ-CZ3 3.85Å; F190-W193 WeakPolarHBondContact O-CB 3.33Å; F190-W193 PolarHBondContact O-N 2.94Å; F190-F194 WeakPolarHBondContact O-CB 3.34Å; F190-F194 PolarHBondContact O-N 2.95Å
191	F	96	Very high	77.8	Confident	0 Å²	0	67.5 Å²	67.5	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-73.7	-25.5	176.2	-66.2	-71.7	0	0	0	112.4	E103 C106 F137 L142 I160 W162 L168 T169 F194 L195	E103-F191 HydrophobicContact CB-CD2 4.46Å; E103-F191 HydrophobicContact CB-CE2 4.33Å; E103-F191 HydrophobicContact CG-CD2 3.72Å; E103-F191 HydrophobicContact CG-CE2 4.04Å; E103-F191 VanDerWaalsContact OE1-CD2 3.27Å; E103-F191 WeakPolarHBondContact OE1-CD2 3.44Å; E103-F191 PolarHBondContact OE1-N 3.24Å; C106-F191 HydrophobicContact CB-CE2 4.03Å; C106-F191 HydrophobicContact CB-CZ 4.23Å; C106-F191 VanDerWaalsContact SG-CZ 3.57Å; F137-F191 AromaticContact CE1-CE1 3.99Å; F137-F191 HydrophobicContact CE1-CE1 3.99Å; F137-F191 HydrophobicContact CE1-CZ 4.02Å; L142-F191 HydrophobicContact CD1-CD1 4.4Å; L142-F191 HydrophobicContact CD1-CE1 3.86Å; I160-F191 HydrophobicContact CD1-CD1 3.8Å; W162-F191 HydrophobicContact CH2-CB 4.13Å; W162-F191 HydrophobicContact CH2-CD1 4.04Å; W162-F191 HydrophobicContact CH2-CD2 4.09Å; W162-F191 AromaticContact CH2-CG 3.81Å; W162-F191 HydrophobicContact CH2-CG 3.81Å; W162-F191 HydrophobicContact CZ2-CB 4.27Å; W162-F191 HydrophobicContact CZ2-CG 4.38Å; L168-F191 HydrophobicContact CB-CD2 4.14Å; L168-F191 HydrophobicContact CD1-CD2 3.67Å; L168-F191 HydrophobicContact CD1-CE2 3.5Å; L168-F191 HydrophobicContact CD1-CZ 4.47Å; T169-F191 HydrophobicContact CG2-CB 3.81Å; F191-F194 PolarHBondContact O-N 3.47Å; F191-L195 PolarHBondContact O-N 3.42Å; F191-L195 VanDerWaalsContact O-N 3.14Å
192	G	94.1	Very high	80	Confident	10 Å²	10	62.6 Å²	62.6	10%	0.103	34%	0.336	C	S	.	.	H	α-helix	trans	-62.4	-47.5	168.3	0	0	0	0	0	111.5	T189 F190 L195 D196	T189-G192 PolarHBondContact O-N 2.93Å; T189-G192 PolarHBondContact OG1-N 3.46Å; F190-G192 VanDerWaalsContact C-N 3.3Å; F190-G192 PolarHBondContact O-N 3.13Å; G192-L195 PolarHBondContact O-N 2.95Å; G192-D196 WeakPolarHBondContact O-CB 3.34Å; G192-D196 PolarHBondContact O-N 3.05Å; G192-D196 VanDerWaalsContact O-N 3.13Å
193	W	95	Very high	82.4	Confident	4 Å²	4	52.8 Å²	52.8	2%	0.015	30%	0.3	C	S	.	.	H	α-helix	trans	-59.4	-47.6	171.8	163	70.2	0	0	0	111.5	L127 F129 K144 P187 T189 F190 L195 D196 D203 V205 A206 I209	L127-W193 HydrophobicContact CD1-CH2 3.8Å; L127-W193 HydrophobicContact CD1-CZ2 4.09Å; F129-W193 HydrophobicContact CE2-CH2 4.4Å; F129-W193 HydrophobicContact CE2-CZ3 4.42Å; F129-W193 AromaticContact CZ-CH2 3.98Å; F129-W193 HydrophobicContact CZ-CH2 3.98Å; F129-W193 AromaticContact CZ-CZ3 4Å; F129-W193 HydrophobicContact CZ-CZ3 4Å; K144-W193 HydrophobicContact CD-CH2 3.94Å; K144-W193 HydrophobicContact CD-CZ2 3.61Å; K144-W193 WeakPolarHBondContact CE-O 3.49Å; P187-W193 HydrophobicContact CB-CB 3.62Å; P187-W193 VanDerWaalsContact CB-N 3.35Å; P187-W193 HydrophobicContact CG-CB 3.46Å; P187-W193 VanDerWaalsContact CG-CB 3.46Å; P187-W193 HydrophobicContact CG-CG 4.1Å; T189-W193 PolarHBondContact O-N 2.96Å; F190-W193 AromaticContact CD2-CE3 3.88Å; F190-W193 HydrophobicContact CD2-CE3 3.88Å; F190-W193 HydrophobicContact CD2-CZ3 4.09Å; F190-W193 AromaticContact CE2-CE3 3.75Å; F190-W193 HydrophobicContact CE2-CE3 3.75Å; F190-W193 AromaticContact CE2-CZ3 3.47Å; F190-W193 HydrophobicContact CE2-CZ3 3.47Å; F190-W193 VanDerWaalsContact CE2-CZ3 3.47Å; F190-W193 HydrophobicContact CZ-CE3 4.31Å; F190-W193 AromaticContact CZ-CZ3 3.85Å; F190-W193 HydrophobicContact CZ-CZ3 3.85Å; F190-W193 WeakPolarHBondContact O-CB 3.33Å; F190-W193 PolarHBondContact O-N 2.94Å; W193-L195 PolarHBondContact O-N 3.02Å; W193-D196 PolarHBondContact O-N 2.79Å; W193-D203 VanDerWaalsContact NE1-CG 3.33Å; W193-D203 PolarHBondContact NE1-OD1 2.9Å; W193-D203 PolarHBondContact NE1-OD2 3.46Å; W193-D203 VanDerWaalsContact NE1-OD2 3.16Å; W193-V205 HydrophobicContact CD2-CB 4.05Å; W193-V205 HydrophobicContact CD2-CG1 3.7Å; W193-V205 HydrophobicContact CE3-CG1 4.09Å; W193-V205 HydrophobicContact CG-CB 4.14Å; W193-V205 HydrophobicContact CG-CG1 4.13Å; W193-V205 HydrophobicContact CG-CG2 4.23Å; W193-V205 HydrophobicContact CH2-CG1 4.25Å; W193-V205 HydrophobicContact CZ2-CB 4.1Å; W193-V205 HydrophobicContact CZ2-CG1 3.87Å; W193-V205 HydrophobicContact CZ3-CG1 4.36Å; W193-A206 HydrophobicContact CZ2-CB 4.02Å; W193-I209 HydrophobicContact CH2-CD1 3.63Å; W193-I209 HydrophobicContact CZ2-CD1 4.33Å; W193-I209 HydrophobicContact CZ3-CD1 4.07Å
194	F	96.5	Very high	85	Confident	1 Å²	1	51.8 Å²	51.8	0%	0.004	28%	0.281	C	S	.	.	H	α-helix	trans	-57.3	-39.7	-176	-179.6	-91.1	0	0	0	111.7	F129 L142 I143 K144 S157 T158 I160 F190 F191	F129-F194 HydrophobicContact CD2-CD2 4.37Å; F129-F194 HydrophobicContact CD2-CE2 4.02Å; F129-F194 HydrophobicContact CE2-CD2 4.19Å; F129-F194 HydrophobicContact CE2-CE2 4.12Å; L142-F194 HydrophobicContact CB-CE1 4.21Å; L142-F194 HydrophobicContact CB-CE2 3.89Å; L142-F194 HydrophobicContact CB-CZ 3.59Å; I143-F194 WeakPolarHBondContact O-CZ 3.44Å; K144-F194 HydrophobicContact CB-CD2 4.13Å; K144-F194 HydrophobicContact CB-CE2 3.81Å; K144-F194 WeakPolarHBondContact CE-O 3.39Å; S157-F194 WeakPolarHBondContact CB-O 3.19Å; S157-F194 PolarHBondContact OG-O 3.32Å; T158-F194 WeakPolarHBondContact O-CE1 3.49Å; T158-F194 WeakPolarHBondContact OG1-CZ 3.47Å; I160-F194 HydrophobicContact CD1-CD1 3.85Å; I160-F194 HydrophobicContact CD1-CE1 4.23Å; I160-F194 HydrophobicContact CG1-CD1 4.25Å; I160-F194 HydrophobicContact CG1-CE1 4.13Å; F190-F194 WeakPolarHBondContact O-CB 3.34Å; F190-F194 PolarHBondContact O-N 2.95Å; F191-F194 PolarHBondContact O-N 3.47Å
195	L	94.9	Very high	87.1	Confident	67 Å²	67	46.4 Å²	46.4	35%	0.351	26%	0.257	S	S	.	.	H	α-helix	trans	-84.3	-14.3	178	-65.2	-179.6	0	0	0	114	I160 T169 F191 G192 W193 N197	I160-L195 HydrophobicContact CD1-CD1 4.33Å; I160-L195 HydrophobicContact CD1-CD2 4.02Å; I160-L195 HydrophobicContact CD1-CG 4.13Å; I160-L195 HydrophobicContact CG1-CD2 4.13Å; T169-L195 HydrophobicContact CG2-CD1 4.02Å; F191-L195 PolarHBondContact O-N 3.42Å; F191-L195 VanDerWaalsContact O-N 3.14Å; G192-L195 PolarHBondContact O-N 2.95Å; W193-L195 PolarHBondContact O-N 3.02Å; L195-N197 PolarHBondContact O-N 3.49Å; L195-N197 PolarHBondContact O-ND2 3.48Å; L195-N197 VanDerWaalsContact O-ND2 3.16Å
196	D	92.9	Very high	89.2	Confident	53 Å²	53	42.3 Å²	42.3	28%	0.283	23%	0.228	S	C	.	.			trans	-75.9	119.2	177.1	-167.3	-1.7	0	0	0	110.9	K144 G192 W193 S198	K144-D196 WeakPolarHBondContact CE-O 3.47Å; K144-D196 PolarHBondContact NZ-O 3.21Å; G192-D196 WeakPolarHBondContact O-CB 3.34Å; G192-D196 PolarHBondContact O-N 3.05Å; G192-D196 VanDerWaalsContact O-N 3.13Å; W193-D196 PolarHBondContact O-N 2.79Å; D196-S198 WeakPolarHBondContact OD1-CB 3.3Å; D196-S198 PolarHBondContact OD1-N 3.13Å; D196-S198 PolarHBondContact OD1-OG 3.12Å; D196-S198 PolarHBondContact OD2-OG 2.7Å
197	N	94.1	Very high	91	Very high	59 Å²	59	41.8 Å²	41.8	32%	0.316	23%	0.226	S	C	.	.			trans	-124.1	23.2	177.8	-65.5	-69.3	0	0	0	111.5	S155 S156 S157 L195	S155-N197 WeakPolarHBondContact CB-OD1 3.41Å; S155-N197 WeakPolarHBondContact O-CB 3.37Å; S155-N197 PolarHBondContact O-OD1 3.15Å; S155-N197 VanDerWaalsContact OG-CA 3.24Å; S155-N197 WeakPolarHBondContact OG-CA 3.12Å; S155-N197 WeakPolarHBondContact OG-CB 3.39Å; S155-N197 PolarHBondContact OG-OD1 3.03Å; S155-N197 VanDerWaalsContact OG-OD1 3.13Å; S156-N197 WeakPolarHBondContact CA-OD1 3.4Å; S156-N197 PolarHBondContact N-OD1 3.5Å; S156-N197 VanDerWaalsContact N-OD1 3.16Å; S157-N197 PolarHBondContact OG-ND2 3.12Å; S157-N197 PolarHBondContact OG-OD1 3.4Å; L195-N197 PolarHBondContact O-N 3.49Å; L195-N197 PolarHBondContact O-ND2 3.48Å; L195-N197 VanDerWaalsContact O-ND2 3.16Å
198	S	90.1	Very high	92.6	Very high	94 Å²	94	41.4 Å²	41.4	66%	0.657	22%	0.223	S	C	*	.	S	Bend	trans	-77.9	-28.8	-173.9	62.5	0	0	0	0	114.5	D196	D196-S198 WeakPolarHBondContact OD1-CB 3.3Å; D196-S198 PolarHBondContact OD1-N 3.13Å; D196-S198 PolarHBondContact OD1-OG 3.12Å; D196-S198 PolarHBondContact OD2-OG 2.7Å
199	D	87.8	Confident	93.5	Very high	37 Å²	37	34.6 Å²	34.6	20%	0.198	20%	0.197	C	C	.	.			trans	-139.7	99.7	175.3	-165.3	-22.1	0	0	0	110.3	H184 S201 L202	H184-D199 IonicContact CE1-OD2 3.7Å; H184-D199 PolarHBondContact CE1-OD2 3.43Å; H184-D199 WeakPolarHBondContact NE2-CB 3.41Å; H184-D199 IonicContact NE2-OD2 3.12Å; H184-D199 PolarHBondContact NE2-OD2 3.17Å; D199-S201 VanDerWaalsContact C-N 3.33Å; D199-S201 PolarHBondContact OD1-N 3.2Å; D199-S201 PolarHBondContact OD1-OG 3.39Å; D199-L202 PolarHBondContact OD1-N 3.48Å
200	A	90.8	Very high	93.7	Very high	9 Å²	9	35.9 Å²	35.9	7%	0.074	20%	0.202	C	C	.	.	S	Bend	trans	-83.3	-12.5	177.7	0	0	0	0	0	113.2	F146 P153	F146-A200 HydrophobicContact CD1-CB 4.26Å; P153-A200 HydrophobicContact CB-CB 4.14Å
201	S	87.2	Confident	93.7	Very high	53 Å²	53	40.5 Å²	40.5	37%	0.371	23%	0.226	S	C	.	.	S	Bend	trans	-86.3	-25.1	-175	63.8	0	0	0	0	113.3	D199	D199-S201 VanDerWaalsContact C-N 3.33Å; D199-S201 PolarHBondContact OD1-N 3.2Å; D199-S201 PolarHBondContact OD1-OG 3.39Å
202	L	86.5	Confident	93.8	Very high	113 Å²	113	43.2 Å²	43.2	59%	0.592	24%	0.241	S	C	*	.	S	Bend	trans	-131.8	50.9	-176.9	-63.5	173.7	0	0	0	110.5	D199 D204	D199-L202 PolarHBondContact OD1-N 3.48Å; L202-D204 PolarHBondContact O-N 3.38Å
203	D	93.1	Very high	93.9	Very high	16 Å²	16	42.7 Å²	42.7	9%	0.086	24%	0.236	C	C	.	.			trans	-89.7	82	177.9	-166.7	-35.7	0	0	0	110.1	K144 F146 W193 V205 A206 E207	K144-D203 IonicContact NZ-OD2 3.17Å; K144-D203 PolarHBondContact NZ-OD2 2.94Å; F146-D203 HydrophobicContact CE1-CB 3.69Å; F146-D203 VanDerWaalsContact CE1-OD2 3.28Å; F146-D203 WeakPolarHBondContact CE1-OD2 3.5Å; F146-D203 HydrophobicContact CZ-CB 4.15Å; F146-D203 WeakPolarHBondContact CZ-OD2 3.26Å; W193-D203 VanDerWaalsContact NE1-CG 3.33Å; W193-D203 PolarHBondContact NE1-OD1 2.9Å; W193-D203 PolarHBondContact NE1-OD2 3.46Å; W193-D203 VanDerWaalsContact NE1-OD2 3.16Å; D203-V205 PolarHBondContact O-N 2.88Å; D203-V205 VanDerWaalsContact O-N 3.15Å; D203-V205 PolarHBondContact OD1-N 3.36Å; D203-A206 HydrophobicContact CB-CB 3.97Å; D203-A206 PolarHBondContact O-N 2.93Å; D203-A206 VanDerWaalsContact O-N 3.09Å; D203-A206 WeakPolarHBondContact OD1-CB 3.45Å; D203-A206 PolarHBondContact OD1-N 3.2Å; D203-E207 PolarHBondContact O-N 2.88Å
204	D	93.4	Very high	94.1	Very high	76 Å²	76	43.1 Å²	43.1	41%	0.406	24%	0.238	S	C	.	.	H	α-helix	trans	-52.5	-38	-176.7	-60.1	-31.5	0	0	0	112.3	Q186 L202 E207 V208	Q186-D204 PolarHBondContact NE2-OD2 2.98Å; L202-D204 PolarHBondContact O-N 3.38Å; D204-E207 PolarHBondContact O-N 3.35Å; D204-V208 WeakPolarHBondContact O-CB 3.39Å; D204-V208 WeakPolarHBondContact O-CG2 3.34Å; D204-V208 PolarHBondContact O-N 3.01Å
205	V	95.3	Very high	94.1	Very high	12 Å²	12	46.3 Å²	46.3	7%	0.073	26%	0.258	C	S	.	.	H	α-helix	trans	-71.2	-40.2	-177	-176.4	0	0	0	0	110.7	L98 W193 D203 V208 I209	L98-V205 HydrophobicContact CD1-CB 4.27Å; L98-V205 HydrophobicContact CD1-CG1 3.73Å; L98-V205 HydrophobicContact CD1-CG2 3.49Å; L98-V205 VanDerWaalsContact CD1-CG2 3.49Å; W193-V205 HydrophobicContact CD2-CB 4.05Å; W193-V205 HydrophobicContact CD2-CG1 3.7Å; W193-V205 HydrophobicContact CE3-CG1 4.09Å; W193-V205 HydrophobicContact CG-CB 4.14Å; W193-V205 HydrophobicContact CG-CG1 4.13Å; W193-V205 HydrophobicContact CG-CG2 4.23Å; W193-V205 HydrophobicContact CH2-CG1 4.25Å; W193-V205 HydrophobicContact CZ2-CB 4.1Å; W193-V205 HydrophobicContact CZ2-CG1 3.87Å; W193-V205 HydrophobicContact CZ3-CG1 4.36Å; D203-V205 PolarHBondContact O-N 2.88Å; D203-V205 VanDerWaalsContact O-N 3.15Å; D203-V205 PolarHBondContact OD1-N 3.36Å; V205-V208 PolarHBondContact O-N 3.2Å; V205-I209 HydrophobicContact CG1-CD1 4.19Å; V205-I209 WeakPolarHBondContact O-CG1 3.46Å; V205-I209 PolarHBondContact O-N 2.99Å
206	A	96.4	Very high	94.2	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-65.9	-40.5	176.4	0	0	0	0	0	111.9	Y125 L127 F146 W193 D203 I209 K210	Y125-A206 HydrophobicContact CE2-CB 4.33Å; Y125-A206 WeakPolarHBondContact OH-CB 3.24Å; L127-A206 HydrophobicContact CD1-CB 4.04Å; F146-A206 HydrophobicContact CD2-CB 4.49Å; F146-A206 HydrophobicContact CE1-CB 4.04Å; F146-A206 HydrophobicContact CE2-CB 3.57Å; F146-A206 HydrophobicContact CZ-CB 3.29Å; W193-A206 HydrophobicContact CZ2-CB 4.02Å; D203-A206 HydrophobicContact CB-CB 3.97Å; D203-A206 PolarHBondContact O-N 2.93Å; D203-A206 VanDerWaalsContact O-N 3.09Å; D203-A206 WeakPolarHBondContact OD1-CB 3.45Å; D203-A206 PolarHBondContact OD1-N 3.2Å; A206-I209 PolarHBondContact O-N 3.02Å; A206-K210 VanDerWaalsContact O-CB 3.27Å; A206-K210 WeakPolarHBondContact O-CB 3.37Å; A206-K210 PolarHBondContact O-N 3.49Å
207	E	95.5	Very high	94.5	Very high	91 Å²	91	44.2 Å²	44.2	43%	0.425	25%	0.248	S	C	.	.	H	α-helix	trans	-61.1	-46.4	174	-70.3	-174.7	-179.4	0	0	111.3	D203 D204 I209 K210 D211	D203-E207 PolarHBondContact O-N 2.88Å; D204-E207 PolarHBondContact O-N 3.35Å; E207-I209 VanDerWaalsContact C-N 3.35Å; E207-I209 PolarHBondContact O-N 3.48Å; E207-K210 PolarHBondContact O-N 3.25Å; E207-D211 WeakPolarHBondContact O-CB 3.42Å; E207-D211 PolarHBondContact O-N 3.44Å
208	V	97	Very high	94.6	Very high	15 Å²	15	45.2 Å²	45.2	9%	0.091	25%	0.252	C	S	.	.	I	π-helix	trans	-58.4	-46.3	176.1	167.5	0	0	0	0	111.9	H92 I95 D204 V205 K210 D212 M213	H92-V208 WeakPolarHBondContact CE1-CG1 3.48Å; H92-V208 WeakPolarHBondContact NE2-CG1 3.37Å; I95-V208 HydrophobicContact CD1-CG1 4.03Å; I95-V208 HydrophobicContact CG1-CG1 3.94Å; D204-V208 WeakPolarHBondContact O-CB 3.39Å; D204-V208 WeakPolarHBondContact O-CG2 3.34Å; D204-V208 PolarHBondContact O-N 3.01Å; V205-V208 PolarHBondContact O-N 3.2Å; V208-K210 VanDerWaalsContact C-N 3.34Å; V208-K210 PolarHBondContact O-N 2.83Å; V208-D212 WeakPolarHBondContact O-CB 3.32Å; V208-D212 PolarHBondContact O-N 2.98Å; V208-D212 VanDerWaalsContact O-N 3.15Å; V208-M213 PolarHBondContact O-N 3.36Å
209	I	97.9	Very high	94.9	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	24%	0.24	C	C	.	.	I	π-helix	trans	-63	-44	177.6	-68.7	170.2	0	0	0	110.4	I95 L113 V115 L127 F129 W193 V205 A206 E207 W214	I95-I209 HydrophobicContact CD1-CD1 4.48Å; I95-I209 HydrophobicContact CD1-CG1 3.73Å; L113-I209 HydrophobicContact CD1-CG2 4.46Å; L113-I209 HydrophobicContact CD2-CG2 4.02Å; V115-I209 HydrophobicContact CG2-CG2 4.14Å; L127-I209 HydrophobicContact CD1-CB 4.39Å; L127-I209 HydrophobicContact CD1-CD1 4.37Å; L127-I209 HydrophobicContact CD1-CG2 4.27Å; L127-I209 HydrophobicContact CD2-CG2 4.04Å; F129-I209 HydrophobicContact CE1-CD1 4.31Å; F129-I209 HydrophobicContact CZ-CD1 4.03Å; W193-I209 HydrophobicContact CH2-CD1 3.63Å; W193-I209 HydrophobicContact CZ2-CD1 4.33Å; W193-I209 HydrophobicContact CZ3-CD1 4.07Å; V205-I209 HydrophobicContact CG1-CD1 4.19Å; V205-I209 WeakPolarHBondContact O-CG1 3.46Å; V205-I209 PolarHBondContact O-N 2.99Å; A206-I209 PolarHBondContact O-N 3.02Å; E207-I209 VanDerWaalsContact C-N 3.35Å; E207-I209 PolarHBondContact O-N 3.48Å; I209-W214 WeakPolarHBondContact O-CA 3.4Å; I209-W214 WeakPolarHBondContact O-CB 3.36Å; I209-W214 PolarHBondContact O-N 3.37Å
210	K	97	Very high	95.4	Very high	42 Å²	42	44.5 Å²	44.5	18%	0.183	24%	0.236	C	C	.	.	I	π-helix	trans	-74.4	-45.6	-174.8	173.5	-178.4	161.2	-70.6	0	113.9	V115 Y125 A206 E207 V208 P215	V115-K210 HydrophobicContact CG1-CB 4.14Å; V115-K210 HydrophobicContact CG1-CG 3.95Å; Y125-K210 HydrophobicContact CD1-CD 3.64Å; Y125-K210 HydrophobicContact CD2-CD 3.89Å; Y125-K210 HydrophobicContact CE1-CD 3.66Å; Y125-K210 HydrophobicContact CE2-CB 4.35Å; Y125-K210 HydrophobicContact CE2-CD 3.91Å; Y125-K210 HydrophobicContact CG-CD 3.76Å; A206-K210 VanDerWaalsContact O-CB 3.27Å; A206-K210 WeakPolarHBondContact O-CB 3.37Å; A206-K210 PolarHBondContact O-N 3.49Å; E207-K210 PolarHBondContact O-N 3.25Å; V208-K210 VanDerWaalsContact C-N 3.34Å; V208-K210 PolarHBondContact O-N 2.83Å; K210-P215 WeakPolarHBondContact O-CD 3.43Å
211	D	96.6	Very high	95.6	Very high	98 Å²	98	46.5 Å²	46.5	52%	0.524	24%	0.244	S	C	.	.	I	π-helix	trans	-106	-17.2	-165	-68.5	-42.2	0	0	0	113.6	E207 P215	E207-D211 WeakPolarHBondContact O-CB 3.42Å; E207-D211 PolarHBondContact O-N 3.44Å; D211-P215 WeakPolarHBondContact O-CG 3.48Å
212	D	97.6	Very high	96	Very high	57 Å²	57	49.3 Å²	49.3	31%	0.305	25%	0.254	S	S	.	.	I	π-helix	trans	-113.4	-62.8	176.9	-173.9	-5.4	0	0	0	112.2	H92 V208 P215 Q219 Y220	H92-D212 IonicContact NE2-OD2 2.66Å; H92-D212 PolarHBondContact NE2-OD2 3.24Å; V208-D212 WeakPolarHBondContact O-CB 3.32Å; V208-D212 PolarHBondContact O-N 2.98Å; V208-D212 VanDerWaalsContact O-N 3.15Å; D212-P215 WeakPolarHBondContact O-CD 3.49Å; D212-Q219 PolarHBondContact OD1-NE2 3.05Å; D212-Q219 VanDerWaalsContact OD1-NE2 3.14Å; D212-Y220 WeakPolarHBondContact OD1-CE2 3.48Å; D212-Y220 PolarHBondContact OD1-OH 3.29Å; D212-Y220 PolarHBondContact OD2-OH 3.48Å
213	M	97.2	Very high	96	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	24%	0.239	C	C	.	.	I	π-helix	trans	-69.5	-45.5	-174.9	-178.1	167.5	-71.1	0	0	112.6	A88 F89 H92 I95 V208 N216 P217 Y220	A88-M213 WeakPolarHBondContact O-CE 3.49Å; F89-M213 HydrophobicContact CD2-CE 4.17Å; F89-M213 HydrophobicContact CD2-SD 3.4Å; F89-M213 WeakPolarHBondContact CD2-SD 3.11Å; F89-M213 HydrophobicContact CE2-SD 3.32Å; F89-M213 WeakPolarHBondContact CE2-SD 3.45Å; F89-M213 HydrophobicContact CG-SD 4.33Å; F89-M213 HydrophobicContact CZ-SD 4.17Å; H92-M213 HydrophobicContact CB-CE 3.35Å; I95-M213 HydrophobicContact CD1-CE 3.57Å; I95-M213 HydrophobicContact CD1-SD 3.91Å; V208-M213 PolarHBondContact O-N 3.36Å; M213-N216 CarbonylContact O-C 3.41Å; M213-N216 PolarHBondContact O-N 2.74Å; M213-P217 HydrophobicContact CG-CB 4.3Å; M213-P217 VanDerWaalsContact O-CA 3.29Å; M213-P217 WeakPolarHBondContact O-CA 3.5Å; M213-P217 WeakPolarHBondContact O-CB 3.46Å; M213-P217 WeakPolarHBondContact O-CD 3.49Å; M213-Y220 HydrophobicContact CE-CD2 4.13Å; M213-Y220 HydrophobicContact CE-CG 4.48Å; M213-Y220 HydrophobicContact CG-CD2 4.42Å
214	W	98.1	Very high	95	Very high	13 Å²	13	48.5 Å²	48.5	5%	0.049	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-39.2	-174.8	177.7	-110.3	0	0	0	113.9	F71 R74 W85 L113 V115 I209 N216	F71-W214 HydrophobicContact CB-CZ2 4.05Å; F71-W214 HydrophobicContact CD1-CZ2 4.04Å; F71-W214 HydrophobicContact CD2-CZ2 4.43Å; F71-W214 AromaticContact CE1-NE1 3.8Å; F71-W214 AromaticContact CE2-NE1 3.74Å; F71-W214 AromaticContact CG-CZ2 3.95Å; F71-W214 HydrophobicContact CG-CZ2 3.95Å; F71-W214 AromaticContact CZ-NE1 3.63Å; R74-W214 PolarHBondContact NH1-O 2.94Å; R74-W214 VanDerWaalsContact NH2-CE2 3.32Å; R74-W214 VanDerWaalsContact NH2-CH2 3.29Å; R74-W214 PolarHBondContact NH2-O 3.43Å; W85-W214 AromaticContact CH2-CE3 3.94Å; W85-W214 HydrophobicContact CH2-CE3 3.94Å; W85-W214 AromaticContact CH2-CZ3 3.74Å; W85-W214 HydrophobicContact CH2-CZ3 3.74Å; W85-W214 HydrophobicContact CZ2-CZ3 4.03Å; L113-W214 HydrophobicContact CB-CZ3 4.39Å; L113-W214 HydrophobicContact CD2-CE3 4.14Å; L113-W214 HydrophobicContact CG-CE3 4.18Å; L113-W214 HydrophobicContact CG-CZ3 4.25Å; L113-W214 WeakPolarHBondContact O-CH2 3.33Å; L113-W214 WeakPolarHBondContact O-CZ3 3.39Å; V115-W214 HydrophobicContact CB-CB 4.2Å; V115-W214 HydrophobicContact CB-CD2 3.75Å; V115-W214 HydrophobicContact CB-CE3 4.47Å; V115-W214 HydrophobicContact CB-CG 3.59Å; V115-W214 HydrophobicContact CG1-CG 4.46Å; V115-W214 HydrophobicContact CG2-CB 3.64Å; V115-W214 HydrophobicContact CG2-CD2 3.63Å; V115-W214 HydrophobicContact CG2-CE3 3.99Å; V115-W214 HydrophobicContact CG2-CG 3.47Å; V115-W214 VanDerWaalsContact CG2-CG 3.47Å; I209-W214 WeakPolarHBondContact O-CA 3.4Å; I209-W214 WeakPolarHBondContact O-CB 3.36Å; I209-W214 PolarHBondContact O-N 3.37Å; W214-N216 PolarHBondContact O-N 2.85Å
215	P	97.3	Very high	93.7	Very high	67 Å²	67	53.2 Å²	53.2	44%	0.435	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-42.4	176.1	-30.3	39.1	0	0	0	113.1	R74 K210 D211 D212	R74-P215 PolarHBondContact NH1-O 3.46Å; R74-P215 VanDerWaalsContact NH1-O 3.13Å; K210-P215 WeakPolarHBondContact O-CD 3.43Å; D211-P215 WeakPolarHBondContact O-CG 3.48Å; D212-P215 WeakPolarHBondContact O-CD 3.49Å
216	N	97.3	Very high	91.8	Very high	75 Å²	75	56.4 Å²	56.4	40%	0.401	30%	0.298	S	S	.	.			trans	-144.7	71.6	-176.6	-172.4	22.6	0	0	0	113.9	M213 W214 L218 Q219	M213-N216 CarbonylContact O-C 3.41Å; M213-N216 PolarHBondContact O-N 2.74Å; W214-N216 PolarHBondContact O-N 2.85Å; N216-L218 PolarHBondContact O-N 3.44Å; N216-L218 VanDerWaalsContact O-N 3.11Å; N216-Q219 WeakPolarHBondContact O-CG 3.29Å; N216-Q219 PolarHBondContact O-N 3.22Å
217	P	97.9	Very high	90	Very high	2 Å²	2	60.3 Å²	60.3	1%	0.013	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-16.8	-176.8	29	-35.9	0	0	0	113	R74 F84 W85 M213 Q219 Y220 F221	R74-P217 VanDerWaalsContact NH1-CD 3.26Å; F84-P217 HydrophobicContact CE1-CB 3.9Å; F84-P217 HydrophobicContact CE1-CG 3.96Å; F84-P217 HydrophobicContact CZ-CB 4.13Å; F84-P217 HydrophobicContact CZ-CG 4.07Å; W85-P217 HydrophobicContact CE3-CB 4.5Å; W85-P217 HydrophobicContact CH2-CB 4.05Å; W85-P217 HydrophobicContact CH2-CG 3.87Å; W85-P217 HydrophobicContact CZ3-CB 3.63Å; W85-P217 HydrophobicContact CZ3-CG 4Å; M213-P217 HydrophobicContact CG-CB 4.3Å; M213-P217 VanDerWaalsContact O-CA 3.29Å; M213-P217 WeakPolarHBondContact O-CA 3.5Å; M213-P217 WeakPolarHBondContact O-CB 3.46Å; M213-P217 WeakPolarHBondContact O-CD 3.49Å; P217-Q219 PolarHBondContact O-N 3.33Å; P217-Y220 PolarHBondContact O-N 3.27Å; P217-F221 PolarHBondContact O-N 2.9Å
218	L	97.3	Very high	88	Confident	80 Å²	80	59.4 Å²	59.4	42%	0.419	32%	0.315	S	S	.	.	H	α-helix	trans	-63.5	-30.1	179.3	-172.1	64.7	0	0	0	111.9	F84 N216 Y220 F221 L222	F84-L218 HydrophobicContact CE2-CD1 4.24Å; N216-L218 PolarHBondContact O-N 3.44Å; N216-L218 VanDerWaalsContact O-N 3.11Å; L218-Y220 PolarHBondContact O-N 2.97Å; L218-F221 HydrophobicContact CD1-CD1 4.15Å; L218-F221 PolarHBondContact O-N 3.37Å; L218-L222 HydrophobicContact CD1-CD1 3.92Å; L218-L222 HydrophobicContact CD1-CD2 4.19Å; L218-L222 HydrophobicContact CD1-CG 3.78Å; L218-L222 HydrophobicContact CD2-CD1 4.16Å; L218-L222 HydrophobicContact CG-CD1 3.69Å; L218-L222 HydrophobicContact CG-CG 3.97Å; L218-L222 WeakPolarHBondContact O-CB 3.41Å; L218-L222 WeakPolarHBondContact O-CG 3.44Å; L218-L222 PolarHBondContact O-N 3.23Å
219	Q	96.5	Very high	85.6	Confident	84 Å²	84	65.4 Å²	65.4	39%	0.393	35%	0.347	S	S	.	.	H	α-helix	trans	-62.4	-33.9	178.4	77.2	-164.4	-16.7	0	0	112.3	D212 N216 P217 V223	D212-Q219 PolarHBondContact OD1-NE2 3.05Å; D212-Q219 VanDerWaalsContact OD1-NE2 3.14Å; N216-Q219 WeakPolarHBondContact O-CG 3.29Å; N216-Q219 PolarHBondContact O-N 3.22Å; P217-Q219 PolarHBondContact O-N 3.33Å; Q219-V223 WeakPolarHBondContact O-CG2 3.39Å
220	Y	96.9	Very high	83.2	Confident	32 Å²	32	73.3 Å²	73.3	13%	0.125	38%	0.384	C	S	.	.	H	α-helix	trans	-84.6	-39.8	177.2	-60.1	-63.2	0	0	0	111.4	A88 N91 H92 D212 M213 P217 L218 L222 V223	A88-Y220 WeakPolarHBondContact O-CB 3.49Å; N91-Y220 WeakPolarHBondContact CB-O 3.38Å; N91-Y220 PolarHBondContact ND2-O 2.93Å; H92-Y220 HydrophobicContact CB-CD1 4.29Å; H92-Y220 HydrophobicContact CB-CG 4.44Å; H92-Y220 AromaticContact CD2-CD2 3.93Å; H92-Y220 AromaticContact CD2-CE1 3.63Å; H92-Y220 AromaticContact CD2-CE2 3.47Å; H92-Y220 VanDerWaalsContact CD2-CE2 3.47Å; H92-Y220 WeakPolarHBondContact CD2-CE2 3.22Å; H92-Y220 AromaticContact CD2-CZ 3.34Å; H92-Y220 AromaticContact NE2-CZ 3.76Å; D212-Y220 WeakPolarHBondContact OD1-CE2 3.48Å; D212-Y220 PolarHBondContact OD1-OH 3.29Å; D212-Y220 PolarHBondContact OD2-OH 3.48Å; M213-Y220 HydrophobicContact CE-CD2 4.13Å; M213-Y220 HydrophobicContact CE-CG 4.48Å; M213-Y220 HydrophobicContact CG-CD2 4.42Å; P217-Y220 PolarHBondContact O-N 3.27Å; L218-Y220 PolarHBondContact O-N 2.97Å; Y220-L222 VanDerWaalsContact C-N 3.27Å; Y220-L222 PolarHBondContact O-N 2.94Å; Y220-V223 WeakPolarHBondContact O-CG2 3.49Å; Y220-V223 PolarHBondContact O-N 3.46Å
221	F	95.9	Very high	80.8	Confident	51 Å²	51	79 Å²	79	22%	0.224	42%	0.416	C	S	.	.	H	α-helix	trans	-60.4	-34.8	177.2	179.7	-98.2	0	0	0	113.4	I81 F84 P217 L218	I81-F221 HydrophobicContact CG2-CE1 4.21Å; I81-F221 HydrophobicContact CG2-CE2 4.06Å; I81-F221 HydrophobicContact CG2-CZ 3.55Å; F84-F221 HydrophobicContact CB-CD2 4.37Å; F84-F221 HydrophobicContact CB-CE2 4.32Å; F84-F221 HydrophobicContact CD2-CB 4.18Å; F84-F221 AromaticContact CD2-CD1 3.99Å; F84-F221 HydrophobicContact CD2-CD1 3.99Å; F84-F221 AromaticContact CD2-CD2 3.51Å; F84-F221 HydrophobicContact CD2-CD2 3.51Å; F84-F221 HydrophobicContact CD2-CE1 4.28Å; F84-F221 AromaticContact CD2-CE2 3.87Å; F84-F221 HydrophobicContact CD2-CE2 3.87Å; F84-F221 AromaticContact CD2-CG 3.59Å; F84-F221 HydrophobicContact CD2-CG 3.59Å; F84-F221 HydrophobicContact CD2-CZ 4.23Å; F84-F221 HydrophobicContact CE2-CB 3.71Å; F84-F221 AromaticContact CE2-CD1 3.86Å; F84-F221 HydrophobicContact CE2-CD1 3.86Å; F84-F221 AromaticContact CE2-CD2 3.95Å; F84-F221 HydrophobicContact CE2-CD2 3.95Å; F84-F221 AromaticContact CE2-CG 3.53Å; F84-F221 HydrophobicContact CE2-CG 3.53Å; F84-F221 HydrophobicContact CG-CD2 4.05Å; F84-F221 HydrophobicContact CG-CE2 4.4Å; F84-F221 HydrophobicContact CG-CG 4.47Å; F84-F221 HydrophobicContact CZ-CB 4.08Å; F84-F221 HydrophobicContact CZ-CG 4.36Å; P217-F221 PolarHBondContact O-N 2.9Å; L218-F221 HydrophobicContact CD1-CD1 4.15Å; L218-F221 PolarHBondContact O-N 3.37Å
222	L	94.5	Very high	78.3	Confident	112 Å²	112	77 Å²	77	59%	0.586	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.2	-2.6	-177	-66.9	179.6	0	0	0	114.5	L218 Y220 P224	L218-L222 HydrophobicContact CD1-CD1 3.92Å; L218-L222 HydrophobicContact CD1-CD2 4.19Å; L218-L222 HydrophobicContact CD1-CG 3.78Å; L218-L222 HydrophobicContact CD2-CD1 4.16Å; L218-L222 HydrophobicContact CG-CD1 3.69Å; L218-L222 HydrophobicContact CG-CG 3.97Å; L218-L222 WeakPolarHBondContact O-CB 3.41Å; L218-L222 WeakPolarHBondContact O-CG 3.44Å; L218-L222 PolarHBondContact O-N 3.23Å; Y220-L222 VanDerWaalsContact C-N 3.27Å; Y220-L222 PolarHBondContact O-N 2.94Å; L222-P224 VanDerWaalsContact O-CD 3.3Å; L222-P224 WeakPolarHBondContact O-CD 3.32Å
223	V	87.1	Confident	75.3	Confident	47 Å²	47	82.1 Å²	82.1	29%	0.285	44%	0.444	S	S	.	.	S	Bend	trans	-63.5	120.8	176.6	-178.7	0	0	0	0	108.8	N91 Q219 Y220 D227	N91-V223 HydrophobicContact CB-CB 4.29Å; N91-V223 PolarHBondContact ND2-O 3.49Å; Q219-V223 WeakPolarHBondContact O-CG2 3.39Å; Y220-V223 WeakPolarHBondContact O-CG2 3.49Å; Y220-V223 PolarHBondContact O-N 3.46Å; V223-D227 HydrophobicContact CG1-CB 4.25Å
224	P	72.4	Confident	72.6	Confident	64 Å²	64	91.6 Å²	91.6	42%	0.416	49%	0.488	S	S	.	.			trans	-59	139.3	176.3	-22.9	33.6	0	0	0	111.5	L222 S226 D227	L222-P224 VanDerWaalsContact O-CD 3.3Å; L222-P224 WeakPolarHBondContact O-CD 3.32Å; P224-S226 WeakPolarHBondContact CB-OG 3.43Å; P224-S226 PolarHBondContact O-N 3.08Å; P224-D227 WeakPolarHBondContact CD-OD2 3.36Å; P224-D227 PolarHBondContact O-N 2.92Å
225	E	65.3	Low	69.7	Low	175 Å²	175	94.4 Å²	94.4	82%	0.818	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.8	-24.1	173.9	-67.2	178.9	178.5	0	0	112.8	D227	E225-D227 VanDerWaalsContact C-N 3.31Å; E225-D227 PolarHBondContact O-N 3.4Å
226	S	57	Low	66.7	Low	80 Å²	80	98.4 Å²	98.4	56%	0.559	54%	0.539	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-32.7	176.7	51.9	0	0	0	0	113.6	P224 M228	P224-S226 WeakPolarHBondContact CB-OG 3.43Å; P224-S226 PolarHBondContact O-N 3.08Å; S226-M228 VanDerWaalsContact C-N 3.3Å; S226-M228 PolarHBondContact O-N 2.85Å
227	D	58	Low	64.2	Low	82 Å²	82	99.8 Å²	99.8	44%	0.439	56%	0.555	S	S	.	*	G	3₁₀ helix	trans	-84.6	-14.6	-170.2	-58.7	-1.6	0	0	0	111.1	V223 P224 E225 N229	V223-D227 HydrophobicContact CG1-CB 4.25Å; P224-D227 WeakPolarHBondContact CD-OD2 3.36Å; P224-D227 PolarHBondContact O-N 2.92Å; E225-D227 VanDerWaalsContact C-N 3.31Å; E225-D227 PolarHBondContact O-N 3.4Å; D227-N229 VanDerWaalsContact C-N 3.3Å; D227-N229 PolarHBondContact O-N 3.46Å
228	M	52.9	Low	61.6	Low	72 Å²	72	110.6 Å²	110.6	36%	0.355	60%	0.597	S	S	.	*	G	3₁₀ helix	trans	-72.1	-23.6	178.1	-66.2	-79.6	-79.9	0	0	112.8	I90 N91 S226	I90-M228 HydrophobicContact CG2-CE 3.67Å; I90-M228 WeakPolarHBondContact O-CE 3.45Å; N91-M228 HydrophobicContact CB-CE 4.5Å; N91-M228 HydrophobicContact CB-SD 4.27Å; N91-M228 WeakPolarHBondContact OD1-CE 3.47Å; N91-M228 PolarHBondContact OD1-SD 2.76Å; S226-M228 VanDerWaalsContact C-N 3.3Å; S226-M228 PolarHBondContact O-N 2.85Å
229	N	46.2	Very low	59.5	Low	141 Å²	141	111.3 Å²	111.3	75%	0.754	61%	0.609	S	S	*	*	G	3₁₀ helix	trans	-95.7	-6.9	-176.3	-72.6	-21.3	0	0	0	114	D227	D227-N229 VanDerWaalsContact C-N 3.3Å; D227-N229 PolarHBondContact O-N 3.46Å
230	E	47.6	Very low	57.1	Low	166 Å²	166	114.9 Å²	114.9	78%	0.776	63%	0.63	S	S	*	*	S	Bend	trans	-93.6	-13	-173.5	-150	168.9	-162.5	0	0	113.6
231	N	46.6	Very low	55	Low	161 Å²	161	120.9 Å²	120.9	86%	0.861	66%	0.659	S	S	*	*	S	Bend	trans	-95.6	15.2	178.9	-73.6	9.5	0	0	0	114.3
232	G	43.8	Very low	53	Low	55 Å²	55	124.4 Å²	124.4	57%	0.567	68%	0.681	S	S	*	*	S	Bend	trans	-114.8	79.7	-179.4	0	0	0	0	0	114.1
233	I	35.6	Very low	51.3	Low	165 Å²	165	125.3 Å²	125.3	85%	0.846	69%	0.686	S	S	*	*			trans	64.4	86	154.4	-46.3	173	0	0	0	116.5
234	E	41	Very low	49.9	Very low	199 Å²	199	130.9 Å²	130.9	93%	0.93	71%	0.709	S	S	*	*			trans	-143.3	110.4	139.8	-69.4	-164.2	165.2	0	0	105.9
235	G	37	Very low	48.8	Very low	73 Å²	73	134.2 Å²	134.2	75%	0.753	73%	0.728	S	S	*	*				97.4	93.2	81.8	0	0	0	0	0	110.3
236	D	33.3	Very low	48.1	Very low	151 Å²	151	133.1 Å²	133.1	81%	0.807	73%	0.728	S	S	*	*			trans	43.2	99.9	150	-169.8	8.6	0	0	0	118.4
237	S	44.6	Very low	48	Very low	104 Å²	104	135.1 Å²	135.1	73%	0.727	73%	0.732	S	S	*	*			trans	-162	84.3	150.8	167.8	0	0	0	0	109.4	S239	S237-S239 PolarHBondContact O-N 2.66Å
238	Y	44.7	Very low	47.7	Very low	229 Å²	229	137.9 Å²	137.9	90%	0.898	75%	0.747	S	S	*	*			trans	-62.3	100.7	158.5	-69.5	-91.1	0	0	0	108.3
239	S	52.6	Low	47.8	Very low	95 Å²	95	140.5 Å²	140.5	66%	0.664	77%	0.767	S	S	*	*			trans	-112.3	87.2	161.3	-160.9	0	0	0	0	107.2	S237 E241	S237-S239 PolarHBondContact O-N 2.66Å; S239-E241 PolarHBondContact O-N 2.77Å
240	D	46.2	Very low	48	Very low	158 Å²	158	140 Å²	140	85%	0.845	77%	0.769	S	S	*	*			trans	-61	112.4	157.8	-163.4	27.5	0	0	0	106.4
241	E	51.9	Low	48.6	Very low	158 Å²	158	137.1 Å²	137.1	74%	0.738	76%	0.762	S	S	*	*			trans	-167.6	107.9	160.3	-107.6	167.9	-147.1	0	0	109.3	S239	S239-E241 PolarHBondContact O-N 2.77Å
242	D	55.5	Low	49	Very low	125 Å²	125	135.1 Å²	135.1	67%	0.668	76%	0.755	S	S	*	*			trans	79.8	106.8	131.2	-69.4	-6.2	0	0	0	120.2
243	D	58.5	Low	49.8	Very low	131 Å²	131	140.2 Å²	140.2	70%	0.701	76%	0.764	S	S	*	*				117.2	109.2	109.6	-74.7	-19.4	0	0	0	118.4
244	E	56.8	Low	50.4	Low	165 Å²	165	141.3 Å²	141.3	77%	0.771	77%	0.766	S	S	*	*			trans	68.5	99.8	131.7	-60.4	-158.8	155	0	0	119.8
245	V	49	Very low	51.1	Low	134 Å²	134	140.6 Å²	140.6	81%	0.812	76%	0.763	S	S	*	*				7.2	122.9	124.9	-84.7	0	0	0	0	116.4
246	D	51.5	Low	51.7	Low	151 Å²	151	140.7 Å²	140.7	81%	0.807	76%	0.764	S	S	*	*				-163.7	155.5	112.5	-148.9	4.1	0	0	0	113.5
247	D	55.2	Low	52.4	Low	122 Å²	122	142.9 Å²	142.9	65%	0.652	77%	0.769	S	S	*	*			trans	-43.7	141.8	-170.9	-89.2	-47.3	0	0	0	120.7
248	N	50.8	Low	52.9	Low	140 Å²	140	147 Å²	147	75%	0.749	78%	0.777	S	S	*	*				14.9	112	125.2	-65.7	-47.6	0	0	0	117.8
249	V	54.5	Low	53.1	Low	127 Å²	127	145.2 Å²	145.2	77%	0.77	78%	0.777	S	S	*	*			trans	-145.4	112.2	137.8	178	0	0	0	0	109.1	V251	V249-V251 HydrophobicContact CG1-CG2 3.71Å
250	V	52.2	Low	53	Low	132 Å²	132	144.3 Å²	144.3	80%	0.8	78%	0.782	S	S	*	*			trans	-82.1	113.6	160.9	179.2	0	0	0	0	106.9	V252	V250-V252 HydrophobicContact CG1-CG2 4.05Å
251	V	59.8	Low	53.3	Low	105 Å²	105	146.2 Å²	146.2	64%	0.636	79%	0.786	S	S	*	*			trans	-93.6	109	167.5	-175.3	0	0	0	0	107.1	V249 E253	V249-V251 HydrophobicContact CG1-CG2 3.71Å; V251-E253 HydrophobicContact CG1-CG 3.85Å
252	V	55.4	Low	53.3	Low	119 Å²	119	142.1 Å²	142.1	72%	0.721	79%	0.787	S	S	*	*			trans	-87.9	108.7	163.3	-179	0	0	0	0	106.3	V250 E254	V250-V252 HydrophobicContact CG1-CG2 4.05Å; V252-E254 PolarHBondContact O-N 3.03Å
253	E	59.6	Low	53.1	Low	162 Å²	162	143.2 Å²	143.2	76%	0.757	79%	0.788	S	S	*	*			trans	-85.4	102.3	166.9	-66.4	-171.9	156.6	0	0	107.9	V251 E255	V251-E253 HydrophobicContact CG1-CG 3.85Å; E253-E255 PolarHBondContact O-N 3.42Å
254	E	48.8	Very low	52.9	Low	188 Å²	188	143.8 Å²	143.8	88%	0.879	79%	0.791	S	S	*	*			trans	-71.3	107.1	155.4	-83.9	-174.2	147.6	0	0	107.7	V252	V252-E254 PolarHBondContact O-N 3.03Å
255	E	55	Low	53	Low	184 Å²	184	144.8 Å²	144.8	86%	0.86	79%	0.789	S	S	*	*			trans	-134.4	117.9	160.2	-73.7	-158.2	162.2	0	0	111.1	E253	E253-E255 PolarHBondContact O-N 3.42Å
256	G	49.9	Very low	53.4	Low	75 Å²	75	146.3 Å²	146.3	77%	0.773	79%	0.787	S	S	*	*			trans	101.7	79.3	136.1	0	0	0	0	0	117	E258	G256-E258 PolarHBondContact O-N 3.08Å
257	E	46.9	Very low	53.5	Low	197 Å²	197	148.2 Å²	148.2	92%	0.921	79%	0.791	S	S	*	*			trans	-62.8	109.4	146.7	-68.8	178.9	159.6	0	0	108.5
258	E	56	Low	53.7	Low	190 Å²	190	151.4 Å²	151.4	89%	0.888	80%	0.802	S	S	*	*			trans	-115.3	108.7	156.5	-88.3	-165	161.6	0	0	109	G256 G260	G256-E258 PolarHBondContact O-N 3.08Å; E258-G260 PolarHBondContact O-N 2.71Å
259	E	49.6	Very low	54	Low	192 Å²	192	153.3 Å²	153.3	90%	0.897	81%	0.806	S	S	*	*			trans	-61.6	116.4	166.5	-64.6	-172.6	150.7	0	0	109.7
260	G	50.7	Low	54.2	Low	76 Å²	76	154.3 Å²	154.3	78%	0.784	81%	0.808	S	S	*	*			trans	-113.1	91.2	170.1	0	0	0	0	0	110.4	E258	E258-G260 PolarHBondContact O-N 2.71Å
261	E	51.4	Low	54.5	Low	197 Å²	197	157 Å²	157	92%	0.921	81%	0.811	S	S	*	*			trans	-58.1	133	164.9	-65	-176.1	152.5	0	0	110.3
262	G	51.9	Low	54.7	Low	73 Å²	73	160.7 Å²	160.7	75%	0.753	85%	0.853	S	S	*	*			trans	-161.7	69.3	-177.2	0	0	0	0	0	113.5
263	E	52.1	Low	54.6	Low	148 Å²	148	162.8 Å²	162.8	69%	0.692	86%	0.859	S	S	*	*			trans	41.5	100.5	149.7	-58.6	-172.9	174.6	0	0	119.1	Y265	E263-Y265 HydrophobicContact CB-CD2 4.37Å; E263-Y265 HydrophobicContact CB-CE2 3.86Å; E263-Y265 WeakPolarHBondContact OE2-CE2 3.23Å; E263-Y265 PolarHBondContact OE2-OH 3.45Å
264	N	53.8	Low	54.4	Low	143 Å²	143	162.8 Å²	162.8	77%	0.765	87%	0.865	S	S	*	*			trans	-76.3	118.8	155	-173.5	14.7	0	0	0	109
265	Y	59.6	Low	54.7	Low	186 Å²	186	161.4 Å²	161.4	73%	0.729	86%	0.864	S	S	*	*			trans	-91.6	109.1	166.4	-75.8	-93.8	0	0	0	107.9	E263	E263-Y265 HydrophobicContact CB-CD2 4.37Å; E263-Y265 HydrophobicContact CB-CE2 3.86Å; E263-Y265 WeakPolarHBondContact OE2-CE2 3.23Å; E263-Y265 PolarHBondContact OE2-OH 3.45Å
266	E	57.5	Low	54.7	Low	166 Å²	166	160.1 Å²	160.1	78%	0.776	86%	0.864	S	S	*	*			trans	-65.4	129.4	173.2	-69.1	178.9	156.7	0	0	110.7
267	E	52.6	Low	55	Low	191 Å²	191	165.4 Å²	165.4	89%	0.893	87%	0.87	S	S	*	*			trans	-70.8	118.9	159.7	-74	175.5	151.8	0	0	108.8
268	E	60.1	Low	55.5	Low	189 Å²	189	163.3 Å²	163.3	88%	0.883	87%	0.866	S	S	*	*			trans	-104.2	98.8	153.4	-78.3	-167	165	0	0	108.1
269	E	56.6	Low	55.5	Low	179 Å²	179	161.4 Å²	161.4	84%	0.836	87%	0.865	S	S	*	*			trans	-74.9	124.1	145.7	-76.7	-173.7	148.8	0	0	107.3
270	D	58.9	Low	55.9	Low	149 Å²	149	159 Å²	159	80%	0.797	86%	0.862	S	S	*	*			trans	-164.6	113.8	143.8	-96.3	-24.5	0	0	0	111.6
271	E	59.2	Low	56.4	Low	188 Å²	188	165.9 Å²	165.9	88%	0.879	87%	0.869	S	S	*	*			trans	40.4	100	138.2	-56.7	-167.7	157.4	0	0	120.9
272	A	62.5	Low	56.8	Low	182 Å²	182	163.1 Å²	163.1	100%	1.504	86%	0.864	S	S	*	*				179.1	0	122.4	0	0	0	0	0	112.5

Retrieved 272 of 272 residues in 214.7 ms (Link to these results)

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